#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gre h HIS 4 N 0.00 -0.65 -1.36 4.41 -0.00 -2.03 -2.85 115.15 112.66 2gre h HIS 4 Ca 0.00 -0.02 0.39 0.00 -0.00 0.00 0.00 60.37 60.75 2gre h HIS 4 Cb 0.00 0.22 -0.05 0.00 -0.00 0.00 0.00 27.41 27.57 2gre h HIS 4 CO 0.00 -0.33 1.11 2.41 -0.00 0.00 0.00 177.93 181.13 2gre n THR 5 N -5.28 0.00 0.08 6.26 -1.04 -1.26 0.36 114.28 113.40 2gre n THR 5 Ca -0.11 1.16 -0.13 0.00 -2.04 0.00 0.00 64.05 62.93 2gre n THR 5 Cb 0.32 -1.97 -0.07 0.00 -1.82 0.00 0.00 70.33 66.79 2gre n THR 5 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 2gre h LYS 6 N 0.00 -0.13 0.00 -2.82 1.63 -1.92 -3.21 116.57 110.12 2gre h LYS 6 Ca 0.65 0.01 -0.10 0.00 -0.85 0.00 0.00 60.65 60.35 2gre h LYS 6 Cb 2.87 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 34.51 2gre h LYS 6 CO -0.01 -0.08 -0.49 0.93 -3.45 0.00 0.00 179.45 176.34 2gre h GLU 7 N -0.13 0.00 0.00 1.90 5.08 -0.17 -1.00 114.58 120.26 2gre h GLU 7 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2gre h GLU 7 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2gre h GLU 7 CO 0.01 0.49 0.00 2.41 -1.00 0.00 0.00 179.01 180.93 2gre n THR 8 N -3.32 0.00 0.00 1.13 -1.04 -0.96 -2.36 114.28 107.73 2gre n THR 8 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 2gre n THR 8 Cb 0.68 -0.24 0.00 0.00 -1.82 0.00 0.00 70.33 68.95 2gre n THR 8 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2gre n GLU 10 N 0.02 0.00 0.03 -2.82 1.02 -0.38 -1.00 120.64 117.51 2gre n GLU 10 Ca 0.00 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.18 2gre n GLU 10 Cb 0.00 0.00 0.44 0.00 -0.02 0.00 0.00 31.44 31.86 2gre n GLU 10 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2gre h LEU 11 N 0.00 0.42 -0.17 -4.62 5.85 -1.75 0.56 115.31 115.60 2gre h LEU 11 Ca 0.00 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 2gre h LEU 11 Cb 0.00 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 2gre h LEU 11 CO 0.00 0.32 0.00 0.40 -0.34 0.00 0.00 178.44 178.82 2gre h ILE 12 N 0.50 1.25 -0.75 4.05 2.04 -1.35 -1.54 117.51 121.70 2gre h ILE 12 Ca 0.13 -0.84 0.16 0.00 1.00 0.00 0.00 64.86 65.32 2gre h ILE 12 Cb -0.04 1.46 -0.11 0.00 -0.74 0.00 0.00 36.82 37.40 2gre h ILE 12 CO -0.03 0.25 0.22 0.50 0.00 0.00 0.00 178.15 179.09 2gre h LYS 13 N 0.06 0.30 -0.70 2.37 3.64 -1.66 -1.30 116.57 119.27 2gre h LYS 13 Ca 0.05 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 2gre h LYS 13 Cb 0.37 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 2gre h LYS 13 CO 0.01 0.20 0.28 0.93 -2.27 0.00 0.00 179.45 178.60 2gre h GLU 14 N 0.31 1.05 -0.08 1.90 5.08 -0.12 -2.88 114.58 119.84 2gre h GLU 14 Ca 0.43 -0.19 -0.20 0.00 -1.00 0.00 0.00 59.36 58.40 2gre h GLU 14 Cb 0.73 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 2gre h GLU 14 CO -0.49 0.87 -0.78 -0.07 -1.00 0.00 0.00 179.01 177.53 2gre h LEU 15 N 1.00 0.59 -1.84 1.33 3.38 -0.52 -2.96 115.31 116.29 2gre h LEU 15 Ca 0.23 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 2gre h LEU 15 Cb 0.21 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2gre h LEU 15 CO -0.02 1.17 -0.10 0.58 0.09 0.00 0.00 178.44 180.16 2gre h VAL 16 N 0.32 1.02 -0.00 1.22 2.07 -1.22 -1.66 116.25 117.99 2gre h VAL 16 Ca -0.05 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.13 2gre h VAL 16 Cb 1.38 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 32.34 2gre h VAL 16 CO 0.14 0.10 -0.03 -1.20 0.02 0.00 0.00 177.57 176.60 2gre n SER 17 N -4.34 0.11 -4.47 0.57 7.64 -1.09 -4.51 113.62 107.53 2gre n SER 17 Ca -0.03 -0.32 -0.42 0.00 1.01 0.00 0.00 58.87 59.10 2gre n SER 17 Cb 0.18 -0.21 -0.10 0.00 -1.01 0.00 0.00 64.21 63.07 2gre n SER 17 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2gre s ILE 18 N -2.50 5.26 0.10 0.44 1.01 -0.63 -5.06 121.20 119.82 2gre s ILE 18 Ca 0.30 -0.57 -0.33 0.00 0.00 0.00 0.00 60.65 60.05 2gre s ILE 18 Cb 0.20 -3.89 -0.12 0.00 0.01 0.00 0.00 42.46 38.66 2gre s ILE 18 CO 0.46 -0.26 1.73 -2.65 0.00 0.00 0.00 174.94 174.22 2gre n PRO 19 N 5.16 2.37 -3.19 2.79 -0.02 -1.26 -4.92 135.00 135.93 2gre n PRO 19 Ca -0.11 0.86 -0.24 0.00 -2.02 0.00 0.00 63.50 61.99 2gre n PRO 19 Cb 0.48 -2.68 -0.07 0.00 -0.02 0.00 0.00 33.50 31.20 2gre n PRO 19 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2gre n SER 20 N 4.79 0.28 -4.78 2.55 3.41 -1.26 -4.73 113.62 113.87 2gre n SER 20 Ca 0.18 -2.72 -0.36 0.00 -0.26 0.00 0.00 58.87 55.71 2gre n SER 20 Cb 0.32 -0.64 -0.02 0.00 -0.26 0.00 0.00 64.21 63.60 2gre n SER 20 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2gre s PRO 21 N -1.29 3.91 0.05 4.33 0.04 -1.25 -1.22 135.00 139.57 2gre s PRO 21 Ca 0.35 1.62 -0.37 0.00 0.04 0.00 0.00 61.00 62.64 2gre s PRO 21 Cb 0.18 -2.42 -0.19 0.00 0.04 0.00 0.00 34.50 32.12 2gre s PRO 21 CO -0.11 -0.39 1.05 0.43 0.04 0.00 0.00 177.00 178.03 2gre n SER 22 N -0.39 0.19 0.00 6.66 7.64 -0.94 -1.00 113.62 125.78 2gre n SER 22 Ca 0.07 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.10 2gre n SER 22 Cb 0.49 -0.99 0.00 0.00 -1.01 0.00 0.00 64.21 62.70 2gre n SER 22 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gre n GLY 23 N 1.76 3.17 2.31 0.23 0.00 -1.26 -4.95 105.19 106.44 2gre n GLY 23 Ca 0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.96 2gre n GLY 23 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2gre n ASN 24 N 0.00 -0.30 0.00 1.61 5.15 -0.17 -4.96 115.26 116.59 2gre n ASN 24 Ca 0.00 -2.54 0.00 0.00 -0.60 0.00 0.00 54.58 51.44 2gre n ASN 24 Cb 0.00 -0.50 0.00 0.00 -0.53 0.00 0.00 39.78 38.75 2gre n ASN 24 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 2gre n THR 25 N 2.17 0.27 -0.06 -0.44 -2.24 -1.26 -3.92 114.28 108.81 2gre n THR 25 Ca 0.25 -0.58 -0.02 0.00 -2.27 0.00 0.00 64.05 61.43 2gre n THR 25 Cb 0.51 0.94 -0.02 0.00 -2.10 0.00 0.00 70.33 69.66 2gre n THR 25 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gre h ALA 26 N 0.00 -0.22 -0.52 6.98 0.00 -1.93 -1.91 119.26 121.66 2gre h ALA 26 Ca 0.00 0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.00 2gre h ALA 26 Cb 0.20 0.95 -0.10 0.00 0.00 0.00 0.00 17.79 18.84 2gre h ALA 26 CO 0.00 -0.29 -0.45 0.87 0.00 0.00 0.00 179.25 179.38 2gre h LYS 27 N -0.03 -0.26 -0.45 0.00 1.57 -1.93 0.26 116.57 115.74 2gre h LYS 27 Ca 0.02 0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.85 2gre h LYS 27 Cb 0.09 0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.43 2gre h LYS 27 CO -0.15 -0.17 0.24 0.97 -0.57 0.00 0.00 179.45 179.77 2gre h ILE 28 N -0.27 1.00 0.11 1.86 -0.00 -1.82 0.12 117.51 118.51 2gre h ILE 28 Ca 0.16 -0.16 0.02 0.00 -0.00 0.00 0.00 64.86 64.87 2gre h ILE 28 Cb 0.57 0.47 -0.04 0.00 -0.00 0.00 0.00 36.82 37.83 2gre h ILE 28 CO -0.65 0.09 -0.30 0.40 -0.00 0.00 0.00 178.15 177.68 2gre h ILE 29 N 0.48 0.35 -0.19 2.19 1.08 -0.50 -1.00 117.51 119.91 2gre h ILE 29 Ca 0.19 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.68 2gre h ILE 29 Cb 0.07 0.35 -0.02 0.00 -3.07 0.00 0.00 36.82 34.14 2gre h ILE 29 CO -0.12 0.00 -0.11 0.59 -0.69 0.00 0.00 178.15 177.82 2gre n ASN 30 N -5.41 -0.21 -0.35 1.72 4.13 0.84 -1.48 115.26 114.50 2gre n ASN 30 Ca -0.06 1.00 0.05 0.00 1.68 0.00 0.00 54.58 57.25 2gre n ASN 30 Cb 0.32 -0.37 0.13 0.00 -1.54 0.00 0.00 39.78 38.31 2gre n ASN 30 CO 0.00 0.00 0.00 0.15 0.28 0.00 0.00 177.26 177.69 2gre h PHE 31 N 0.00 -0.55 -0.13 3.10 3.04 -0.16 -0.07 116.94 122.17 2gre h PHE 31 Ca 0.03 0.09 -0.00 0.00 3.98 0.00 0.00 57.97 62.07 2gre h PHE 31 Cb 0.08 0.39 -0.01 0.00 2.56 0.00 0.00 35.95 38.98 2gre h PHE 31 CO -0.82 -0.42 0.06 0.82 -2.02 0.00 0.00 178.31 175.93 2gre h ILE 32 N -0.00 1.12 -0.88 1.41 2.04 -0.25 -1.33 117.51 119.62 2gre h ILE 32 Ca 0.46 -0.35 0.16 0.00 1.00 0.00 0.00 64.86 66.13 2gre h ILE 32 Cb 0.71 1.13 -0.16 0.00 -0.74 0.00 0.00 36.82 37.76 2gre h ILE 32 CO -1.01 0.11 -0.30 -0.33 0.00 0.00 0.00 178.15 176.63 2gre h GLU 33 N 0.08 -0.03 0.38 2.37 5.08 0.12 -1.29 114.58 121.28 2gre h GLU 33 Ca 0.04 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 2gre h GLU 33 Cb 0.12 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2gre h GLU 33 CO -0.01 -0.02 -0.18 -0.91 -1.00 0.00 0.00 179.01 176.89 2gre h ASN 34 N -0.03 -0.43 -0.84 1.42 4.21 -1.12 -2.62 115.58 116.17 2gre h ASN 34 Ca 0.37 -0.05 0.24 0.00 1.21 0.00 0.00 56.30 58.07 2gre h ASN 34 Cb 0.62 0.11 -0.16 0.00 -1.12 0.00 0.00 38.32 37.77 2gre h ASN 34 CO -0.90 -0.22 0.04 0.00 -1.29 0.00 0.00 177.43 175.05 2gre n TYR 35 N -5.27 0.56 0.84 1.19 9.36 -0.52 -1.48 117.16 121.84 2gre n TYR 35 Ca -0.11 1.02 0.12 0.00 3.32 0.00 0.00 57.90 62.25 2gre n TYR 35 Cb 0.25 -1.15 0.13 0.00 -0.63 0.00 0.00 39.34 37.94 2gre n TYR 35 CO 0.00 0.00 0.00 1.33 0.22 0.00 0.00 176.86 178.41 2gre n VAL 36 N -5.20 0.12 -0.11 2.97 0.24 -0.98 -4.68 118.33 110.69 2gre n VAL 36 Ca 0.20 -0.56 -0.02 0.00 -2.04 0.00 0.00 64.34 61.93 2gre n VAL 36 Cb 0.67 1.37 0.22 0.00 -1.47 0.00 0.00 33.84 34.63 2gre n VAL 36 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2gre h SER 37 N 4.64 0.72 1.65 -1.34 4.64 -0.88 -2.56 113.55 120.42 2gre h SER 37 Ca 0.00 -0.12 -0.04 0.00 -0.47 0.00 0.00 61.79 61.16 2gre h SER 37 Cb 0.99 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.89 2gre h SER 37 CO 0.00 0.70 -0.21 -0.33 -0.87 0.00 0.00 176.83 176.12 2gre h GLU 38 N 0.75 0.00 -7.08 4.77 4.39 -1.83 -3.45 114.58 112.12 2gre h GLU 38 Ca 0.17 0.00 -0.52 0.00 0.34 0.00 0.00 59.36 59.35 2gre h GLU 38 Cb 0.26 0.00 0.21 0.00 -0.10 0.00 0.00 28.75 29.12 2gre h GLU 38 CO -0.00 0.21 -0.10 0.91 -1.16 0.00 0.00 179.01 178.86 2gre n TRP 39 N -3.17 -0.14 0.09 4.33 7.02 -0.97 -4.95 117.44 119.65 2gre n TRP 39 Ca 0.03 0.30 -0.07 0.00 -1.02 0.00 0.00 57.50 56.73 2gre n TRP 39 Cb 0.58 -1.89 -0.00 0.00 -2.42 0.00 0.00 31.31 27.58 2gre n TRP 39 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 2gre h ASN 40 N -1.86 0.16 -2.42 -0.99 2.35 -1.88 -3.46 115.58 107.49 2gre h ASN 40 Ca -0.45 -0.13 -0.60 0.00 -0.55 0.00 0.00 56.30 54.57 2gre h ASN 40 Cb 1.28 -0.05 0.07 0.00 0.05 0.00 0.00 38.32 39.68 2gre h ASN 40 CO 0.39 0.95 0.60 0.52 -1.65 0.00 0.00 177.43 178.24 2gre n VAL 41 N -3.62 0.66 -2.19 2.81 0.31 -1.26 -4.97 118.33 110.07 2gre n VAL 41 Ca -0.03 -0.16 -0.29 0.00 -0.01 0.00 0.00 64.34 63.85 2gre n VAL 41 Cb 0.81 -1.36 0.02 0.00 -0.91 0.00 0.00 33.84 32.39 2gre n VAL 41 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2gre s GLU 42 N -0.04 3.31 0.04 5.55 -1.05 -1.20 -4.90 118.70 120.41 2gre