#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ofw s ALA 25 N 0.00 3.55 0.08 2.89 0.00 -1.26 -4.99 121.76 122.03 2ofw s ALA 25 Ca 0.00 0.62 0.06 0.00 0.00 0.00 0.00 51.96 52.64 2ofw s ALA 25 Cb 0.00 -3.73 -0.03 0.00 0.00 0.00 0.00 23.12 19.36 2ofw s ALA 25 CO 0.00 -1.46 -0.16 0.95 0.00 0.00 0.00 175.76 175.09 2ofw s THR 26 N 4.11 1.27 -1.37 0.00 -4.23 -1.26 -4.80 115.64 109.37 2ofw s THR 26 Ca 0.65 -1.39 -0.01 0.00 -1.18 0.00 0.00 61.69 59.76 2ofw s THR 26 Cb -0.26 -1.22 0.00 0.00 1.34 0.00 0.00 72.50 72.36 2ofw s THR 26 CO 0.24 -0.20 0.18 0.59 -0.54 0.00 0.00 174.62 174.89 2ofw n ASN 27 N 1.18 -5.07 -4.82 3.99 3.02 -1.26 -5.01 115.26 107.29 2ofw n ASN 27 Ca -0.20 -0.10 -0.34 0.00 -0.03 0.00 0.00 54.58 53.91 2ofw n ASN 27 Cb 0.54 -4.07 -0.06 0.00 -0.61 0.00 0.00 39.78 35.57 2ofw n ASN 27 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2ofw s VAL 28 N -2.92 4.97 -0.06 2.41 0.11 -1.26 -5.11 120.40 118.54 2ofw s VAL 28 Ca 0.09 -0.27 0.04 0.00 -2.93 0.00 0.00 61.98 58.90 2ofw s VAL 28 Cb -0.04 -3.27 0.00 0.00 -1.53 0.00 0.00 36.38 31.55 2ofw s VAL 28 CO 0.11 0.38 -0.17 -0.89 -3.33 0.00 0.00 175.10 171.21 2ofw s THR 29 N -1.20 1.43 0.29 5.04 2.01 -1.26 -5.12 115.64 116.83 2ofw s THR 29 Ca 0.23 -0.69 -0.29 0.00 0.31 0.00 0.00 61.69 61.24 2ofw s THR 29 Cb -0.12 -1.25 -0.10 0.00 0.01 0.00 0.00 72.50 71.04 2ofw s THR 29 CO 0.14 0.42 1.27 -0.47 -0.69 0.00 0.00 174.62 175.28 2ofw s TYR 30 N 0.23 3.19 -0.15 4.92 5.04 -1.26 -5.03 117.35 124.29 2ofw s TYR 30 Ca -0.08 1.42 0.01 0.00 -2.44 0.00 0.00 57.07 55.97 2ofw s TYR 30 Cb -0.13 -3.60 0.02 0.00 0.35 0.00 0.00 41.96 38.60 2ofw s TYR 30 CO 0.03 -1.65 -0.17 -0.65 -1.34 0.00 0.00 175.55 171.78 2ofw s GLN 31 N -1.34 2.57 0.71 4.97 -1.52 -1.26 -5.13 119.66 118.66 2ofw s GLN 31 Ca 0.50 -0.67 -0.13 0.00 -1.95 0.00 0.00 55.36 53.10 2ofw s GLN 31 Cb -0.38 -2.25 0.02 0.00 -0.22 0.00 0.00 33.01 30.18 2ofw s GLN 31 CO 0.47 -0.18 1.11 0.00 -0.25 0.00 0.00 175.29 176.44 2ofw s ALA 32 N 1.29 2.35 0.65 6.09 0.00 -1.26 -5.06 121.76 125.82 2ofw s ALA 32 Ca 0.02 0.48 -0.08 0.00 0.00 0.00 0.00 51.96 52.39 2ofw s ALA 32 Cb -0.13 -3.32 0.02 0.00 0.00 0.00 0.00 23.12 19.69 2ofw s ALA 32 CO -0.09 -1.52 0.98 -1.01 0.00 0.00 0.00 175.76 174.12 2ofw s HIS 33 N -2.50 3.22 -0.11 0.00 0.09 -1.26 -5.02 115.29 109.71 2ofw s HIS 33 Ca 0.66 0.73 0.00 0.00 -0.00 0.00 0.00 55.06 56.45 2ofw s HIS 33 Cb -0.20 -2.92 -0.25 0.00 -0.00 0.00 0.00 32.58 29.21 2ofw s HIS 33 CO 0.47 -1.04 0.41 0.72 -0.00 0.00 0.00 174.74 175.30 2ofw n HIS 34 N -2.78 1.08 -2.58 1.40 8.25 -1.26 -4.93 115.22 114.41 2ofw n HIS 34 Ca 0.06 0.27 -0.36 0.00 -0.26 0.00 0.00 57.72 57.43 2ofw n HIS 34 Cb 0.58 -1.16 -0.04 0.00 1.12 0.00 0.00 29.99 30.49 2ofw n HIS 34 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2ofw s VAL 35 N -2.57 3.82 0.25 1.59 1.01 -1.26 -5.07 120.40 118.17 2ofw s VAL 35 Ca -0.18 1.31 -0.02 0.00 0.00 0.00 0.00 61.98 63.10 2ofw s VAL 35 Cb 0.07 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 2ofw s VAL 35 CO 0.78 -0.07 0.47 -0.94 0.00 0.00 0.00 175.10 175.34 2ofw s SER 36 N -1.71 6.40 0.28 3.32 1.04 -1.26 -5.00 113.70 116.77 2ofw s SER 36 Ca 0.60 0.51 0.01 0.00 0.48 0.00 0.00 55.95 57.55 2ofw s SER 36 Cb -0.19 -2.06 0.63 0.00 0.10 0.00 0.00 66.02 64.50 2ofw s SER 36 CO 0.24 -0.13 1.73 0.03 0.98 0.00 0.00 173.24 176.09 2ofw h ARG 37 N 1.73 0.48 -0.29 4.02 3.08 -1.97 -1.39 114.38 120.03 2ofw h ARG 37 Ca -0.48 -0.03 0.07 0.00 0.07 0.00 0.00 59.98 59.61 2ofw h ARG 37 Cb 1.19 -0.11 -0.07 0.00 0.08 0.00 0.00 29.97 31.06 2ofw h ARG 37 CO 0.66 0.32 -0.22 -0.97 -1.07 0.00 0.00 179.97 178.69 2ofw h ASN 38 N 0.49 -0.72 -0.67 7.04 -1.24 -2.00 -1.69 115.58 116.80 2ofw h ASN 38 Ca 0.51 0.14 -0.07 0.00 0.71 0.00 0.00 56.30 57.59 2ofw h ASN 38 Cb 0.86 0.35 -0.03 0.00 0.73 0.00 0.00 38.32 40.24 2ofw h ASN 38 CO -0.45 -0.25 0.16 0.50 -1.29 0.00 0.00 177.43 176.09 2ofw h LYS 39 N -0.20 1.09 -0.73 6.67 3.64 -1.69 -2.07 116.57 123.29 2ofw h LYS 39 Ca 0.16 -0.26 0.12 0.00 -1.27 0.00 0.00 60.65 59.39 2ofw h LYS 39 Cb 0.44 -0.14 -0.08 0.00 -0.41 0.00 0.00 32.23 32.03 2ofw h LYS 39 CO -0.41 0.97 0.33 0.00 -2.27 0.00 0.00 179.45 178.06 2ofw h ARG 40 N 1.03 0.51 -0.18 1.90 3.08 -1.03 -1.72 114.38 117.98 2ofw h ARG 40 Ca 0.21 -0.03 0.02 0.00 0.07 0.00 0.00 59.98 60.25 2ofw h ARG 40 Cb 0.37 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 2ofw h ARG 40 CO 0.00 0.34 0.12 0.78 -1.07 0.00 0.00 179.97 180.14 2ofw h GLY 41 N 0.53 0.18 1.92 0.04 0.00 -0.60 0.22 103.07 105.37 2ofw h GLY 41 Ca 0.38 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.64 2ofw h GLY 41 CO -0.33 0.06 0.00 -1.06 0.00 0.00 0.00 176.54 175.21 2ofw n GLN 42 N -4.51 0.07 0.00 4.80 6.02 -0.66 -3.28 117.38 119.82 2ofw n GLN 42 Ca 0.00 0.04 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 2ofw n GLN 42 Cb 0.14 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.90 2ofw n GLN 42 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 2ofw n VAL 43 N -1.46 0.00 0.10 5.09 3.14 -0.59 -4.86 118.33 119.75 2ofw n VAL 43 Ca 0.08 0.00 -0.22 0.00 -2.96 0.00 0.00 64.34 61.24 2ofw n VAL 43 Cb 0.29 -0.47 -0.13 0.00 -1.06 0.00 0.00 33.84 32.47 2ofw n VAL 43 CO 0.00 0.00 0.00 1.62 -6.46 0.00 0.00 176.83 171.99 2ofw h VAL 44 N 0.00 1.30 -3.90 1.55 3.04 -1.15 -3.47 116.25 113.64 2ofw h VAL 44 Ca 0.00 -2.55 0.00 0.00 -1.01 0.00 0.00 66.70 63.14 2ofw h VAL 44 Cb 0.61 2.76 0.00 0.00 -2.01 0.00 0.00 31.29 32.65 2ofw h VAL 44 CO 0.00 0.77 0.00 0.61 -1.01 0.00 0.00 177.57 177.94 2ofw n GLY 45 N 1.43 4.07 0.04 3.17 0.00 -1.26 -4.81 105.19 107.82 2ofw n GLY 45 Ca -0.14 -2.18 0.10 0.00 0.00 0.00 0.00 46.02 43.80 2ofw n GLY 45 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ofw n THR 46 N -0.17 0.00 -3.86 2.61 -2.24 -1.26 -4.80 114.28 104.55 2ofw n THR 46 Ca 0.00 -0.04 -0.36 0.00 -2.27 0.00 0.00 64.05 61.38 2ofw n THR 46 Cb 0.00 1.02 -0.14 0.00 -2.10 0.00 0.00 70.33 69.11 2ofw n THR 46 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2ofw s ARG 47 N -2.87 3.37 1.33 -0.78 3.52 -1.26 -5.12 118.95 117.13 2ofw s ARG 47 Ca 0.08 -0.64 -0.18 0.00 -0.13 0.00 0.00 55.73 54.86 2ofw s ARG 47 Cb 0.15 -3.12 0.34 0.00 -1.56 0.00 0.00 34.95 30.77 2ofw s ARG 47 CO 0.81 -0.24 0.95 0.41 -0.81 0.00 0.00 175.30 176.42 2ofw n GLY 48 N 4.82 -2.91 0.00 8.12 0.00 -1.26 -4.93 105.19 109.03 2ofw n GLY 48 Ca -0.17 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.42 2ofw n GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ofw n GLY 49 N 1.42 0.54 3.69 -0.02 0.00 -1.21 -4.98 105.19 104.63 2ofw n GLY 49 Ca 0.07 -1.46 -0.41 0.00 0.00 0.00 0.00 46.02 44.22 2ofw n GLY 49 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2ofw s PHE 50 N -1.46 3.51 -0.08 1.61 5.36 -1.26 -4.61 117.98 121.06 2ofw s PHE 50 Ca 0.00 1.29 0.21 0.00 -0.96 0.00 0.00 56.93 57.46 2ofw s PHE 50 Cb 0.00 -2.93 0.43 0.00 -0.34 0.00 0.00 43.02 40.18 2ofw s PHE 50 CO 0.00 -0.07 1.19 2.89 -1.46 0.00 0.00 175.22 177.77 2ofw n ARG 51 N 4.44 0.60 -1.82 10.12 1.85 -1.26 -5.04 116.66 125.56 2ofw n ARG 51 Ca 0.02 -2.49 -0.42 0.00 -1.00 0.00 0.00 57.85 53.96 2ofw n ARG 51 Cb 0.50 -0.60 -0.03 0.00 -1.05 0.00 0.00 32.46 31.28 2ofw n ARG 51 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2ofw s GLY 52 N -2.47 1.46 0.31 2.89 0.00 -1.24 -4.48 107.32 103.78 2ofw s GLY 52 Ca 0.35 1.30 -0.19 0.00 0.00 0.00 0.00 44.72 46.19 2ofw s GLY 52 CO -0.13 3.06 0.72 0.00 0.00 0.00 0.00 173.10 176.75 2ofw s THR 54 N -3.46 1.70 -0.39 0.00 2.01 0.00 -1.40 115.64 114.10 2ofw s THR 54 Ca 0.13 -0.81 -0.11 0.00 0.31 0.00 0.00 61.69 61.21 2ofw s THR 54 Cb -0.05 -1.50 0.04 0.00 0.01 0.00 0.00 72.50 71.00 2ofw s THR 54 CO 0.09 0.48 0.23 -0.63 -0.69 0.00 0.00 174.62 174.10 2ofw s ILE 55 N 0.50 4.54 -0.42 1.82 -1.09 0.89 -0.73 121.20 126.71 2ofw s ILE 55 Ca -0.17 -1.00 -0.09 0.00 -2.23 0.00 0.00 60.65 57.16 2ofw s ILE 55 Cb -0.17 -3.60 0.08 0.00 -1.58 0.00 0.00 42.46 37.18 2ofw s ILE 55 CO 0.06 -0.32 0.26 0.86 -1.23 0.00 0.00 174.94 174.57 2ofw s TRP 56 N 1.53 3.34 0.29 3.97 -0.11 0.18 -1.02 118.94 127.12 2ofw s TRP 56 Ca 0.02 -1.51 -0.20 0.00 1.22 0.00 0.00 56.10 55.63 2ofw s TRP 56 Cb -0.20 -2.95 -0.09 0.00 -1.50 0.00 0.00 33.47 28.72 2ofw s TRP 56 CO 0.06 -0.84 0.80 -0.51 -4.62 0.00 0.00 176.95 171.83 2ofw s LEU 57 N 1.43 4.22 -0.03 5.86 1.43 -0.83 -0.51 118.68 130.24 2ofw s LEU 57 Ca 0.03 1.50 -0.14 0.00 -1.03 0.00 0.00 54.13 54.49 2ofw s LEU 57 Cb -0.23 -3.92 0.02 0.00 0.03 0.00 0.00 46.19 42.10 2ofw s LEU 57 CO 0.02 -0.10 0.31 0.28 0.23 0.00 0.00 176.35 177.09 2ofw s THR 58 N -1.75 0.05 0.00 5.49 -1.32 -0.89 -3.83 115.64 113.39 2ofw s THR 58 Ca 0.50 -0.40 0.00 0.00 -1.21 0.00 0.00 61.69 60.58 2ofw s THR 58 Cb -0.14 -0.58 0.00 0.00 -1.51 0.00 0.00 72.50 70.27 2ofw s THR 58 CO 0.20 -0.22 0.00 0.61 -2.21 0.00 0.00 174.62 173.00 2ofw n GLY 59 N 1.59 0.52 3.71 6.08 0.00 -1.12 -0.21 105.19 115.76 2ofw n GLY 59 Ca -0.20 -1.45 -0.33 0.00 0.00 0.00 0.00 46.02 44.04 2ofw n GLY 59 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ofw s LEU 60 N 0.00 3.12 0.17 0.99 1.02 -1.26 -4.42 118.68 118.30 2ofw s LEU 60 Ca 0.00 2.25 -0.32 0.00 0.02 0.00 0.00 54.13 56.08 2ofw s LEU 60 Cb 0.00 -4.58 -0.11 0.00 0.02 0.00 0.00 46.19 41.52 2ofw s LEU 60 CO 0.00 -2.55 1.76 -0.55 0.02 0.00 0.00 176.35 175.02 2ofw s SER 61 N -2.39 6.41 0.00 2.29 0.15 -1.26 -2.15 113.70 116.75 2ofw s SER 61 Ca 0.70 2.81 0.00 0.00 0.70 0.00 0.00 55.95 60.16 2ofw s SER 61 Cb -0.26 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.47 2ofw s SER 61 CO 0.51 -0.98 0.00 0.61 1.20 0.00 0.00 173.24 174.58 2ofw n GLY 62 N 4.07 0.85 0.20 9.45 0.00 -1.26 -4.80 105.19 113.69 2ofw n GLY 62 Ca 0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.32 2ofw n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ofw h ALA 63 N 0.00 1.00 0.00 4.61 0.00 -1.77 -3.45 119.26 119.66 2ofw h ALA 63 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2ofw h ALA 63 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2ofw h ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2ofw n GLY 64 N 0.60 1.07 0.12 0.00 0.00 -1.26 -4.60 105.19 101.12 2ofw n GLY 64 Ca 0.03 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.97 2ofw n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ofw h LYS 65 N 0.00 0.16 -0.13 1.61 1.57 -1.91 -0.69 116.57 117.18 2ofw h LYS 65 Ca 0.00 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.73 2ofw h LYS 65 Cb 0.00 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.27 2ofw h LYS 65 CO 0.00 0.10 -0.06 1.15 -0.57 0.00 0.00 179.45 180.07 2ofw h THR 66 N 0.16 1.31 -0.44 -0.16 2.02 -1.98 0.39 112.91 114.23 2ofw h THR 66 Ca 0.12 -1.08 0.09 0.00 0.77 0.00 0.00 66.41 66.30 2ofw h THR 66 Cb 0.11 1.75 -0.09 0.00 -1.74 0.00 0.00 68.15 68.18 2ofw h THR 66 CO -0.15 0.31 -0.24 0.74 0.37 0.00 0.00 175.52 176.56 2ofw h THR 67 N -0.06 0.33 -0.23 3.16 2.02 -1.95 0.89 112.91 117.08 2ofw h THR 67 Ca 0.03 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.17 2ofw h THR 67 Cb 0.52 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 2ofw h THR 67 CO 0.02 0.00 -0.00 0.58 0.37 0.00 0.00 175.52 176.49 2ofw h VAL 68 N -0.16 1.26 -0.26 3.16 2.07 -1.07 -2.64 116.25 118.61 2ofw h VAL 68 Ca 0.20 -0.89 0.06 0.00 0.82 0.00 0.00 66.70 66.89 2ofw h VAL 68 Cb 0.48 1.40 -0.08 0.00 -1.52 0.00 0.00 31.29 31.57 2ofw h VAL 68 CO -0.53 0.28 -0.33 0.28 0.02 0.00 0.00 177.57 177.29 2ofw h SER 69 N 0.17 -1.06 0.24 0.57 0.02 0.31 0.55 113.55 114.35 2ofw h SER 69 Ca 0.06 0.17 -0.16 0.00 -0.84 0.00 0.00 61.79 61.02 2ofw h SER 69 Cb 0.41 0.47 -0.01 0.00 0.14 0.00 0.00 62.40 63.41 2ofw h SER 69 CO 0.01 -0.34 -0.61 0.24 -1.14 0.00 0.00 176.83 174.99 2ofw h MET 70 N -0.33 0.37 -0.02 3.45 2.86 -0.89 -0.50 114.93 119.88 2ofw h MET 70 Ca 0.13 -0.26 -0.19 0.00 -2.06 0.00 0.00 59.70 57.33 2ofw h MET 70 Cb 0.54 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.23 2ofw h MET 70 CO -0.44 0.87 -0.82 0.00 1.06 0.00 0.00 176.91 177.57 2ofw h ALA 71 N 1.07 0.57 -0.43 6.32 0.00 -1.24 -1.04 119.26 124.52 2ofw h ALA 71 Ca -0.01 -0.68 -0.04 0.00 0.00 0.00 0.00 54.91 54.18 2ofw h ALA 71 Cb 1.14 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 2ofw h ALA 71 CO 0.10 0.86 0.10 1.25 0.00 0.00 0.00 179.25 181.56 2ofw h LEU 72 N 0.14 0.66 -0.22 0.00 5.85 0.26 -1.71 115.31 120.28 2ofw h LEU 72 Ca -0.04 -0.24 -0.00 0.00 0.84 0.00 0.00 57.88 58.44 2ofw h LEU 72 Cb 1.42 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.27 2ofw h LEU 72 CO 0.13 0.72 0.13 -0.08 -0.34 0.00 0.00 178.44 179.00 2ofw h GLU 73 N 0.56 0.30 -0.63 1.25 4.81 -1.02 -1.64 114.58 118.21 2ofw h GLU 73 Ca 0.13 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.40 2ofw h GLU 73 Cb 0.32 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.58 2ofw h GLU 73 CO 0.00 0.26 0.32 1.49 -0.73 0.00 0.00 179.01 180.36 2ofw h GLU 74 N 0.26 0.58 -0.87 1.92 4.81 -1.17 -1.72 114.58 118.39 2ofw h GLU 74 Ca 0.08 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.28 2ofw h GLU 74 Cb 0.04 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.25 2ofw h GLU 74 CO -0.01 0.38 0.57 -0.92 -0.73 0.00 0.00 179.01 178.30 2ofw h TYR 75 N 0.60 1.10 -0.21 0.92 3.20 -1.01 -1.86 116.97 119.71 2ofw h TYR 75 Ca 0.29 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.11 2ofw h TYR 75 Cb 0.23 -0.37 -0.00 0.00 1.54 0.00 0.00 36.73 38.12 2ofw h TYR 75 CO -0.10 0.70 -0.15 -0.07 -1.64 0.00 0.00 178.16 176.90 2ofw h LEU 76 N 1.18 0.50 0.49 2.82 3.38 -0.84 -2.62 115.31 