#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gre h HIS 3 N 0.00 -1.31 0.00 0.00 3.86 -2.06 -3.04 115.15 112.60 2gre h HIS 3 Ca 0.00 0.10 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 2gre h HIS 3 Cb 0.00 0.69 0.00 0.00 1.06 0.00 0.00 27.41 29.16 2gre h HIS 3 CO 0.00 -0.40 -0.70 -2.39 0.86 0.00 0.00 177.93 175.30 2gre n HIS 4 N -5.40 0.00 -0.06 2.45 -0.00 -1.26 -4.47 115.22 106.48 2gre n HIS 4 Ca 0.05 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.67 2gre n HIS 4 Cb 0.35 -0.03 -0.04 0.00 -0.00 0.00 0.00 29.99 30.27 2gre n HIS 4 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.34 177.49 2gre h THR 5 N 0.00 1.15 -0.77 0.61 2.02 -1.97 -2.58 112.91 111.36 2gre h THR 5 Ca 0.00 -0.44 0.14 0.00 0.77 0.00 0.00 66.41 66.88 2gre h THR 5 Cb 0.32 1.06 -0.09 0.00 -1.74 0.00 0.00 68.15 67.70 2gre h THR 5 CO 0.00 0.14 0.35 0.50 0.37 0.00 0.00 175.52 176.88 2gre h LYS 6 N 0.19 0.50 -0.47 6.66 3.64 -1.76 -1.86 116.57 123.48 2gre h LYS 6 Ca 0.07 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.37 2gre h LYS 6 Cb 0.14 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 2gre h LYS 6 CO -0.01 0.33 0.11 0.93 -2.27 0.00 0.00 179.45 178.55 2gre h GLU 7 N 0.52 0.75 -0.67 1.90 5.08 -1.79 0.60 114.58 120.97 2gre h GLU 7 Ca 0.42 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 2gre h GLU 7 Cb 0.59 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2gre h GLU 7 CO -0.37 0.74 0.00 2.41 -1.00 0.00 0.00 179.01 180.79 2gre n THR 8 N -4.49 0.00 0.00 1.13 -1.04 -0.70 -1.08 114.28 108.10 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 0.22 -0.14 0.00 0.00 -1.82 0.00 0.00 70.33 68.59 2gre n THR 8 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 2gre n GLU 10 N 0.56 0.00 -0.02 -2.82 4.07 0.20 -1.93 120.64 120.70 2gre n GLU 10 Ca 0.00 0.00 -0.09 0.00 -0.06 0.00 0.00 57.16 57.01 2gre n GLU 10 Cb 0.00 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.35 2gre n GLU 10 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 2gre h LEU 11 N 0.00 -0.30 -0.16 4.31 5.85 -1.39 -0.35 115.31 123.27 2gre h LEU 11 Ca 0.00 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.83 2gre h LEU 11 Cb 0.00 0.16 -0.07 0.00 0.37 0.00 0.00 40.66 41.12 2gre h LEU 11 CO 0.00 -0.12 -0.44 0.40 -0.34 0.00 0.00 178.44 177.94 2gre h ILE 12 N -0.08 0.12 -0.94 4.05 2.04 -1.65 0.24 117.51 121.28 2gre h ILE 12 Ca 0.09 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.11 2gre h ILE 12 Cb 0.22 0.12 -0.08 0.00 -0.74 0.00 0.00 36.82 36.34 2gre h ILE 12 CO -0.21 0.00 0.60 0.50 0.00 0.00 0.00 178.15 179.03 2gre h LYS 13 N -0.49 0.71 -0.03 2.37 3.64 -1.78 0.35 116.57 121.34 2gre h LYS 13 Ca 0.07 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2gre h LYS 13 Cb 0.63 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.29 2gre h LYS 13 CO -0.42 0.47 0.02 1.49 -2.27 0.00 0.00 179.45 178.74 2gre h GLU 14 N 0.73 0.04 -0.16 1.90 4.81 0.11 -2.14 114.58 119.87 2gre h GLU 14 Ca 0.49 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.71 2gre h GLU 14 Cb 0.78 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 2gre h GLU 14 CO -0.25 0.10 0.07 -0.07 -0.73 0.00 0.00 179.01 178.12 2gre h LEU 15 N -0.02 0.21 -2.39 1.64 3.38 0.09 -2.65 115.31 115.57 2gre h LEU 15 Ca 0.01 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.86 2gre h LEU 15 Cb 0.07 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 2gre h LEU 15 CO -0.00 0.30 0.16 0.58 0.09 0.00 0.00 178.44 179.56 2gre h VAL 16 N 0.11 0.30 -0.01 1.22 2.07 -0.29 0.10 116.25 119.75 2gre h VAL 16 Ca 0.05 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.57 2gre h VAL 16 Cb 0.15 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 2gre h VAL 16 CO -0.01 0.00 -0.14 -1.20 0.02 0.00 0.00 177.57 176.25 2gre n SER 17 N -3.50 0.65 -4.42 0.57 7.64 -0.81 -4.56 113.62 109.19 2gre n SER 17 Ca -0.00 -0.71 -0.37 0.00 1.01 0.00 0.00 58.87 58.79 2gre n SER 17 Cb 0.25 -0.02 -0.12 0.00 -1.01 0.00 0.00 64.21 63.31 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 -2.44 4.34 0.40 0.44 1.01 0.35 -5.06 121.20 120.22 2gre s ILE 18 Ca 0.29 -0.37 -0.27 0.00 0.00 0.00 0.00 60.65 60.30 2gre s ILE 18 Cb 0.20 -3.14 -0.10 0.00 0.01 0.00 0.00 42.46 39.44 2gre s ILE 18 CO 0.48 0.19 1.43 -2.84 0.00 0.00 0.00 174.94 174.19 2gre s PRO 19 N 1.59 3.98 -0.45 2.79 0.02 -1.26 -4.96 135.00 136.71 2gre s PRO 19 Ca 0.05 2.44 0.07 0.00 0.02 0.00 0.00 61.00 63.58 2gre s PRO 19 Cb -0.16 -2.85 0.29 0.00 0.02 0.00 0.00 34.50 31.79 2gre s PRO 19 CO 0.04 -0.59 0.92 -1.13 -0.33 0.00 0.00 177.00 175.92 2gre n SER 20 N 0.24 -1.88 -4.79 2.53 3.41 -1.26 -4.69 113.62 107.18 2gre n SER 20 Ca 0.02 -3.37 -0.34 0.00 -0.26 0.00 0.00 58.87 54.93 2gre n SER 20 Cb 0.41 1.31 -0.01 0.00 -0.26 0.00 0.00 64.21 65.65 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 -0.07 3.54 -0.14 4.33 0.04 -1.24 -2.50 135.00 138.96 2gre s PRO 21 Ca 0.29 1.42 -0.41 0.00 0.04 0.00 0.00 61.00 62.35 2gre s PRO 21 Cb 0.26 -2.05 -0.18 0.00 0.04 0.00 0.00 34.50 32.57 2gre s PRO 21 CO -0.13 -0.66 1.38 0.45 0.04 0.00 0.00 177.00 178.08 2gre n SER 22 N -1.28 1.10 0.00 6.66 2.88 -0.99 0.07 113.62 122.06 2gre n SER 22 Ca 0.10 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.78 2gre n SER 22 Cb 0.52 -1.02 0.00 0.00 -0.75 0.00 0.00 64.21 62.96 2gre n SER 22 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2gre n GLY 23 N 2.80 3.12 2.24 0.46 0.00 -1.26 -4.94 105.19 107.61 2gre n GLY 23 Ca 0.23 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.09 -0.37 1.61 5.15 0.11 -4.90 115.26 116.77 2gre n ASN 24 Ca 0.00 -2.74 0.05 0.00 -0.60 0.00 0.00 54.58 51.29 2gre n ASN 24 Cb 0.00 -0.43 0.04 0.00 -0.53 0.00 0.00 39.78 38.85 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 1.43 0.00 -0.22 -0.44 -2.24 -1.25 -3.72 114.28 107.84 2gre n THR 25 Ca 0.20 -0.49 0.02 0.00 -2.27 0.00 0.00 64.05 61.52 2gre n THR 25 Cb 0.54 1.19 0.12 0.00 -2.10 0.00 0.00 70.33 70.08 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 1.91 0.67 -0.84 6.98 0.00 -1.93 -1.45 119.26 124.61 2gre h ALA 26 Ca 0.00 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2gre h ALA 26 Cb 0.40 0.36 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 2gre h ALA 26 CO 0.00 -0.40 0.48 -0.22 0.00 0.00 0.00 179.25 179.11 2gre h LYS 27 N 0.12 1.15 0.04 0.00 3.64 -1.90 0.45 116.57 120.07 2gre h LYS 27 Ca 0.36 -0.12 -0.27 0.00 -1.27 0.00 0.00 60.65 59.35 2gre h LYS 27 Cb 0.59 -0.23 0.02 0.00 -0.41 0.00 0.00 32.23 32.20 2gre h LYS 27 CO -0.58 0.82 -1.09 0.97 -2.27 0.00 0.00 179.45 177.31 2gre h ILE 28 N 1.16 1.31 -0.69 2.00 2.10 -1.74 -1.71 117.51 119.95 2gre h ILE 28 Ca 0.30 -2.36 -0.03 0.00 1.08 0.00 0.00 64.86 63.84 2gre h ILE 28 Cb -0.01 2.49 -0.03 0.00 -1.09 0.00 0.00 36.82 38.17 2gre h ILE 28 CO -0.05 0.72 0.29 0.40 -1.08 0.00 0.00 178.15 178.43 2gre h ILE 29 N 0.33 1.23 -0.16 2.19 1.08 -0.59 0.12 117.51 121.71 2gre h ILE 29 Ca -0.14 -0.70 0.03 0.00 -0.39 0.00 0.00 64.86 63.67 2gre h ILE 29 Cb 1.74 0.39 -0.03 0.00 -3.07 0.00 0.00 36.82 35.86 2gre h ILE 29 CO 0.21 0.28 -0.03 0.78 -0.69 0.00 0.00 178.15 178.70 2gre h ASN 30 N 0.98 -0.13 -0.93 1.72 -0.26 -0.89 -0.55 115.58 115.52 2gre h ASN 30 Ca 0.23 0.04 0.09 0.00 -0.56 0.00 0.00 56.30 56.11 2gre h ASN 30 Cb 0.16 0.09 -0.07 0.00 -1.06 0.00 0.00 38.32 37.43 2gre h ASN 30 CO -0.02 -0.04 0.58 0.15 -1.06 0.00 0.00 177.43 177.03 2gre h PHE 31 N 0.01 1.05 -0.35 1.19 3.04 -0.16 -0.37 116.94 121.36 2gre h PHE 31 Ca 0.08 0.03 -0.09 0.00 3.98 0.00 0.00 57.97 61.96 2gre h PHE 31 Cb 0.11 -0.34 -0.01 0.00 2.56 0.00 0.00 35.95 38.28 2gre h PHE 31 CO -0.18 0.47 -0.15 0.82 -2.02 0.00 0.00 178.31 177.25 2gre h ILE 32 N 0.98 1.28 -0.34 1.41 2.04 -0.48 -3.00 117.51 119.40 2gre h ILE 32 Ca 0.44 -1.26 0.01 0.00 1.00 0.00 0.00 64.86 65.05 2gre h ILE 32 Cb 0.33 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 2gre h ILE 32 CO -0.23 0.41 0.20 -0.33 0.00 0.00 0.00 178.15 178.20 2gre h GLU 33 N 0.51 0.39 -1.58 2.37 5.08 0.10 -2.25 114.58 119.20 2gre h GLU 33 Ca 0.08 -0.02 -0.15 0.00 -1.00 0.00 0.00 59.36 58.27 2gre h GLU 33 Cb 0.68 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.77 2gre h GLU 33 CO 0.05 0.26 0.20 0.09 -1.00 0.00 0.00 179.01 178.60 2gre n ASN 34 N -4.90 5.26 0.00 1.42 4.13 -0.27 -1.40 115.26 119.50 2gre n ASN 34 Ca -0.00 -2.65 0.00 0.00 1.68 0.00 0.00 54.58 53.61 2gre n ASN 34 Cb 0.06 -0.97 0.00 0.00 -1.54 0.00 0.00 39.78 37.32 2gre n ASN 34 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2gre n TYR 35 N 0.73 0.00 0.29 3.10 9.36 -0.87 -4.75 117.16 125.01 2gre n TYR 35 Ca 0.15 0.00 0.04 0.00 3.32 0.00 0.00 57.90 61.41 2gre n TYR 35 Cb 0.60 0.00 0.05 0.00 -0.63 0.00 0.00 39.34 39.35 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 -0.92 0.14 0.34 2.97 0.24 -1.05 -4.66 118.33 115.38 2gre n VAL 36 Ca 0.00 -0.57 0.22 0.00 -2.04 0.00 0.00 64.34 61.95 2gre n VAL 36 Cb 0.13 1.09 1.18 0.00 -1.47 0.00 0.00 33.84 34.76 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 1.65 0.00 0.92 -1.34 4.64 -1.49 -1.45 113.55 116.48 2gre h SER 37 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2gre h SER 37 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2gre h SER 37 CO 0.00 0.00 -1.05 -0.62 -0.87 0.00 0.00 176.83 174.29 2gre n GLU 38 N -3.09 0.59 -1.43 4.77 -0.58 -1.26 -4.96 120.64 114.67 2gre n GLU 38 Ca -0.03 0.10 -0.31 0.00 -0.42 0.00 0.00 57.16 56.51 2gre n GLU 38 Cb 0.10 -1.80 0.08 0.00 -0.57 0.00 0.00 31.44 29.26 2gre n GLU 38 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 2gre s TRP 39 N -3.36 2.78 -2.11 -0.32 0.52 -0.55 -4.94 118.94 110.96 2gre s TRP 39 Ca -0.01 1.36 0.21 0.00 0.02 0.00 0.00 56.10 57.68 2gre s TRP 39 Cb 0.10 -3.03 1.06 0.00 -1.15 0.00 0.00 33.47 30.45 2gre s TRP 39 CO 0.80 -1.70 1.71 0.09 0.02 0.00 0.00 176.95 177.87 2gre n ASN 40 N -3.42 0.59 -4.78 2.95 4.13 -1.26 -4.87 115.26 108.59 2gre n ASN 40 Ca 0.08 -1.48 -0.34 0.00 1.68 0.00 0.00 54.58 54.51 2gre n ASN 40 Cb 0.54 -0.03 -0.01 0.00 -1.54 0.00 0.00 39.78 38.75 2gre n ASN 40 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2gre s VAL 41 N -1.94 3.41 -0.09 2.41 0.11 -1.26 -5.01 120.40 118.04 2gre s VAL 41 Ca 0.31 0.85 -0.14 0.00 -2.93 0.00 0.00 61.98 60.08 2gre s VAL 41 Cb 0.15 -3.34 -0.05 0.00 -1.53 0.00 0.00 36.38 31.62 2gre s VAL 41 CO 0.25 -0.22 0.34 -0.70 -3.33 0.00 0.00 175.10 171.44 2gre s GLU 42 N -3.37 4.04 -0.14 1.54 2.12 -1.12 -4.96 118.70 116.81 2gre s GLU 42 Ca 0.70 0.23 0.00 0.00 0.36 0.00 0.00 54.97 56.26 2gre s GLU 42 Cb -0.21 -3.32 0.02 0.00 0.26 0.00 0.00 34.13 30.88 2gre s GLU 42 CO 0.26 0.46 -0.14 0.99 -0.54 0.00 0.00 175.26 176.30 2gre s THR 43 N -0.26 1.52 -0.16 -1.70 2.01 -1.26 -1.11 115.64 114.69 2gre s THR 43 Ca 0.20 -0.60 -0.02 0.00 0.31 0.00 0.00 61.69 61.58 2gre s THR 43 Cb -0.14 -1.44 0.05 0.00 0.01 0.00 0.00 72.50 70.98 2gre s THR 43 CO 0.08 0.45 0.01 -0.75 -0.69 0.00 0.00 174.62 173.72 2gre s LYS 44 N 1.49 0.80 0.92 4.92 2.20 -0.31 -4.99 119.74 124.76 2gre s LYS 44 Ca 0.05 -0.31 -0.13 0.00 -0.36 0.00 0.00 55.97 55.22 2gre s LYS 44 Cb -0.13 -1.80 0.14 0.00 -1.51 0.00 0.00 37.83 34.54 2gre s LYS 44 CO -0.10 -0.51 1.17 0.50 -0.36 0.00 0.00 175.35 176.05 2gre s ARG 45 N 1.84 1.09 0.24 4.03 3.52 -1.26 -1.38 118.95 127.03 2gre s ARG 45 Ca 0.01 0.14 0.04 0.00 -0.13 0.00 0.00 55.73 55.79 2gre s ARG 45 Cb -0.15 -1.85 -0.05 0.00 -1.56 0.00 0.00 34.95 31.34 2gre s ARG 45 CO -0.07 -2.20 -0.02 1.21 -0.81 0.00 0.00 175.30 173.41 2gre s ASN 46 N -4.25 2.07 0.19 -2.12 3.04 -1.06 -4.92 114.94 107.90 2gre s ASN 46 Ca 0.65 -1.21 -0.07 0.00 0.04 0.00 0.00 52.86 52.26 2gre s ASN 46 Cb -0.12 -0.04 0.12 0.00 -1.54 0.00 0.00 41.25 39.67 2gre s ASN 46 CO 0.53 -0.47 1.63 0.78 -3.04 0.00 0.00 177.10 176.53 2gre h ASN 47 N 2.42 0.96 0.00 -4.21 2.35 -1.98 -2.96 115.58 112.16 2gre h ASN 47 Ca -0.39 -0.30 0.00 0.00 -0.55 0.00 0.00 56.30 55.06 2gre h ASN 47 Cb 1.23 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 39.34 2gre h ASN 47 CO 0.65 1.07 0.00 0.29 -1.65 0.00 0.00 177.43 177.79 2gre n LYS 48 N -4.15 0.92 -0.65 0.81 5.02 -1.26 -4.90 118.16 113.95 2gre n LYS 48 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 2gre n LYS 48 Cb 0.39 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 34.03 2gre n LYS 48 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2gre n GLY 49 N 0.74 0.70 3.92 0.72 0.00 -1.12 -4.97 105.19 105.18 2gre n GLY 49 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.21 3.22 0.03 4.61 0.00 -1.26 -4.76 121.76 121.38 2gre s ALA 50 Ca 0.00 -0.80 0.04 0.00 0.00 0.00 0.00 51.96 51.20 2gre s ALA 50 Cb 0.00 -2.62 -0.04 0.00 0.00 0.00 0.00 23.12 20.47 2gre s ALA 50 CO 0.00 -1.06 -0.04 -0.51 0.00 0.00 0.00 175.76 174.15 2gre s LEU 51 N -5.13 3.30 -0.13 0.00 1.43 -1.02 -2.56 118.68 114.57 2gre s LEU 51 Ca 0.57 -0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.54 2gre s LEU 51 Cb -0.11 -1.95 0.02 0.00 0.03 0.00 0.00 46.19 44.19 2gre s LEU 51 CO 0.45 0.25 -0.15 -0.63 0.23 0.00 0.00 176.35 176.50 2gre s ILE 52 N -1.11 1.54 -0.15 -0.59 1.09 -0.48 -1.01 121.20 120.49 2gre s ILE 52 Ca 0.20 -0.64 -0.02 0.00 -1.10 0.00 0.00 60.65 59.09 2gre s ILE 52 Cb -0.11 -1.43 -0.02 0.00 -1.06 0.00 0.00 42.46 39.84 2gre s ILE 52 CO 0.11 0.45 -0.07 -0.76 -0.10 0.00 0.00 174.94 174.57 2gre s LEU 53 N 1.24 3.00 -0.05 2.97 1.43 0.01 -1.16 118.68 126.12 2gre s LEU 53 Ca -0.01 -0.24 0.06 0.00 -1.03 0.00 0.00 54.13 52.92 2gre s LEU 53 Cb -0.14 -1.71 -0.01 0.00 0.03 0.00 0.00 46.19 44.36 2gre s LEU 53 CO -0.06 0.15 -0.25 -0.89 0.23 0.00 0.00 176.35 175.52 2gre s THR 54 N 0.48 2.05 -0.19 5.49 2.01 -0.27 0.11 115.64 125.32 2gre s THR 54 Ca -0.06 -1.07 0.00 0.00 0.31 0.00 0.00 61.69 60.87 2gre s THR 54 Cb -0.15 -1.72 0.04 0.00 0.01 0.00 0.00 72.50 70.68 2gre s THR 54 CO 0.03 0.57 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.76 2gre s VAL 55 N -0.26 1.45 0.23 3.82 1.01 0.39 -2.78 120.40 124.26 2gre s VAL 55 Ca -0.01 -0.87 -0.30 0.00 0.00 0.00 0.00 61.98 60.80 2gre s VAL 55 Cb -0.13 -1.56 -0.09 0.00 0.00 0.00 0.00 36.38 34.60 2gre s VAL 55 CO 0.03 0.16 1.31 -0.54 0.00 0.00 0.00 175.10 176.05 2gre s LYS 56 N 1.48 4.39 0.00 2.72 -0.14 -1.26 -0.70 119.74 126.23 2gre s LYS 56 Ca -0.01 2.09 0.00 0.00 -1.36 0.00 0.00 55.97 56.69 2gre s LYS 56 Cb -0.16 -3.17 0.00 0.00 -1.68 0.00 0.00 37.83 32.82 2gre s LYS 56 CO -0.08 -0.23 0.00 0.41 -0.76 0.00 0.00 175.35 174.68 2gre n GLY 57 N 2.06 1.64 0.08 -3.33 0.00 -1.23 -4.69 105.19 99.72 2gre n GLY 57 Ca 0.05 -1.86 -0.10 0.00 0.00 0.00 0.00 46.02 44.10 2gre n GLY 57 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gre h LYS 58 N 0.00 -0.06 -5.79 1.61 1.79 -0.96 -3.44 116.57 109.73 2gre h LYS 58 Ca 0.00 0.00 -0.58 0.00 -2.18 0.00 0.00 60.65 57.89 2gre h LYS 58 Cb 0.00 0.01 -0.08 0.00 -1.58 0.00 0.00 32.23 30.58 2gre h LYS 58 CO 0.00 0.55 0.15 1.21 -1.08 0.00 0.00 179.45 180.29 2gre s ASN 59 N -5.84 6.79 0.00 0.86 3.84 0.01 -4.94 114.94 115.66 2gre s ASN 59 Ca -0.13 0.96 0.06 0.00 0.21 0.00 0.00 52.86 53.96 2gre s ASN 59 Cb -0.01 -2.38 0.17 0.00 -0.55 0.00 0.00 41.25 38.48 2gre s ASN 59 CO 0.50 -0.26 1.13 -0.67 -2.79 0.00 0.00 177.10 175.01 2gre n ASP 60 N 4.79 2.49 -0.86 -4.21 4.64 -1.26 -1.65 116.55 120.48 2gre n ASP 60 Ca -0.00 -1.97 0.10 0.00 -1.38 0.00 0.00 54.79 51.53 2gre n ASP 60 Cb 0.50 -0.13 0.12 0.00 -1.04 0.00 0.00 41.12 40.57 2gre n ASP 60 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2gre n ALA 61 N 0.08 2.44 -3.49 -1.67 0.00 -1.26 -4.80 120.51 111.81 