s GLU 42 Ca 0.72 0.39 0.04 0.00 -0.15 0.00 0.00 54.97 55.98 2gre s GLU 42 Cb -0.70 -2.19 -0.02 0.00 -0.44 0.00 0.00 34.13 30.78 2gre s GLU 42 CO 0.47 -0.58 -0.12 0.99 0.95 0.00 0.00 175.26 176.97 2gre s THR 43 N -3.06 0.93 0.11 1.83 2.01 -1.26 -2.50 115.64 113.71 2gre s THR 43 Ca 0.53 -1.03 -0.01 0.00 0.31 0.00 0.00 61.69 61.50 2gre s THR 43 Cb -0.11 -0.89 -0.04 0.00 0.01 0.00 0.00 72.50 71.48 2gre s THR 43 CO 0.49 -0.12 0.04 -0.75 -0.69 0.00 0.00 174.62 173.59 2gre s LYS 44 N -1.30 0.86 -0.19 4.92 2.47 -0.89 -5.01 119.74 120.60 2gre s LYS 44 Ca -0.02 -1.40 -0.03 0.00 -1.56 0.00 0.00 55.97 52.97 2gre s LYS 44 Cb -0.08 0.23 0.06 0.00 -1.46 0.00 0.00 37.83 36.57 2gre s LYS 44 CO 0.01 -0.23 0.05 1.03 0.16 0.00 0.00 175.35 176.37 2gre s ARG 45 N -4.02 0.54 0.77 4.03 1.81 -1.26 -3.21 118.95 117.61 2gre s ARG 45 Ca 0.21 -0.38 -0.16 0.00 -1.72 0.00 0.00 55.73 53.67 2gre s ARG 45 Cb 0.08 -2.05 -0.07 0.00 -0.45 0.00 0.00 34.95 32.46 2gre s ARG 45 CO -0.01 -0.66 0.13 0.09 -0.68 0.00 0.00 175.30 174.17 2gre n ASN 46 N 5.09 -2.73 -0.20 0.23 5.03 0.94 -4.88 115.26 118.74 2gre n ASN 46 Ca -0.08 0.49 -0.01 0.00 0.87 0.00 0.00 54.58 55.84 2gre n ASN 46 Cb 0.47 -1.06 0.20 0.00 -1.02 0.00 0.00 39.78 38.38 2gre n ASN 46 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.26 174.30 2gre h ASN 47 N -0.59 0.87 1.45 6.41 -0.73 -1.98 -2.94 115.58 118.07 2gre h ASN 47 Ca -0.44 -0.07 0.00 0.00 1.87 0.00 0.00 56.30 57.65 2gre h ASN 47 Cb 1.35 -0.22 0.00 0.00 0.27 0.00 0.00 38.32 39.72 2gre h ASN 47 CO 0.37 0.71 0.00 0.07 -0.37 0.00 0.00 177.43 178.22 2gre h LYS 48 N 0.98 0.00 0.00 6.67 2.10 -1.99 -3.47 116.57 120.87 2gre h LYS 48 Ca 0.25 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.90 2gre h LYS 48 Cb 0.04 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.37 2gre h LYS 48 CO -0.04 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 177.82 2gre n GLY 49 N 0.95 0.87 3.86 0.07 0.00 -1.11 -5.08 105.19 104.75 2gre n GLY 49 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 2gre n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gre s ALA 50 N -1.70 3.27 -0.05 4.61 0.00 -1.26 -4.77 121.76 121.85 2gre s ALA 50 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 51.96 51.82 2gre s ALA 50 Cb 0.00 -2.83 -0.05 0.00 0.00 0.00 0.00 23.12 20.24 2gre s ALA 50 CO 0.00 0.10 0.36 -0.51 0.00 0.00 0.00 175.76 175.72 2gre s LEU 51 N -3.48 4.41 -0.16 0.00 1.43 -1.11 -0.04 118.68 119.73 2gre s LEU 51 Ca 0.54 0.82 -0.02 0.00 -1.03 0.00 0.00 54.13 54.45 2gre s LEU 51 Cb -0.10 -2.50 -0.01 0.00 0.03 0.00 0.00 46.19 43.60 2gre s LEU 51 CO 0.24 0.27 -0.09 -0.63 0.23 0.00 0.00 176.35 176.38 2gre s ILE 52 N -0.69 3.29 0.01 -0.59 1.01 -1.20 0.44 121.20 123.48 2gre s ILE 52 Ca 0.22 -0.56 0.08 0.00 0.00 0.00 0.00 60.65 60.39 2gre s ILE 52 Cb -0.15 -2.43 -0.02 0.00 0.01 0.00 0.00 42.46 39.86 2gre s ILE 52 CO 0.11 0.49 -0.26 -0.76 0.00 0.00 0.00 174.94 174.52 2gre s LEU 53 N 0.69 2.13 -0.03 2.97 1.43 0.10 -2.09 118.68 123.88 2gre s LEU 53 Ca -0.04 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 52.55 2gre s LEU 53 Cb -0.15 -1.33 0.02 0.00 0.03 0.00 0.00 46.19 44.76 2gre s LEU 53 CO 0.02 0.30 -0.02 -0.89 0.23 0.00 0.00 176.35 175.99 2gre s THR 54 N -0.70 0.29 -0.21 5.49 2.01 -1.04 0.11 115.64 121.58 2gre s THR 54 Ca 0.11 -0.00 -0.03 0.00 0.31 0.00 0.00 61.69 62.08 2gre s THR 54 Cb -0.10 -0.34 0.00 0.00 0.01 0.00 0.00 72.50 72.07 2gre s THR 54 CO 0.00 0.16 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.32 2gre s VAL 55 N 0.83 3.04 0.25 3.82 1.01 -0.80 -3.25 120.40 125.31 2gre s VAL 55 Ca -0.09 -0.64 -0.30 0.00 0.00 0.00 0.00 61.98 60.95 2gre s VAL 55 Cb -0.12 -2.38 -0.10 0.00 0.00 0.00 0.00 36.38 33.78 2gre s VAL 55 CO -0.01 0.43 1.34 -0.75 0.00 0.00 0.00 175.10 176.11 2gre s LYS 56 N 1.42 4.35 0.54 2.72 2.36 -1.26 -1.77 119.74 128.10 2gre s LYS 56 Ca 0.05 2.17 0.03 0.00 -2.55 0.00 0.00 55.97 55.66 2gre s LYS 56 Cb -0.14 -3.14 0.02 0.00 -1.05 0.00 0.00 37.83 33.53 2gre s LYS 56 CO -0.06 -0.27 0.20 0.20 1.55 0.00 0.00 175.35 176.97 2gre s GLY 57 N 0.10 2.77 0.04 5.54 0.00 -1.25 -4.68 107.32 109.84 2gre s GLY 57 Ca 0.55 -0.59 -0.25 0.00 0.00 0.00 0.00 44.72 44.44 2gre s GLY 57 CO 0.44 -2.09 1.53 1.70 0.00 0.00 0.00 173.10 174.67 2gre h LYS 58 N 1.00 -0.11 -5.38 2.90 3.64 -0.85 -3.34 116.57 114.43 2gre h LYS 58 Ca -0.40 0.01 -0.65 0.00 -1.27 0.00 0.00 60.65 58.34 2gre h LYS 58 Cb 1.32 0.03 -0.15 0.00 -0.41 0.00 0.00 32.23 33.01 2gre h LYS 58 CO 0.65 0.09 0.35 1.21 -2.27 0.00 0.00 179.45 179.49 2gre s ASN 59 N -5.27 6.25 -0.05 4.20 3.84 -0.24 -4.89 114.94 118.79 2gre s ASN 59 Ca -0.14 -0.76 0.17 0.00 0.21 0.00 0.00 52.86 52.34 2gre s ASN 59 Cb 0.04 -2.37 0.59 0.00 -0.55 0.00 0.00 41.25 38.95 2gre s ASN 59 CO 0.65 -1.16 1.48 -0.67 -2.79 0.00 0.00 177.10 174.61 2gre n ASP 60 N 7.00 3.76 -0.02 -4.21 2.03 -1.25 -2.43 116.55 121.43 2gre n ASP 60 Ca -0.03 -2.19 -0.19 0.00 0.52 0.00 0.00 54.79 52.90 2gre n ASP 60 Cb 0.46 -0.48 -0.14 0.00 -0.72 0.00 0.00 41.12 40.24 2gre n ASP 60 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2gre n ALA 61 N 1.14 1.07 -2.92 -1.67 0.00 -1.26 -4.88 120.51 111.99 2gre n ALA 61 Ca 0.22 -0.71 -0.33 0.00 0.00 0.00 0.00 53.44 52.62 2gre n ALA 61 Cb 0.66 -0.61 -0.15 0.00 0.00 0.00 0.00 19.45 19.35 2gre n ALA 61 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2gre s GLN 62 N -2.56 3.05 0.19 0.00 -0.21 -1.26 -4.82 119.66 114.05 2gre s GLN 62 Ca -0.21 -0.74 0.11 0.00 0.02 0.00 0.00 55.36 54.53 2gre s GLN 62 Cb 0.07 -2.47 -0.04 0.00 1.00 0.00 0.00 33.01 31.56 2gre s GLN 62 CO 0.75 0.32 -0.23 -1.01 -2.12 0.00 0.00 175.29 173.01 2gre s HIS 63 N 0.05 2.22 -0.04 0.91 3.76 -0.10 -4.17 115.29 117.92 2gre s HIS 63 Ca -0.06 -0.38 0.05 0.00 -0.15 0.00 0.00 55.06 54.53 2gre s HIS 63 Cb -0.15 -1.09 -0.02 0.00 1.11 0.00 0.00 32.58 32.43 2gre s HIS 63 CO 0.05 0.49 -0.19 0.50 -0.85 0.00 0.00 174.74 174.73 2gre s ARG 64 N -2.75 2.34 -0.14 1.40 6.06 -0.97 -0.02 118.95 124.86 2gre s ARG 64 Ca 0.20 -0.80 0.01 0.00 -2.50 0.00 0.00 55.73 52.65 2gre s ARG 64 Cb -0.07 -2.23 0.02 0.00 0.06 0.00 0.00 34.95 32.72 2gre s ARG 64 CO 0.10 0.59 -0.16 -1.17 -2.50 0.00 0.00 175.30 172.16 2gre s LEU 65 N -0.67 1.77 -0.14 -0.88 2.96 0.10 -1.70 118.68 120.13 2gre s LEU 65 Ca 0.11 -0.50 -0.12 0.00 -0.22 0.00 0.00 54.13 53.39 2gre s LEU 65 Cb -0.10 -1.21 -0.05 0.00 0.50 0.00 0.00 46.19 45.33 2gre s LEU 65 CO -0.00 -0.02 0.26 -0.76 -1.32 0.00 0.00 176.35 174.50 2gre s LEU 66 N 1.30 4.29 0.05 -0.68 1.02 0.13 -0.42 118.68 124.37 2gre s LEU 66 Ca 0.01 0.51 0.09 0.00 0.02 0.00 0.00 54.13 54.77 2gre s LEU 66 Cb -0.14 -2.31 -0.03 0.00 0.02 0.00 0.00 46.19 43.74 2gre s LEU 66 CO -0.08 0.19 -0.25 0.28 0.02 0.00 0.00 176.35 176.50 2gre s THR 67 N 0.04 2.04 -0.00 5.49 -1.32 -0.02 0.28 115.64 122.14 2gre s THR 67 Ca 0.16 -1.39 -0.21 0.00 -1.21 0.00 0.00 61.69 59.04 2gre s THR 67 Cb -0.13 -1.76 0.04 0.00 -1.51 0.00 0.00 72.50 69.15 2gre s THR 67 CO 0.04 0.30 0.46 0.00 -2.21 0.00 0.00 174.62 173.21 2gre s ALA 68 N -0.83 -1.18 0.04 11.08 0.00 -0.53 -0.84 121.76 129.50 2gre s ALA 68 Ca 0.11 0.64 0.07 0.00 0.00 0.00 0.00 51.96 52.77 2gre s ALA 68 Cb -0.10 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 2gre s ALA 68 CO 0.02 -0.36 -0.16 -3.38 0.00 0.00 0.00 175.76 171.87 2gre s HIS 69 N -1.68 2.60 -0.14 0.00 -3.43 -1.26 -0.89 115.29 110.49 2gre s HIS 69 Ca -0.10 -0.23 0.22 0.00 -0.80 0.00 0.00 55.06 54.15 2gre s HIS 69 Cb -0.02 -1.47 -0.30 0.00 -1.43 0.00 0.00 32.58 29.35 2gre s HIS 69 CO 0.04 0.28 0.56 1.33 -2.00 0.00 0.00 174.74 174.95 2gre n VAL 70 N 1.49 0.04 -2.24 -5.38 0.24 -0.47 -3.86 118.33 108.15 2gre n VAL 70 Ca -0.16 -0.45 -0.36 0.00 -2.04 0.00 0.00 64.34 61.33 2gre n VAL 70 Cb 0.52 0.08 -0.00 0.00 -1.47 0.00 0.00 33.84 32.97 2gre n VAL 70 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 2gre s ASP 71 N -4.41 5.88 0.47 -1.34 3.84 -1.26 -4.79 116.67 115.06 2gre s ASP 71 Ca -0.06 2.26 0.03 0.00 -0.00 0.00 0.00 52.55 54.78 2gre s ASP 71 Cb 0.14 -2.59 -0.04 0.00 -1.38 0.00 0.00 42.92 39.05 2gre s ASP 71 CO 0.90 -1.11 0.02 0.42 -0.00 0.00 0.00 175.17 175.39 2gre s THR 72 N -1.65 1.38 0.85 2.11 -4.23 -0.36 -4.85 115.64 108.89 2gre s THR 72 Ca 0.69 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 59.09 2gre s THR 72 Cb -0.27 -2.46 0.11 0.00 1.34 0.00 0.00 72.50 71.22 2gre s THR 72 CO 0.31 0.00 1.15 -0.76 -0.54 0.00 0.00 174.62 174.78 2gre s LEU 73 N -3.79 2.98 0.00 4.79 1.43 -1.26 -2.20 118.68 120.62 2gre s LEU 73 Ca 0.17 2.15 0.00 0.00 -1.03 0.00 0.00 54.13 55.43 2gre s LEU 73 Cb 0.05 -4.56 0.00 0.00 0.03 0.00 0.00 46.19 41.70 2gre s LEU 73 CO 0.09 -2.74 0.00 0.61 0.23 0.00 0.00 176.35 174.54 2gre n GLY 74 N -0.03 -0.64 0.00 -3.19 0.00 -0.93 -4.63 105.19 95.77 2gre n GLY 74 Ca 0.12 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.43 2gre n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gre n ALA 75 N 0.00 0.00 -2.85 4.61 0.00 -0.93 -0.17 120.51 121.16 2gre n ALA 75 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 2gre n ALA 75 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 2gre n ALA 75 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2gre s VAL 77 N -1.51 4.73 -0.57 0.00 1.01 -0.59 -0.76 120.40 122.71 2gre s VAL 77 Ca 0.00 -0.04 0.13 0.00 0.00 0.00 0.00 61.98 62.07 2gre s VAL 77 Cb 0.00 -3.18 -0.15 0.00 0.00 0.00 0.00 36.38 33.05 2gre s VAL 77 CO 0.00 0.38 0.53 2.29 0.00 0.00 0.00 175.10 178.30 2gre n LYS 78 N 4.28 2.50 -3.61 2.72 2.85 -0.30 -1.03 118.16 125.58 2gre n LYS 78 Ca -0.16 -0.01 -0.11 0.00 -1.05 0.00 0.00 58.31 56.98 2gre n LYS 78 Cb 0.52 -1.13 -0.07 0.00 -0.65 0.00 0.00 35.03 33.70 2gre n LYS 78 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 177.40 175.35 2gre s GLU 79 N -2.29 0.65 -0.46 -1.58 2.12 -1.24 -4.97 118.70 110.92 2gre s GLU 79 Ca 0.04 0.54 -0.12 0.00 0.36 0.00 0.00 54.97 55.79 2gre s GLU 79 Cb 0.10 0.31 0.09 0.00 0.26 0.00 0.00 34.13 34.89 2gre s GLU 79 CO 0.54 -0.12 0.35 0.42 -0.54 0.00 0.00 175.26 175.91 2gre s ILE 80 N -0.17 4.68 0.69 -3.70 1.01 -1.26 -1.32 121.20 121.12 2gre s ILE 80 Ca 0.00 -1.39 -0.16 0.00 0.00 0.00 0.00 60.65 59.11 2gre s ILE 80 Cb -0.04 -3.90 0.02 0.00 0.01 0.00 0.00 42.46 38.55 2gre s ILE 80 CO -0.01 -0.64 1.17 -0.54 0.00 0.00 0.00 174.94 174.92 2gre s LYS 81 N 1.51 2.47 0.55 2.79 1.02 -0.22 -4.77 119.74 123.09 2gre s LYS 81 Ca 0.04 1.65 0.22 0.00 0.02 0.00 0.00 55.97 57.89 2gre