120.23 2ofw h LEU 76 Ca 0.32 -0.44 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 2ofw h LEU 76 Cb -0.12 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.49 2ofw h LEU 76 CO -0.07 0.84 -0.24 0.58 0.09 0.00 0.00 178.44 179.64 2ofw h VAL 77 N 0.17 0.51 0.00 1.22 2.07 -1.22 0.58 116.25 119.59 2ofw h VAL 77 Ca 0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 2ofw h VAL 77 Cb 0.67 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 2ofw h VAL 77 CO 0.04 0.00 0.13 0.00 0.02 0.00 0.00 177.57 177.76 2ofw n HIS 79 N -2.02 0.74 -1.04 0.00 -0.00 -0.91 -4.98 115.22 107.01 2ofw n HIS 79 Ca -0.01 -0.85 -0.01 0.00 -0.00 0.00 0.00 57.72 56.85 2ofw n HIS 79 Cb 0.15 -0.25 -0.01 0.00 -0.00 0.00 0.00 29.99 29.88 2ofw n HIS 79 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2ofw n GLY 80 N -0.53 0.51 3.33 -1.41 0.00 0.39 -5.01 105.19 102.47 2ofw n GLY 80 Ca 0.19 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 2ofw n GLY 80 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ofw s ILE 81 N -1.96 4.60 0.22 -0.61 -1.09 0.15 -4.25 121.20 118.26 2ofw s ILE 81 Ca 0.00 -1.15 -0.31 0.00 -2.23 0.00 0.00 60.65 56.96 2ofw s ILE 81 Cb 0.00 -3.73 -0.11 0.00 -1.58 0.00 0.00 42.46 37.05 2ofw s ILE 81 CO 0.00 -0.45 1.56 -2.84 -1.23 0.00 0.00 174.94 171.98 2ofw s PRO 82 N 1.52 4.20 0.31 2.79 0.02 -1.26 -3.28 135.00 139.29 2ofw s PRO 82 Ca 0.03 2.42 -0.14 0.00 0.02 0.00 0.00 61.00 63.33 2ofw s PRO 82 Cb -0.22 -3.11 0.02 0.00 0.02 0.00 0.00 34.50 31.21 2ofw s PRO 82 CO 0.05 -0.58 0.62 0.00 -0.33 0.00 0.00 177.00 176.76 2ofw s TYR 84 N -3.40 -0.83 -0.31 0.00 5.04 -0.26 -4.90 117.35 112.69 2ofw s TYR 84 Ca 0.19 1.72 -0.19 0.00 -2.44 0.00 0.00 57.07 56.34 2ofw s TYR 84 Cb -0.03 0.45 -0.01 0.00 0.35 0.00 0.00 41.96 42.71 2ofw s TYR 84 CO 0.11 -0.43 0.57 0.99 -1.34 0.00 0.00 175.55 175.45 2ofw s THR 85 N 1.45 4.99 -0.40 4.34 2.01 -1.26 -1.36 115.64 125.41 2ofw s THR 85 Ca -0.09 0.69 -0.15 0.00 0.31 0.00 0.00 61.69 62.45 2ofw s THR 85 Cb -0.06 -3.95 0.01 0.00 0.01 0.00 0.00 72.50 68.50 2ofw s THR 85 CO -0.16 -0.12 0.29 -0.76 -0.69 0.00 0.00 174.62 173.18 2ofw s LEU 86 N 2.49 4.98 -0.15 4.42 1.43 -0.15 -4.98 118.68 126.71 2ofw s LEU 86 Ca 0.22 -0.79 -0.04 0.00 -1.03 0.00 0.00 54.13 52.49 2ofw s LEU 86 Cb -0.15 -2.16 -0.03 0.00 0.03 0.00 0.00 46.19 43.87 2ofw s LEU 86 CO 0.12 -0.41 -0.01 -0.62 0.23 0.00 0.00 176.35 175.66 2ofw s ASP 87 N 1.69 5.05 0.23 2.29 2.15 -1.26 -0.84 116.67 125.97 2ofw s ASP 87 Ca 0.05 -0.04 -0.08 0.00 0.43 0.00 0.00 52.55 52.92 2ofw s ASP 87 Cb -0.19 -1.76 0.37 0.00 -0.30 0.00 0.00 42.92 41.04 2ofw s ASP 87 CO 0.10 0.21 1.68 1.23 -0.17 0.00 0.00 175.17 178.22 2ofw h GLY 88 N 6.44 0.84 1.13 2.66 0.00 -1.86 0.34 103.07 112.61 2ofw h GLY 88 Ca -0.36 0.01 -0.11 0.00 0.00 0.00 0.00 47.33 46.88 2ofw h GLY 88 CO 0.63 -0.19 -0.06 -0.55 0.00 0.00 0.00 176.54 176.37 2ofw h ASP 89 N 0.21 1.02 -0.22 0.19 3.32 -1.95 -0.50 116.42 118.48 2ofw h ASP 89 Ca 0.37 -0.32 -0.03 0.00 0.02 0.00 0.00 57.03 57.07 2ofw h ASP 89 Cb 0.60 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 2ofw h ASP 89 CO -0.51 1.11 0.01 0.78 -1.72 0.00 0.00 179.24 178.91 2ofw h ASN 90 N 0.93 0.37 -0.65 6.45 2.35 -1.48 -3.25 115.58 120.30 2ofw h ASN 90 Ca 0.15 -0.29 -0.05 0.00 -0.55 0.00 0.00 56.30 55.56 2ofw h ASN 90 Cb 0.62 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 38.86 2ofw h ASN 90 CO 0.04 0.57 0.22 0.40 -1.65 0.00 0.00 177.43 177.00 2ofw h ILE 91 N 0.15 1.25 0.00 2.81 1.08 -0.30 -2.31 117.51 120.19 2ofw h ILE 91 Ca 0.06 -0.85 0.00 0.00 -0.39 0.00 0.00 64.86 63.69 2ofw h ILE 91 Cb 0.37 0.50 0.00 0.00 -3.07 0.00 0.00 36.82 34.61 2ofw h ILE 91 CO 0.01 0.33 0.00 0.54 -0.69 0.00 0.00 178.15 178.34 2ofw n ARG 92 N -4.27 0.24 -0.16 2.37 1.74 -0.21 -0.72 116.66 115.66 2ofw n ARG 92 Ca 0.06 0.13 0.11 0.00 -0.77 0.00 0.00 57.85 57.37 2ofw n ARG 92 Cb 0.22 -1.50 0.19 0.00 -1.02 0.00 0.00 32.46 30.34 2ofw n ARG 92 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2ofw n GLN 93 N -1.24 2.35 0.00 5.56 6.02 -0.87 -3.20 117.38 126.00 2ofw n GLN 93 Ca 0.07 -2.15 0.00 0.00 -0.01 0.00 0.00 57.00 54.91 2ofw n GLN 93 Cb 0.11 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 29.90 2ofw n GLN 93 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ofw n GLY 94 N 1.34 1.89 0.32 1.08 0.00 0.10 -4.80 105.19 105.12 2ofw n GLY 94 Ca 0.17 -0.23 0.16 0.00 0.00 0.00 0.00 46.02 46.13 2ofw n GLY 94 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2ofw h LEU 95 N 0.00 0.21 -3.26 0.99 5.85 -1.80 -2.85 115.31 114.45 2ofw h LEU 95 Ca 0.00 0.19 -0.10 0.00 0.84 0.00 0.00 57.88 58.81 2ofw h LEU 95 Cb 0.00 0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 2ofw h LEU 95 CO 0.00 -0.13 -0.09 0.59 -0.34 0.00 0.00 178.44 178.48 2ofw n ASN 96 N -5.15 2.73 0.33 1.25 3.02 -0.39 -4.66 115.26 112.39 2ofw n ASN 96 Ca 0.25 -3.53 0.21 0.00 -0.03 0.00 0.00 54.58 51.48 2ofw n ASN 96 Cb 0.77 -0.58 1.12 0.00 -0.61 0.00 0.00 39.78 40.47 2ofw n ASN 96 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 2ofw h LYS 97 N 1.09 0.00 -0.79 3.52 2.10 -1.46 -2.61 116.57 118.42 2ofw h LYS 97 Ca 0.13 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.64 2ofw h LYS 97 Cb 1.48 0.00 -0.08 0.00 -0.90 0.00 0.00 32.23 32.73 2ofw h LYS 97 CO 0.27 0.00 0.17 0.27 -2.00 0.00 0.00 179.45 178.17 2ofw n ASN 98 N -3.16 4.23 -4.04 7.07 6.94 -1.26 -4.90 115.26 120.13 2ofw n ASN 98 Ca -0.02 -2.88 -0.24 0.00 -0.02 0.00 0.00 54.58 51.42 2ofw n ASN 98 Cb 0.11 -0.68 -0.16 0.00 -2.36 0.00 0.00 39.78 36.68 2ofw n ASN 98 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2ofw s LEU 99 N -2.21 1.73 0.00 -4.53 1.43 -0.98 -5.15 118.68 108.97 2ofw s LEU 99 Ca 0.42 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.23 2ofw s LEU 99 Cb 0.33 -0.81 0.00 0.00 0.03 0.00 0.00 46.19 45.74 2ofw s LEU 99 CO 0.11 0.07 0.00 0.61 0.23 0.00 0.00 176.35 177.36 2ofw n GLY 100 N 3.57 1.53 0.08 -3.19 0.00 -1.26 -5.06 105.19 100.87 2ofw n GLY 100 Ca -0.21 -1.71 0.03 0.00 0.00 0.00 0.00 46.02 44.13 2ofw n GLY 100 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2ofw n PHE 101 N 0.00 0.05 -1.00 1.61 3.72 -1.26 -4.34 117.46 116.25 2ofw n PHE 101 Ca 0.00 -0.65 -0.33 0.00 -0.05 0.00 0.00 57.45 56.42 2ofw n PHE 101 Cb 0.00 -0.08 0.13 0.00 -0.94 0.00 0.00 39.48 38.58 2ofw n PHE 101 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2ofw n SER 102 N -0.70 0.01 -0.35 4.37 3.41 -1.26 -4.64 113.62 114.47 2ofw n SER 102 Ca 0.06 0.51 0.12 0.00 -0.26 0.00 0.00 58.87 59.30 2ofw n SER 102 Cb 0.38 -1.41 0.30 0.00 -0.26 0.00 0.00 64.21 63.23 2ofw n SER 102 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2ofw h PRO 103 N -1.12 0.74 -0.55 4.33 0.11 -1.99 -0.18 132.00 133.34 2ofw h PRO 103 Ca -0.45 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 2ofw h PRO 103 Cb 1.30 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 2ofw h PRO 103 CO 0.42 0.49 0.28 0.93 -0.21 0.00 0.00 178.00 179.91 2ofw h GLU 104 N 0.76 0.78 -0.12 1.05 3.07 -1.99 -1.34 114.58 116.79 2ofw h GLU 104 Ca 0.56 -0.11 -0.17 0.00 -0.50 0.00 0.00 59.36 59.15 2ofw h GLU 104 Cb 0.85 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.61 2ofw h GLU 104 CO -0.38 0.63 -0.64 -0.44 -1.40 0.00 0.00 179.01 176.78 2ofw h ASP 105 N 0.74 0.53 -0.28 1.42 5.19 -1.56 -1.53 116.42 120.92 2ofw h ASP 105 Ca 0.19 -0.31 -0.10 0.00 -0.62 0.00 0.00 57.03 56.19 2ofw h ASP 105 Cb 0.09 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.43 2ofw h ASP 105 CO -0.03 1.03 -0.16 0.03 -3.12 0.00 0.00 179.24 176.99 2ofw h ARG 106 N 0.34 0.73 -0.11 3.56 3.08 -1.08 0.30 114.38 121.20 2ofw h ARG 106 Ca -0.01 -0.26 -0.00 0.00 0.07 0.00 0.00 59.98 59.77 2ofw h ARG 106 Cb 1.19 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.19 2ofw h ARG 106 CO 0.11 0.85 0.06 1.49 -1.07 0.00 0.00 179.97 181.41 2ofw h GLU 107 N 0.65 0.15 -0.75 0.04 4.81 -1.12 -2.33 114.58 116.04 2ofw h GLU 107 Ca 0.10 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.28 2ofw h GLU 107 Cb 0.64 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.96 2ofw h GLU 107 CO 0.05 0.18 0.31 1.49 -0.73 0.00 0.00 179.01 180.31 2ofw h GLU 108 N 0.09 1.11 -0.22 1.92 4.57 -1.00 -1.44 114.58 119.61 2ofw h GLU 108 Ca 0.04 -0.19 0.05 0.00 -1.18 0.00 0.00 59.36 58.07 2ofw h GLU 108 Cb 0.07 -0.18 -0.04 0.00 -0.16 0.00 0.00 28.75 28.43 2ofw h GLU 108 CO -0.01 0.90 -0.07 -0.97 -1.18 0.00 0.00 179.01 177.68 2ofw h ASN 109 N 1.07 -0.25 -0.33 1.04 -0.00 -0.39 -1.28 115.58 115.44 2ofw h ASN 109 Ca 0.25 0.07 -0.15 0.00 -0.00 0.00 0.00 56.30 56.47 2ofw h ASN 109 Cb 0.19 0.15 -0.00 0.00 -0.00 0.00 0.00 38.32 38.66 2ofw h ASN 109 CO -0.02 -0.09 -0.38 0.58 -0.00 0.00 0.00 177.43 177.51 2ofw h VAL 110 N -0.03 1.28 -0.29 2.57 2.07 -1.34 -2.76 116.25 117.75 2ofw h VAL 110 Ca 0.11 -1.56 0.01 0.00 0.82 0.00 0.00 66.70 66.08 2ofw h VAL 110 Cb 0.19 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.44 2ofw h VAL 110 CO -0.24 0.51 0.16 -0.09 0.02 0.00 0.00 177.57 177.94 2ofw h ARG 111 N 0.64 0.32 0.06 1.57 2.43 -1.05 0.03 114.38 118.39 2ofw h ARG 111 Ca 0.05 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 2ofw h ARG 111 Cb 0.98 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 2ofw h ARG 111 CO 0.09 0.21 -0.03 0.00 -1.51 0.00 0.00 179.97 178.74 2ofw h ARG 112 N 0.33 -0.08 -0.15 0.20 3.08 -1.28 -2.24 114.38 114.25 2ofw h ARG 112 Ca 0.12 0.01 -0.07 0.00 0.07 0.00 0.00 59.98 60.10 2ofw h ARG 112 Cb 0.01 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 2ofw h ARG 112 CO -0.06 -0.03 -0.23 0.97 -1.07 0.00 0.00 179.97 179.54 2ofw h ILE 113 N -0.11 1.23 -0.69 2.04 6.09 -1.32 -1.30 117.51 123.46 2ofw h ILE 113 Ca -0.01 -1.07 -0.00 0.00 -1.37 0.00 0.00 64.86 62.41 2ofw h ILE 113 Cb 0.09 1.38 -0.03 0.00 0.47 0.00 0.00 36.82 38.72 2ofw h ILE 113 CO 0.01 0.33 0.41 0.00 -3.07 0.00 0.00 178.15 175.84 2ofw h ALA 114 N 1.53 0.88 -0.52 0.18 0.00 -0.92 0.27 119.26 120.68 2ofw h ALA 114 Ca 0.04 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 2ofw h ALA 114 Cb 0.54 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2ofw h ALA 114 CO 0.04 0.35 0.07 0.93 0.00 0.00 0.00 179.25 180.63 2ofw h GLU 115 N 0.94 0.83 -0.21 0.00 4.39 -0.87 -1.73 114.58 117.91 2ofw h GLU 115 Ca 0.25 -0.20 -0.20 0.00 0.34 0.00 0.00 59.36 59.55 2ofw h GLU 115 Cb -0.03 -0.11 0.01 0.00 -0.10 0.00 0.00 28.75 28.52 2ofw h GLU 115 CO -0.05 0.79 -0.65 0.28 -1.16 0.00 0.00 179.01 178.22 2ofw h VAL 116 N 0.78 1.28 -0.79 3.13 2.07 -0.70 -2.73 116.25 119.29 2ofw h VAL 116 Ca 0.16 -1.85 -0.01 0.00 0.82 0.00 0.00 66.70 65.82 2ofw h VAL 116 Cb 0.38 1.83 -0.04 0.00 -1.52 0.00 0.00 31.29 31.94 2ofw h VAL 116 CO 0.01 0.59 0.44 0.00 0.02 0.00 0.00 177.57 178.63 2ofw h ALA 117 N 0.61 1.02 -0.93 1.67 0.00 -0.43 -1.54 119.26 119.65 2ofw h ALA 117 Ca -0.02 -0.12 0.13 0.00 0.00 0.00 0.00 54.91 54.90 2ofw h ALA 117 Cb 1.28 -0.32 -0.09 0.00 0.00 0.00 0.00 17.79 18.66 2ofw h ALA 117 CO 0.14 0.52 0.55 -0.22 0.00 0.00 0.00 179.25 180.24 2ofw h LYS 118 N 1.10 0.82 -0.16 0.00 3.64 -1.17 0.11 116.57 120.92 2ofw h LYS 118 Ca 0.28 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.54 2ofw h LYS 118 Cb 0.03 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 31.66 2ofw h LYS 118 CO -0.05 0.54 -0.16 -0.07 -2.27 0.00 0.00 179.45 177.45 2ofw h LEU 119 N 0.85 0.41 -1.17 5.20 3.38 -1.09 -0.58 115.31 122.31 2ofw h LEU 119 Ca 0.47 -0.48 0.01 0.00 0.09 0.00 0.00 57.88 57.97 2ofw h LEU 119 Cb 0.53 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 2ofw h LEU 119 CO -0.29 0.81 0.56 -0.26 0.09 0.00 0.00 178.44 179.35 2ofw h PHE 120 N 0.02 1.06 -0.19 1.13 0.04 -0.97 -0.69 116.94 117.34 2ofw h PHE 120 Ca 0.02 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.77 2ofw h PHE 120 Cb 0.70 -0.36 -0.01 0.00 2.20 0.00 0.00 35.95 38.49 2ofw h PHE 120 CO 0.08 0.65 -0.08 0.00 -0.60 0.00 0.00 178.31 178.37 2ofw h ALA 121 N 1.48 0.26 -0.37 2.45 0.00 -0.79 -1.15 119.26 121.15 2ofw h ALA 121 Ca 0.32 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.99 2ofw h ALA 121 Cb -0.09 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2ofw h ALA 121 CO -0.08 0.07 0.25 0.22 0.00 0.00 0.00 179.25 179.71 2ofw h ASP 122 N 0.08 0.30 0.68 0.00 3.58 -0.86 -1.25 116.42 118.95 2ofw h ASP 122 Ca 0.04 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.49 2ofw h ASP 122 Cb 0.55 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.53 2ofw h ASP 122 CO 0.03 0.21 0.00 0.00 -2.88 0.00 0.00 179.24 176.59 2ofw n ALA 123 N -2.51 2.00 0.00 -0.78 0.00 -0.29 -4.90 120.51 114.03 2ofw n ALA 123 Ca 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2ofw n ALA 123 Cb 0.18 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.28 2ofw n ALA 123 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ofw n GLY 124 N 0.67 0.71 3.93 0.00 0.00 -0.47 -4.95 105.19 105.07 2ofw n GLY 124 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 2ofw n GLY 124 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ofw s LEU 125 N 0.00 3.97 -0.32 0.99 1.02 -0.44 -3.69 118.68 120.21 2ofw s LEU 125 Ca 0.00 0.60 -0.21 0.00 0.02 0.00 0.00 54.13 54.54 2ofw s LEU 125 Cb 0.00 -3.46 -0.00 0.00 0.02 0.00 0.00 46.19 42.74 2ofw s LEU 125 CO 0.00 -0.31 0.68 -0.69 0.02 0.00 0.00 176.35 176.06 2ofw s VAL 126 N -2.31 4.88 -0.22 -1.59 1.01 -0.85 -2.75 120.40 118.57 2ofw s VAL 126 Ca 0.42 0.90 -0.09 0.00 0.00 0.00 0.00 61.98 63.21 2ofw s VAL 126 Cb -0.10 -4.06 -0.05 0.00 0.00 0.00 0.00 36.38 32.17 2ofw s VAL 126 CO 0.36 -0.22 0.13 