2gre n ALA 61 Ca 0.06 -0.77 -0.24 0.00 0.00 0.00 0.00 53.44 52.50 2gre n ALA 61 Cb 0.34 -0.69 -0.13 0.00 0.00 0.00 0.00 19.45 18.97 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 -1.54 0.24 0.35 0.00 -0.21 -1.26 -4.88 119.66 112.36 2gre s GLN 62 Ca 0.27 -0.34 0.01 0.00 0.02 0.00 0.00 55.36 55.32 2gre s GLN 62 Cb 0.18 -0.99 -0.03 0.00 1.00 0.00 0.00 33.01 33.17 2gre s GLN 62 CO 0.26 -1.00 0.54 -1.01 -2.12 0.00 0.00 175.29 171.96 2gre s HIS 63 N 2.21 3.42 0.21 0.91 3.76 0.16 -4.31 115.29 121.64 2gre s HIS 63 Ca 0.09 0.24 0.11 0.00 -0.15 0.00 0.00 55.06 55.34 2gre s HIS 63 Cb -0.15 -1.93 -0.04 0.00 1.11 0.00 0.00 32.58 31.56 2gre s HIS 63 CO -0.34 0.07 -0.21 0.50 -0.85 0.00 0.00 174.74 173.91 2gre s ARG 64 N -4.30 1.48 -0.03 1.40 6.06 0.14 -0.49 118.95 123.21 2gre s ARG 64 Ca 0.41 -1.55 -0.01 0.00 -2.50 0.00 0.00 55.73 52.08 2gre s ARG 64 Cb -0.10 -1.66 0.03 0.00 0.06 0.00 0.00 34.95 33.28 2gre s ARG 64 CO 0.35 0.34 0.04 -1.17 -2.50 0.00 0.00 175.30 172.37 2gre s LEU 65 N -2.88 0.54 0.04 -0.88 1.98 -1.08 -0.55 118.68 115.86 2gre s LEU 65 Ca 0.22 0.05 0.03 0.00 -2.89 0.00 0.00 54.13 51.53 2gre s LEU 65 Cb -0.06 -0.13 -0.04 0.00 0.66 0.00 0.00 46.19 46.62 2gre s LEU 65 CO 0.10 -0.20 0.02 -0.76 -1.89 0.00 0.00 176.35 173.62 2gre s LEU 66 N 1.71 3.57 0.02 -0.68 2.01 0.14 -1.68 118.68 123.77 2gre s LEU 66 Ca -0.01 -0.05 0.00 0.00 0.01 0.00 0.00 54.13 54.09 2gre s LEU 66 Cb -0.12 -2.17 -0.02 0.00 0.01 0.00 0.00 46.19 43.89 2gre s LEU 66 CO -0.03 0.23 -0.03 0.28 1.01 0.00 0.00 176.35 177.81 2gre s THR 67 N -1.21 0.13 -0.10 5.49 -1.32 -0.63 0.17 115.64 118.18 2gre s THR 67 Ca 0.23 -0.69 -0.15 0.00 -1.21 0.00 0.00 61.69 59.88 2gre s THR 67 Cb -0.12 -0.23 0.04 0.00 -1.51 0.00 0.00 72.50 70.67 2gre s THR 67 CO 0.15 -0.35 0.38 0.00 -2.21 0.00 0.00 174.62 172.59 2gre s ALA 68 N -1.06 -0.95 0.06 11.08 0.00 -0.80 -0.72 121.76 129.37 2gre s ALA 68 Ca -0.11 0.87 0.01 0.00 0.00 0.00 0.00 51.96 52.73 2gre s ALA 68 Cb -0.07 -0.38 -0.04 0.00 0.00 0.00 0.00 23.12 22.62 2gre s ALA 68 CO -0.01 -0.22 0.14 -3.38 0.00 0.00 0.00 175.76 172.30 2gre s HIS 69 N -0.36 3.36 -0.46 0.00 -3.43 -1.26 -1.37 115.29 111.78 2gre s HIS 69 Ca -0.05 0.18 0.16 0.00 -0.80 0.00 0.00 55.06 54.55 2gre s HIS 69 Cb -0.03 -1.70 -0.21 0.00 -1.43 0.00 0.00 32.58 29.21 2gre s HIS 69 CO 0.02 0.56 0.55 1.33 -2.00 0.00 0.00 174.74 175.20 2gre n VAL 70 N 0.44 0.00 -1.38 -5.38 0.24 -0.14 -4.39 118.33 107.72 2gre n VAL 70 Ca -0.07 -0.22 -0.30 0.00 -2.04 0.00 0.00 64.34 61.70 2gre n VAL 70 Cb 0.51 0.65 0.10 0.00 -1.47 0.00 0.00 33.84 33.63 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 -3.05 4.37 0.08 -1.34 -4.77 -1.26 -4.79 116.67 105.90 2gre s ASP 71 Ca 0.01 1.55 -0.08 0.00 -3.30 0.00 0.00 52.55 50.73 2gre s ASP 71 Cb 0.11 -2.29 -0.00 0.00 -1.09 0.00 0.00 42.92 39.65 2gre s ASP 71 CO 0.66 -2.08 0.17 0.28 0.70 0.00 0.00 175.17 174.90 2gre s THR 72 N -3.01 0.14 0.41 2.11 -1.32 -1.04 -4.84 115.64 108.10 2gre s THR 72 Ca 0.61 -1.18 -0.26 0.00 -1.21 0.00 0.00 61.69 59.64 2gre s THR 72 Cb -0.16 -1.27 -0.10 0.00 -1.51 0.00 0.00 72.50 69.46 2gre s THR 72 CO 0.56 -0.65 1.40 0.18 -2.21 0.00 0.00 174.62 173.90 2gre n LEU 73 N 0.10 4.64 0.00 9.08 4.77 -1.26 -2.34 117.00 131.99 2gre n LEU 73 Ca -0.16 1.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.98 2gre n LEU 73 Cb 0.62 -1.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.13 2gre n LEU 73 CO 0.23 -0.19 0.00 0.61 -1.33 0.00 0.00 177.39 176.71 2gre n GLY 74 N 0.60 3.14 0.00 -0.72 0.00 -0.37 -4.73 105.19 103.11 2gre n GLY 74 Ca 0.04 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.42 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 -3.00 0.00 -3.18 4.61 0.00 -0.54 0.21 120.51 118.61 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 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 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 -0.05 3.97 -0.23 0.00 1.01 -0.30 -0.27 120.40 124.52 2gre s VAL 77 Ca 0.00 -0.30 0.01 0.00 0.00 0.00 0.00 61.98 61.70 2gre s VAL 77 Cb 0.00 -2.82 -0.15 0.00 0.00 0.00 0.00 36.38 33.41 2gre s VAL 77 CO 0.00 0.39 -0.21 1.17 0.00 0.00 0.00 175.10 176.45 2gre n LYS 78 N 4.65 0.57 -3.69 2.72 4.81 0.40 -1.39 118.16 126.23 2gre n LYS 78 Ca -0.17 0.14 -0.14 0.00 -0.87 0.00 0.00 58.31 57.27 2gre n LYS 78 Cb 0.51 -1.46 -0.09 0.00 0.02 0.00 0.00 35.03 34.02 2gre n LYS 78 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 2gre s GLU 79 N -2.46 0.66 -0.28 1.64 2.12 -1.05 -4.90 118.70 114.42 2gre s GLU 79 Ca -0.31 0.46 -0.20 0.00 0.36 0.00 0.00 54.97 55.28 2gre s GLU 79 Cb 0.08 0.31 -0.01 0.00 0.26 0.00 0.00 34.13 34.77 2gre s GLU 79 CO 0.53 -0.12 0.64 0.42 -0.54 0.00 0.00 175.26 176.18 2gre s ILE 80 N -0.23 4.95 0.32 -3.70 1.01 -1.26 -0.17 121.20 122.11 2gre s ILE 80 Ca -0.04 1.01 -0.15 0.00 0.00 0.00 0.00 60.65 61.47 2gre s ILE 80 Cb -0.03 -3.97 -0.09 0.00 0.01 0.00 0.00 42.46 38.37 2gre s ILE 80 CO 0.03 -0.06 0.74 -0.54 0.00 0.00 0.00 174.94 175.10 2gre s LYS 81 N 2.58 4.02 0.39 2.79 1.02 0.40 -4.86 119.74 126.07 2gre s LYS 81 Ca 0.26 0.69 0.20 0.00 0.02 0.00 0.00 55.97 57.14 2gre s LYS 81 Cb -0.15 -2.45 1.17 0.00 -0.52 0.00 0.00 37.83 35.88 2gre s LYS 81 CO 0.10 0.16 1.69 -1.00 -0.92 0.00 0.00 175.35 175.39 2gre h PRO 82 N 2.31 0.29 0.00 -1.68 0.13 -1.96 1.65 132.00 132.74 2gre h PRO 82 Ca -0.48 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2gre h PRO 82 Cb 1.18 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2gre h PRO 82 CO 0.65 0.19 0.00 -0.40 -0.23 0.00 0.00 178.00 178.22 2gre n ASP 83 N -4.80 0.00 0.00 1.44 5.68 -1.26 -3.32 116.55 114.29 2gre n ASP 83 Ca 0.31 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.60 2gre n ASP 83 Cb 1.05 -0.31 0.00 0.00 -1.14 0.00 0.00 41.12 40.72 2gre n ASP 83 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2gre n GLY 84 N 0.91 0.67 3.76 6.12 0.00 0.56 -3.73 105.19 113.47 2gre n GLY 84 Ca 0.11 0.00 -0.37 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 -0.77 3.30 -0.04 1.61 1.81 -1.25 -4.73 118.95 118.87 2gre s ARG 85 Ca 0.00 1.93 -0.05 0.00 -1.72 0.00 0.00 55.73 55.89 2gre s ARG 85 Cb 0.00 -2.19 -0.04 0.00 -0.45 0.00 0.00 34.95 32.27 2gre s ARG 85 CO 0.00 -0.97 0.18 -0.51 -0.68 0.00 0.00 175.30 173.32 2gre s LEU 86 N -3.54 4.38 0.06 2.53 1.02 -0.54 -0.45 118.68 122.14 2gre s LEU 86 Ca 0.71 0.42 0.07 0.00 0.02 0.00 0.00 54.13 55.35 2gre s LEU 86 Cb -0.33 -2.45 -0.04 0.00 0.02 0.00 0.00 46.19 43.40 2gre s LEU 86 CO 0.38 0.31 -0.15 -0.94 0.02 0.00 0.00 176.35 175.97 2gre s SER 87 N -1.60 4.03 0.15 2.29 1.04 0.76 0.26 113.70 120.62 2gre s SER 87 Ca 0.23 -0.41 0.08 0.00 0.48 0.00 0.00 55.95 56.33 2gre s SER 87 Cb -0.13 -0.69 -0.04 0.00 0.10 0.00 0.00 66.02 65.26 2gre s SER 87 CO 0.13 0.23 -0.07 -0.76 0.98 0.00 0.00 173.24 173.75 2gre s LEU 88 N -1.73 3.10 0.00 2.42 1.43 -1.24 0.15 118.68 122.81 2gre s LEU 88 Ca 0.17 -0.46 0.00 0.00 -1.03 0.00 0.00 54.13 52.81 2gre s LEU 88 Cb -0.11 -1.81 0.00 0.00 0.03 0.00 0.00 46.19 44.31 2gre s LEU 88 CO 0.08 0.12 0.00 -0.24 0.23 0.00 0.00 176.35 176.54 2gre n SER 89 N 0.21 0.00 -3.62 2.29 2.88 -1.26 -4.73 113.62 109.39 2gre n SER 89 Ca -0.11 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.34 2gre n SER 89 Cb 0.54 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.91 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 4.01 -0.65 0.00 2.46 -1.09 0.13 -4.39 121.20 121.67 2gre s ILE 91 Ca 0.00 0.14 0.00 0.00 -2.23 0.00 0.00 60.65 58.56 2gre s ILE 91 Cb 0.00 -0.69 0.00 0.00 -1.58 0.00 0.00 42.46 40.19 2gre s ILE 91 CO 0.00 0.05 0.00 0.61 -1.23 0.00 0.00 174.94 174.37 2gre n GLY 92 N 5.39 -1.75 2.88 6.18 0.00 -1.26 -1.23 105.19 115.39 2gre n GLY 92 Ca -0.08 -1.95 -0.29 0.00 0.00 0.00 0.00 46.02 