s LYS 81 Cb -0.25 -1.89 1.47 0.00 -0.52 0.00 0.00 37.83 36.64 2gre s LYS 81 CO 0.03 -1.55 2.16 -1.00 -0.92 0.00 0.00 175.35 174.06 2gre h PRO 82 N -0.02 0.00 0.00 -1.68 0.13 -1.96 -2.30 132.00 126.17 2gre h PRO 82 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2gre h PRO 82 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2gre h PRO 82 CO 0.52 0.00 0.00 0.38 -0.23 0.00 0.00 178.00 178.67 2gre h ASP 83 N 0.00 0.00 0.00 1.44 -0.00 -1.90 -3.31 116.42 112.65 2gre h ASP 83 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.07 2gre h ASP 83 Cb 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.50 2gre h ASP 83 CO -0.00 0.00 0.00 0.61 -0.00 0.00 0.00 179.24 179.85 2gre n GLY 84 N -0.40 2.16 3.96 7.15 0.00 -0.86 -3.96 105.19 113.24 2gre n GLY 84 Ca -0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 2gre n GLY 84 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gre s ARG 85 N -0.00 1.72 -0.05 1.61 0.52 -1.26 -4.78 118.95 116.70 2gre s ARG 85 Ca 0.00 -0.65 0.05 0.00 -0.52 0.00 0.00 55.73 54.61 2gre s ARG 85 Cb 0.00 -2.19 -0.00 0.00 0.52 0.00 0.00 34.95 33.27 2gre s ARG 85 CO 0.00 -1.51 -0.20 -0.51 0.02 0.00 0.00 175.30 173.11 2gre s LEU 86 N -5.30 1.96 0.28 2.53 1.02 -1.02 -1.05 118.68 117.10 2gre s LEU 86 Ca 0.65 -0.41 -0.17 0.00 0.02 0.00 0.00 54.13 54.23 2gre s LEU 86 Cb -0.07 -1.10 -0.09 0.00 0.02 0.00 0.00 46.19 44.95 2gre s LEU 86 CO 0.46 0.17 0.72 -0.44 0.02 0.00 0.00 176.35 177.29 2gre s SER 87 N 0.02 6.87 0.19 2.29 0.01 -0.44 0.05 113.70 122.70 2gre s SER 87 Ca -0.05 1.32 0.10 0.00 1.31 0.00 0.00 55.95 58.63 2gre s SER 87 Cb -0.13 -2.38 -0.04 0.00 0.21 0.00 0.00 66.02 63.68 2gre s SER 87 CO 0.03 -0.11 -0.22 -0.76 0.41 0.00 0.00 173.24 172.59 2gre s LEU 88 N -2.60 2.44 0.00 2.44 1.43 -1.16 -1.15 118.68 120.08 2gre s LEU 88 Ca 0.50 -0.87 0.00 0.00 -1.03 0.00 0.00 54.13 52.73 2gre s LEU 88 Cb -0.13 -1.03 0.00 0.00 0.03 0.00 0.00 46.19 45.06 2gre s LEU 88 CO 0.19 0.06 0.00 -0.24 0.23 0.00 0.00 176.35 176.58 2gre n SER 89 N 0.24 0.00 -3.65 2.29 2.88 -1.26 -4.74 113.62 109.38 2gre n SER 89 Ca -0.12 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.35 2gre n SER 89 Cb 0.57 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.95 2gre n SER 89 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2gre s ILE 91 N 4.07 -0.18 0.00 2.46 1.01 0.76 -4.31 121.20 125.01 2gre s ILE 91 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.67 2gre s ILE 91 Cb 0.00 -0.94 0.00 0.00 0.01 0.00 0.00 42.46 41.53 2gre s ILE 91 CO 0.00 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.56 2gre n GLY 92 N 4.52 -1.08 3.35 6.18 0.00 -1.26 -2.19 105.19 114.72 2gre n GLY 92 Ca -0.19 -1.62 -0.39 0.00 0.00 0.00 0.00 46.02 43.82 2gre n GLY 92 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2gre s GLY 93 N -2.17 1.87 0.00 -0.02 0.00 -1.26 -4.98 107.32 100.75 2gre s GLY 93 Ca 0.00 -1.63 0.00 0.00 0.00 0.00 0.00 44.72 43.09 2gre s GLY 93 CO 0.00 0.77 0.00 1.97 0.00 0.00 0.00 173.10 175.84 2gre n PHE 94 N 4.92 -0.31 -4.07 1.90 -1.74 -1.26 -5.06 117.46 111.85 2gre n PHE 94 Ca -0.13 0.00 -0.35 0.00 -0.56 0.00 0.00 57.45 56.42 2gre n PHE 94 Cb 0.46 0.00 -0.13 0.00 1.52 0.00 0.00 39.48 41.33 2gre n PHE 94 CO 0.00 0.00 0.00 1.03 -0.56 0.00 0.00 176.76 177.23 2gre s ARG 95 N -1.40 3.48 0.27 3.97 1.81 -1.26 -5.01 118.95 120.81 2gre s ARG 95 Ca 0.00 -0.58 -0.00 0.00 -1.72 0.00 0.00 55.73 53.42 2gre s ARG 95 Cb 0.00 -3.00 0.59 0.00 -0.45 0.00 0.00 34.95 32.08 2gre s ARG 95 CO 0.00 -0.06 1.73 -1.49 -0.68 0.00 0.00 175.30 174.79 2gre h TRP 96 N 7.70 0.65 -0.85 -0.53 -0.00 -2.01 0.30 115.95 121.21 2gre h TRP 96 Ca -0.37 0.04 0.08 0.00 -0.00 0.00 0.00 58.89 58.64 2gre h TRP 96 Cb 1.17 -0.16 -0.11 0.00 -0.00 0.00 0.00 29.16 30.07 2gre h TRP 96 CO 0.58 0.06 -0.48 -1.71 -0.00 0.00 0.00 178.44 176.89 2gre n ASN 97 N -4.98 -0.85 -0.34 -3.49 4.05 -1.26 -1.07 115.26 107.33 2gre n ASN 97 Ca 0.18 1.51 0.00 0.00 0.45 0.00 0.00 54.58 56.72 2gre n ASN 97 Cb 0.51 -0.22 0.00 0.00 1.23 0.00 0.00 39.78 41.31 2gre n ASN 97 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 2gre n SER 98 N -5.09 0.00 0.00 1.20 3.41 0.09 -0.79 113.62 112.44 2gre n SER 98 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 2gre n SER 98 Cb 0.24 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 2gre n SER 98 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2gre n VAL 99 N 0.17 0.00 -1.64 -3.33 0.24 -0.23 -4.94 118.33 108.60 2gre n VAL 99 Ca 0.00 0.00 -0.49 0.00 -2.04 0.00 0.00 64.34 61.81 2gre n VAL 99 Cb 0.00 1.03 -0.05 0.00 -1.47 0.00 0.00 33.84 33.35 2gre n VAL 99 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 2gre n GLU 100 N 0.00 1.76 -0.05 7.34 2.13 0.03 -1.96 120.64 129.89 2gre n GLU 100 Ca 0.00 0.63 0.00 0.00 0.66 0.00 0.00 57.16 58.45 2gre n GLU 100 Cb 0.39 -2.36 0.00 0.00 0.27 0.00 0.00 31.44 29.74 2gre n GLU 100 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2gre n GLY 101 N 3.20 1.65 3.77 8.31 0.00 0.12 -5.01 105.19 117.23 2gre n GLY 101 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2gre n GLY 101 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gre s GLU 102 N -0.42 3.10 0.35 1.61 0.41 -0.83 -4.67 118.70 118.24 2gre s GLU 102 Ca 0.00 1.64 -0.21 0.00 -0.41 0.00 0.00 54.97 55.98 2gre s GLU 102 Cb 0.00 -1.97 -0.10 0.00 -1.78 0.00 0.00 34.13 30.28 2gre s GLU 102 CO 0.00 -1.06 0.88 0.71 -0.49 0.00 0.00 175.26 175.30 2gre s TYR 103 N -1.83 3.49 0.22 1.61 4.12 -1.26 -1.19 117.35 122.51 2gre s TYR 103 Ca 0.73 1.56 -0.00 0.00 0.02 0.00 0.00 57.07 59.38 2gre s TYR 103 Cb -0.25 -2.78 -0.04 0.00 -1.52 0.00 0.00 41.96 37.37 2gre s TYR 103 CO 0.32 0.10 0.14 0.00 0.02 0.00 0.00 175.55 176.12 2gre s GLU 105 N -4.08 1.41 -0.13 0.00 2.02 0.01 -2.06 118.70 115.87 2gre s GLU 105 Ca 0.39 -1.39 0.02 0.00 0.02 0.00 0.00 54.97 54.01 2gre s GLU 105 Cb 0.07 -1.81 0.01 0.00 0.10 0.00 0.00 34.13 32.50 2gre s GLU 105 CO 0.14 0.41 -0.18 0.42 0.02 0.00 0.00 175.26 176.06 2gre s ILE 106 N -1.31 1.78 -0.23 -1.63 -1.09 0.70 -0.97 121.20 118.44 2gre s ILE 106 Ca 0.15 -0.81 -0.07 0.00 -2.23 0.00 0.00 60.65 57.70 2gre s ILE 106 Cb -0.09 -1.59 -0.03 0.00 -1.58 0.00 0.00 42.46 39.16 2gre s ILE 106 CO 0.07 0.49 0.06 -0.70 -1.23 0.00 0.00 174.94 173.64 2gre s GLU 107 N 0.92 3.71 0.60 2.79 2.12 -0.69 -0.75 118.70 127.40 2gre s GLU 107 Ca -0.06 -0.46 -0.08 0.00 0.36 0.00 0.00 54.97 54.73 2gre s GLU 107 Cb -0.15 -3.29 -0.01 0.00 0.26 0.00 0.00 34.13 30.95 2gre s GLU 107 CO -0.02 -0.09 0.94 0.95 -0.54 0.00 0.00 175.26 176.50 2gre s THR 108 N 1.34 4.02 0.37 -1.70 -4.23 -0.09 -3.73 115.64 111.62 2gre s THR 108 Ca 0.05 0.26 0.13 0.00 -1.18 0.00 0.00 61.69 60.95 2gre s THR 108 Cb -0.15 -3.60 0.35 0.00 1.34 0.00 0.00 72.50 70.44 2gre s THR 108 CO 0.03 -0.67 1.81 0.28 -0.54 0.00 0.00 174.62 175.53 2gre h SER 109 N -0.21 0.58 0.00 3.99 0.02 -1.90 0.11 113.55 116.14 2gre h SER 109 Ca -0.45 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 2gre h SER 109 Cb 1.24 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.74 2gre h SER 109 CO 0.62 0.21 0.00 -1.54 -1.14 0.00 0.00 176.83 174.98 2gre n SER 110 N -4.63 0.00 0.00 3.07 3.41 -1.26 -4.85 113.62 109.36 2gre n SER 110 Ca 0.22 -1.18 0.00 0.00 -0.26 0.00 0.00 58.87 57.64 2gre n SER 110 Cb 0.66 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.61 2gre n SER 110 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gre n GLY 111 N 0.29 0.84 3.76 5.00 0.00 0.39 -5.03 105.19 110.44 2gre n GLY 111 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 2gre n GLY 111 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2gre s LYS 112 N -0.08 4.77 -0.06 1.61 2.47 -1.25 -4.78 119.74 122.42 2gre s LYS 112 Ca 0.00 1.38 0.04 0.00 -1.56 0.00 0.00 55.97 55.83 2gre s LYS 112 Cb 0.00 -3.28 -0.02 0.00 -1.46 0.00 0.00 37.83 33.07 2gre s LYS 112 CO 0.00 0.53 -0.17 0.99 0.16 0.00 0.00 175.35 176.87 2gre s THR 113 N -1.16 2.80 0.09 3.43 2.01 -1.26 -0.91 115.64 120.65 2gre s THR 113 Ca 0.39 -0.80 0.05 0.00 0.31 0.00 0.00 61.69 61.64 2gre s THR 113 Cb -0.25 -2.09 -0.03 0.00 0.01 0.00 0.00 72.50 70.13 2gre s THR 113 CO 0.30 0.57 -0.13 -0.31 -0.69 0.00 0.00 174.62 174.36 2gre s TYR 114 N -0.41 1.24 0.13 4.92 1.51 0.07 -4.94 117.35 119.86 2gre s TYR 114 Ca 0.04 -0.53 0.03 0.00 -1.01 0.00 0.00 57.07 55.60 2gre s TYR 114 Cb -0.12 -0.68 -0.04 0.00 -0.11 0.00 0.00 41.96 41.01 2gre s TYR 114 CO 0.02 0.07 0.17 0.95 -1.11 0.00 0.00 175.55 175.66 2gre s THR 115 N -1.81 4.83 0.32 -0.71 -4.23 -1.26 -0.22 115.64 112.57 2gre s THR 115 Ca 0.03 -0.82 -0.18 0.00 -1.18 0.00 0.00 61.69 59.54 2gre s THR 115 Cb -0.07 -3.43 0.05 0.00 1.34 0.00 0.00 72.50 70.39 2gre s THR 115 CO 0.02 -0.02 0.82 -0.83 -0.54 0.00 0.00 174.62 174.07 2gre s GLY 116 N -2.90 0.21 -0.04 3.99 0.00 -0.88 -1.18 107.32 106.53 2gre s GLY 116 Ca 0.32 -0.56 0.04 0.00 0.00 0.00 0.00 44.72 44.52 2gre s GLY 116 CO 0.25 0.11 -0.15 -1.59 0.00 0.00 0.00 173.10 171.72 2gre s THR 117 N -2.68 1.25 0.06 0.90 2.01 -0.47 -0.97 115.64 115.74 2gre s THR 117 Ca 0.15 -0.62 -0.30 0.00 0.31 0.00 0.00 61.69 61.23 2gre s THR 117 Cb -0.05 -1.08 -0.05 0.00 0.01 0.00 0.00 72.50 71.33 2gre s THR 117 CO 0.09 0.37 1.17 -0.63 -0.69 0.00 0.00 174.62 174.93 2gre s ILE 118 N 0.06 4.11 0.00 1.82 1.09 -0.33 -0.52 121.20 127.42 2gre s ILE 118 Ca -0.03 1.53 0.00 0.00 -1.10 0.00 0.00 60.65 61.05 2gre s ILE 118 Cb -0.10 -3.98 0.00 0.00 -1.06 0.00 0.00 42.46 37.32 2gre s ILE 118 CO 0.02 0.13 0.00 0.18 -0.10 0.00 0.00 174.94 175.16 2gre n LEU 119 N 3.84 0.00 -1.89 2.97 4.77 0.99 0.13 117.00 127.82 2gre n LEU 119 Ca 0.08 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.88 2gre n LEU 119 Cb 0.47 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.57 2gre n LEU 119 CO 0.55 0.00 -0.97 1.17 -1.33 0.00 0.00 177.39 176.81 2gre n LYS 139 N -0.85 0.00 0.00 3.23 4.81 -1.26 -1.94 118.16 122.14 2gre n LYS 139 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2gre n LYS 139 Cb 0.11 -0.47 0.00 0.00 0.02 0.00 0.00 35.03 34.69 2gre n LYS 139 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2gre n ASN 140 N 1.65 0.00 -4.41 3.14 2.85 -1.26 -4.87 115.26 112.37 2gre n ASN 140 Ca -0.01 0.00 -0.38 0.00 -0.11 0.00 0.00 54.58 54.08 2gre n ASN 140 Cb 0.35 -0.44 -0.12 0.00 1.24 0.00 0.00 39.78 40.80 2gre n ASN 140 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2gre s ILE 141 N -0.00 4.31 0.14 -1.44 -1.09 -1.26 -5.08 121.20 116.78 2gre s ILE 