0.00 0.00 0.00 0.00 175.10 175.36 2ofw s ILE 128 N 0.81 3.44 -0.02 0.00 1.01 -0.46 -0.07 121.20 125.90 2ofw s ILE 128 Ca 0.06 -0.76 -0.09 0.00 0.00 0.00 0.00 60.65 59.87 2ofw s ILE 128 Cb -0.13 -2.71 -0.05 0.00 0.01 0.00 0.00 42.46 39.58 2ofw s ILE 128 CO 0.02 0.21 0.28 0.42 0.00 0.00 0.00 174.94 175.87 2ofw s THR 129 N 1.43 5.27 -0.50 2.92 -4.23 -0.19 -0.98 115.64 119.36 2ofw s THR 129 Ca 0.02 0.35 0.06 0.00 -1.18 0.00 0.00 61.69 60.94 2ofw s THR 129 Cb -0.16 -3.56 0.21 0.00 1.34 0.00 0.00 72.50 70.32 2ofw s THR 129 CO -0.01 0.47 0.49 -1.54 -0.54 0.00 0.00 174.62 173.48 2ofw n SER 130 N 1.46 1.08 -4.45 3.99 3.41 -0.02 -1.96 113.62 117.12 2ofw n SER 130 Ca -0.14 -2.80 -0.32 0.00 -0.26 0.00 0.00 58.87 55.35 2ofw n SER 130 Cb 0.53 -0.64 -0.13 0.00 -0.26 0.00 0.00 64.21 63.71 2ofw n SER 130 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2ofw s PHE 131 N -1.01 2.60 0.30 7.33 2.99 -1.25 -2.29 117.98 126.66 2ofw s PHE 131 Ca 0.33 -0.23 0.05 0.00 0.00 0.00 0.00 56.93 57.08 2ofw s PHE 131 Cb 0.08 -1.55 0.78 0.00 0.00 0.00 0.00 43.02 42.33 2ofw s PHE 131 CO -0.14 0.19 1.69 0.82 -0.00 0.00 0.00 175.22 177.78 2ofw h ILE 132 N 4.19 0.44 -5.31 0.64 2.04 -1.85 -3.36 117.51 114.30 2ofw h ILE 132 Ca -0.46 -0.13 -0.26 0.00 1.00 0.00 0.00 64.86 65.00 2ofw h ILE 132 Cb 1.15 0.02 0.01 0.00 -0.74 0.00 0.00 36.82 37.26 2ofw h ILE 132 CO 0.49 0.07 -0.70 -1.54 0.00 0.00 0.00 178.15 176.47 2ofw n SER 133 N -5.06 -3.05 0.00 1.72 3.41 -1.26 -2.79 113.62 106.59 2ofw n SER 133 Ca 0.23 -0.32 0.14 0.00 -0.26 0.00 0.00 58.87 58.67 2ofw n SER 133 Cb 0.70 -0.94 0.68 0.00 -0.26 0.00 0.00 64.21 64.39 2ofw n SER 133 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2ofw n PRO 134 N -0.86 0.24 -4.22 4.33 -0.04 -1.26 -4.71 135.00 128.49 2ofw n PRO 134 Ca -0.12 0.01 -0.33 0.00 -0.04 0.00 0.00 63.50 63.02 2ofw n PRO 134 Cb 0.41 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.22 2ofw n PRO 134 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2ofw s TYR 135 N -2.75 2.81 0.17 0.54 2.02 -1.26 0.01 117.35 118.89 2ofw s TYR 135 Ca 0.22 -1.32 -0.14 0.00 -0.37 0.00 0.00 57.07 55.46 2ofw s TYR 135 Cb 0.19 -1.94 0.12 0.00 -0.40 0.00 0.00 41.96 39.93 2ofw s TYR 135 CO 0.48 -0.65 1.75 1.15 -1.57 0.00 0.00 175.55 176.70 2ofw h THR 136 N 5.81 0.86 0.00 -0.71 2.02 -1.88 -1.92 112.91 117.10 2ofw h THR 136 Ca -0.41 -0.11 -0.00 0.00 0.77 0.00 0.00 66.41 66.66 2ofw h THR 136 Cb 1.16 0.52 -0.00 0.00 -1.74 0.00 0.00 68.15 68.09 2ofw h THR 136 CO 0.61 0.06 -0.01 -0.61 0.37 0.00 0.00 175.52 175.94 2ofw h GLN 137 N 0.32 0.00 0.06 6.66 4.15 -1.97 0.39 115.11 124.72 2ofw h GLN 137 Ca 0.20 0.00 -0.31 0.00 0.77 0.00 0.00 58.65 59.31 2ofw h GLN 137 Cb 0.19 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.86 2ofw h GLN 137 CO -0.21 0.01 -1.68 -0.44 -1.93 0.00 0.00 178.83 174.58 2ofw h ASP 138 N 0.00 0.21 -0.37 -0.69 3.32 -1.79 -1.91 116.42 115.20 2ofw h ASP 138 Ca -0.00 -0.39 -0.13 0.00 0.02 0.00 0.00 57.03 56.53 2ofw h ASP 138 Cb 0.02 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 2ofw h ASP 138 CO 0.00 1.34 -0.25 0.03 -1.72 0.00 0.00 179.24 178.64 2ofw h ARG 139 N 0.04 0.88 -0.20 3.56 3.08 -1.06 -1.69 114.38 119.00 2ofw h ARG 139 Ca -0.29 -0.38 0.00 0.00 0.07 0.00 0.00 59.98 59.38 2ofw h ARG 139 Cb 2.00 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 32.02 2ofw h ARG 139 CO 0.11 1.03 0.13 -0.91 -1.07 0.00 0.00 179.97 179.26 2ofw h ASN 140 N 0.75 0.23 -0.82 7.04 2.35 -0.30 -1.86 115.58 122.97 2ofw h ASN 140 Ca 0.09 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2ofw h ASN 140 Cb 0.81 -0.06 -0.04 0.00 0.05 0.00 0.00 38.32 39.08 2ofw h ASN 140 CO 0.07 0.17 0.52 -1.13 -1.65 0.00 0.00 177.43 175.41 2ofw h ASN 141 N 0.26 0.97 -0.26 5.81 -0.00 -1.27 -1.21 115.58 119.88 2ofw h ASN 141 Ca 0.07 -0.04 0.00 0.00 -0.00 0.00 0.00 56.30 56.33 2ofw h ASN 141 Cb -0.02 -0.24 -0.01 0.00 -0.00 0.00 0.00 38.32 38.04 2ofw h ASN 141 CO -0.02 0.73 0.17 0.00 -0.00 0.00 0.00 177.43 178.31 2ofw h ALA 142 N 1.44 0.33 -0.47 1.57 0.00 -1.11 -0.53 119.26 120.49 2ofw h ALA 142 Ca 0.30 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.25 2ofw h ALA 142 Cb -0.08 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.55 2ofw h ALA 142 CO -0.06 -0.19 0.16 -0.09 0.00 0.00 0.00 179.25 179.07 2ofw h ARG 143 N 0.34 0.32 -0.48 0.00 2.43 -0.84 -2.66 114.38 113.49 2ofw h ARG 143 Ca 0.09 -0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.14 2ofw h ARG 143 Cb -0.03 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 2ofw h ARG 143 CO -0.02 0.21 -0.11 1.96 -1.51 0.00 0.00 179.97 180.51 2ofw h GLN 144 N 0.33 0.88 -0.81 0.20 4.20 -0.93 0.46 115.11 119.44 2ofw h GLN 144 Ca 0.23 -0.30 0.18 0.00 0.06 0.00 0.00 58.65 58.82 2ofw h GLN 144 Cb 0.24 -0.07 -0.12 0.00 0.30 0.00 0.00 27.48 27.83 2ofw h GLN 144 CO -0.24 0.94 0.28 0.82 -0.67 0.00 0.00 178.83 179.97 2ofw h ILE 145 N 0.79 0.51 0.09 2.54 2.04 -0.91 -1.87 117.51 120.70 2ofw h ILE 145 Ca 0.13 -0.12 -0.21 0.00 1.00 0.00 0.00 64.86 65.66 2ofw h ILE 145 Cb 0.62 0.13 0.02 0.00 -0.74 0.00 0.00 36.82 36.86 2ofw h ILE 145 CO 0.04 0.06 -0.89 0.45 0.00 0.00 0.00 178.15 177.81 2ofw h HIS 146 N 0.35 0.72 -0.50 1.37 3.86 -0.94 -3.25 115.15 116.75 2ofw h HIS 146 Ca 0.48 -0.46 0.04 0.00 -1.16 0.00 0.00 60.37 59.27 2ofw h HIS 146 Cb 0.85 -0.06 -0.04 0.00 1.06 0.00 0.00 27.41 29.22 2ofw h HIS 146 CO -0.20 1.31 0.26 0.93 0.86 0.00 0.00 177.93 181.09 2ofw h GLU 147 N -0.08 0.49 0.00 2.45 5.08 -0.78 0.17 114.58 121.92 2ofw h GLU 147 Ca -0.14 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 2ofw h GLU 147 Cb 1.63 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.77 2ofw h GLU 147 CO 0.17 0.32 0.00 0.78 -1.00 0.00 0.00 179.01 179.29 2ofw h GLY 148 N 0.51 0.00 -1.68 -3.84 0.00 -1.44 0.14 103.07 96.76 2ofw h GLY 148 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 2ofw h GLY 148 CO -0.14 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.40 2ofw n ALA 149 N -1.98 2.39 -3.46 3.60 0.00 -0.66 -4.97 120.51 115.43 2ofw n ALA 149 Ca -0.02 -0.89 -0.25 0.00 0.00 0.00 0.00 53.44 52.28 2ofw n ALA 149 Cb 0.07 -0.64 0.03 0.00 0.00 0.00 0.00 19.45 18.91 2ofw n ALA 149 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2ofw n SER 150 N 1.05 -5.36 -4.64 0.00 7.64 0.47 -4.99 113.62 107.79 2ofw n SER 150 Ca 0.14 -0.50 -0.35 0.00 1.01 0.00 0.00 58.87 59.17 2ofw n SER 150 Cb 0.48 -4.30 -0.10 0.00 -1.01 0.00 0.00 64.21 59.28 2ofw n SER 150 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2ofw s LEU 151 N -6.95 3.69 0.25 -3.43 1.43 0.52 -4.99 118.68 109.20 2ofw s LEU 151 Ca 0.49 0.09 -0.31 0.00 -1.03 0.00 0.00 54.13 53.36 2ofw s LEU 151 Cb -0.23 -1.90 -0.13 0.00 0.03 0.00 0.00 46.19 43.96 2ofw s LEU 151 CO 0.60 