43.70 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 -0.15 1.00 0.33 -0.02 0.00 -1.26 -5.02 107.32 102.20 2gre s GLY 93 Ca 0.00 -0.94 -0.18 0.00 0.00 0.00 0.00 44.72 43.60 2gre s GLY 93 CO 0.00 1.02 0.74 -0.11 0.00 0.00 0.00 173.10 174.74 2gre s PHE 94 N 1.61 0.00 0.05 1.90 -0.71 -1.26 -5.12 117.98 114.46 2gre s PHE 94 Ca -0.01 -0.56 -0.15 0.00 -1.04 0.00 0.00 56.93 55.16 2gre s PHE 94 Cb -0.16 0.73 -0.06 0.00 -1.21 0.00 0.00 43.02 42.32 2gre s PHE 94 CO -0.07 -1.39 0.47 1.03 -1.34 0.00 0.00 175.22 173.92 2gre s ARG 95 N -3.15 3.99 0.35 1.99 0.52 -1.26 -4.99 118.95 116.40 2gre s ARG 95 Ca 0.14 0.49 0.10 0.00 -0.52 0.00 0.00 55.73 55.94 2gre s ARG 95 Cb -0.05 -3.16 0.65 0.00 0.52 0.00 0.00 34.95 32.91 2gre s ARG 95 CO 0.09 0.63 1.81 -1.49 0.02 0.00 0.00 175.30 176.37 2gre h TRP 96 N 4.39 0.17 -0.84 -0.53 4.06 -2.01 -3.03 115.95 118.16 2gre h TRP 96 Ca -0.50 -0.03 0.16 0.00 2.06 0.00 0.00 58.89 60.57 2gre h TRP 96 Cb 1.21 -0.04 -0.15 0.00 -1.00 0.00 0.00 29.16 29.18 2gre h TRP 96 CO 0.69 0.45 -0.23 0.09 -3.56 0.00 0.00 178.44 175.87 2gre n ASN 97 N -4.13 -0.35 0.00 -3.49 3.02 -1.26 -1.27 115.26 107.78 2gre n ASN 97 Ca -0.01 1.44 0.10 0.00 -0.03 0.00 0.00 54.58 56.08 2gre n ASN 97 Cb 0.39 -0.41 0.60 0.00 -0.61 0.00 0.00 39.78 39.75 2gre n ASN 97 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2gre n SER 98 N -5.33 0.00 0.00 6.41 3.41 -1.14 -2.35 113.62 114.61 2gre n SER 98 Ca 0.12 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.89 2gre n SER 98 Cb 0.40 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.35 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 -0.93 0.82 -2.23 -3.33 0.24 -0.40 -4.89 118.33 107.61 2gre n VAL 99 Ca 0.15 -0.90 -0.41 0.00 -2.04 0.00 0.00 64.34 61.14 2gre n VAL 99 Cb 0.07 0.60 -0.03 0.00 -1.47 0.00 0.00 33.84 33.01 2gre n VAL 99 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2gre s GLU 100 N -0.82 4.39 0.00 7.34 2.12 -0.99 -2.11 118.70 128.62 2gre s GLU 100 Ca 0.00 2.03 0.00 0.00 0.36 0.00 0.00 54.97 57.36 2gre s GLU 100 Cb 0.00 -3.21 0.00 0.00 0.26 0.00 0.00 34.13 31.18 2gre s GLU 100 CO 0.00 -0.27 0.00 0.41 -0.54 0.00 0.00 175.26 174.86 2gre n GLY 101 N 2.52 0.39 3.77 -1.50 0.00 0.17 -5.01 105.19 105.53 2gre n GLY 101 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.70 4.45 0.58 1.61 2.02 -0.90 -4.76 118.70 120.99 2gre s GLU 102 Ca 0.00 1.60 -0.15 0.00 0.02 0.00 0.00 54.97 56.45 2gre s GLU 102 Cb 0.00 -2.88 -0.05 0.00 0.10 0.00 0.00 34.13 31.30 2gre s GLU 102 CO 0.00 0.09 1.02 0.71 0.02 0.00 0.00 175.26 177.11 2gre s TYR 103 N -1.42 3.31 0.27 1.61 4.12 -1.26 -1.22 117.35 122.75 2gre s TYR 103 Ca 0.50 1.45 -0.12 0.00 0.02 0.00 0.00 57.07 58.92 2gre s TYR 103 Cb -0.26 -2.85 0.00 0.00 -1.52 0.00 0.00 41.96 37.33 2gre s TYR 103 CO 0.33 -0.74 0.51 0.00 0.02 0.00 0.00 175.55 175.68 2gre s GLU 105 N -3.75 1.02 -0.11 0.00 2.02 -0.68 -0.69 118.70 116.51 2gre s GLU 105 Ca 0.22 -0.54 0.02 0.00 0.02 0.00 0.00 54.97 54.70 2gre s GLU 105 Cb -0.01 -0.99 -0.01 0.00 0.10 0.00 0.00 34.13 33.22 2gre s GLU 105 CO 0.11 0.27 -0.18 0.42 0.02 0.00 0.00 175.26 175.89 2gre s ILE 106 N -0.45 2.62 -0.09 -1.63 1.01 0.16 -1.73 121.20 121.10 2gre s ILE 106 Ca 0.04 -0.83 0.01 0.00 0.00 0.00 0.00 60.65 59.87 2gre s ILE 106 Cb -0.06 -2.05 -0.02 0.00 0.01 0.00 0.00 42.46 40.33 2gre s ILE 106 CO -0.00 0.55 -0.10 -0.70 0.00 0.00 0.00 174.94 174.68 2gre s GLU 107 N 0.22 2.95 0.39 2.79 2.12 -0.96 -0.44 118.70 125.77 2gre s GLU 107 Ca -0.12 -0.62 -0.01 0.00 0.36 0.00 0.00 54.97 54.59 2gre s GLU 107 Cb -0.16 -2.58 -0.03 0.00 0.26 0.00 0.00 34.13 31.62 2gre s GLU 107 CO 0.06 0.49 0.61 0.95 -0.54 0.00 0.00 175.26 176.84 2gre s THR 108 N -0.36 4.89 0.34 -1.70 -4.23 0.11 -3.72 115.64 110.96 2gre s THR 108 Ca 0.05 -0.35 0.13 0.00 -1.18 0.00 0.00 61.69 60.34 2gre s THR 108 Cb -0.12 -3.80 0.33 0.00 1.34 0.00 0.00 72.50 70.25 2gre s THR 108 CO 0.02 -0.57 1.65 0.28 -0.54 0.00 0.00 174.62 175.46 2gre h SER 109 N 0.60 0.40 0.30 3.99 0.02 -1.89 0.14 113.55 117.11 2gre h SER 109 Ca -0.49 0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 2gre h SER 109 Cb 1.22 0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.94 2gre h SER 109 CO 0.61 -0.18 -0.09 -1.54 -1.14 0.00 0.00 176.83 174.49 2gre n SER 110 N -5.11 0.52 0.00 3.07 3.41 -1.26 -4.90 113.62 109.35 2gre n SER 110 Ca 0.31 -0.68 0.00 0.00 -0.26 0.00 0.00 58.87 58.24 2gre n SER 110 Cb 0.97 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.86 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 1.25 0.39 3.77 5.00 0.00 0.48 -5.07 105.19 111.00 2gre n GLY 111 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.97 3.67 -0.04 1.61 2.36 -1.26 -4.68 119.74 120.42 2gre s LYS 112 Ca 0.00 1.90 0.03 0.00 -2.55 0.00 0.00 55.97 55.35 2gre s LYS 112 Cb 0.00 -2.42 0.00 0.00 -1.05 0.00 0.00 37.83 34.36 2gre s LYS 112 CO 0.00 -0.66 -0.13 0.95 1.55 0.00 0.00 175.35 177.06 2gre s THR 113 N -1.46 1.11 0.09 3.43 -4.23 -1.26 0.08 115.64 113.40 2gre s THR 113 Ca 0.64 -0.52 0.09 0.00 -1.18 0.00 0.00 61.69 60.73 2gre s THR 113 Cb -0.32 -0.98 -0.03 0.00 1.34 0.00 0.00 72.50 72.51 2gre s THR 113 CO 0.39 0.33 -0.24 -0.31 -0.54 0.00 0.00 174.62 174.26 2gre s TYR 114 N 0.28 2.04 0.52 3.99 1.51 0.42 -4.91 117.35 121.19 2gre s TYR 114 Ca -0.07 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.60 2gre s TYR 114 Cb -0.12 -1.15 0.02 0.00 -0.11 0.00 0.00 41.96 40.60 2gre s TYR 114 CO 0.02 0.21 0.75 0.95 -1.11 0.00 0.00 175.55 176.37 2gre s THR 115 N -1.00 3.24 0.16 -0.71 -4.23 -1.26 0.39 115.64 112.23 2gre s THR 115 Ca 0.10 -0.55 -0.24 0.00 -1.18 0.00 0.00 61.69 59.82 2gre s THR 115 Cb -0.10 -3.22 0.08 0.00 1.34 0.00 0.00 72.50 70.60 2gre s THR 115 CO 0.04 -0.16 1.04 -0.83 -0.54 0.00 0.00 174.62 174.17 2gre s GLY 116 N -4.34 -0.03 -0.03 3.99 0.00 0.13 -1.85 107.32 105.18 2gre s GLY 116 Ca 0.54 -0.12 0.03 0.00 0.00 0.00 0.00 44.72 45.16 2gre s GLY 116 CO 0.39 1.56 -0.10 -1.59 0.00 0.00 0.00 173.10 173.36 2gre s THR 117 N -2.53 0.87 -0.00 0.90 2.01 -0.52 -0.24 115.64 116.14 2gre s THR 117 Ca 0.18 -0.40 -0.26 0.00 0.31 0.00 0.00 61.69 61.52 2gre s THR 117 Cb -0.02 -0.78 -0.04 0.00 0.01 0.00 0.00 72.50 71.67 2gre s THR 117 CO 0.04 0.27 0.82 -0.63 -0.69 0.00 0.00 174.62 174.43 2gre s ILE 118 N 0.23 4.86 0.00 1.82 1.09 -0.36 -1.66 121.20 127.19 2gre s ILE 118 Ca -0.04 1.73 0.00 0.00 -1.10 0.00 0.00 60.65 61.24 2gre s ILE 118 Cb -0.10 -4.17 0.00 0.00 -1.06 0.00 0.00 42.46 37.14 2gre s ILE 118 CO 0.01 0.26 0.00 0.18 -0.10 0.00 0.00 174.94 175.29 2gre n LEU 119 N 3.47 0.00 -4.32 2.97 4.77 -1.26 0.45 117.00 123.08 2gre n LEU 119 Ca 0.01 -0.01 -0.47 0.00 -0.03 0.00 0.00 56.01 55.52 2gre n LEU 119 Cb 0.51 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.56 2gre n LEU 119 CO 0.49 0.00 0.29 -0.51 -1.33 0.00 0.00 177.39 176.33 2gre s ILE 141 N -0.02 5.42 0.40 -0.08 1.10 -1.26 -4.65 121.20 122.11 2gre s ILE 141 Ca 0.00 -2.01 0.04 0.00 -0.51 0.00 0.00 60.65 58.16 2gre s ILE 141 Cb 0.00 -4.41 -0.04 0.00 0.15 0.00 0.00 42.46 38.16 2gre s ILE 141 CO 0.00 -0.95 0.07 -1.61 -2.11 0.00 0.00 174.94 170.34 2gre s GLU 142 N 0.84 1.89 -0.21 3.50 2.02 -1.26 -3.65 118.70 121.82 2gre s GLU 142 Ca 0.11 -2.12 0.00 0.00 0.02 0.00 0.00 54.97 52.98 2gre s GLU 142 Cb -0.20 -0.96 0.03 0.00 0.10 0.00 0.00 34.13 33.10 2gre s GLU 142 CO -0.03 -0.32 -0.13 0.08 0.02 0.00 0.00 175.26 174.88 2gre s VAL 143 N -3.13 2.42 -0.32 2.63 1.01 0.14 -4.39 120.40 118.76 2gre s VAL 143 Ca 0.26 -1.03 -0.29 0.00 0.00 0.00 0.00 61.98 60.92 2gre s VAL 143 Cb 0.05 -2.15 0.02 0.00 0.00 0.00 0.00 36.38 34.30 2gre s VAL 143 CO 0.13 0.35 1.08 -0.60 0.00 0.00 0.00 175.10 176.05 2gre s ARG 144 N 1.29 4.07 0.11 2.72 3.52 -0.66 -1.46 118.95 128.54 2gre s ARG 