141 Ca 0.00 -0.45 0.01 0.00 -2.23 0.00 0.00 60.65 57.98 2gre s ILE 141 Cb 0.00 -3.16 -0.04 0.00 -1.58 0.00 0.00 42.46 37.68 2gre s ILE 141 CO 0.00 0.14 -0.01 -1.83 -1.23 0.00 0.00 174.94 172.02 2gre s GLU 142 N 1.58 0.98 -0.14 2.79 -1.05 -0.82 -3.00 118.70 119.03 2gre s GLU 142 Ca 0.04 -1.45 -0.01 0.00 -0.15 0.00 0.00 54.97 53.41 2gre s GLU 142 Cb -0.17 -0.12 -0.02 0.00 -0.44 0.00 0.00 34.13 33.39 2gre s GLU 142 CO 0.04 -0.13 -0.11 0.08 0.95 0.00 0.00 175.26 176.09 2gre s VAL 143 N -3.74 3.20 -0.39 1.83 1.01 0.11 -0.01 120.40 122.41 2gre s VAL 143 Ca 0.20 -0.60 -0.19 0.00 0.00 0.00 0.00 61.98 61.39 2gre s VAL 143 Cb 0.06 -2.36 0.01 0.00 0.00 0.00 0.00 36.38 34.09 2gre s VAL 143 CO 0.01 0.51 0.53 -0.60 0.00 0.00 0.00 175.10 175.54 2gre s ARG 144 N 0.45 3.39 0.39 2.72 3.52 0.32 -2.43 118.95 127.30 2gre s ARG 144 Ca -0.08 -0.38 -0.22 0.00 -0.13 0.00 0.00 55.73 54.92 2gre s ARG 144 Cb -0.15 -3.89 -0.10 0.00 -1.56 0.00 0.00 34.95 29.24 2gre s ARG 144 CO 0.04 -0.80 0.93 0.42 -0.81 0.00 0.00 175.30 175.08 2gre s ILE 145 N 2.44 4.37 -1.03 4.11 1.01 -1.26 -1.36 121.20 129.47 2gre s ILE 145 Ca 0.18 1.54 -0.06 0.00 0.00 0.00 0.00 60.65 62.30 2gre s ILE 145 Cb -0.15 -3.72 0.02 0.00 0.01 0.00 0.00 42.46 38.61 2gre s ILE 145 CO 0.15 -0.17 2.73 0.47 0.00 0.00 0.00 174.94 178.13 2gre n ASP 146 N -0.25 7.51 -3.83 3.58 8.00 -0.32 -4.84 116.55 126.40 2gre n ASP 146 Ca 0.05 -2.97 -0.12 0.00 0.71 0.00 0.00 54.79 52.46 2gre n ASP 146 Cb 0.53 -1.38 -0.11 0.00 -0.02 0.00 0.00 41.12 40.14 2gre n ASP 146 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2gre s GLU 147 N -0.39 0.30 -0.78 -1.24 0.41 -1.26 -4.89 118.70 110.85 2gre s GLU 147 Ca 0.60 0.02 -0.15 0.00 -0.41 0.00 0.00 54.97 55.03 2gre s GLU 147 Cb 0.25 0.13 -0.11 0.00 -1.78 0.00 0.00 34.13 32.62 2gre s GLU 147 CO -0.11 -0.06 1.95 0.54 -0.49 0.00 0.00 175.26 177.10 2gre n ARG 148 N 2.46 1.63 -4.83 1.61 1.74 -1.26 -4.85 116.66 113.16 2gre n ARG 148 Ca -0.16 -1.61 -0.33 0.00 -0.77 0.00 0.00 57.85 54.98 2gre n ARG 148 Cb 0.58 -2.68 -0.14 0.00 -1.02 0.00 0.00 32.46 29.19 2gre n ARG 148 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2gre s VAL 149 N 4.41 2.98 -0.18 1.55 -7.23 -1.26 -5.03 120.40 115.64 2gre s VAL 149 Ca 0.48 -0.70 0.14 0.00 -1.81 0.00 0.00 61.98 60.09 2gre s VAL 149 Cb 0.12 -2.23 0.37 0.00 0.56 0.00 0.00 36.38 35.20 2gre s VAL 149 CO 0.06 0.54 1.19 0.49 -0.31 0.00 0.00 175.10 177.07 2gre n PHE 150 N 3.31 0.00 -3.61 2.82 0.99 -1.26 -4.80 117.46 114.91 2gre n PHE 150 Ca -0.18 -1.29 -0.05 0.00 -0.00 0.00 0.00 57.45 55.93 2gre n PHE 150 Cb 0.53 -0.21 -0.02 0.00 -1.00 0.00 0.00 39.48 38.78 2gre n PHE 150 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 2gre s SER 151 N -3.08 -0.24 0.16 4.37 1.04 -1.25 -4.43 113.70 110.26 2gre s SER 151 Ca 0.35 -0.15 -0.23 0.00 0.48 0.00 0.00 55.95 56.40 2gre s SER 151 Cb 0.33 0.37 0.04 0.00 0.10 0.00 0.00 66.02 66.86 2gre s SER 151 CO -0.03 -0.64 1.62 0.00 0.98 0.00 0.00 173.24 175.17 2gre h ALA 152 N 2.00 -0.15 -0.02 5.32 0.00 -1.68 -1.79 119.26 122.93 2gre h ALA 152 Ca -0.22 0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.79 2gre h ALA 152 Cb 1.22 0.59 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 2gre h ALA 152 CO 0.28 -0.69 -0.05 -0.44 0.00 0.00 0.00 179.25 178.35 2gre h ASP 153 N -0.26 -0.14 -0.76 0.00 5.19 -1.94 0.44 116.42 118.95 2gre h ASP 153 Ca 0.15 0.02 0.16 0.00 -0.62 0.00 0.00 57.03 56.75 2gre h ASP 153 Cb 0.50 0.06 -0.05 0.00 0.18 0.00 0.00 39.33 40.02 2gre h ASP 153 CO -0.45 -0.07 0.51 -0.33 -3.12 0.00 0.00 179.24 175.78 2gre h GLU 154 N -0.08 0.35 -0.07 3.56 5.08 -1.95 0.12 114.58 121.60 2gre h GLU 154 Ca 0.03 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 2gre h GLU 154 Cb 0.11 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.28 2gre h GLU 154 CO -0.06 0.23 -0.17 0.28 -1.00 0.00 0.00 179.01 178.28 2gre h VAL 155 N 0.36 1.43 -0.90 3.13 2.07 -0.16 -2.95 116.25 119.23 2gre h VAL 155 Ca 0.38 -1.53 0.10 0.00 0.82 0.00 0.00 66.70 66.48 2gre h VAL 155 Cb 0.96 2.26 -0.07 0.00 -1.52 0.00 0.00 31.29 32.92 2gre h VAL 155 CO -0.11 0.43 0.58 0.03 0.02 0.00 0.00 177.57 178.51 2gre h ARG 156 N -0.27 0.84 -0.06 1.57 3.08 0.25 -0.19 114.38 119.59 2gre h ARG 156 Ca -0.00 -0.05 0.02 0.00 0.07 0.00 0.00 59.98 60.02 2gre h ARG 156 Cb 0.78 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.64 2gre h ARG 156 CO 0.04 0.55 0.09 0.93 -1.07 0.00 0.00 179.97 180.51 2gre h GLU 157 N 0.86 0.00 0.00 0.04 5.08 -0.64 0.38 114.58 120.30 2gre h GLU 157 Ca 0.42 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.74 2gre h GLU 157 Cb 0.46 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2gre h GLU 157 CO -0.19 0.00 -0.19 -0.07 -1.00 0.00 0.00 179.01 177.57 2gre h LEU 158 N 0.00 0.00 0.00 1.33 4.07 -0.95 -3.46 115.31 116.30 2gre h LEU 158 Ca 0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.99 2gre h LEU 158 Cb 0.21 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.95 2gre h LEU 158 CO -0.00 0.19 0.00 0.61 -1.08 0.00 0.00 178.44 178.16 2gre n GLY 159 N -0.05 0.93 3.66 0.83 0.00 0.13 -5.05 105.19 105.64 2gre n GLY 159 Ca -0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 2gre n GLY 159 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gre s ILE 160 N -2.00 4.99 0.14 -0.61 1.01 -1.22 -4.23 121.20 119.28 2gre s ILE 160 Ca 0.00 1.25 0.06 0.00 0.00 0.00 0.00 60.65 61.97 2gre s ILE 160 Cb 0.00 -3.97 -0.04 0.00 0.01 0.00 0.00 42.46 38.46 2gre s ILE 160 CO 0.00 0.09 -0.14 -0.70 0.00 0.00 0.00 174.94 174.19 2gre s GLU 161 N 2.00 1.10 0.43 2.79 2.56 -1.26 -4.05 118.70 122.28 2gre s GLU 161 Ca 0.30 -1.34 -0.23 0.00 0.00 0.00 0.00 54.97 53.70 2gre s GLU 161 Cb -0.16 -0.93 -0.11 0.00 2.00 0.00 0.00 34.13 34.93 2gre s GLU 161 CO 0.10 0.17 0.79 0.28 -0.56 0.00 0.00 175.26 176.05 2gre n VAL 162 N 0.26 2.24 -0.06 3.70 0.31 -1.26 -2.67 118.33 120.85 2gre n VAL 162 Ca -0.13 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.70 2gre n VAL 162 Cb 0.58 -0.87 0.00 0.00 -0.91 0.00 0.00 33.84 32.64 2gre n VAL 162 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2gre n GLY 163 N 1.47 0.78 3.76 2.92 0.00 -0.20 -4.99 105.19 108.93 2gre n GLY 163 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2gre n GLY 163 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gre s ASP 164 N -2.64 7.05 -0.05 1.61 1.01 -1.09 -4.77 116.67 117.79 2gre s ASP 164 Ca 0.00 2.42 -0.30 0.00 0.71 0.00 0.00 52.55 55.39 2gre s ASP 164 Cb 0.00 -2.63 -0.02 0.00 1.01 0.00 0.00 42.92 41.27 2gre s ASP 164 CO 0.00 -0.32 1.04 -0.36 0.21 0.00 0.00 175.17 175.73 2gre s PHE 165 N -0.98 3.52 -0.13 4.23 0.40 -1.24 -1.55 117.98 122.23 2gre s PHE 165 Ca 0.47 1.56 -0.04 0.00 -0.60 0.00 0.00 56.93 58.33 2gre s PHE 165 Cb -0.35 -3.21 -0.03 0.00 0.51 0.00 0.00 43.02 39.94 2gre s PHE 165 CO 0.45 -0.36 0.01 0.08 0.70 0.00 0.00 175.22 176.10 2gre s VAL 166 N 1.62 4.39 0.02 -0.44 1.01 0.06 -1.70 120.40 125.36 2gre s VAL 166 Ca 0.51 -0.20 0.08 0.00 0.00 0.00 0.00 61.98 62.38 2gre s VAL 166 Cb -0.21 -2.91 -0.03 0.00 0.00 0.00 0.00 36.38 33.24 2gre s VAL 166 CO 0.23 0.54 -0.23 -0.94 0.00 0.00 0.00 175.10 174.69 2gre s SER 167 N -0.22 3.37 0.22 3.32 1.04 -0.15 -2.19 113.70 119.09 2gre s SER 167 Ca 0.06 -0.49 -0.21 0.00 0.48 0.00 0.00 55.95 55.79 2gre s SER 167 Cb -0.12 -0.43 -0.08 0.00 0.10 0.00 0.00 66.02 65.48 2gre s SER 167 CO 0.02 0.28 0.76 -0.36 0.98 0.00 0.00 173.24 174.92 2gre s PHE 168 N -0.78 3.70 -0.03 5.02 2.99 -1.26 -0.81 117.98 126.82 2gre s PHE 168 Ca 0.12 1.48 -0.30 0.00 0.00 0.00 0.00 56.93 58.22 2gre s PHE 168 Cb -0.10 -2.68 -0.04 0.00 0.00 0.00 0.00 43.02 40.20 2gre s PHE 168 CO 0.02 0.36 1.26 -0.51 -0.00 0.00 0.00 175.22 176.34 2gre s ASP 169 N -1.54 7.00 0.36 1.36 1.11 0.97 -4.89 116.67 121.03 2gre s ASP 169 Ca 0.42 1.91 0.26 0.00 0.18 0.00 0.00 52.55 55.33 2gre s ASP 169 Cb -0.18 -2.56 0.83 0.00 1.07 0.00 0.00 42.92 42.08 2gre s ASP 169 CO 0.22 -0.61 1.76 1.55 1.18 0.00 0.00 175.17 179.27 2gre h PRO 170 N 7.51 0.00 -6.72 8.23 0.13 -1.88 -3.45 132.00 135.82 2gre h PRO 170 Ca -0.36 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.23 2gre h PRO 170 Cb 1.17 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.26 2gre h PRO 170 CO 0.88 0.00 -0.97 0.54 -0.23 0.00 0.00 178.00 178.23 2gre n ARG 171 N -2.66 -1.16 -2.89 0.86 1.74 -1.26 -0.60 116.66 110.68 2gre n ARG 171 Ca 0.03 0.23 -0.40 0.00 -0.77 0.00 0.00 57.85 56.94 2gre n ARG 171 Cb 0.39 -3.47 -0.05 0.00 -1.02 0.00 0.00 32.46 28.31 2gre n ARG 171 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2gre s VAL 172 N -3.76 4.51 -0.02 1.55 0.11 -1.26 -4.29 120.40 117.23 2gre s VAL 172 Ca 0.30 1.81 0.02 0.00 -2.93 0.00 0.00 61.98 61.18 2gre s VAL 172 Cb -0.15 -4.20 0.01 0.00 -1.53 0.00 0.00 36.38 30.51 2gre s VAL 172 CO 0.94 0.41 -0.06 -1.10 -3.33 0.00 0.00 175.10 171.96 2gre s GLN 173 N -0.44 0.65 -0.14 1.54 -0.21 0.11 -4.98 119.66 116.19 2gre s GLN 173 Ca 0.40 -0.18 -0.03 0.00 0.02 0.00 0.00 55.36 55.56 2gre s GLN 173 Cb -0.22 -0.64 -0.03 0.00 1.00 0.00 0.00 33.01 33.11 2gre s GLN 173 CO 0.26 0.05 -0.02 0.42 -2.12 0.00 0.00 175.29 173.89 2gre s ILE 174 N 0.27 4.11 -0.09 1.08 1.01 -1.26 -0.36 121.20 125.96 2gre s ILE 174 Ca -0.03 -0.29 -0.03 0.00 0.00 0.00 0.00 60.65 60.29 2gre s ILE 174 Cb -0.08 -2.79 -0.04 0.00 0.01 0.00 0.00 42.46 39.57 2gre s ILE 174 CO -0.00 0.52 0.05 -0.89 0.00 0.00 0.00 174.94 174.62 2gre s THR 175 N -0.01 4.72 0.35 2.92 2.01 0.70 -4.98 115.64 121.36 2gre s THR 175 Ca 0.02 -0.11 0.17 0.00 0.31 0.00 0.00 61.69 62.07 2gre s THR 175 Cb -0.13 -3.02 0.35 0.00 0.01 0.00 0.00 72.50 69.71 2gre s THR 175 CO 0.02 0.59 1.60 -0.08 -0.69 0.00 0.00 174.62 176.07 2gre h GLU 176 N 5.02 0.09 -0.01 4.92 4.57 -1.99 0.29 114.58 127.47 2gre h GLU 176 Ca -0.52 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.65 2gre h GLU 176 Cb 1.20 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.77 2gre h GLU 176 CO 0.56 0.06 -0.06 -1.13 -1.18 0.00 0.00 179.01 177.25 2gre n SER 177 N -5.23 0.86 0.00 1.04 3.41 -1.26 -4.91 113.62 107.52 2gre n SER 177 Ca 0.34 -1.07 0.00 0.00 -0.26 0.00 0.00 58.87 57.89 2gre n SER 177 Cb 1.13 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.08 2gre n SER 177 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gre n GLY 178 N 1.19 1.27 3.90 5.00 0.00 0.10 -4.92 105.19 111.74 2gre n GLY 178 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 2gre n GLY 178 