0.24 1.50 -2.65 0.23 0.00 0.00 176.35 176.27 2ofw n PRO 152 N 3.07 2.32 -4.20 1.29 -0.02 -1.26 -3.90 135.00 132.30 2ofw n PRO 152 Ca -0.17 0.83 -0.24 0.00 -2.02 0.00 0.00 63.50 61.90 2ofw n PRO 152 Cb 0.53 -2.55 -0.17 0.00 -0.02 0.00 0.00 33.50 31.29 2ofw n PRO 152 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2ofw s PHE 153 N 0.08 1.19 -0.26 6.00 2.19 -1.26 -0.82 117.98 125.10 2ofw s PHE 153 Ca 0.68 -0.46 0.01 0.00 0.33 0.00 0.00 56.93 57.48 2ofw s PHE 153 Cb -0.59 -0.98 0.07 0.00 -1.31 0.00 0.00 43.02 40.22 2ofw s PHE 153 CO 0.48 -0.32 -0.03 -0.06 1.83 0.00 0.00 175.22 177.12 2ofw s PHE 154 N 1.15 2.60 -0.43 10.12 0.40 0.09 -4.99 117.98 126.93 2ofw s PHE 154 Ca -0.06 -1.99 -0.26 0.00 -0.60 0.00 0.00 56.93 54.02 2ofw s PHE 154 Cb -0.14 -1.82 0.02 0.00 0.51 0.00 0.00 43.02 41.59 2ofw s PHE 154 CO -0.01 -0.82 0.93 -2.00 0.70 0.00 0.00 175.22 174.02 2ofw s GLU 155 N 1.32 3.65 -0.27 0.44 2.12 -1.26 0.50 118.70 125.20 2ofw s GLU 155 Ca -0.02 0.33 -0.07 0.00 0.36 0.00 0.00 54.97 55.57 2ofw s GLU 155 Cb -0.19 -3.88 -0.01 0.00 0.26 0.00 0.00 34.13 30.31 2ofw s GLU 155 CO -0.08 -1.13 0.07 0.08 -0.54 0.00 0.00 175.26 173.66 2ofw s VAL 156 N 3.67 4.11 -0.39 3.70 1.01 0.33 -0.69 120.40 132.15 2ofw s VAL 156 Ca 0.38 -0.44 -0.27 0.00 0.00 0.00 0.00 61.98 61.65 2ofw s VAL 156 Cb -0.11 -3.01 0.02 0.00 0.00 0.00 0.00 36.38 33.28 2ofw s VAL 156 CO 0.24 0.22 1.00 0.12 0.00 0.00 0.00 175.10 176.67 2ofw s PHE 157 N 1.56 3.03 -0.70 5.22 5.36 0.30 -2.09 117.98 130.66 2ofw s PHE 157 Ca 0.05 0.81 -0.19 0.00 -0.96 0.00 0.00 56.93 56.64 2ofw s PHE 157 Cb -0.16 -3.83 0.12 0.00 -0.34 0.00 0.00 43.02 38.81 2ofw s PHE 157 CO 0.03 -0.92 0.84 0.08 -1.46 0.00 0.00 175.22 173.78 2ofw s VAL 158 N 3.72 4.81 -0.37 3.12 1.01 0.70 -0.78 120.40 132.61 2ofw s VAL 158 Ca 0.41 -1.18 -0.05 0.00 0.00 0.00 0.00 61.98 61.17 2ofw s VAL 158 Cb -0.11 -4.58 0.07 0.00 0.00 0.00 0.00 36.38 31.77 2ofw s VAL 158 CO 0.21 -1.24 0.16 -0.62 0.00 0.00 0.00 175.10 173.60 2ofw s ASP 159 N 3.48 5.29 -0.03 3.32 2.15 0.54 -4.26 116.67 127.16 2ofw s ASP 159 Ca 0.18 -1.55 0.02 0.00 0.43 0.00 0.00 52.55 51.63 2ofw s ASP 159 Cb -0.18 -1.85 0.01 0.00 -0.30 0.00 0.00 42.92 40.60 2ofw s ASP 159 CO 0.02 -0.44 -0.08 0.00 -0.17 0.00 0.00 175.17 174.50 2ofw s ALA 160 N 1.29 0.81 0.73 3.66 0.00 -1.26 -2.58 121.76 124.42 2ofw s ALA 160 Ca 0.02 -0.27 -0.16 0.00 0.00 0.00 0.00 51.96 51.55 2ofw s ALA 160 Cb -0.22 -0.34 0.03 0.00 0.00 0.00 0.00 23.12 22.60 2ofw s ALA 160 CO -0.00 0.11 1.19 -0.35 0.00 0.00 0.00 175.76 176.71 2ofw n PRO 161 N 3.44 0.59 -0.12 0.00 -0.04 -1.26 -4.76 135.00 132.85 2ofw n PRO 161 Ca -0.19 0.27 -0.05 0.00 -0.04 0.00 0.00 63.50 63.48 2ofw n PRO 161 Cb 0.54 -2.43 0.01 0.00 -0.04 0.00 0.00 33.50 31.58 2ofw n PRO 161 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2ofw h LEU 162 N -0.25 -0.37 -1.80 1.53 5.85 -1.99 -1.95 115.31 116.33 2ofw h LEU 162 Ca -0.48 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 2ofw h LEU 162 Cb 1.32 0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.59 2ofw h LEU 162 CO 0.49 -0.13 0.06 1.12 -0.34 0.00 0.00 178.44 179.64 2ofw h HIS 163 N -0.00 0.18 -0.64 1.25 2.07 -1.98 0.34 115.15 116.38 2ofw h HIS 163 Ca 0.19 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 57.62 2ofw h HIS 163 Cb 0.29 -0.06 -0.02 0.00 2.57 0.00 0.00 27.41 30.19 2ofw h HIS 163 CO -0.35 0.14 0.06 0.28 -3.07 0.00 0.00 177.93 174.99 2ofw h VAL 164 N 0.19 1.26 -0.22 6.12 2.07 -1.73 -0.27 116.25 123.68 2ofw h VAL 164 Ca 0.05 -1.09 -0.19 0.00 0.82 0.00 0.00 66.70 66.29 2ofw h VAL 164 Cb 0.03 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 2ofw h VAL 164 CO -0.01 0.40 -0.63 0.00 0.02 0.00 0.00 177.57 177.36 2ofw h GLU 166 N 0.57 0.08 -0.12 0.00 4.81 -0.31 -1.26 114.58 118.34 2ofw h GLU 166 Ca -0.01 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.10 2ofw h GLU 166 Cb 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 2ofw h GLU 166 CO 0.13 0.53 -0.24 0.37 -0.73 0.00 0.00 179.01 179.07 2ofw h GLN 167 N 0.06 0.37 -0.46 1.92 4.15 -1.05 -2.90 115.11 117.21 2ofw h GLN 167 Ca 0.00 -0.24 0.07 0.00 0.77 0.00 0.00 58.65 59.25 2ofw h GLN 167 Cb 0.85 0.03 -0.06 0.00 0.21 0.00 0.00 27.48 28.51 2ofw h GLN 167 CO 0.06 0.84 0.12 0.00 -1.93 0.00 0.00 178.83 177.93 2ofw h ARG 168 N -0.04 0.27 -7.09 1.69 3.08 -1.48 -3.47 114.38 107.34 2ofw h ARG 168 Ca 0.00 -0.02 -0.12 0.00 0.07 0.00 0.00 59.98 59.92 2ofw h ARG 168 Cb 0.83 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.82 2ofw h ARG 168 CO 0.05 0.18 -0.20 -3.47 -1.07 0.00 0.00 179.97 175.46 2ofw n ASP 169 N -5.06 -0.83 -0.18 7.04 2.03 -0.48 -4.76 116.55 114.30 2ofw n ASP 169 Ca 0.04 -0.25 0.03 0.00 0.52 0.00 0.00 54.79 55.13 2ofw n ASP 169 Cb 0.21 -0.31 0.30 0.00 -0.72 0.00 0.00 41.12 40.59 2ofw n ASP 169 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 2ofw h VAL 170 N 1.82 1.12 -0.35 5.18 3.04 -1.91 -2.76 116.25 122.40 2ofw h VAL 170 Ca -0.14 -0.30 0.00 0.00 -1.01 0.00 0.00 66.70 65.25 2ofw h VAL 170 Cb 0.28 0.16 0.00 0.00 -2.01 0.00 0.00 31.29 29.72 2ofw h VAL 170 CO 0.10 0.16 0.00 0.29 -1.01 0.00 0.00 177.57 177.11 2ofw n LYS 171 N -4.45 2.39 -0.94 4.17 5.02 -1.26 -4.97 118.16 118.12 2ofw n LYS 171 Ca 0.09 -2.01 0.00 0.00 -2.02 0.00 0.00 58.31 54.36 2ofw n LYS 171 Cb 0.10 -1.34 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 2ofw n LYS 171 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ofw n GLY 172 N 0.83 0.58 0.26 0.72 0.00 -1.04 -4.95 105.19 101.59 2ofw n GLY 172 Ca 0.14 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.08 2ofw n GLY 172 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ofw h LEU 173 N 0.00 0.77 -0.34 0.99 3.38 -1.93 -2.14 115.31 116.03 2ofw h LEU 173 Ca 0.00 -0.29 -0.09 0.00 0.09 0.00 0.00 57.88 57.59 2ofw h LEU 173 Cb 0.11 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2ofw h LEU 173 CO 0.00 1.00 -0.13 1.88 0.09 0.00 0.00 178.44 181.28 2ofw h TYR 174 N 0.65 0.79 -0.12 1.13 0.05 -1.92 0.25 116.97 117.79 2ofw h TYR 174 Ca 0.08 -0.18 0.04 0.00 0.05 0.00 0.00 58.73 58.71 2ofw h TYR 174 Cb 0.78 -0.19 -0.04 0.00 1.01 0.00 0.00 36.73 38.30 2ofw h TYR 174 CO 0.04 0.88 -0.12 -0.22 -1.05 0.00 0.00 178.16 177.69 2ofw h LYS 175 N 0.47 -0.13 -0.36 4.88 3.11 -1.91 0.33 116.57 122.96 2ofw h LYS 175 Ca 0.08 0.01 0.04 0.00 -2.81 0.00 0.00 60.65 57.97 2ofw h LYS 175 Cb 0.65 0.03 -0.04 0.00 -1.00 0.00 0.00 32.23 31.87 2ofw h LYS 175 CO 0.04 -0.09 0.14 0.87 -2.81 0.00 0.00 179.45 177.60 2ofw h LYS 176 N -0.14 0.28 -0.56 1.90 1.57 -1.24 -1.71 116.57 116.68 2ofw h LYS 176 Ca 0.08 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 2ofw h LYS 176 Cb 0.26 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.48 2ofw h LYS 176 CO -0.21 0.19 