144 Ca 0.02 1.08 -0.25 0.00 -0.13 0.00 0.00 55.73 56.45 2gre s ARG 144 Cb -0.15 -3.73 -0.07 0.00 -1.56 0.00 0.00 34.95 29.44 2gre s ARG 144 CO -0.08 -0.89 0.76 0.42 -0.81 0.00 0.00 175.30 174.69 2gre s ILE 145 N 3.64 4.54 -0.74 4.11 1.01 -1.26 -1.43 121.20 131.08 2gre s ILE 145 Ca 0.45 1.65 -0.07 0.00 0.00 0.00 0.00 60.65 62.68 2gre s ILE 145 Cb -0.12 -4.12 -0.15 0.00 0.01 0.00 0.00 42.46 38.08 2gre s ILE 145 CO 0.15 0.46 2.92 0.47 0.00 0.00 0.00 174.94 178.94 2gre n ASP 146 N 2.13 6.09 -3.90 3.58 8.00 -0.77 -4.77 116.55 126.91 2gre n ASP 146 Ca -0.04 -2.42 -0.11 0.00 0.71 0.00 0.00 54.79 52.93 2gre n ASP 146 Cb 0.49 -1.32 -0.10 0.00 -0.02 0.00 0.00 41.12 40.18 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 1.97 0.45 -0.91 -1.24 8.01 -1.26 -4.89 118.70 120.82 2gre s GLU 147 Ca 0.59 -0.46 -0.16 0.00 0.01 0.00 0.00 54.97 54.95 2gre s GLU 147 Cb 0.21 0.18 -0.10 0.00 -4.31 0.00 0.00 34.13 30.11 2gre s GLU 147 CO -0.03 -0.10 2.05 0.54 0.01 0.00 0.00 175.26 177.73 2gre n ARG 148 N 1.46 1.89 -4.97 1.61 1.74 -1.26 -4.86 116.66 112.27 2gre n ARG 148 Ca -0.23 -1.82 -0.32 0.00 -0.77 0.00 0.00 57.85 54.71 2gre n ARG 148 Cb 0.55 -2.81 -0.14 0.00 -1.02 0.00 0.00 32.46 29.04 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 4.24 2.86 0.00 1.55 -7.23 -1.26 -5.03 120.40 115.52 2gre s VAL 149 Ca 0.51 -0.80 0.00 0.00 -1.81 0.00 0.00 61.98 59.89 2gre s VAL 149 Cb 0.13 -2.10 0.00 0.00 0.56 0.00 0.00 36.38 34.97 2gre s VAL 149 CO 0.04 0.58 0.64 0.49 -0.31 0.00 0.00 175.10 176.55 2gre n PHE 150 N 2.45 0.00 -3.47 2.82 3.01 -1.26 -4.83 117.46 116.17 2gre n PHE 150 Ca -0.17 -0.19 -0.12 0.00 1.01 0.00 0.00 57.45 57.98 2gre n PHE 150 Cb 0.52 -0.02 -0.03 0.00 -0.01 0.00 0.00 39.48 39.94 2gre n PHE 150 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2gre s SER 151 N -0.38 -0.50 0.18 4.37 1.04 -1.24 -4.26 113.70 112.90 2gre s SER 151 Ca 0.00 0.15 -0.24 0.00 0.48 0.00 0.00 55.95 56.34 2gre s SER 151 Cb 0.00 0.50 0.08 0.00 0.10 0.00 0.00 66.02 66.70 2gre s SER 151 CO 0.00 -0.75 1.56 0.00 0.98 0.00 0.00 173.24 175.03 2gre h ALA 152 N 2.20 -0.20 -0.91 5.32 0.00 -1.69 -0.68 119.26 123.30 2gre h ALA 152 Ca -0.28 0.16 0.16 0.00 0.00 0.00 0.00 54.91 54.95 2gre h ALA 152 Cb 1.25 1.01 -0.07 0.00 0.00 0.00 0.00 17.79 19.97 2gre h ALA 152 CO 0.35 -0.78 0.58 -0.44 0.00 0.00 0.00 179.25 178.97 2gre h ASP 153 N -0.14 0.61 0.45 0.00 3.32 -1.95 -0.39 116.42 118.33 2gre h ASP 153 Ca 0.22 0.05 -0.25 0.00 0.02 0.00 0.00 57.03 57.07 2gre h ASP 153 Cb 0.55 -0.07 0.01 0.00 0.22 0.00 0.00 39.33 40.04 2gre h ASP 153 CO -0.80 0.29 -1.11 -0.33 -1.72 0.00 0.00 179.24 175.57 2gre h GLU 154 N 0.63 0.37 -0.15 3.56 5.08 -1.58 -1.43 114.58 121.05 2gre h GLU 154 Ca 0.47 -0.49 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2gre h GLU 154 Cb 0.84 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 2gre h GLU 154 CO -0.22 1.18 0.05 0.28 -1.00 0.00 0.00 179.01 179.30 2gre h VAL 155 N 0.16 1.18 -0.48 3.13 2.07 -0.53 -2.89 116.25 118.89 2gre h VAL 155 Ca -0.12 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 2gre h VAL 155 Cb 1.79 1.26 -0.02 0.00 -1.52 0.00 0.00 31.29 32.79 2gre h VAL 155 CO 0.19 0.17 0.26 0.03 0.02 0.00 0.00 177.57 178.24 2gre h ARG 156 N 0.07 0.66 -0.22 1.57 3.08 -1.07 -1.47 114.38 117.01 2gre h ARG 156 Ca 0.05 -0.06 0.06 0.00 0.07 0.00 0.00 59.98 60.10 2gre h ARG 156 Cb 0.22 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 2gre h ARG 156 CO -0.00 0.49 0.21 1.49 -1.07 0.00 0.00 179.97 181.08 2gre h GLU 157 N 0.67 0.00 0.00 0.04 4.22 -1.04 1.03 114.58 119.49 2gre h GLU 157 Ca 0.17 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.61 2gre h GLU 157 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2gre h GLU 157 CO -0.03 0.00 0.00 1.28 -2.18 0.00 0.00 179.01 178.08 2gre n LEU 158 N -3.98 0.54 0.00 1.64 4.32 -0.55 -4.92 117.00 114.04 2gre n LEU 158 Ca 0.02 0.61 0.00 0.00 -0.02 0.00 0.00 56.01 56.62 2gre n LEU 158 Cb 0.34 -0.51 0.00 0.00 -1.62 0.00 0.00 43.42 41.63 2gre n LEU 158 CO 0.30 -0.41 0.00 0.61 -1.22 0.00 0.00 177.39 176.67 2gre n GLY 159 N 0.32 0.73 3.72 -0.72 0.00 0.35 -5.03 105.19 104.56 2gre n GLY 159 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.83 3.24 0.13 -0.61 1.01 -1.24 -4.44 121.20 116.46 2gre s ILE 160 Ca 0.00 0.91 0.05 0.00 0.00 0.00 0.00 60.65 61.61 2gre s ILE 160 Cb 0.00 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.85 2gre s ILE 160 CO 0.00 0.08 -0.13 -0.70 0.00 0.00 0.00 174.94 174.19 2gre s GLU 161 N 0.94 1.01 0.12 2.79 2.12 -1.26 -4.19 118.70 120.23 2gre s GLU 161 Ca 0.64 -1.27 -0.35 0.00 0.36 0.00 0.00 54.97 54.34 2gre s GLU 161 Cb -0.37 -0.81 -0.16 0.00 0.26 0.00 0.00 34.13 33.04 2gre s GLU 161 CO 0.31 0.14 1.26 0.28 -0.54 0.00 0.00 175.26 176.72 2gre n VAL 162 N 0.38 0.34 0.00 3.70 0.31 -1.26 -1.87 118.33 119.93 2gre n VAL 162 Ca -0.14 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 2gre n VAL 162 Cb 0.58 -0.80 0.00 0.00 -0.91 0.00 0.00 33.84 32.71 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 2.31 3.00 3.71 2.92 0.00 -0.49 -5.00 105.19 111.63 2gre n GLY 163 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2gre n GLY 163 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2gre n ASP 164 N 0.00 2.86 -4.81 1.61 8.00 -0.78 -4.71 116.55 118.71 2gre n ASP 164 Ca 0.00 1.20 -0.35 0.00 0.71 0.00 0.00 54.79 56.36 2gre n ASP 164 Cb 0.00 -1.50 -0.07 0.00 -0.02 0.00 0.00 41.12 39.53 2gre n ASP 164 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2gre s PHE 165 N -1.10 3.49 -0.01 1.24 0.40 -1.24 -1.15 117.98 119.60 2gre s PHE 165 Ca 0.55 1.62 0.05 0.00 -0.60 0.00 0.00 56.93 58.55 2gre s PHE 165 Cb -0.56 -2.83 -0.01 0.00 0.51 0.00 0.00 43.02 40.13 2gre s PHE 165 CO 0.62 0.07 -0.16 0.08 0.70 0.00 0.00 175.22 176.54 2gre s VAL 166 N -1.88 1.25 0.20 -0.44 1.01 0.62 -2.28 120.40 118.88 2gre s VAL 166 Ca 0.55 -0.68 0.08 0.00 0.00 0.00 0.00 61.98 61.92 2gre s VAL 166 Cb -0.14 -1.04 -0.05 0.00 0.00 0.00 0.00 36.38 35.16 2gre s VAL 166 CO 0.18 0.35 -0.14 -0.94 0.00 0.00 0.00 175.10 174.55 2gre s SER 167 N -0.39 2.52 -0.17 3.32 1.04 -0.70 -1.47 113.70 117.85 2gre s SER 167 Ca 0.06 -1.01 -0.07 0.00 0.48 0.00 0.00 55.95 55.41 2gre s SER 167 Cb -0.06 -0.13 -0.04 0.00 0.10 0.00 0.00 66.02 65.89 2gre s SER 167 CO -0.01 -0.17 0.07 -0.36 0.98 0.00 0.00 173.24 173.75 2gre s PHE 168 N -2.93 3.28 0.21 5.02 2.99 -1.26 -1.69 117.98 123.60 2gre s PHE 168 Ca 0.21 0.13 -0.32 0.00 0.00 0.00 0.00 56.93 56.96 2gre s PHE 168 Cb -0.01 -2.05 -0.13 0.00 0.00 0.00 0.00 43.02 40.83 2gre s PHE 168 CO 0.06 0.23 1.54 -0.25 -0.00 0.00 0.00 175.22 176.81 2gre n ASP 169 N 3.30 3.17 0.08 1.36 9.92 -0.13 -4.85 116.55 129.39 2gre n ASP 169 Ca -0.17 1.11 0.13 0.00 -0.53 0.00 0.00 54.79 55.33 2gre n ASP 169 Cb 0.52 -1.46 0.46 0.00 -0.64 0.00 0.00 41.12 40.00 2gre n ASP 169 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 2gre n PRO 170 N 2.85 0.19 -4.06 -0.24 -0.04 -1.26 -4.85 135.00 127.60 2gre n PRO 170 Ca 0.14 0.16 -0.45 0.00 -0.04 0.00 0.00 63.50 63.31 2gre n PRO 170 Cb 0.31 -1.72 0.02 0.00 -0.04 0.00 0.00 33.50 32.07 2gre n PRO 170 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2gre n ARG 171 N -2.06 -0.38 -3.24 0.54 1.74 -1.26 -2.34 116.66 109.66 2gre n ARG 171 Ca 0.06 0.15 -0.39 0.00 -0.77 0.00 0.00 57.85 56.90 2gre n ARG 171 Cb 0.40 -2.40 -0.06 0.00 -1.02 0.00 0.00 32.46 29.39 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 -3.45 4.96 -0.01 1.55 0.11 -1.26 -4.18 120.40 118.12 2gre s VAL 172 Ca 0.43 1.18 -0.01 0.00 -2.93 0.00 0.00 61.98 60.65 2gre s VAL 172 Cb -0.24 -3.90 0.00 0.00 -1.53 0.00 0.00 36.38 30.71 2gre s VAL 172 CO 0.97 0.41 0.03 -1.10 -3.33 0.00 0.00 175.10 172.08 2gre s GLN 173 N -0.12 0.03 -0.25 