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gre s TYR 179 N -2.00 3.47 -0.24 1.61 1.51 -1.25 0.46 117.35 120.90 2gre s TYR 179 Ca 0.00 0.60 0.02 0.00 -1.01 0.00 0.00 57.07 56.67 2gre s TYR 179 Cb 0.00 -2.04 0.04 0.00 -0.11 0.00 0.00 41.96 39.85 2gre s TYR 179 CO 0.00 0.39 -0.12 -1.50 -1.11 0.00 0.00 175.55 173.21 2gre s ILE 180 N -1.72 2.28 0.23 2.71 2.07 -0.46 -0.21 121.20 126.10 2gre s ILE 180 Ca 0.42 -1.36 -0.05 0.00 -1.41 0.00 0.00 60.65 58.25 2gre s ILE 180 Cb -0.12 -2.22 -0.05 0.00 0.13 0.00 0.00 42.46 40.20 2gre s ILE 180 CO 0.25 0.14 0.48 -0.54 -1.91 0.00 0.00 174.94 173.36 2gre s LYS 181 N 1.19 3.63 0.00 3.50 1.02 0.51 -2.36 119.74 127.23 2gre s LYS 181 Ca -0.04 -0.05 0.00 0.00 0.02 0.00 0.00 55.97 55.90 2gre s LYS 181 Cb -0.18 -2.73 0.00 0.00 -0.52 0.00 0.00 37.83 34.40 2gre s LYS 181 CO -0.07 0.32 0.00 0.45 -0.92 0.00 0.00 175.35 175.14 2gre n SER 182 N -0.54 0.00 0.00 2.83 2.88 -0.26 -0.71 113.62 117.82 2gre n SER 182 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 2gre n SER 182 Cb 0.53 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 2gre n SER 182 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2gre n ARG 183 N 0.00 2.46 0.00 -1.46 0.63 0.23 -3.20 116.66 115.32 2gre n ARG 183 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2gre n ARG 183 Cb 0.00 -0.86 0.00 0.00 0.45 0.00 0.00 32.46 32.05 2gre n ARG 183 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 2gre n HIS 184 N -1.39 0.00 -3.85 -0.14 8.25 -1.26 -4.56 115.22 112.27 2gre n HIS 184 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2gre n HIS 184 Cb 0.23 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.34 2gre n HIS 184 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2gre n LEU 185 N 0.00 0.00 -2.36 2.41 4.77 -1.26 -4.69 117.00 115.87 2gre n LEU 185 Ca 0.00 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2gre n LEU 185 Cb 0.00 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2gre n LEU 185 CO 0.00 -0.70 -0.48 -0.67 -1.33 0.00 0.00 177.39 174.21 2gre n ASP 186 N -3.23 -9.15 0.00 -1.43 4.64 -1.26 -4.46 116.55 101.65 2gre n ASP 186 Ca 0.00 1.85 0.00 0.00 -1.38 0.00 0.00 54.79 55.26 2gre n ASP 186 Cb 0.00 -5.11 0.00 0.00 -1.04 0.00 0.00 41.12 34.97 2gre n ASP 186 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 2gre n ASP 187 N 1.87 0.00 0.26 1.67 10.43 -1.26 -4.77 116.55 124.74 2gre n ASP 187 Ca -0.01 0.00 0.10 0.00 2.57 0.00 0.00 54.79 57.45 2gre n ASP 187 Cb 0.01 -0.06 0.69 0.00 1.84 0.00 0.00 41.12 43.60 2gre n ASP 187 CO 0.00 0.00 0.00 0.11 -1.07 0.00 0.00 177.20 176.24 2gre h LYS 188 N 0.00 0.00 0.17 -1.24 1.57 -1.78 -1.19 116.57 114.10 2gre h LYS 188 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2gre h LYS 188 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2gre h LYS 188 CO 0.00 0.00 -0.08 0.28 -0.57 0.00 0.00 179.45 179.08 2gre h VAL 189 N 0.00 0.89 -0.89 0.50 2.07 -1.91 -2.82 116.25 114.09 2gre h VAL 189 Ca 0.01 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.27 2gre h VAL 189 Cb 0.03 1.05 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 2gre h VAL 189 CO -0.00 0.06 0.55 0.28 0.02 0.00 0.00 177.57 178.48 2gre h SER 190 N -0.34 1.06 -0.48 0.57 0.02 -1.72 -1.91 113.55 110.74 2gre h SER 190 Ca -0.02 -0.06 0.08 0.00 -0.84 0.00 0.00 61.79 60.95 2gre h SER 190 Cb 0.27 -0.27 -0.06 0.00 0.14 0.00 0.00 62.40 62.48 2gre h SER 190 CO 0.04 0.81 0.13 0.58 -1.14 0.00 0.00 176.83 177.24 2gre h VAL 191 N 1.23 0.77 -0.16 2.27 2.07 -1.14 -0.70 116.25 120.59 2gre h VAL 191 Ca 0.32 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.75 2gre h VAL 191 Cb -0.07 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 2gre h VAL 191 CO -0.06 0.05 0.10 0.00 0.02 0.00 0.00 177.57 177.68 2gre h ALA 192 N 1.36 0.20 -0.53 1.67 0.00 -1.22 0.19 119.26 120.93 2gre h ALA 192 Ca 0.24 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.22 2gre h ALA 192 Cb 0.29 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 17.92 2gre h ALA 192 CO -0.29 -0.32 -0.40 0.82 0.00 0.00 0.00 179.25 179.07 2gre h ILE 193 N 0.20 0.13 -0.12 0.00 2.04 -0.56 0.20 117.51 119.40 2gre h ILE 193 Ca 0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.92 2gre h ILE 193 Cb -0.02 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.18 2gre h ILE 193 CO -0.01 0.00 0.06 -0.07 0.00 0.00 0.00 178.15 178.13 2gre h LEU 194 N -0.23 0.10 -0.39 1.44 3.38 -0.98 0.28 115.31 118.91 2gre h LEU 194 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2gre h LEU 194 Cb 0.56 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 2gre h LEU 194 CO -0.65 0.08 0.25 -0.07 0.09 0.00 0.00 178.44 178.14 2gre h LEU 195 N 0.14 0.46 -0.22 1.67 4.07 -0.36 -0.26 115.31 120.81 2gre h LEU 195 Ca 0.05 -0.04 -0.05 0.00 0.08 0.00 0.00 57.88 57.92 2gre h LEU 195 Cb -0.00 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.62 2gre h LEU 195 CO -0.03 0.36 -0.04 0.11 -1.08 0.00 0.00 178.44 177.76 2gre h LYS 196 N 0.52 0.42 -0.79 1.13 1.79 -0.48 -2.78 116.57 116.38 2gre h LYS 196 Ca 0.14 -0.16 0.17 0.00 -2.18 0.00 0.00 60.65 58.63 2gre h LYS 196 Cb -0.02 -0.03 -0.11 0.00 -1.58 0.00 0.00 32.23 30.49 2gre h LYS 196 CO -0.03 0.65 0.27 1.25 -1.08 0.00 0.00 179.45 180.51 2gre h LEU 197 N 0.16 0.16 -0.18 2.94 5.85 0.01 0.35 115.31 124.59 2gre h LEU 197 Ca 0.06 0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.95 2gre h LEU 197 Cb 0.49 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.65 2gre h LEU 197 CO 0.02 0.00 0.02 0.40 -0.34 0.00 0.00 178.44 178.54 2gre h ILE 198 N 0.34 0.90 -0.69 4.05 2.04 -0.83 -2.80 117.51 120.52 2gre h ILE 198 Ca 0.46 -0.03 -0.03 0.00 1.00 0.00 0.00 64.86 66.26 2gre h ILE 198 Cb 0.80 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.65 2gre h ILE 198 CO -0.50 0.02 0.32 0.50 0.00 0.00 0.00 178.15 178.49 2gre h LYS 199 N 0.09 1.00 -0.85 2.37 1.63 -0.86 -2.33 116.57 117.62 2gre h LYS 199 Ca 0.08 -0.16 0.21 0.00 -0.85 0.00 0.00 60.65 59.93 2gre h LYS 199 Cb 0.09 -0.18 -0.12 0.00 -0.60 0.00 0.00 32.23 31.42 2gre h LYS 199 CO -0.12 0.80 0.31 -0.09 -3.45 0.00 0.00 179.45 176.90 2gre h ARG 200 N 0.97 0.33 0.06 1.90 2.43 -0.12 -0.72 114.38 119.22 2gre h ARG 200 Ca 0.24 -0.02 -0.27 0.00 -0.81 0.00 0.00 59.98 59.12 2gre h ARG 200 Cb 0.14 -0.07 0.02 0.00 -0.42 0.00 0.00 29.97 29.63 2gre h ARG 200 CO -0.03 0.22 -1.12 -0.07 -1.51 0.00 0.00 179.97 177.46 2gre h LEU 201 N 0.34 0.75 -0.64 3.80 3.38 -1.24 0.55 115.31 122.25 2gre h LEU 201 Ca 0.52 -0.66 0.07 0.00 0.09 0.00 0.00 57.88 57.90 2gre h LEU 201 Cb 0.98 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.43 2gre h LEU 201 CO -0.54 1.47 0.33 -0.61 0.09 0.00 0.00 178.44 179.17 2gre h GLN 202 N 0.27 0.59 0.22 1.13 4.15 -0.95 -0.31 115.11 120.22 2gre h GLN 202 Ca -0.14 -0.04 -0.32 0.00 0.77 0.00 0.00 58.65 58.92 2gre h GLN 202 Cb 1.78 -0.13 0.03 0.00 0.21 0.00 0.00 27.48 29.37 2gre h GLN 202 CO 0.21 0.39 -1.41 -0.44 -1.93 0.00 0.00 178.83 175.64 2gre h ASP 203 N 0.60 0.77 0.49 -0.69 3.32 -0.92 -2.83 116.42 117.17 2gre h ASP 203 Ca 0.29 -0.81 0.00 0.00 0.02 0.00 0.00 57.03 56.53 2gre h ASP 203 Cb 0.23 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.53 2gre h ASP 203 CO -0.20 1.63 0.00 -0.33 -1.72 0.00 0.00 179.24 178.62 2gre h GLU 204 N 0.14 0.00 -2.26 3.56 5.08 0.07 -3.47 114.58 117.71 2gre h GLU 204 Ca -0.23 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.00 2gre h GLU 204 Cb 2.11 0.00 0.03 0.00 0.50 0.00 0.00 28.75 31.40 2gre h GLU 204 CO 0.26 0.00 -0.22 -1.71 -1.00 0.00 0.00 179.01 176.34 2gre n ASN 205 N -2.74 -3.31 -4.15 1.42 4.05 -0.14 -5.02 115.26 105.38 2gre n ASN 205 Ca -0.00 -0.14 -0.12 0.00 0.45 0.00 0.00 54.58 54.76 2gre n ASN 205 Cb 0.18 -2.03 -0.11 0.00 1.23 0.00 0.00 39.78 39.05 2gre n ASN 205 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 2gre s VAL 206 N -2.93 0.75 -0.06 3.44 -7.23 -1.10 -5.06 120.40 108.20 2gre s VAL 206 Ca 0.15 -1.67 -0.22 0.00 -1.81 0.00 0.00 61.98 58.43 2gre s VAL 206 Cb -0.07 -1.36 -0.04 0.00 0.56 0.00 0.00 36.38 35.47 2gre s VAL 206 CO 0.19 -0.67 0.66 -0.89 -0.31 0.00 0.00 175.10 174.08 2gre s THR 207 N -2.78 5.02 0.44 5.32 2.01 -1.26 -4.83 115.64 119.56 2gre s THR 207 Ca 0.05 1.37 -0.25 0.00 0.31 0.00 0.00 61.69 63.18 2gre s THR 207 Cb -0.01 -4.00 -0.08 0.00 0.01 0.00 0.00 72.50 68.42 2gre s THR 207 CO -0.02 0.29 1.29 -0.76 -0.69 0.00 0.00 174.62 174.74 2gre s LEU 208 N 0.57 4.12 0.46 4.42 1.43 -1.26 -4.91 118.68 123.52 2gre s LEU 208 Ca 0.35 2.63 0.14 0.00 -1.03 0.00 0.00 54.13 56.22 2gre s LEU 208 Cb -0.18 -4.02 1.07 0.00 0.03 0.00 0.00 46.19 43.09 2gre s LEU 208 CO 0.17 -0.98 2.04 1.55 0.23 0.00 0.00 176.35 179.36 2gre h PRO 209 N 2.38 0.03 -4.42 1.29 0.13 -1.88 0.52 132.00 130.04 2gre h PRO 209 Ca -0.50 -0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.34 2gre h PRO 209 Cb 1.26 -0.01 -0.24 0.00 0.13 0.00 0.00 31.00 32.14 2gre h PRO 209 CO 0.61 0.14 -0.74 0.71 -0.23 0.00 0.00 178.00 178.50 2gre s TYR 210 N -4.80 0.56 0.05 1.56 1.51 -1.26 -1.08 117.35 113.89 2gre s TYR 210 Ca -0.04 -0.33 -0.35 0.00 -1.01 0.00 0.00 57.07 55.33 2gre s TYR 210 Cb 0.16 -0.34 -0.14 0.00 -0.11 0.00 0.00 41.96 41.53 2gre s TYR 210 CO 0.69 -0.06 1.63 2.41 -1.11 0.00 0.00 175.55 179.11 2gre n THR 211 N 2.07 0.18 -4.45 -0.71 -1.04 -1.02 -3.92 114.28 105.39 2gre n THR 211 Ca -0.19 -0.03 -0.23 0.00 -2.04 0.00 0.00 64.05 61.56 2gre n THR 211 Cb 0.56 -1.47 -0.16 0.00 -1.82 0.00 0.00 70.33 67.43 2gre n THR 211 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2gre s THR 212 N 1.87 0.93 -0.01 12.58 2.01 -0.73 -2.30 115.64 129.99 2gre s THR 212 Ca 0.85 -0.37 0.00 0.00 0.31 0.00 0.00 61.69 62.49 2gre s THR 212 Cb -0.76 -0.87 -0.04 0.00 0.01 0.00 0.00 72.50 70.84 2gre s THR 212 CO 0.45 0.31 0.03 -1.00 -0.69 0.00 0.00 174.62 173.72 2gre s HIS 213 N 0.67 3.16 -0.27 4.92 3.76 -0.69 -1.90 115.29 124.95 2gre s HIS 213 Ca -0.12 0.14 0.02 0.00 -0.15 0.00 0.00 55.06 54.94 2gre s HIS 213 Cb -0.15 -1.71 0.07 0.00 1.11 0.00 0.00 32.58 31.90 2gre s HIS 213 CO 0.02 0.49 -0.05 -0.06 -0.85 0.00 0.00 174.74 174.30 2gre s PHE 214 N -1.10 2.89 -0.46 1.40 0.40 0.30 0.22 117.98 121.64 2gre s PHE 214 Ca 0.20 -2.17 -0.19 0.00 -0.60 0.00 0.00 56.93 54.18 2gre s PHE 214 Cb -0.12 -1.94 0.04 0.00 0.51 0.00 0.00 43.02 41.51 2gre s PHE 214 CO 0.10 -0.85 0.54 -1.17 0.70 0.00 0.00 175.22 174.55 2gre s LEU 215 N 1.22 4.88 -1.01 -0.37 2.96 0.14 -0.72 118.68 125.78 2gre s LEU 215 Ca -0.03 -0.74 -0.19 0.00 -0.22 0.00 0.00 54.13 52.95 2gre s LEU 215 Cb -0.19 -2.46 0.12 0.00 0.50 0.00 0.00 46.19 44.15 2gre s LEU 215 CO -0.07 -0.74 1.27 -0.63 -1.32 0.00 0.00 176.35 174.86 2gre s ILE 216 N 2.42 4.60 0.57 6.68 -1.09 0.17 -1.46 121.20 133.09 2gre s ILE 216 Ca 0.15 -1.62 -0.13 0.00 -2.23 0.00 0.00 60.65 56.82 2gre s ILE 216 Cb -0.18 -4.88 -0.06 0.00 -1.58 0.00 0.00 42.46 35.77 2gre s ILE 216 CO 0.14 -1.63 1.01 -0.94 -1.23 0.00 0.00 174.94 172.28 2gre s SER 217 N 3.79 6.40 -0.08 3.58 1.04 -0.07 -2.73 113.70 125.63 2gre s SER 217 Ca 0.38 1.48 0.11 0.00 0.48 0.00 0.00 55.95 58.40 2gre s SER 217 Cb -0.03 -2.48 0.17 0.00 0.10 0.00 0.00 66.02 63.78 2gre s SER 217 CO -0.07 -0.75 1.08 -0.46 0.98 0.00 0.00 173.24 174.02 2gre n ASN 218 N -2.24 1.49 -4.10 7.02 2.04 -1.26 -1.36 115.26 116.84 2gre n ASN 218 Ca 0.06 -2.63 -0.16 0.00 -0.44 0.00 0.00 54.58 51.41 2gre n ASN 218 Cb 0.54 -0.32 -0.10 0.00 -2.53 0.00 0.00 39.78 37.37 2gre n ASN 218 CO 0.00 0.00 0.00 0.20 -0.44 0.00 0.00 177.26 177.02 2gre s ASN 219 N -2.10 1.02 0.00 0.53 0.02 -1.26 -4.56 114.94 108.59 2gre s ASN 219 Ca 0.19 -1.47 0.00 0.00 -1.02 0.00 0.00 52.86 50.56 2gre s ASN 219 Cb 0.17 0.33 0.00 0.00 0.02 0.00 0.00 41.25 41.77 2gre s ASN 219 CO 0.02 -0.84 0.00 -0.62 0.02 0.00 0.00 177.10 175.68 2gre n GLU 220 N -0.46 0.00 -2.24 -0.60 4.71 -1.26 -4.94 120.64 115.86 2gre n GLU 220 Ca 0.01 0.00 -0.04 0.00 -0.01 0.00 0.00 57.16 57.12 2gre n GLU 220 Cb 0.65 0.00 0.01 0.00 -1.01 0.00 0.00 31.44 31.10 2gre n GLU 220 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65 2gre n SER 228 N -2.74 -0.98 0.00 1.62 7.64 -1.26 -4.99 113.62 112.91 2gre n SER 228 Ca 0.00 -1.70 0.00 0.00 1.01 0.00 0.00 58.87 58.18 2gre n SER 228 Cb 0.00 1.63 0.00 0.00 -1.01 0.00 0.00 64.21 64.83 2gre n SER 228 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2gre n ASN 229 N -1.28 0.00 -4.38 6.43 4.05 -1.26 -5.09 115.26 113.73 2gre n ASN 229 Ca -0.04 0.00 -0.35 0.00 0.45 0.00 0.00 54.58 54.64 2gre n ASN 229 Cb 0.26 0.00 -0.13 0.00 1.23 0.00 0.00 39.78 41.14 2gre n ASN 229 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2gre s ILE 230 N 0.00 3.71 0.09 -1.44 1.09 -1.26 -5.07 121.20 118.32 2gre s ILE 230 Ca 0.00 -0.39 -0.32 0.00 -1.10 0.00 0.00 60.65 58.85 2gre s ILE 230 Cb 0.00 -2.69 -0.17 0.00 -1.06 0.00 0.00 42.46 38.54 2gre s ILE 230 CO 0.00 0.41 0.75 -2.65 -0.10 0.00 0.00 174.94 173.35 2gre n PRO 231 N 4.59 0.00 0.20 2.79 -0.01 -1.26 -4.83 135.00 136.48 2gre n PRO 231 Ca -0.17 0.00 0.17 0.00 -0.01 0.00 0.00 63.50 63.48 2gre n PRO 231 Cb 0.51 -1.17 0.81 0.00 -0.01 0.00 0.00 33.50 33.65 2gre n PRO 231 CO 0.00 0.00 0.00 1.49 -0.01 0.00 0.00 175.50 176.98 2gre h GLU 232 N 1.88 0.00 -0.68 -0.52 4.57 -2.02 -2.57 114.58 115.24 2gre h GLU 232 Ca -0.37 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.81 2gre h GLU 232 Cb 1.34 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.93 2gre h GLU 232 CO 0.57 0.00 0.00 -0.85 -1.18 0.00 0.00 179.01 177.55 2gre n GLU 233 N -3.89 3.36 -1.96 1.92 0.00 -1.26 -4.91 120.64 113.90 2gre n GLU 233 Ca 0.02 -2.81 -0.42 0.00 0.00 0.00 0.00 57.16 53.95 2gre n GLU 233 Cb 0.32 -1.77 -0.03 0.00 0.00 0.00 0.00 31.44 29.96 2gre n GLU 233 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 2gre s THR 234 N -1.53 3.49 -0.17 3.84 2.01 -0.97 -0.92 115.64 121.39 2gre s THR 234 Ca 0.50 0.59 0.02 0.00 0.31 0.00 0.00 61.69 63.11 2gre s THR 234 Cb 0.30 -3.42 -0.22 0.00 0.01 0.00 0.00 72.50 69.17 2gre s THR 234 CO 0.28 -0.10 0.15 0.52 -0.69 0.00 0.00 174.62 174.78 2gre n VAL 235 N 5.82 1.61 -4.70 3.82 0.31 0.98 -4.74 118.33 121.42 2gre n VAL 235 Ca 0.19 -0.67 -0.25 0.00 -0.01 0.00 0.00 64.34 63.60 2gre n VAL 235 Cb 0.43 -1.38 -0.15 0.00 -0.91 0.00 0.00 33.84 31.83 2gre n VAL 235 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2gre s GLU 236 N -2.54 1.36 -0.11 5.55 2.02 -1.13 -1.64 118.70 122.20 2gre s GLU 236 Ca -0.23 -0.78 -0.03 0.00 0.02 0.00 0.00 54.97 53.94 2gre s GLU 236 Cb 0.08 -1.39 0.05 0.00 0.10 0.00 0.00 34.13 32.97 2gre s GLU 236 CO 0.72 0.36 0.07 -0.47 0.02 0.00 0.00 175.26 175.96 2gre s TYR 237 N -0.64 0.25 -0.30 1.61 6.14 0.29 -0.72 117.35 123.98 2gre s TYR 237 Ca 0.06 -0.13 -0.05 0.00 0.64 0.00 0.00 57.07 57.59 2gre s TYR 237 Cb -0.08 -0.65 0.02 0.00 0.42 0.00 0.00 41.96 41.68 2gre s TYR 237 CO 0.01 -0.38 0.06 -1.17 0.64 0.00 0.00 175.55 174.70 2gre s LEU 238 N 2.11 3.90 -0.05 6.97 2.96 0.43 -1.34 118.68 133.66 2gre s LEU 238 Ca 0.03 -0.91 -0.29 0.00 -0.22 0.00 0.00 54.13 52.74 2gre s LEU 238 Cb -0.14 -1.83 -0.02 0.00 0.50 0.00 0.00 46.19 44.69 2gre s LEU 238 CO -0.06 -0.23 0.96 0.00 -1.32 0.00 0.00 176.35 175.70 2gre s ALA 239 N 1.42 3.27 -0.36 5.97 0.00 0.21 -0.84 121.76 131.43 2gre s ALA 239 Ca 0.00 0.43 -0.09 0.00 0.00 0.00 0.00 51.96 52.29 2gre s ALA 239 Cb -0.18 -3.33 0.03 0.00 0.00 0.00 0.00 23.12 19.64 2gre s ALA 239 CO 0.01 -0.36 0.17 0.08 0.00 0.00 0.00 175.76 175.66 2gre s VAL 240 N 1.38 4.33 0.00 0.00 1.01 -0.02 -1.20 120.40 125.89 2gre s VAL 240 Ca 0.49 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.54 2gre s VAL 240 Cb -0.20 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.77 2gre s VAL 240 CO 0.23 -0.20 0.00 -0.67 0.00 0.00 0.00 175.10 174.46 2gre n ASP 241 N 4.94 0.00 -3.63 3.32 -0.08 0.30 -4.49 116.55 116.91 2gre n ASP 241 Ca -0.12 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.16 2gre n ASP 241 Cb 0.46 0.00 0.01 0.00 2.34 0.00 0.00 41.12 43.93 2gre n ASP 241 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 2gre s GLY 243 N -0.00 -0.07 0.61 0.27 0.00 -1.26 -3.50 107.32 103.36 2gre s GLY 243 Ca 0.00 -0.02 0.06 0.00 0.00 0.00 0.00 44.72 44.75 2gre s GLY 243 CO 0.00 3.63 0.84 0.00 0.00 0.00 0.00 173.10 177.57 2gre s ALA 244 N -2.16 4.33 0.00 3.20 0.00 -1.26 -4.60 121.76 121.26 2gre s ALA 244 Ca 0.24 -1.94 0.00 0.00 0.00 0.00 0.00 51.96 50.26 2gre s ALA 244 Cb -0.01 -1.68 0.00 0.00 0.00 0.00 0.00 23.12 21.43 2gre s ALA 244 CO 0.01 -1.02 0.00 1.28 0.00 0.00 0.00 175.76 176.03 2gre n LEU 245 N -2.42 0.28 0.00 0.00 4.77 -1.26 -4.12 117.00 114.25 2gre n LEU 245 Ca 0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2gre n LEU 245 Cb 0.61 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.70 2gre n LEU 245 CO 0.41 -0.19 0.00 0.61 -1.33 0.00 0.00 177.39 176.89 2gre n GLY 246 N 1.99 0.31 0.00 -0.72 0.00 -1.26 -4.71 105.19 100.80 2gre n GLY 246 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2gre n GLY 246 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2gre n ASP 247 N 0.00 0.00 0.00 1.61 8.00 -1.26 -5.27 116.55 119.63 2gre n ASP 247 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2gre n ASP 247 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2gre n ASP 247 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gre n GLY 248 N 5.00 0.86 2.90 0.44 0.00 -1.26 -5.08 105.19 108.05 2gre n GLY 248 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2gre n GLY 248 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2gre s ASP 252 N -1.00 0.39 0.00 1.61 2.15 -1.26 -4.92 116.67 113.64 2gre s ASP 252 Ca 0.00 0.20 0.28 0.00 0.43 0.00 0.00 52.55 53.45 2gre s ASP 252 Cb 0.00 1.01 1.43 0.00 -0.30 0.00 0.00 42.92 45.06 2gre s ASP 252 CO 0.00 -0.30 1.95 -0.62 -0.17 0.00 0.00 175.17 176.03 2gre n GLU 253 N 5.36 1.25 -0.12 4.34 1.02 -1.26 -3.86 120.64 127.37 2gre n GLU 253 Ca -0.04 -0.37 0.04 0.00 -0.02 0.00 0.00 57.16 56.77 2gre n GLU 253 Cb 0.50 -1.45 0.10 0.00 -0.02 0.00 0.00 31.44 30.57 2gre n GLU 253 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2gre n TYR 254 N -0.51 0.26 -3.82 -0.32 4.02 -1.26 -2.81 117.16 112.71 2gre n TYR 254 Ca 0.20 -0.62 -0.10 0.00 -0.01 0.00 0.00 57.90 57.38 2gre n TYR 254 Cb 0.19 -0.09 -0.07 0.00 -0.02 0.00 0.00 39.34 39.35 2gre n TYR 254 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 2gre s THR 255 N -1.48 0.12 0.01 -0.72 -4.23 -1.25 -3.94 115.64 104.15 2gre s THR 255 Ca 0.17 -0.99 -0.29 0.00 -1.18 0.00 0.00 61.69 59.40 2gre s THR 255 Cb 0.12 -1.17 -0.04 0.00 1.34 0.00 0.00 72.50 72.75 2gre s THR 255 CO 0.06 -0.55 0.92 0.54 -0.54 0.00 0.00 174.62 175.06 2gre s VAL 256 N -3.37 4.84 -0.20 2.29 0.11 -1.05 -3.27 120.40 119.75 2gre s VAL 256 Ca 0.01 1.93 -0.15 0.00 -2.93 0.00 0.00 61.98 60.85 2gre s VAL 256 Cb 0.02 -4.26 -0.04 0.00 -1.53 0.00 0.00 36.38 30.57 2gre s VAL 256 CO -0.08 0.21 0.34 -0.55 -3.33 0.00 0.00 175.10 171.68 2gre s SER 257 N 0.78 6.39 -0.22 3.54 0.15 0.17 -2.57 113.70 121.94 2gre s SER 257 Ca 0.48 0.46 -0.05 0.00 0.70 0.00 0.00 55.95 57.54 2gre s SER 257 Cb -0.21 -2.20 -0.02 0.00 -1.71 0.00 0.00 66.02 61.88 2gre s SER 257 CO 0.26 -0.01 0.01 -0.63 1.20 0.00 0.00 173.24 174.06 2gre s ILE 258 N 1.06 3.83 -0.13 6.45 1.01 -0.64 -1.64 121.20 131.14 2gre s ILE 258 Ca 0.17 -0.34 -0.21 0.00 0.00 0.00 0.00 60.65 60.27 2gre s ILE 258 Cb -0.14 -2.76 -0.03 0.00 0.01 0.00 0.00 42.46 39.54 2gre s ILE 258 CO 0.07 0.40 0.61 0.00 0.00 0.00 0.00 174.94 176.01 2gre h ALA 260 N 7.03 0.67 -1.44 0.00 0.00 -1.19 -3.43 119.26 120.90 2gre h ALA 260 Ca -0.37 -0.99 0.12 0.00 0.00 0.00 0.00 54.91 53.67 2gre h ALA 260 Cb 1.17 0.29 -0.25 0.00 0.00 0.00 0.00 17.79 19.00 2gre h ALA 260 CO 0.76 1.09 0.63 0.21 0.00 0.00 0.00 179.25 181.95 2gre s LYS 261 N -2.83 0.44 0.17 0.00 2.20 -1.25 0.57 119.74 119.03 2gre s LYS 261 Ca -0.03 0.19 0.02 0.00 -0.36 0.00 0.00 55.97 55.79 2gre s LYS 261 Cb 0.08 0.21 -0.01 0.00 -1.51 0.00 0.00 37.83 36.61 2gre s LYS 261 CO 0.81 -0.12 0.09 -0.40 -0.36 0.00 0.00 175.35 175.36 2gre n ASP 262 N 0.97 0.54 -0.35 1.43 3.85 -0.95 -1.73 116.55 120.32 2gre n ASP 262 Ca -0.09 -1.95 0.36 0.00 -0.71 0.00 0.00 54.79 52.40 2gre n ASP 262 Cb 0.58 0.56 0.74 0.00 -1.35 0.00 0.00 41.12 41.65 2gre n ASP 262 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.20 176.47 2gre h SER 263 N 0.78 0.03 1.53 -1.12 0.02 -1.63 2.35 113.55 115.51 2gre h SER 263 Ca -0.13 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 2gre h SER 263 Cb 0.53 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.07 2gre h SER 263 CO 0.19 0.00 0.00 0.77 -1.14 0.00 0.00 176.83 176.66 2gre h SER 264 N 0.03 0.00 -4.81 3.07 4.64 -1.93 -3.50 113.55 111.05 2gre h SER 264 Ca 0.60 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.92 2gre h SER 264 Cb 2.