0.16 0.00 -0.57 0.00 0.00 179.45 179.02 2ofw h ALA 177 N 1.22 1.22 -0.06 3.86 0.00 0.01 -0.16 119.26 125.35 2ofw h ALA 177 Ca 0.16 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 2ofw h ALA 177 Cb 0.13 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2ofw h ALA 177 CO -0.16 0.54 -0.44 0.00 0.00 0.00 0.00 179.25 179.20 2ofw h ARG 178 N 0.82 0.15 0.00 0.00 2.47 -0.14 -2.57 114.38 115.11 2ofw h ARG 178 Ca 0.18 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.83 2ofw h ARG 178 Cb 0.27 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.59 2ofw h ARG 178 CO -0.01 0.56 0.00 0.00 0.56 0.00 0.00 179.97 181.09 2ofw n ALA 179 N -2.47 2.11 -2.50 0.04 0.00 -0.66 -4.90 120.51 112.13 2ofw n ALA 179 Ca -0.02 -0.07 -0.06 0.00 0.00 0.00 0.00 53.44 53.29 2ofw n ALA 179 Cb 0.49 -1.40 0.01 0.00 0.00 0.00 0.00 19.45 18.55 2ofw n ALA 179 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ofw n GLY 180 N 1.00 0.35 0.06 0.00 0.00 -0.91 -4.94 105.19 100.75 2ofw n GLY 180 Ca 0.06 -0.52 0.07 0.00 0.00 0.00 0.00 46.02 45.63 2ofw n GLY 180 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ofw n GLU 181 N -1.68 0.64 -3.85 1.61 1.02 -0.13 -4.78 120.64 113.46 2ofw n GLU 181 Ca -0.03 -0.03 -0.29 0.00 -0.02 0.00 0.00 57.16 56.79 2ofw n GLU 181 Cb 0.53 -1.65 -0.16 0.00 -0.02 0.00 0.00 31.44 30.15 2ofw n GLU 181 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2ofw s ILE 182 N -3.27 1.12 0.64 -3.67 1.01 -1.23 -4.95 121.20 110.84 2ofw s ILE 182 Ca -0.05 -0.97 -0.11 0.00 0.00 0.00 0.00 60.65 59.52 2ofw s ILE 182 Cb 0.11 -1.50 -0.02 0.00 0.01 0.00 0.00 42.46 41.06 2ofw s ILE 182 CO 0.85 -0.16 1.03 -1.59 0.00 0.00 0.00 174.94 175.07 2ofw s LYS 183 N 1.58 3.34 -1.48 2.79 -2.85 -1.26 -4.23 119.74 117.63 2ofw s LYS 183 Ca -0.03 0.60 -0.03 0.00 -1.00 0.00 0.00 55.97 55.50 2ofw s LYS 183 Cb -0.18 -2.09 0.01 0.00 -2.06 0.00 0.00 37.83 33.51 2ofw s LYS 183 CO -0.07 -0.70 0.28 0.41 0.10 0.00 0.00 175.35 175.37 2ofw n GLY 184 N -2.79 -0.51 3.71 0.59 0.00 -1.26 -4.94 105.19 99.99 2ofw n GLY 184 Ca 0.06 0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2ofw n GLY 184 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2ofw s PHE 185 N -2.98 3.42 -0.34 1.61 5.36 -1.26 -4.25 117.98 119.54 2ofw s PHE 185 Ca 0.16 1.35 -0.43 0.00 -0.96 0.00 0.00 56.93 57.05 2ofw s PHE 185 Cb -0.08 -3.36 -0.19 0.00 -0.34 0.00 0.00 43.02 39.05 2ofw s PHE 185 CO 0.20 -1.05 1.56 2.41 -1.46 0.00 0.00 175.22 176.88 2ofw n THR 186 N 4.09 0.09 0.00 0.12 -1.04 -1.26 -0.50 114.28 115.78 2ofw n THR 186 Ca 0.09 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 2ofw n THR 186 Cb 0.47 -0.67 0.00 0.00 -1.82 0.00 0.00 70.33 68.31 2ofw n THR 186 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ofw n GLY 187 N 3.65 2.54 0.86 3.41 0.00 -0.52 -4.81 105.19 110.31 2ofw n GLY 187 Ca 0.27 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.28 2ofw n GLY 187 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2ofw n ILE 188 N -2.00 1.23 -1.49 -0.61 5.41 0.27 -4.88 119.36 117.29 2ofw n ILE 188 Ca 0.00 0.34 0.07 0.00 1.00 0.00 0.00 62.75 64.16 2ofw n ILE 188 Cb 0.00 -1.71 0.12 0.00 -0.71 0.00 0.00 39.64 37.34 2ofw n ILE 188 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 2ofw n ASP 189 N -3.63 1.63 -3.84 4.38 2.03 0.34 -4.94 116.55 112.53 2ofw n ASP 189 Ca -0.03 -2.95 -0.07 0.00 0.52 0.00 0.00 54.79 52.26 2ofw n ASP 189 Cb 0.10 -0.39 -0.02 0.00 -0.72 0.00 0.00 41.12 40.08 2ofw n ASP 189 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2ofw s SER 190 N -2.51 -0.27 0.26 1.67 1.04 -1.12 -4.03 113.70 108.74 2ofw s SER 190 Ca 0.27 -0.58 -0.14 0.00 0.48 0.00 0.00 55.95 55.98 2ofw s SER 190 Cb 0.25 0.72 -0.08 0.00 0.10 0.00 0.00 66.02 67.01 2ofw s SER 190 CO -0.01 -1.33 0.65 -1.61 0.98 0.00 0.00 173.24 171.92 2ofw s GLU 191 N -3.91 3.97 -0.19 4.02 0.41 -1.26 -1.44 118.70 120.30 2ofw s GLU 191 Ca 0.11 0.56 0.01 0.00 -0.41 0.00 0.00 54.97 55.23 2ofw s GLU 191 Cb -0.06 -2.62 0.02 0.00 -1.78 0.00 0.00 34.13 29.69 2ofw s GLU 191 CO 0.06 0.28 -0.17 -0.47 -0.49 0.00 0.00 175.26 174.47 2ofw s TYR 192 N -1.80 2.85 -0.46 1.61 5.04 -1.26 -4.66 117.35 118.67 2ofw s TYR 192 Ca 0.48 -1.62 -0.16 0.00 -2.44 0.00 0.00 57.07 53.33 2ofw s TYR 192 Cb -0.12 -1.95 0.05 0.00 0.35 0.00 0.00 41.96 40.30 2ofw s TYR 192 CO 0.19 -0.78 0.42 -1.21 -1.34 0.00 0.00 175.55 172.83 2ofw s GLU 193 N 1.30 3.01 0.37 4.97 2.02 0.10 -5.05 118.70 125.43 2ofw s GLU 193 Ca 0.04 -1.14 -0.24 0.00 0.02 0.00 0.00 54.97 53.64 2ofw s GLU 193 Cb -0.14 -4.08 -0.10 0.00 0.10 0.00 0.00 34.13 29.91 2ofw s GLU 193 CO -0.11 -0.99 0.98 -1.59 0.02 0.00 0.00 175.26 173.57 2ofw s LYS 194 N 1.87 4.37 0.60 1.61 0.00 -1.26 -4.40 119.74 122.54 2ofw s LYS 194 Ca 0.07 1.33 -0.19 0.00 0.00 0.00 0.00 55.97 57.18 2ofw s LYS 194 Cb -0.22 -2.57 -0.03 0.00 0.00 0.00 0.00 37.83 35.01 2ofw s LYS 194 CO 0.09 0.08 1.27 -2.30 0.00 0.00 0.00 175.35 174.49 2ofw n PRO 195 N 0.08 1.29 -0.07 1.78 -0.02 -1.26 -4.97 135.00 131.83 2ofw n PRO 195 Ca 0.04 0.49 -0.22 0.00 -2.02 0.00 0.00 63.50 61.79 2ofw n PRO 195 Cb 0.51 -2.49 -0.12 0.00 -0.02 0.00 0.00 33.50 31.37 2ofw n PRO 195 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2ofw n GLU 196 N -1.45 0.67 -2.49 -0.52 1.02 -1.26 -4.67 120.64 111.94 2ofw n GLU 196 Ca 0.14 0.32 -0.21 0.00 -0.02 0.00 0.00 57.16 57.39 2ofw n GLU 196 Cb 0.47 -1.66 0.01 0.00 -0.02 0.00 0.00 31.44 30.24 2ofw n GLU 196 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ofw n ALA 197 N -3.31 4.54 -1.57 0.62 0.00 -1.26 -5.10 120.51 114.44 2ofw n ALA 197 Ca -0.38 -3.90 -0.34 0.00 0.00 0.00 0.00 53.44 48.82 2ofw n ALA 197 Cb 0.93 -0.63 0.05 0.00 0.00 0.00 0.00 19.45 19.79 2ofw n ALA 197 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2ofw s PRO 198 N -3.46 2.79 0.51 0.00 0.04 -1.26 -4.89 135.00 128.73 2ofw s PRO 198 Ca 0.42 1.58 0.20 0.00 0.04 0.00 0.00 61.00 63.25 2ofw s PRO 198 Cb 0.41 -1.93 1.32 0.00 0.04 0.00 0.00 34.50 34.34 2ofw s PRO 198 CO -0.10 -1.29 2.10 0.93 0.04 0.00 0.00 177.00 178.68 2ofw h GLU 199 N 0.32 0.00 -1.98 4.56 3.07 -1.28 -3.45 114.58 115.82 2ofw h GLU 199 Ca -0.48 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.34 2ofw h GLU 199 Cb 1.27 0.00 -0.21 0.00 -0.84 0.00 0.00 28.75 28.97 2ofw h GLU 199 CO 0.54 0.09 0.15 -1.17 -1.40 0.00 0.00 179.01 177.21 2ofw s LEU 200 N -8.30 -0.74 -0.15 1.33 2.96 -1.12 -5.02 118.68 107.65 2ofw s LEU 200 Ca -0.04 1.42 -0.02 0.00 -0.22 0.00 0.00 54.13 55.27 2ofw s LEU 200 Cb 0.15 2.44 -0.02 0.00 0.50 0.00 0.00 46.19 49.27 2ofw s LEU 200 CO 0.64 -0.25 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.64 2ofw s VAL 201 N 0.36 3.34 -0.34 1.68 1.01 -1.26 -0.54 120.40 124.65 2ofw s VAL 201 Ca 0.00 -0.55 -0.08 0.00 0.00 0.00 0.00 