1.54 -0.21 0.22 -4.97 119.66 115.90 2gre s GLN 173 Ca 0.30 0.04 -0.04 0.00 0.02 0.00 0.00 55.36 55.69 2gre s GLN 173 Cb -0.18 0.00 0.01 0.00 1.00 0.00 0.00 33.01 33.85 2gre s GLN 173 CO 0.16 -0.01 -0.02 0.42 -2.12 0.00 0.00 175.29 173.72 2gre s ILE 174 N 0.07 3.33 0.34 1.08 1.01 -1.26 -0.74 121.20 125.03 2gre s ILE 174 Ca -0.00 -0.77 -0.12 0.00 0.00 0.00 0.00 60.65 59.76 2gre s ILE 174 Cb -0.01 -2.64 -0.07 0.00 0.01 0.00 0.00 42.46 39.74 2gre s ILE 174 CO -0.00 0.24 0.71 -0.89 0.00 0.00 0.00 174.94 175.00 2gre s THR 175 N 1.42 4.78 0.31 2.92 2.01 -0.16 -4.96 115.64 121.96 2gre s THR 175 Ca 0.03 0.68 0.03 0.00 0.31 0.00 0.00 61.69 62.74 2gre s THR 175 Cb -0.16 -3.67 0.29 0.00 0.01 0.00 0.00 72.50 68.97 2gre s THR 175 CO -0.02 -0.32 1.86 -0.08 -0.69 0.00 0.00 174.62 175.37 2gre h GLU 176 N 1.84 0.89 -0.02 4.92 4.81 -1.99 0.72 114.58 125.76 2gre h GLU 176 Ca -0.47 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.70 2gre h GLU 176 Cb 1.18 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.36 2gre h GLU 176 CO 0.65 0.59 0.00 -1.13 -0.73 0.00 0.00 179.01 178.39 2gre n SER 177 N -4.57 0.02 0.00 1.04 3.41 -1.26 -4.87 113.62 107.38 2gre n SER 177 Ca 0.17 -1.70 0.00 0.00 -0.26 0.00 0.00 58.87 57.08 2gre n SER 177 Cb 0.35 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 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 0.34 0.79 3.84 5.00 0.00 0.25 -4.93 105.19 110.47 2gre n GLY 178 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.03 3.46 -0.18 1.61 1.51 -1.26 -0.40 117.35 120.06 2gre s TYR 179 Ca 0.00 1.31 -0.04 0.00 -1.01 0.00 0.00 57.07 57.33 2gre s TYR 179 Cb 0.00 -2.59 -0.02 0.00 -0.11 0.00 0.00 41.96 39.24 2gre s TYR 179 CO 0.00 0.16 -0.04 -1.50 -1.11 0.00 0.00 175.55 173.06 2gre s ILE 180 N -1.85 3.69 -0.00 2.71 2.07 -0.18 -0.98 121.20 126.65 2gre s ILE 180 Ca 0.51 -0.41 0.04 0.00 -1.41 0.00 0.00 60.65 59.38 2gre s ILE 180 Cb -0.12 -2.64 -0.01 0.00 0.13 0.00 0.00 42.46 39.82 2gre s ILE 180 CO 0.18 0.46 -0.13 -1.59 -1.91 0.00 0.00 174.94 171.95 2gre s LYS 181 N 0.80 1.03 -0.22 3.50 -2.85 0.08 -2.17 119.74 119.92 2gre s LYS 181 Ca -0.01 -0.51 -0.19 0.00 -1.00 0.00 0.00 55.97 54.26 2gre s LYS 181 Cb -0.15 -1.00 0.06 0.00 -2.06 0.00 0.00 37.83 34.68 2gre s LYS 181 CO 0.02 0.27 0.57 0.45 0.10 0.00 0.00 175.35 176.76 2gre s SER 182 N -0.44 -0.63 0.35 0.03 0.15 -0.95 0.73 113.70 112.94 2gre s SER 182 Ca 0.04 1.17 0.25 0.00 0.70 0.00 0.00 55.95 58.11 2gre s SER 182 Cb -0.05 1.16 1.19 0.00 -1.71 0.00 0.00 66.02 66.60 2gre s SER 182 CO -0.00 -0.20 1.26 -1.14 1.20 0.00 0.00 173.24 174.36 2gre n ARG 183 N 3.04 -0.03 0.00 5.44 0.63 -0.99 -2.87 116.66 121.89 2gre n ARG 183 Ca -0.15 1.03 0.00 0.00 -0.92 0.00 0.00 57.85 57.81 2gre n ARG 183 Cb 0.56 -2.00 0.00 0.00 0.45 0.00 0.00 32.46 31.48 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 -4.39 0.00 0.00 -0.14 8.25 -1.26 -4.27 115.22 113.41 2gre n HIS 184 Ca 0.32 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.78 2gre n HIS 184 Cb 1.23 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.34 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 -0.23 0.00 -4.19 2.41 4.77 -1.25 -4.76 117.00 113.75 2gre n LEU 185 Ca 0.00 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.68 2gre n LEU 185 Cb 0.00 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.00 2gre n LEU 185 CO 0.00 0.00 -0.41 0.47 -1.33 0.00 0.00 177.39 176.12 2gre n ASP 186 N 0.83 0.58 0.00 -1.43 10.43 -1.26 -1.70 116.55 124.00 2gre n ASP 186 Ca 0.00 -1.18 0.00 0.00 2.57 0.00 0.00 54.79 56.18 2gre n ASP 186 Cb 0.00 -1.47 0.00 0.00 1.84 0.00 0.00 41.12 41.49 2gre n ASP 186 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 2gre n ASP 187 N -2.59 0.00 0.28 -2.24 4.64 -1.26 -4.84 116.55 110.53 2gre n ASP 187 Ca -0.26 0.00 0.18 0.00 -1.38 0.00 0.00 54.79 53.33 2gre n ASP 187 Cb 0.62 0.00 0.72 0.00 -1.04 0.00 0.00 41.12 41.42 2gre n ASP 187 CO 0.00 0.00 0.00 0.11 -0.82 0.00 0.00 177.20 176.49 2gre h LYS 188 N 4.49 0.00 0.35 -0.67 1.57 -1.53 -2.53 116.57 118.24 2gre h LYS 188 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 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 -0.17 0.28 -0.57 0.00 0.00 179.45 178.99 2gre h VAL 189 N 0.00 0.66 -0.76 0.50 2.07 -1.93 -1.25 116.25 115.54 2gre h VAL 189 Ca 0.00 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.48 2gre h VAL 189 Cb 0.46 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 2gre h VAL 189 CO 0.00 0.00 0.38 0.28 0.02 0.00 0.00 177.57 178.25 2gre h SER 190 N -0.47 0.98 -0.57 0.57 0.02 -1.77 -0.24 113.55 112.07 2gre h SER 190 Ca -0.05 -0.13 0.12 0.00 -0.84 0.00 0.00 61.79 60.89 2gre h SER 190 Cb 0.36 -0.25 -0.10 0.00 0.14 0.00 0.00 62.40 62.55 2gre h SER 190 CO 0.08 0.83 -0.05 0.58 -1.14 0.00 0.00 176.83 177.14 2gre h VAL 191 N 1.07 0.50 -0.30 2.27 2.07 -1.21 0.40 116.25 121.05 2gre h VAL 191 Ca 0.26 -0.03 -0.11 0.00 0.82 0.00 0.00 66.70 67.64 2gre h VAL 191 Cb 0.10 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 2gre h VAL 191 CO -0.04 0.01 -0.28 0.00 0.02 0.00 0.00 177.57 177.28 2gre h ALA 192 N 1.54 0.94 -0.09 1.67 0.00 0.09 -1.30 119.26 122.11 2gre h ALA 192 Ca 0.29 -0.38 0.03 0.00 0.00 0.00 0.00 54.91 54.85 2gre h ALA 192 Cb 0.46 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2gre h ALA 192 CO -0.52 0.61 -0.07 0.82 0.00 0.00 0.00 179.25 180.09 2gre h ILE 193 N 0.53 0.78 -0.34 0.00 1.08 0.10 -0.19 117.51 119.47 2gre h ILE 193 Ca 0.07 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.51 2gre h ILE 193 Cb 0.76 0.78 -0.01 0.00 -3.07 0.00 0.00 36.82 35.28 2gre h ILE 193 CO 0.06 0.00 0.09 -0.07 -0.69 0.00 0.00 178.15 177.54 2gre h LEU 194 N -0.09 0.51 -0.96 1.44 3.38 -0.32 -0.83 115.31 118.44 2gre h LEU 194 Ca 0.06 -0.22 0.11 0.00 0.09 0.00 0.00 57.88 57.92 2gre h LEU 194 Cb 0.18 -0.13 -0.08 0.00 0.09 0.00 0.00 40.66 40.71 2gre h LEU 194 CO -0.15 0.60 0.59 -0.07 0.09 0.00 0.00 178.44 179.51 2gre h LEU 195 N 0.40 0.86 0.01 1.67 4.07 -1.16 -2.00 115.31 119.17 2gre h LEU 195 Ca 0.11 0.05 -0.24 0.00 0.08 0.00 0.00 57.88 57.88 2gre h LEU 195 Cb 0.29 -0.12 -0.03 0.00 1.08 0.00 0.00 40.66 41.87 2gre h LEU 195 CO -0.00 0.46 -1.23 0.11 -1.08 0.00 0.00 178.44 176.71 2gre h LYS 196 N 0.94 0.03 0.08 1.13 1.57 -0.17 -2.85 116.57 117.30 2gre h LYS 196 Ca 0.47 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 59.20 2gre h LYS 196 Cb 0.46 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.79 2gre h LYS 196 CO -0.26 0.89 -0.04 1.25 -0.57 0.00 0.00 179.45 180.72 2gre h LEU 197 N 0.01 -0.10 -0.67 2.94 5.85 -1.01 -0.51 115.31 121.81 2gre h LEU 197 Ca -0.10 0.01 0.14 0.00 0.84 0.00 0.00 57.88 58.77 2gre h LEU 197 Cb 1.86 0.03 -0.11 0.00 0.37 0.00 0.00 40.66 42.81 2gre h LEU 197 CO 0.12 -0.07 0.03 0.40 -0.34 0.00 0.00 178.44 178.58 2gre h ILE 198 N -0.11 0.46 -0.53 4.05 2.04 -1.35 0.22 117.51 122.29 2gre h ILE 198 Ca -0.01 -0.05 -0.02 0.00 1.00 0.00 0.00 64.86 65.78 2gre h ILE 198 Cb 0.09 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.45 2gre h ILE 198 CO 0.01 0.03 0.25 0.50 0.00 0.00 0.00 178.15 178.93 2gre h LYS 199 N 0.14 0.74 -0.16 2.37 1.63 -1.36 -2.78 116.57 117.14 2gre h LYS 199 Ca 0.36 -0.09 -0.04 0.00 -0.85 0.00 0.00 60.65 60.03 2gre h LYS 199 Cb 0.60 -0.14 -0.00 0.00 -0.60 0.00 0.00 32.23 32.08 2gre h LYS 199 CO -0.56 0.58 -0.06 -0.09 -3.45 0.00 0.00 179.45 175.87 2gre h ARG 200 N 0.74 0.32 0.00 1.90 2.43 0.10 -2.02 114.38 117.86 2gre h ARG 200 Ca 0.18 -0.13 -0.00 0.00 -0.81 0.00 0.00 59.98 59.22 2gre h ARG 200 Cb 0.09 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.63 2gre h ARG 200 CO -0.02 0.62 -0.01 -0.07 -1.51 0.00 0.00 179.97 178.98 2gre h LEU 201 N 0.01 0.00 0.07 3.80 3.38 -0.95 0.98 115.31 122.60 2gre h LEU 201 Ca 