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.43 2gre h SER 264 CO -0.03 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.54 2gre n GLY 265 N 1.06 0.66 3.78 -0.77 0.00 0.79 -5.10 105.19 105.62 2gre n GLY 265 Ca 0.05 -2.25 -0.32 0.00 0.00 0.00 0.00 46.02 43.50 2gre n GLY 265 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2gre s PRO 266 N -0.72 2.81 0.38 1.61 0.02 -1.26 -2.23 135.00 135.61 2gre s PRO 266 Ca 0.00 1.24 -0.01 0.00 0.02 0.00 0.00 61.00 62.25 2gre s PRO 266 Cb 0.00 -1.96 -0.03 0.00 0.02 0.00 0.00 34.50 32.53 2gre s PRO 266 CO 0.00 -1.22 0.61 0.71 -0.33 0.00 0.00 177.00 176.77 2gre s TYR 267 N -2.58 3.50 -0.35 6.54 1.51 0.19 -4.88 117.35 121.27 2gre s TYR 267 Ca 0.64 0.45 -0.37 0.00 -1.01 0.00 0.00 57.07 56.77 2gre s TYR 267 Cb -0.18 -2.01 -0.13 0.00 -0.11 0.00 0.00 41.96 39.53 2gre s TYR 267 CO 0.45 -0.00 2.10 1.58 -1.11 0.00 0.00 175.55 178.58 2gre n HIS 268 N -1.92 1.62 -0.09 2.71 -0.00 -0.85 -4.81 115.22 111.88 2gre n HIS 268 Ca -0.03 0.39 -0.08 0.00 -0.00 0.00 0.00 57.72 58.00 2gre n HIS 268 Cb 0.56 -2.48 -0.01 0.00 -0.00 0.00 0.00 29.99 28.05 2gre n HIS 268 CO 0.00 0.00 0.00 -0.92 -0.00 0.00 0.00 176.34 175.42 2gre h TYR 269 N 10.95 -0.80 -0.70 1.57 -0.00 -1.92 -0.61 116.97 125.46 2gre h TYR 269 Ca -0.28 0.05 -0.04 0.00 -0.00 0.00 0.00 58.73 58.46 2gre h TYR 269 Cb 1.34 0.40 -0.03 0.00 -0.00 0.00 0.00 36.73 38.43 2gre h TYR 269 CO 0.93 -0.36 0.29 0.00 -0.00 0.00 0.00 178.16 179.02 2gre h ALA 270 N 0.78 0.91 -0.78 1.82 0.00 -1.98 0.73 119.26 120.74 2gre h ALA 270 Ca 0.16 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2gre h ALA 270 Cb 0.51 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2gre h ALA 270 CO -0.48 0.53 0.44 1.25 0.00 0.00 0.00 179.25 180.99 2gre h LEU 271 N 1.00 0.97 -0.31 0.00 5.85 -1.87 -0.57 115.31 120.39 2gre h LEU 271 Ca 0.24 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.80 2gre h LEU 271 Cb 0.20 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 2gre h LEU 271 CO -0.02 0.78 -0.06 -0.09 -0.34 0.00 0.00 178.44 178.71 2gre h ARG 272 N 1.09 0.58 -0.87 1.25 2.43 -0.56 -2.23 114.38 116.08 2gre h ARG 272 Ca 0.28 -0.22 0.05 0.00 -0.81 0.00 0.00 59.98 59.28 2gre h ARG 272 Cb 0.02 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.48 2gre h ARG 272 CO -0.05 0.76 0.57 0.87 -1.51 0.00 0.00 179.97 180.61 2gre h LYS 273 N 0.36 1.01 -0.26 0.20 1.57 -0.67 -1.44 116.57 117.34 2gre h LYS 273 Ca 0.08 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2gre h LYS 273 Cb 0.54 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 2gre h LYS 273 CO 0.03 0.67 0.17 1.25 -0.57 0.00 0.00 179.45 180.99 2gre h HIS 274 N 1.04 0.31 -0.78 -1.35 2.76 -0.81 -1.23 115.15 115.09 2gre h HIS 274 Ca 0.36 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.51 2gre h HIS 274 Cb 0.10 -0.11 -0.04 0.00 1.55 0.00 0.00 27.41 28.92 2gre h HIS 274 CO -0.00 0.20 0.38 -0.07 -1.30 0.00 0.00 177.93 177.13 2gre h LEU 275 N 0.34 1.01 0.41 0.26 3.38 -0.72 0.41 115.31 120.40 2gre h LEU 275 Ca 0.09 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2gre h LEU 275 Cb -0.03 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 2gre h LEU 275 CO -0.03 0.85 -0.29 0.58 0.09 0.00 0.00 178.44 179.64 2gre h VAL 276 N 1.11 0.40 -0.67 1.22 2.07 -0.89 0.59 116.25 120.08 2gre h VAL 276 Ca 0.27 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.92 2gre h VAL 276 Cb 0.10 0.40 -0.10 0.00 -1.52 0.00 0.00 31.29 30.17 2gre h VAL 276 CO -0.04 0.00 0.16 -0.33 0.02 0.00 0.00 177.57 177.39 2gre h GLU 277 N -0.69 0.27 -0.23 1.57 4.39 -0.35 0.30 114.58 119.84 2gre h GLU 277 Ca -0.04 -0.02 0.06 0.00 0.34 0.00 0.00 59.36 59.70 2gre h GLU 277 Cb 0.58 -0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 29.11 2gre h GLU 277 CO 0.02 0.18 -0.19 -0.07 -1.16 0.00 0.00 179.01 177.79 2gre h LEU 278 N 0.28 -0.60 0.31 1.33 3.38 0.66 -1.76 115.31 118.91 2gre h LEU 278 Ca 0.36 0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.44 2gre h LEU 278 Cb 0.58 0.30 -0.00 0.00 0.09 0.00 0.00 40.66 41.62 2gre h LEU 278 CO -0.45 -0.23 -0.17 0.00 0.09 0.00 0.00 178.44 177.68 2gre h ALA 279 N 0.93 -0.45 -0.25 1.53 0.00 0.86 -2.09 119.26 119.79 2gre h ALA 279 Ca 0.13 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.00 2gre h ALA 279 Cb 0.39 0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.30 2gre h ALA 279 CO -0.34 -0.76 -0.43 0.87 0.00 0.00 0.00 179.25 178.59 2gre h LYS 280 N -0.45 -0.41 -0.97 0.00 1.57 -0.13 -0.36 116.57 115.82 2gre h LYS 280 Ca -0.04 0.03 0.26 0.00 -1.87 0.00 0.00 60.65 59.04 2gre h LYS 280 Cb 0.36 0.09 -0.13 0.00 0.08 0.00 0.00 32.23 32.63 2gre h LYS 280 CO 0.05 -0.27 0.51 1.15 -0.57 0.00 0.00 179.45 180.32 2gre h THR 281 N -0.42 0.42 -0.58 -0.16 2.02 -1.23 -1.70 112.91 111.25 2gre h THR 281 Ca 0.10 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.14 2gre h THR 281 Cb 0.61 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.98 2gre h THR 281 CO -0.48 0.08 0.00 0.59 0.37 0.00 0.00 175.52 176.08 2gre n ASN 282 N -5.01 3.94 -3.89 4.18 5.03 -0.29 -4.91 115.26 114.31 2gre n ASN 282 Ca 0.27 -2.28 -0.25 0.00 0.87 0.00 0.00 54.58 53.19 2gre n ASN 282 Cb 0.80 -0.50 -0.00 0.00 -1.02 0.00 0.00 39.78 39.06 2gre n ASN 282 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 2gre n HIS 283 N 1.05 -1.79 -3.70 3.10 8.25 -0.64 -4.95 115.22 116.53 2gre n HIS 283 Ca 0.22 0.79 -0.35 0.00 -0.26 0.00 0.00 57.72 58.12 2gre n HIS 283 Cb 0.71 -3.93 -0.08 0.00 1.12 0.00 0.00 29.99 27.82 2gre n HIS 283 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2gre s ILE 284 N -3.77 5.40 -0.02 1.59 1.01 -0.38 -5.05 121.20 119.98 2gre s ILE 284 Ca 0.10 0.23 -0.30 0.00 0.00 0.00 0.00 60.65 60.69 2gre s ILE 284 Cb -0.05 -3.49 -0.04 0.00 0.01 0.00 0.00 42.46 38.89 2gre s ILE 284 CO 0.86 0.43 1.15 -1.61 0.00 0.00 0.00 174.94 175.76 2gre s GLU 285 N 0.41 4.41 0.13 2.79 8.01 -1.26 -4.46 118.70 128.73 2gre s GLU 285 Ca 0.09 1.63 0.00 0.00 0.01 0.00 0.00 54.97 56.70 2gre s GLU 285 Cb -0.11 -3.48 -0.04 0.00 -4.31 0.00 0.00 34.13 26.18 2gre s GLU 285 CO -0.01 -0.32 0.01 1.52 0.01 0.00 0.00 175.26 176.47 2gre s TYR 286 N 1.68 0.96 -0.02 1.61 1.13 -1.26 -2.54 117.35 118.92 2gre s TYR 286 Ca 0.55 -1.08 0.02 0.00 -1.41 0.00 0.00 57.07 55.15 2gre s TYR 286 Cb -0.25 -0.56 0.00 0.00 -1.10 0.00 0.00 41.96 40.06 2gre s TYR 286 CO 0.24 -0.33 -0.08 0.15 -2.51 0.00 0.00 175.55 173.03 2gre s LYS 287 N -3.95 0.77 -0.26 -3.49 3.01 -1.06 -4.92 119.74 109.83 2gre s LYS 287 Ca 0.20 -0.27 -0.24 0.00 -1.01 0.00 0.00 55.97 54.65 2gre s LYS 287 Cb 0.07 -0.74 -0.00 0.00 -1.01 0.00 0.00 37.83 36.15 2gre s LYS 287 CO 0.00 0.12 0.83 0.08 0.51 0.00 0.00 175.35 176.89 2gre s VAL 288 N 0.09 4.81 0.28 3.17 1.01 -1.26 -1.62 120.40 126.87 2gre s VAL 288 Ca -0.01 1.48 0.08 0.00 0.00 0.00 0.00 61.98 63.53 2gre s VAL 288 Cb -0.06 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 2gre s VAL 288 CO 0.00 -0.14 0.09 -1.81 0.00 0.00 0.00 175.10 173.25 2gre s ASP 289 N 1.43 4.89 -0.18 3.32 1.01 0.98 -4.92 116.67 123.20 2gre s ASP 289 Ca 0.35 -0.54 0.01 0.00 0.71 0.00 0.00 52.55 53.07 2gre s ASP 289 Cb -0.15 -1.00 0.03 0.00 1.01 0.00 0.00 42.92 42.81 2gre s ASP 289 CO 0.09 -0.08 -0.16 -0.63 0.21 0.00 0.00 175.17 174.60 2gre s ILE 290 N -2.28 1.85 -0.69 0.77 1.01 -1.26 -0.61 121.20 119.99 2gre s ILE 290 Ca 0.33 -0.90 -0.15 0.00 0.00 0.00 0.00 60.65 59.93 2gre s ILE 290 Cb -0.06 -1.75 0.17 0.00 0.01 0.00 0.00 42.46 40.83 2gre s ILE 290 CO 0.22 0.42 0.64 -0.31 0.00 0.00 0.00 174.94 175.92 2gre s TYR 291 N 1.35 3.50 -1.41 3.97 2.02 -0.70 -4.67 117.35 121.41 2gre s TYR 291 Ca 0.03 -1.63 0.10 0.00 -0.37 0.00 0.00 57.07 55.20 2gre s TYR 291 Cb -0.14 -3.82 0.50 0.00 -0.40 0.00 0.00 41.96 38.10 2gre s TYR 291 CO -0.11 -1.02 1.21 -0.35 -1.57 0.00 0.00 175.55 173.71 2gre n PRO 292 N 4.66 0.13 -3.84 -1.71 -0.04 -1.26 -3.38 135.00 129.57 2gre n PRO 292 Ca 0.00 0.20 -0.30 0.00 -0.04 0.00 0.00 63.50 63.36 2gre n PRO 292 Cb 0.44 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.24 2gre n PRO 292 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2gre s TYR 293 N -2.59 2.37 0.00 0.54 2.02 -1.26 -4.46 117.35 113.96 2gre s TYR 293 Ca 0.09 -2.09 0.00 0.00 -0.37 0.00 0.00 57.07 54.70 2gre s TYR 293 Cb 0.07 -2.04 0.00 0.00 -0.40 0.00 0.00 41.96 39.58 2gre s TYR 293 CO 0.15 -0.88 0.00 0.66 -1.57 0.00 0.00 175.55 173.91 2gre n TYR 294 N 4.66 0.00 0.00 2.71 4.02 -1.26 -4.61 117.16 122.68 2gre n TYR 294 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.88 2gre n TYR 294 Cb 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.74 2gre n TYR 294 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 176.86 178.74 2gre n ARG 303 N -1.49 0.00 -2.98 -0.72 0.00 -1.26 -3.69 116.66 106.52 2gre n ARG 303 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 57.85 57.70 2gre n ARG 303 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 32.46 32.47 2gre n ARG 303 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2gre n ALA 304 N 0.49 -1.89 -2.68 2.89 0.00 -1.26 -4.87 120.51 113.20 2gre n ALA 304 Ca 0.00 -0.07 0.01 0.00 0.00 0.00 0.00 53.44 53.39 2gre n ALA 304 Cb 0.00 -0.56 0.04 0.00 0.00 0.00 0.00 19.45 18.92 2gre n ALA 304 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gre n GLY 305 N -0.85 1.45 3.06 0.00 0.00 -1.26 -5.10 105.19 102.49 2gre n GLY 305 Ca -0.14 -0.91 -0.21 0.00 0.00 0.00 0.00 46.02 44.75 2gre n GLY 305 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gre s PHE 306 N -2.05 1.13 -1.11 1.61 0.40 -1.26 -5.08 117.98 111.62 2gre s PHE 306 Ca 0.28 -0.26 -0.22 0.00 -0.60 0.00 0.00 56.93 56.14 2gre s PHE 306 Cb 0.34 -0.76 0.03 0.00 0.51 0.00 0.00 43.02 43.14 2gre s PHE 306 CO -0.09 -0.07 1.65 0.34 0.70 0.00 0.00 175.22 177.75 2gre s ASP 307 N -0.05 6.30 -0.08 1.36 2.15 -1.26 -4.89 116.67 120.20 2gre s ASP 307 Ca 0.00 -1.69 -0.10 0.00 0.43 0.00 0.00 52.55 51.19 2gre s ASP 307 Cb -0.07 -2.57 0.02 0.00 -0.30 0.00 0.00 42.92 40.00 2gre s ASP 307 CO 0.00 -1.70 0.27 -0.69 -0.17 0.00 0.00 175.17 172.88 2gre s VAL 308 N 5.94 0.02 0.05 1.11 1.01 -1.26 -4.81 120.40 122.46 2gre s VAL 308 Ca 0.54 -0.15 -0.30 0.00 0.00 0.00 0.00 61.98 62.07 2gre s VAL 308 Cb 0.00 -0.43 -0.05 0.00 0.00 0.00 0.00 36.38 35.90 2gre s VAL 308 CO -0.01 -0.08 1.10 -0.54 0.00 0.00 0.00 175.10 175.57 2gre s LYS 309 N -0.24 4.50 -0.10 2.72 1.02 -0.65 -4.93 119.74 122.05 2gre s LYS 309 Ca -0.04 1.63 -0.00 0.00 0.02 0.00 0.00 55.97 57.58 2gre s LYS 309 Cb -0.03 -3.38 -0.03 0.00 -0.52 0.00 0.00 37.83 33.87 2gre s LYS 309 CO 0.01 -0.14 -0.08 -1.01 -0.92 0.00 0.00 175.35 173.21 2gre s