61.98 61.35 2ofw s VAL 201 Cb -0.05 -2.44 0.03 0.00 0.00 0.00 0.00 36.38 33.93 2ofw s VAL 201 CO 0.01 0.51 0.13 -0.76 0.00 0.00 0.00 175.10 174.99 2ofw s LEU 202 N 0.45 4.39 -0.80 3.92 1.43 0.04 -4.97 118.68 123.14 2ofw s LEU 202 Ca -0.07 -1.04 -0.20 0.00 -1.03 0.00 0.00 54.13 51.79 2ofw s LEU 202 Cb -0.15 -1.92 0.11 0.00 0.03 0.00 0.00 46.19 44.26 2ofw s LEU 202 CO 0.04 -0.33 1.01 -0.54 0.23 0.00 0.00 176.35 176.77 2ofw s LYS 203 N 1.46 3.38 0.23 1.70 1.02 -1.26 -0.34 119.74 125.94 2ofw s LYS 203 Ca 0.00 -1.45 0.25 0.00 0.02 0.00 0.00 55.97 54.79 2ofw s LYS 203 Cb -0.19 -4.61 0.87 0.00 -0.52 0.00 0.00 37.83 33.37 2ofw s LYS 203 CO 0.04 -1.74 1.76 2.41 -0.92 0.00 0.00 175.35 176.90 2ofw n THR 204 N 5.58 0.67 1.05 2.17 -1.04 -1.06 -1.27 114.28 120.39 2ofw n THR 204 Ca 0.11 -0.13 0.12 0.00 -2.04 0.00 0.00 64.05 62.12 2ofw n THR 204 Cb 0.47 -0.77 0.26 0.00 -1.82 0.00 0.00 70.33 68.47 2ofw n THR 204 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 2ofw n ASP 205 N -2.27 0.65 -0.00 8.00 5.75 -1.26 -4.07 116.55 123.34 2ofw n ASP 205 Ca 0.04 -0.43 0.09 0.00 -0.01 0.00 0.00 54.79 54.48 2ofw n ASP 205 Cb 0.37 0.26 -0.12 0.00 -1.03 0.00 0.00 41.12 40.60 2ofw n ASP 205 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2ofw n SER 206 N -1.30 0.87 -3.93 -1.12 7.64 -0.39 -5.04 113.62 110.34 2ofw n SER 206 Ca 0.07 -0.48 -0.10 0.00 1.01 0.00 0.00 58.87 59.37 2ofw n SER 206 Cb 0.34 1.38 -0.07 0.00 -1.01 0.00 0.00 64.21 64.86 2ofw n SER 206 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ofw s ASP 208 N -2.95 6.11 0.27 0.00 3.84 -1.26 -4.76 116.67 117.92 2ofw s ASP 208 Ca 0.16 1.30 0.00 0.00 -0.00 0.00 0.00 52.55 54.01 2ofw s ASP 208 Cb 0.03 -2.35 0.56 0.00 -1.38 0.00 0.00 42.92 39.79 2ofw s ASP 208 CO -0.01 -0.90 1.78 0.58 -0.00 0.00 0.00 175.17 176.62 2ofw h VAL 209 N -0.29 0.77 -0.74 2.11 2.07 -2.00 -1.53 116.25 116.64 2ofw h VAL 209 Ca -0.45 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 66.79 2ofw h VAL 209 Cb 1.20 -0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 2ofw h VAL 209 CO 0.62 0.13 0.33 0.78 0.02 0.00 0.00 177.57 179.46 2ofw h ASN 210 N 0.72 0.98 -0.27 0.57 -0.26 -1.99 -1.51 115.58 113.81 2ofw h ASN 210 Ca 0.48 -0.12 -0.10 0.00 -0.56 0.00 0.00 56.30 56.00 2ofw h ASN 210 Cb 0.65 -0.25 -0.00 0.00 -1.06 0.00 0.00 38.32 37.65 2ofw h ASN 210 CO -0.34 0.84 -0.23 -0.78 -1.06 0.00 0.00 177.43 175.86 2ofw h ASP 211 N 1.06 0.68 -0.24 5.81 3.58 -1.68 -1.07 116.42 124.56 2ofw h ASP 211 Ca 0.25 -0.46 0.06 0.00 0.42 0.00 0.00 57.03 57.30 2ofw h ASP 211 Cb 0.14 -0.19 -0.06 0.00 1.72 0.00 0.00 39.33 40.94 2ofw h ASP 211 CO -0.03 0.99 -0.16 0.00 -2.88 0.00 0.00 179.24 177.16 2ofw h VAL 213 N -0.15 0.89 -0.77 0.00 2.07 -1.27 -2.09 116.25 114.93 2ofw h VAL 213 Ca 0.13 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.64 2ofw h VAL 213 Cb 0.35 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 30.85 2ofw h VAL 213 CO -0.33 0.02 0.51 1.56 0.02 0.00 0.00 177.57 179.35 2ofw h GLN 214 N 0.11 0.95 0.04 1.57 1.08 -0.62 0.40 115.11 118.64 2ofw h GLN 214 Ca 0.10 -0.06 -0.00 0.00 -1.45 0.00 0.00 58.65 57.24 2ofw h GLN 214 Cb 0.10 -0.22 -0.00 0.00 -0.05 0.00 0.00 27.48 27.32 2ofw h GLN 214 CO -0.14 0.63 -0.02 1.96 -0.95 0.00 0.00 178.83 180.31 2ofw h GLN 215 N 0.98 -0.06 -0.68 1.46 4.20 -0.08 -1.58 115.11 119.35 2ofw h GLN 215 Ca 0.30 0.00 0.03 0.00 0.06 0.00 0.00 58.65 59.04 2ofw h GLN 215 Cb -0.02 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.73 2ofw h GLN 215 CO -0.08 -0.04 0.42 0.28 -0.67 0.00 0.00 178.83 178.74 2ofw h VAL 216 N -0.06 1.09 -0.90 -0.54 2.07 -0.77 -2.68 116.25 114.46 2ofw h VAL 216 Ca -0.00 -0.28 0.03 0.00 0.82 0.00 0.00 66.70 67.26 2ofw h VAL 216 Cb 0.05 0.19 -0.05 0.00 -1.52 0.00 0.00 31.29 29.96 2ofw h VAL 216 CO 0.00 0.15 0.59 0.58 0.02 0.00 0.00 177.57 178.92 2ofw h VAL 217 N 0.83 1.18 -0.47 2.57 2.07 -0.80 -2.23 116.25 119.39 2ofw h VAL 217 Ca 0.27 -0.40 -0.08 0.00 0.82 0.00 0.00 66.70 67.32 2ofw h VAL 217 Cb 0.01 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.68 2ofw h VAL 217 CO -0.10 0.21 -0.02 -0.33 0.02 0.00 0.00 177.57 177.35 2ofw h GLU 218 N 1.16 0.80 -0.22 1.57 5.08 -1.06 -0.57 114.58 121.33 2ofw h GLU 218 Ca 0.35 -0.22 0.03 0.00 -1.00 0.00 0.00 59.36 58.51 2ofw h GLU 218 Cb -0.03 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 2ofw h GLU 218 CO -0.10 0.81 0.06 1.25 -1.00 0.00 0.00 179.01 180.03 2ofw h LEU 219 N 0.74 0.04 -1.39 1.33 5.85 -1.11 -0.37 115.31 120.40 2ofw h LEU 219 Ca 0.14 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.85 2ofw h LEU 219 Cb 0.47 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 2ofw h LEU 219 CO 0.02 0.05 -0.05 -0.07 -0.34 0.00 0.00 178.44 178.05 2ofw h LEU 220 N 0.15 0.32 0.64 2.25 3.38 -1.07 -0.40 115.31 120.58 2ofw h LEU 220 Ca 0.10 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2ofw h LEU 220 Cb 0.08 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 40.76 2ofw h LEU 220 CO -0.12 0.42 -0.31 0.78 0.09 0.00 0.00 178.44 179.30 2ofw h ASN 221 N 0.33 -0.73 -0.91 -0.43 -0.26 -0.73 0.30 115.58 113.15 2ofw h ASN 221 Ca 0.07 0.02 0.14 0.00 -0.56 0.00 0.00 56.30 55.98 2ofw h ASN 221 Cb 0.31 0.19 -0.07 0.00 -1.06 0.00 0.00 38.32 37.68 2ofw h ASN 221 CO 0.01 -0.52 0.58 -0.08 -1.06 0.00 0.00 177.43 176.37 2ofw h GLU 222 N -0.86 0.73 -0.02 0.81 4.57 -0.67 -2.48 114.58 116.67 2ofw h GLU 222 Ca -0.09 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.05 2ofw h GLU 222 Cb 0.66 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 29.08 2ofw h GLU 222 CO 0.14 0.48 -0.10 0.54 -1.18 0.00 0.00 179.01 178.89 2ofw n ARG 223 N -4.57 1.55 -2.24 1.92 5.12 -0.20 -4.95 116.66 113.28 2ofw n ARG 223 Ca 0.18 -1.03 -0.05 0.00 -1.93 0.00 0.00 57.85 55.02 2ofw n ARG 223 Cb 0.45 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 30.27 2ofw n ARG 223 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2ofw n ASP 224 N 0.17 -2.38 -0.10 0.55 9.92 -0.47 -4.96 116.55 119.28 2ofw n ASP 224 Ca 0.16 -0.03 -0.21 0.00 -0.53 0.00 0.00 54.79 54.18 2ofw n ASP 224 Cb 0.41 -1.57 -0.12 0.00 -0.64 0.00 0.00 41.12 39.20 2ofw n ASP 224 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 2ofw h ILE 225 N -0.14 1.04 -3.40 0.53 1.08 -0.72 -3.46 117.51 112.44 2ofw h ILE 225 Ca -0.12 -2.21 -0.60 0.00 -0.39 0.00 0.00 64.86 61.54 2ofw h ILE 225 Cb 1.09 2.40 -0.12 0.00 -3.07 0.00 0.00 36.82 37.12 2ofw h ILE 225 CO 0.14 0.37 -0.37 -0.22 -0.69 0.00 0.00 178.15 177.37 2ofw s LEU 226 N -7.91 4.19 0.00 1.44 2.96 -0.97 -4.92 118.68 113.48 2ofw s LEU 226 Ca -0.27 0.36 0.00 0.00 -0.22 0.00 0.00 54.13 54.00 2ofw s LEU 226 Cb 0.05 -2.29 0.00 0.00 0.50 0.00 0.00 46.19 44.45 2ofw s LEU 226 CO 0.61 0.07 0.00 -2.65 -1.32 0.00 0.00 176.35 173.06