0.04 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.88 2gre h LEU 201 Cb 0.51 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.27 2gre h LEU 201 CO 0.02 0.01 -0.53 -0.61 0.09 0.00 0.00 178.44 177.42 2gre h GLN 202 N 0.00 0.24 0.08 1.13 4.15 -1.15 -3.28 115.11 116.27 2gre h GLN 202 Ca -0.00 -0.35 -0.00 0.00 0.77 0.00 0.00 58.65 59.07 2gre h GLN 202 Cb 0.05 0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.86 2gre h GLN 202 CO 0.00 1.12 -0.04 -0.44 -1.93 0.00 0.00 178.83 177.54 2gre h ASP 203 N -0.46 -0.09 -0.28 -0.69 3.32 -0.82 -3.32 116.42 114.08 2gre h ASP 203 Ca -0.08 0.00 0.10 0.00 0.02 0.00 0.00 57.03 57.07 2gre h ASP 203 Cb 1.35 0.02 -0.05 0.00 0.22 0.00 0.00 39.33 40.87 2gre h ASP 203 CO 0.10 -0.03 0.08 1.21 -1.72 0.00 0.00 179.24 178.88 2gre n GLU 204 N -2.52 -0.02 -0.42 3.56 4.07 0.34 -4.75 120.64 120.90 2gre n GLU 204 Ca -0.01 0.41 0.00 0.00 -0.06 0.00 0.00 57.16 57.49 2gre n GLU 204 Cb 0.04 -0.68 0.00 0.00 -0.06 0.00 0.00 31.44 30.74 2gre n GLU 204 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2gre n ASN 205 N -3.92 -0.22 -4.89 4.31 4.13 -1.24 -5.06 115.26 108.37 2gre n ASN 205 Ca 0.09 0.00 -0.30 0.00 1.68 0.00 0.00 54.58 56.05 2gre n ASN 205 Cb 0.29 -0.04 0.01 0.00 -1.54 0.00 0.00 39.78 38.50 2gre n ASN 205 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 2gre s VAL 206 N -2.69 4.48 -0.31 2.41 -7.23 -1.26 -5.05 120.40 110.76 2gre s VAL 206 Ca 0.00 0.56 -0.06 0.00 -1.81 0.00 0.00 61.98 60.67 2gre s VAL 206 Cb 0.00 -3.77 0.02 0.00 0.56 0.00 0.00 36.38 33.19 2gre s VAL 206 CO 0.00 -0.93 0.08 -0.89 -0.31 0.00 0.00 175.10 173.05 2gre s THR 207 N -3.08 3.79 0.19 5.32 2.01 -1.26 -4.91 115.64 117.71 2gre s THR 207 Ca 0.53 -0.91 -0.29 0.00 0.31 0.00 0.00 61.69 61.33 2gre s THR 207 Cb -0.11 -3.04 -0.17 0.00 0.01 0.00 0.00 72.50 69.20 2gre s THR 207 CO 0.50 -0.02 0.69 0.18 -0.69 0.00 0.00 174.62 175.28 2gre n LEU 208 N 4.83 -0.47 0.20 4.42 4.77 -1.26 -4.86 117.00 124.62 2gre n LEU 208 Ca -0.14 1.14 0.14 0.00 -0.03 0.00 0.00 56.01 57.12 2gre n LEU 208 Cb 0.46 -1.02 0.41 0.00 -2.33 0.00 0.00 43.42 40.94 2gre n LEU 208 CO 0.31 -2.53 0.88 1.55 -1.33 0.00 0.00 177.39 176.28 2gre h PRO 209 N 1.49 0.00 -4.30 3.23 0.13 -1.92 -2.07 132.00 128.57 2gre h PRO 209 Ca -0.33 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.49 2gre h PRO 209 Cb 1.42 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.27 2gre h PRO 209 CO 0.59 0.00 -0.75 0.71 -0.23 0.00 0.00 178.00 178.32 2gre s TYR 210 N -3.32 0.46 -0.21 1.56 1.51 -1.26 -0.81 117.35 115.27 2gre s TYR 210 Ca 0.06 -0.14 -0.39 0.00 -1.01 0.00 0.00 57.07 55.59 2gre s TYR 210 Cb 0.08 -0.29 -0.15 0.00 -0.11 0.00 0.00 41.96 41.49 2gre s TYR 210 CO 0.58 -0.02 1.73 2.41 -1.11 0.00 0.00 175.55 179.14 2gre n THR 211 N 2.77 0.32 -4.17 -0.71 -1.04 -0.66 -3.55 114.28 107.24 2gre n THR 211 Ca -0.14 -0.06 -0.24 0.00 -2.04 0.00 0.00 64.05 61.57 2gre n THR 211 Cb 0.58 -1.30 -0.17 0.00 -1.82 0.00 0.00 70.33 67.62 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 3.35 0.89 -0.08 12.58 2.01 0.13 -0.68 115.64 133.84 2gre s THR 212 Ca 0.96 -0.28 -0.09 0.00 0.31 0.00 0.00 61.69 62.60 2gre s THR 212 Cb -0.99 -0.89 -0.04 0.00 0.01 0.00 0.00 72.50 70.58 2gre s THR 212 CO 0.62 0.32 0.21 -1.00 -0.69 0.00 0.00 174.62 174.08 2gre s HIS 213 N 1.22 3.63 -0.28 4.92 3.76 0.29 -0.46 115.29 128.37 2gre s HIS 213 Ca -0.05 0.63 0.03 0.00 -0.15 0.00 0.00 55.06 55.52 2gre s HIS 213 Cb -0.14 -2.02 0.07 0.00 1.11 0.00 0.00 32.58 31.60 2gre s HIS 213 CO -0.02 0.70 -0.06 -0.06 -0.85 0.00 0.00 174.74 174.45 2gre s PHE 214 N -1.08 3.34 -0.37 1.40 0.40 0.30 0.26 117.98 122.24 2gre s PHE 214 Ca 0.18 -2.48 -0.15 0.00 -0.60 0.00 0.00 56.93 53.89 2gre s PHE 214 Cb -0.13 -2.18 0.00 0.00 0.51 0.00 0.00 43.02 41.22 2gre s PHE 214 CO 0.08 -0.89 0.30 -1.17 0.70 0.00 0.00 175.22 174.24 2gre s LEU 215 N 1.07 4.76 -0.77 -0.37 2.96 0.13 -0.81 118.68 125.64 2gre s LEU 215 Ca -0.03 -0.59 -0.19 0.00 -0.22 0.00 0.00 54.13 53.09 2gre s LEU 215 Cb -0.20 -2.21 0.12 0.00 0.50 0.00 0.00 46.19 44.40 2gre s LEU 215 CO -0.06 -0.37 0.96 -0.63 -1.32 0.00 0.00 176.35 174.93 2gre s ILE 216 N 1.80 4.72 0.64 6.68 -1.09 -0.18 -1.91 121.20 131.86 2gre s ILE 216 Ca 0.07 -1.20 -0.09 0.00 -2.23 0.00 0.00 60.65 57.20 2gre s ILE 216 Cb -0.18 -4.66 -0.00 0.00 -1.58 0.00 0.00 42.46 36.04 2gre s ILE 216 CO 0.11 -1.37 1.01 -0.94 -1.23 0.00 0.00 174.94 172.52 2gre s SER 217 N 3.52 5.69 -0.03 3.58 1.04 -0.47 -2.45 113.70 124.58 2gre s SER 217 Ca 0.24 1.05 0.05 0.00 0.48 0.00 0.00 55.95 57.76 2gre s SER 217 Cb -0.13 -1.99 0.07 0.00 0.10 0.00 0.00 66.02 64.08 2gre s SER 217 CO -0.01 -1.12 0.92 -0.46 0.98 0.00 0.00 173.24 173.55 2gre n ASN 218 N -2.78 1.34 -0.05 7.02 2.04 -1.26 -0.97 115.26 120.59 2gre n ASN 218 Ca 0.06 -2.03 0.00 0.00 -0.44 0.00 0.00 54.58 52.16 2gre n ASN 218 Cb 0.57 -0.13 0.00 0.00 -2.53 0.00 0.00 39.78 37.68 2gre n ASN 218 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 2gre n ASN 219 N -0.54 0.00 -3.35 0.53 3.02 -1.26 -4.40 115.26 109.26 2gre n ASN 219 Ca 0.04 -1.09 -0.29 0.00 -0.03 0.00 0.00 54.58 53.21 2gre n ASN 219 Cb 0.47 -0.02 0.26 0.00 -0.61 0.00 0.00 39.78 39.88 2gre n ASN 219 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2gre n GLU 220 N 0.00 -3.91 -0.55 3.52 -0.58 -1.26 -2.08 120.64 115.79 2gre n GLU 220 Ca 0.00 -1.52 0.00 0.00 -0.42 0.00 0.00 57.16 55.22 2gre n GLU 220 Cb 0.52 -1.67 0.00 0.00 -0.57 0.00 0.00 31.44 29.71 2gre n GLU 220 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2gre n GLU 221 N -5.15 0.00 -2.10 3.49 -0.58 -1.26 -4.89 120.64 110.15 2gre n GLU 221 Ca 0.14 0.00 -0.02 0.00 -0.42 0.00 0.00 57.16 56.85 2gre n GLU 221 Cb 0.56 -4.21 -0.02 0.00 -0.57 0.00 0.00 31.44 27.20 2gre n GLU 221 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 2gre n ILE 222 N -2.00 -9.74 0.00 -3.67 -5.35 -0.88 -4.35 119.36 93.37 2gre n ILE 222 Ca 0.00 2.00 0.00 0.00 -0.27 0.00 0.00 62.75 64.48 2gre n ILE 222 Cb 0.00 -5.39 0.00 0.00 -1.74 0.00 0.00 39.64 32.51 2gre n ILE 222 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 2gre n ASN 229 N 1.19 0.00 -3.76 7.28 4.05 -1.26 -4.80 115.26 117.96 2gre n ASN 229 Ca -0.18 0.00 -0.30 0.00 0.45 0.00 0.00 54.58 54.56 2gre n ASN 229 Cb 0.27 0.00 -0.15 0.00 1.23 0.00 0.00 39.78 41.13 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 0.94 -0.30 -1.44 1.09 -1.26 -5.09 121.20 115.14 2gre s ILE 230 Ca 0.00 -1.34 -0.38 0.00 -1.10 0.00 0.00 60.65 57.83 2gre s ILE 230 Cb 0.00 -1.65 -0.17 0.00 -1.06 0.00 0.00 42.46 39.58 2gre s ILE 230 CO 0.00 -0.59 1.23 -2.65 -0.10 0.00 0.00 174.94 172.84 2gre n PRO 231 N 4.83 0.00 -0.24 2.79 -0.02 -1.26 -4.67 135.00 136.43 2gre n PRO 231 Ca -0.03 0.00 0.23 0.00 -2.02 0.00 0.00 63.50 61.68 2gre n PRO 231 Cb 0.43 -1.28 0.36 0.00 -0.02 0.00 0.00 33.50 32.98 2gre n PRO 231 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2gre n GLU 232 N 2.78 0.01 -0.21 -0.52 0.00 -1.26 -0.53 120.64 120.92 2gre n GLU 232 Ca 0.24 0.67 0.12 0.00 0.00 0.00 0.00 57.16 58.18 2gre n GLU 232 Cb -0.02 -1.62 0.22 0.00 0.00 0.00 0.00 31.44 30.03 2gre n GLU 232 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 2gre n GLU 233 N -2.76 2.54 -2.15 5.31 0.00 -1.26 -4.91 120.64 117.41 2gre n GLU 233 Ca 0.19 -2.34 -0.43 0.00 0.00 0.00 0.00 57.16 54.59 2gre n GLU 233 Cb 1.09 -1.52 -0.03 0.00 0.00 0.00 0.00 31.44 30.98 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 -1.46 3.80 -0.19 3.84 2.01 0.32 0.37 115.64 124.33 2gre s THR 234 Ca 0.40 0.95 -0.08 0.00 0.31 0.00 0.00 61.69 63.26 2gre s THR 234 Cb 0.23 -3.68 -0.21 0.00 0.01 0.00 0.00 72.50 68.85 2gre s THR 234 CO 0.32 -0.16 0.10 0.52 -0.69 0.00 0.00 174.62 174.71 2gre n VAL 235 N 5.76 1.63 -4.53 3.82 0.31 0.35 -4.74 