HIS 310 N 0.90 2.91 0.10 3.18 3.76 -1.26 -0.54 115.29 124.33 2gre s HIS 310 Ca 0.55 -0.21 -0.06 0.00 -0.15 0.00 0.00 55.06 55.20 2gre s HIS 310 Cb -0.26 -1.79 -0.02 0.00 1.11 0.00 0.00 32.58 31.62 2gre s HIS 310 CO 0.29 0.12 0.13 0.00 -0.85 0.00 0.00 174.74 174.42 2gre s ALA 311 N -0.27 0.15 -0.12 -1.40 0.00 -0.45 -2.01 121.76 117.66 2gre s ALA 311 Ca 0.03 -0.93 -0.05 0.00 0.00 0.00 0.00 51.96 51.01 2gre s ALA 311 Cb -0.13 0.53 0.06 0.00 0.00 0.00 0.00 23.12 23.59 2gre s ALA 311 CO 0.03 -0.49 0.25 -1.17 0.00 0.00 0.00 175.76 174.38 2gre s LEU 312 N -2.92 -0.27 0.00 0.00 0.20 -1.26 -0.62 118.68 113.82 2gre s LEU 312 Ca 0.10 0.57 0.03 0.00 0.69 0.00 0.00 54.13 55.51 2gre s LEU 312 Cb 0.06 0.66 -0.01 0.00 -0.43 0.00 0.00 46.19 46.47 2gre s LEU 312 CO -0.07 -0.24 0.10 2.30 -0.29 0.00 0.00 176.35 178.15 2gre n ILE 313 N 5.33 0.00 0.00 6.68 -0.00 -0.34 -1.35 119.36 129.68 2gre n ILE 313 Ca -0.06 -2.13 0.00 0.00 -0.00 0.00 0.00 62.75 60.56 2gre n ILE 313 Cb 0.50 0.69 0.00 0.00 -0.00 0.00 0.00 39.64 40.83 2gre n ILE 313 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2gre n GLY 314 N -0.46 2.95 3.76 3.28 0.00 -0.65 -0.54 105.19 113.52 2gre n GLY 314 Ca -0.08 -0.73 -0.33 0.00 0.00 0.00 0.00 46.02 44.88 2gre n GLY 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gre s ALA 315 N -2.00 2.37 0.06 4.61 0.00 -1.26 0.43 121.76 125.97 2gre s ALA 315 Ca 0.00 0.66 -0.30 0.00 0.00 0.00 0.00 51.96 52.32 2gre s ALA 315 Cb 0.00 -3.37 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 2gre s ALA 315 CO 0.00 -1.43 1.02 0.20 0.00 0.00 0.00 175.76 175.55 2gre s GLY 316 N -2.37 2.85 -0.05 0.00 0.00 -1.20 -4.70 107.32 101.86 2gre s GLY 316 Ca 0.69 0.63 0.01 0.00 0.00 0.00 0.00 44.72 46.05 2gre s GLY 316 CO 0.42 1.68 -0.03 -0.26 0.00 0.00 0.00 173.10 174.90 2gre s ILE 317 N 0.61 0.45 0.19 0.90 -0.00 -1.26 -4.48 121.20 117.60 2gre s ILE 317 Ca 0.51 -0.05 -0.21 0.00 -0.00 0.00 0.00 60.65 60.90 2gre s ILE 317 Cb -0.24 -0.51 -0.08 0.00 -0.00 0.00 0.00 42.46 41.63 2gre s ILE 317 CO 0.29 0.22 0.72 -0.62 -0.00 0.00 0.00 174.94 175.55 2gre s ASP 318 N 1.08 7.15 -1.57 4.36 -1.08 -0.89 -4.12 116.67 121.60 2gre s ASP 318 Ca -0.09 1.46 0.00 0.00 -0.52 0.00 0.00 52.55 53.40 2gre s ASP 318 Cb -0.14 -2.43 0.00 0.00 -1.46 0.00 0.00 42.92 38.89 2gre s ASP 318 CO -0.01 0.11 0.00 -0.24 0.52 0.00 0.00 175.17 175.55 2gre n SER 319 N 1.08 -5.23 -3.09 -0.34 2.88 -1.26 -2.94 113.62 104.72 2gre n SER 319 Ca -0.04 0.02 -0.41 0.00 -1.33 0.00 0.00 58.87 57.11 2gre n SER 319 Cb 0.50 -4.30 -0.06 0.00 -0.75 0.00 0.00 64.21 59.61 2gre n SER 319 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2gre n SER 320 N -1.39 0.11 0.00 -3.46 2.88 -1.26 -2.21 113.62 108.29 2gre n SER 320 Ca -0.21 0.79 0.00 0.00 -1.33 0.00 0.00 58.87 58.12 2gre n SER 320 Cb 0.66 -0.62 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 2gre n SER 320 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2gre n HIS 321 N 1.26 0.00 0.00 0.66 8.25 -1.26 -4.78 115.22 119.34 2gre n HIS 321 Ca 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 2gre n HIS 321 Cb 0.04 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.07 2gre n HIS 321 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2gre n ALA 322 N 0.15 0.00 -3.51 -1.41 0.00 -0.94 -4.80 120.51 110.01 2gre n ALA 322 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 2gre n ALA 322 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 2gre n ALA 322 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2gre s PHE 323 N 0.63 3.26 0.02 0.00 0.40 -1.05 -4.75 117.98 116.48 2gre s PHE 323 Ca 0.00 -1.72 -0.10 0.00 -0.60 0.00 0.00 56.93 54.52 2gre s PHE 323 Cb 0.00 -2.16 -0.05 0.00 0.51 0.00 0.00 43.02 41.32 2gre s PHE 323 CO 0.00 -0.78 0.34 -1.21 0.70 0.00 0.00 175.22 174.27 2gre s GLU 324 N 1.30 3.72 -0.09 0.44 2.02 -1.20 -4.44 118.70 120.46 2gre s GLU 324 Ca -0.04 0.14 -0.08 0.00 0.02 0.00 0.00 54.97 55.01 2gre s GLU 324 Cb -0.20 -3.10 0.02 0.00 0.10 0.00 0.00 34.13 30.96 2gre s GLU 324 CO 0.00 0.64 0.23 0.50 0.02 0.00 0.00 175.26 176.65 2gre s ARG 325 N -1.54 0.26 0.29 1.61 3.52 -1.15 -1.10 118.95 120.83 2gre s ARG 325 Ca 0.27 0.33 0.04 0.00 -0.13 0.00 0.00 55.73 56.24 2gre s ARG 325 Cb -0.14 0.11 -0.04 0.00 -1.56 0.00 0.00 34.95 33.32 2gre s ARG 325 CO 0.15 -0.04 0.19 -0.08 -0.81 0.00 0.00 175.30 174.71 2gre s THR 326 N 0.22 0.15 0.12 4.11 -1.32 -0.99 -2.10 115.64 115.83 2gre s THR 326 Ca -0.01 -2.00 0.09 0.00 -1.21 0.00 0.00 61.69 58.57 2gre s THR 326 Cb -0.02 -2.50 -0.04 0.00 -1.51 0.00 0.00 72.50 68.43 2gre s THR 326 CO -0.00 0.00 -0.21 -2.28 -2.21 0.00 0.00 174.62 169.92 2gre s HIS 327 N -3.66 2.46 0.37 9.09 2.46 -1.12 -1.36 115.29 123.53 2gre s HIS 327 Ca 0.38 -0.30 0.14 0.00 0.47 0.00 0.00 55.06 55.74 2gre s HIS 327 Cb 0.04 -1.32 0.96 0.00 -0.13 0.00 0.00 32.58 32.13 2gre s HIS 327 CO 0.20 0.36 1.80 1.05 -2.47 0.00 0.00 174.74 175.68 2gre h GLU 328 N 3.84 0.52 -0.48 2.88 4.11 -0.28 -1.16 114.58 124.01 2gre h GLU 328 Ca -0.50 -0.03 0.09 0.00 0.07 0.00 0.00 59.36 58.99 2gre h GLU 328 Cb 1.17 -0.12 -0.09 0.00 0.50 0.00 0.00 28.75 30.21 2gre h GLU 328 CO 0.44 0.34 -0.09 0.66 0.07 0.00 0.00 179.01 180.43 2gre h SER 329 N 0.53 -0.38 -0.42 3.06 4.64 -1.84 0.29 113.55 119.44 2gre h SER 329 Ca 0.55 0.14 0.05 0.00 -0.47 0.00 0.00 61.79 62.05 2gre h SER 329 Cb 1.17 0.27 -0.04 0.00 -0.31 0.00 0.00 62.40 63.49 2gre h SER 329 CO -0.29 -0.14 0.17 -1.28 -0.87 0.00 0.00 176.83 174.43 2gre h SER 330 N 0.03 0.20 -0.86 4.97 0.87 -1.23 -0.17 113.55 117.35 2gre h SER 330 Ca 0.23 0.04 0.05 0.00 -1.23 0.00 0.00 61.79 60.88 2gre h SER 330 Cb 0.35 0.01 -0.06 0.00 -0.44 0.00 0.00 62.40 62.27 2gre h SER 330 CO -0.47 0.15 0.54 0.40 -0.53 0.00 0.00 176.83 176.93 2gre h ILE 331 N 0.35 1.08 -0.13 2.23 2.04 -0.90 0.14 117.51 122.32 2gre h ILE 331 Ca 0.19 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 2gre h ILE 331 Cb 0.15 -0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 36.20 2gre h ILE 331 CO -0.17 0.19 -0.00 0.00 0.00 0.00 0.00 178.15 178.16 2gre h ALA 332 N 1.39 0.17 -0.50 1.87 0.00 -0.55 0.27 119.26 121.91 2gre h ALA 332 Ca 0.36 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 55.10 2gre h ALA 332 Cb 0.11 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2gre h ALA 332 CO -0.15 -0.14 0.31 0.45 0.00 0.00 0.00 179.25 179.72 2gre h HIS 333 N -0.04 0.58 -0.05 0.00 3.86 -0.72 -0.94 115.15 117.85 2gre h HIS 333 Ca 0.04 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.28 2gre h HIS 333 Cb 0.36 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 28.62 2gre h HIS 333 CO 0.03 0.35 -0.05 1.15 0.86 0.00 0.00 177.93 180.27 2gre h THR 334 N 0.63 0.85 -0.81 2.45 2.02 -0.32 -0.97 112.91 116.76 2gre h THR 334 Ca 0.19 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.55 2gre h THR 334 Cb -0.02 0.85 -0.11 0.00 -1.74 0.00 0.00 68.15 67.13 2gre h THR 334 CO -0.07 0.00 0.29 -0.33 0.37 0.00 0.00 175.52 175.78 2gre h GLU 335 N -0.07 0.36 0.00 6.66 5.08 -0.22 -0.79 114.58 125.59 2gre h GLU 335 Ca 0.04 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2gre h GLU 335 Cb 0.13 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2gre h GLU 335 CO -0.09 0.24 -0.00 0.00 -1.00 0.00 0.00 179.01 178.16 2gre h ALA 336 N 1.64 -0.00 0.09 3.43 0.00 -0.31 -1.74 119.26 122.37 2gre h ALA 336 Ca 0.48 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.29 2gre h ALA 336 Cb 0.83 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2gre h ALA 336 CO -0.50 -0.39 -0.19 1.25 0.00 0.00 0.00 179.25 179.43 2gre h LEU 337 N -0.23 -0.52 -1.25 0.00 6.46 -0.53 0.21 115.31 119.45 2gre h LEU 337 Ca -0.00 0.06 0.15 0.00 -0.12 0.00 0.00 57.88 57.97 2gre h LEU 337 Cb 0.23 0.20 -0.07 0.00 -0.73 0.00 0.00 40.66 40.28 2gre h LEU 337 CO 0.00 -0.26 0.58 0.58 -0.62 0.00 0.00 178.44 178.72 2gre h VAL 338 N -0.35 0.82 0.31 1.05 2.07 -1.17 0.30 116.25 119.28 2gre h VAL 338 Ca 0.03 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 2gre h VAL 338 Cb 0.38 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 2gre h VAL 338 CO -0.11 0.13 -0.15 0.22 0.02 0.00 0.00 177.57 177.68 2gre h TYR 339 N 0.71 -0.39 -0.43 1.57 5.03 -0.27 -2.41 116.97 120.78 2gre h TYR 339 Ca 0.46 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.76 2gre h TYR 339 Cb 0.74 0.13 -0.02 0.00 1.55 0.00 0.00 36.73 39.13 2gre h TYR 339 CO -0.00 -0.05 0.23 0.00 -1.32 0.00 0.00 178.16 177.02 2gre h ALA 340 N -0.29 1.60 0.76 1.82 0.00 -0.02 -2.79 119.26 120.36 2gre h ALA 340 Ca -0.04 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 2gre h ALA 340 Cb 0.51 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.13 2gre h ALA 340 CO 0.07 0.34 -0.37 -0.92 0.00 0.00 0.00 179.25 178.37 2gre h TYR 341 N 0.60 -0.95 0.00 0.00 5.03 -0.45 -2.29 116.97 118.91 2gre h TYR 341 Ca 0.15 -0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.44 2gre h TYR 341 Cb 0.02 0.31 0.00 0.00 1.55 0.00 0.00 36.73 38.61 2gre h TYR 341 CO 0.00 -0.59 0.00 1.55 -1.32 0.00 0.00 178.16 177.80 2gre n VAL 342 N -5.30 0.00 -0.38 1.81 3.14 -0.91 -4.66 118.33 112.04 2gre n VAL 342 Ca -0.13 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.25 2gre n VAL 342 Cb 0.40 -0.22 -0.00 0.00 -1.06 0.00 0.00 33.84 32.96 2gre n VAL 342 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 2gre n SER 344 N 0.75 -0.01 -4.90 6.55 3.41 -0.86 -4.44 113.62 114.12 2gre n SER 344 Ca 0.00 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.33 2gre n SER 344 Cb 0.00 -1.25 -0.02 0.00 -0.26 0.00 0.00 64.21 62.68 2gre n SER 344 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2gre s ASN 345 N -2.51 6.39 0.41 4.04 0.02 -1.26 -4.84 114.94 117.19 2gre s ASN 345 Ca 0.00 0.84 -0.26 0.00 -1.02 0.00 0.00 52.86 52.41 2gre s ASN 345 Cb 0.00 -2.20 -0.10 0.00 0.02 0.00 0.00 41.25 38.97 2gre s ASN 345 CO 0.00 -0.37 1.36 0.18 0.02 0.00 0.00 177.10 178.29 2gre n LEU 346 N -1.52 4.37 -4.60 0.60 4.77 -1.26 -4.85 117.00 114.51 2gre n LEU 346 Ca -0.01 1.15 -0.52 0.00 -0.03 0.00 0.00 56.01 56.61 2gre n LEU 346 Cb 0.55 -1.55 -0.06 0.00 -2.33 0.00 0.00 43.42 40.03 2gre n LEU 346 CO 0.49 -0.34 0.94 2.30 -1.33 0.00 0.00 177.39 179.46 2gre n ILE 347 N 0.01 0.01 0.00 -0.08 -6.64 -1.26 -5.23 119.36 106.17 2gre n ILE 347 Ca 0.05 -0.00 0.00 0.00 -1.77 0.00 0.00 62.75 61.03 2gre n ILE 347 Cb 0.39 -0.89 0.00 0.00 -1.44 0.00 0.00 39.64 37.70 2gre n ILE 347 CO 0.00 0.00 0.00 -1.84 -1.77 0.00 0.00 176.55 172.94