118.33 120.93 2gre n VAL 235 Ca 0.17 -0.49 -0.25 0.00 -0.01 0.00 0.00 64.34 63.76 2gre n VAL 235 Cb 0.44 -1.72 -0.14 0.00 -0.91 0.00 0.00 33.84 31.51 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 -2.51 1.29 -0.22 5.55 2.02 -1.25 -0.28 118.70 123.30 2gre s GLU 236 Ca -0.29 -0.99 -0.03 0.00 0.02 0.00 0.00 54.97 53.69 2gre s GLU 236 Cb 0.08 -1.44 0.07 0.00 0.10 0.00 0.00 34.13 32.94 2gre s GLU 236 CO 0.66 0.36 0.05 -0.47 0.02 0.00 0.00 175.26 175.88 2gre s TYR 237 N -0.90 1.10 -0.21 1.61 6.14 0.26 -2.63 117.35 122.72 2gre s TYR 237 Ca 0.07 -1.02 -0.08 0.00 0.64 0.00 0.00 57.07 56.68 2gre s TYR 237 Cb -0.09 -1.14 -0.04 0.00 0.42 0.00 0.00 41.96 41.11 2gre s TYR 237 CO 0.02 -0.67 0.09 -1.17 0.64 0.00 0.00 175.55 174.46 2gre s LEU 238 N 1.83 3.81 -0.04 6.97 2.96 -0.68 -0.71 118.68 132.82 2gre s LEU 238 Ca 0.02 0.02 -0.12 0.00 -0.22 0.00 0.00 54.13 53.82 2gre s LEU 238 Cb -0.17 -1.99 -0.05 0.00 0.50 0.00 0.00 46.19 44.47 2gre s LEU 238 CO -0.13 0.09 0.33 0.00 -1.32 0.00 0.00 176.35 175.32 2gre s ALA 239 N 0.86 3.75 -0.38 5.97 0.00 0.61 -1.60 121.76 130.97 2gre s ALA 239 Ca 0.05 -0.35 -0.02 0.00 0.00 0.00 0.00 51.96 51.64 2gre s ALA 239 Cb -0.13 -2.26 0.10 0.00 0.00 0.00 0.00 23.12 20.82 2gre s ALA 239 CO 0.03 0.52 0.15 0.08 0.00 0.00 0.00 175.76 176.53 2gre s VAL 240 N -1.03 3.09 0.00 0.00 1.01 0.11 -1.66 120.40 121.91 2gre s VAL 240 Ca 0.21 -1.99 0.00 0.00 0.00 0.00 0.00 61.98 60.20 2gre s VAL 240 Cb -0.15 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.14 2gre s VAL 240 CO 0.10 -0.58 0.00 -0.67 0.00 0.00 0.00 175.10 173.95 2gre n ASP 241 N 4.55 1.25 -3.49 3.32 -0.08 -0.40 -4.55 116.55 117.15 2gre n ASP 241 Ca -0.03 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 53.14 2gre n ASP 241 Cb 0.42 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.85 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 -0.50 0.07 0.27 0.00 -1.26 -3.33 107.32 102.57 2gre s GLY 243 Ca 0.00 1.00 -0.22 0.00 0.00 0.00 0.00 44.72 45.50 2gre s GLY 243 CO 0.00 0.43 0.65 0.00 0.00 0.00 0.00 173.10 174.18 2gre s ALA 244 N -2.88 3.49 0.50 3.20 0.00 -1.26 -4.76 121.76 120.05 2gre s ALA 244 Ca 0.01 0.14 -0.01 0.00 0.00 0.00 0.00 51.96 52.11 2gre s ALA 244 Cb -0.01 -2.79 0.01 0.00 0.00 0.00 0.00 23.12 20.33 2gre s ALA 244 CO -0.07 0.26 0.74 -0.51 0.00 0.00 0.00 175.76 176.17 2gre s LEU 245 N -0.69 3.48 0.33 0.00 1.02 -1.22 -4.06 118.68 117.54 2gre s LEU 245 Ca 0.33 0.29 0.12 0.00 0.02 0.00 0.00 54.13 54.89 2gre s LEU 245 Cb -0.20 -3.16 0.96 0.00 0.02 0.00 0.00 46.19 43.81 2gre s LEU 245 CO 0.21 -0.87 1.72 1.23 0.02 0.00 0.00 176.35 178.65 2gre h GLY 246 N 0.22 1.87 -6.61 -3.19 0.00 -1.99 -3.33 103.07 90.03 2gre h GLY 246 Ca -0.45 -0.28 -0.38 0.00 0.00 0.00 0.00 47.33 46.22 2gre h GLY 246 CO 0.57 -0.29 -0.67 0.51 0.00 0.00 0.00 176.54 176.66 2gre s ASP 247 N -5.13 2.09 0.00 0.19 3.84 -1.26 -5.16 116.67 111.25 2gre s ASP 247 Ca -0.10 -0.81 0.00 0.00 -0.00 0.00 0.00 52.55 51.63 2gre s ASP 247 Cb 0.28 0.28 0.00 0.00 -1.38 0.00 0.00 42.92 42.10 2gre s ASP 247 CO 0.80 -0.39 0.00 0.61 -0.00 0.00 0.00 175.17 176.18 2gre n GLY 248 N 5.30 0.40 0.00 2.12 0.00 -1.25 -5.06 105.19 106.69 2gre n GLY 248 Ca -0.03 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.20 2gre n GLY 248 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gre n SER 251 N 0.00 0.00 -4.09 1.61 3.41 -1.26 -3.43 113.62 109.86 2gre n SER 251 Ca 0.00 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.28 2gre n SER 251 Cb 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 63.81 2gre n SER 251 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2gre s ASP 252 N 0.00 4.85 -0.02 4.04 3.68 -1.26 -4.97 116.67 122.99 2gre s ASP 252 Ca 0.00 -1.75 0.02 0.00 2.13 0.00 0.00 52.55 52.94 2gre s ASP 252 Cb 0.00 -1.68 0.08 0.00 -1.45 0.00 0.00 42.92 39.87 2gre s ASP 252 CO 0.00 -0.35 0.70 -0.62 0.13 0.00 0.00 175.17 175.03 2gre n GLU 253 N 4.46 1.37 0.00 4.34 1.02 -1.26 -4.00 120.64 126.57 2gre n GLU 253 Ca -0.05 -0.32 0.00 0.00 -0.02 0.00 0.00 57.16 56.76 2gre n GLU 253 Cb 0.42 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.35 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 0.01 0.00 -4.23 -0.32 4.02 -1.26 -2.40 117.16 112.97 2gre n TYR 254 Ca 0.03 -0.22 -0.13 0.00 -0.01 0.00 0.00 57.90 57.57 2gre n TYR 254 Cb 0.30 -0.02 -0.10 0.00 -0.02 0.00 0.00 39.34 39.50 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 -0.44 0.30 -0.01 -0.72 -4.23 -1.26 -4.11 115.64 105.17 2gre s THR 255 Ca 0.00 -1.98 -0.20 0.00 -1.18 0.00 0.00 61.69 58.33 2gre s THR 255 Cb 0.00 -2.40 -0.05 0.00 1.34 0.00 0.00 72.50 71.38 2gre s THR 255 CO 0.00 -0.16 0.57 0.54 -0.54 0.00 0.00 174.62 175.03 2gre s VAL 256 N -3.93 4.94 -0.16 2.29 0.11 -0.44 -3.31 120.40 119.91 2gre s VAL 256 Ca 0.34 1.18 -0.12 0.00 -2.93 0.00 0.00 61.98 60.45 2gre s VAL 256 Cb 0.07 -3.90 -0.05 0.00 -1.53 0.00 0.00 36.38 30.97 2gre s VAL 256 CO 0.09 0.43 0.22 -0.94 -3.33 0.00 0.00 175.10 171.57 2gre s SER 257 N -0.21 6.37 -0.21 3.54 1.04 -0.12 -1.37 113.70 122.74 2gre s SER 257 Ca 0.30 0.43 -0.10 0.00 0.48 0.00 0.00 55.95 57.07 2gre s SER 257 Cb -0.18 -2.14 -0.05 0.00 0.10 0.00 0.00 66.02 63.76 2gre s SER 257 CO 0.16 0.18 0.12 -0.63 0.98 0.00 0.00 173.24 174.06 2gre s ILE 258 N 0.14 5.21 -0.14 -1.02 -1.09 -0.85 -1.52 121.20 121.94 2gre s ILE 258 Ca 0.14 0.12 -0.23 0.00 -2.23 0.00 0.00 60.65 58.45 2gre s ILE 258 Cb -0.12 -3.39 -0.03 0.00 -1.58 0.00 0.00 42.46 37.33 2gre s ILE 258 CO 0.02 0.41 0.70 0.00 -1.23 0.00 0.00 174.94 174.84 2gre h ALA 260 N 7.13 0.70 -1.63 0.00 0.00 -1.26 -3.42 119.26 120.78 2gre h ALA 260 Ca -0.35 -1.24 0.06 0.00 0.00 0.00 0.00 54.91 53.38 2gre h ALA 260 Cb 1.16 0.36 -0.24 0.00 0.00 0.00 0.00 17.79 19.08 2gre h ALA 260 CO 0.78 1.37 0.47 0.21 0.00 0.00 0.00 179.25 182.08 2gre s LYS 261 N -2.70 0.62 0.31 0.00 2.20 -1.24 -1.35 119.74 117.58 2gre s LYS 261 Ca -0.03 0.32 0.04 0.00 -0.36 0.00 0.00 55.97 55.94 2gre s LYS 261 Cb 0.08 0.30 -0.03 0.00 -1.51 0.00 0.00 37.83 36.66 2gre s LYS 261 CO 0.82 -0.16 0.18 0.16 -0.36 0.00 0.00 175.35 175.99 2gre s ASP 262 N -0.66 1.55 0.11 1.43 3.84 -0.89 -2.37 116.67 119.69 2gre s ASP 262 Ca -0.01 -1.60 0.03 0.00 -0.00 0.00 0.00 52.55 50.97 2gre s ASP 262 Cb -0.02 0.44 0.34 0.00 -1.38 0.00 0.00 42.92 42.30 2gre s ASP 262 CO 0.00 -0.93 0.52 -0.24 -0.00 0.00 0.00 175.17 174.52 2gre n SER 263 N -1.05 0.03 -2.54 2.11 2.88 -1.10 0.38 113.62 114.32 2gre n SER 263 Ca 0.02 0.56 -0.36 0.00 -1.33 0.00 0.00 58.87 57.76 2gre n SER 263 Cb 0.64 -0.23 0.06 0.00 -0.75 0.00 0.00 64.21 63.93 2gre n SER 263 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2gre n SER 264 N -4.04 7.28 0.00 -3.46 3.41 -1.26 -4.99 113.62 110.56 2gre n SER 264 Ca 0.10 -3.80 0.00 0.00 -0.26 0.00 0.00 58.87 54.91 2gre n SER 264 Cb 0.33 -0.94 0.00 0.00 -0.26 0.00 0.00 64.21 63.34 2gre n SER 264 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gre n GLY 265 N -0.73 0.64 3.71 5.00 0.00 0.16 -4.98 105.19 108.99 2gre n GLY 265 Ca 0.57 -1.82 -0.41 0.00 0.00 0.00 0.00 46.02 44.35 2gre n GLY 265 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2gre n PRO 266 N 0.82 2.10 -1.81 1.61 -0.02 -1.26 -2.10 135.00 134.33 2gre n PRO 266 Ca 0.00 0.74 -0.31 0.00 -2.02 0.00 0.00 63.50 61.91 2gre n PRO 266 Cb 0.00 -2.40 0.03 0.00 -0.02 0.00 0.00 33.50 31.11 2gre n PRO 266 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2gre s TYR 267 N -1.15 3.42 0.14 6.00 1.51 -0.46 -4.91 117.35 121.89 2gre s TYR 267 Ca 0.58 1.23 -0.35 0.00 -1.01 0.00 0.00 57.07 57.53 2gre s TYR 267 Cb -0.52 -2.87 -0.16 0.00 -0.11 0.00 0.00 41.96 38.30 2gre s TYR 267 CO 0.60 -0.97 1.31 1.58 -1.11 0.00 0.00 175.55 176.96 2gre n HIS 268 N -2.92 1.58 0.00 2.71 -0.00 -0.95 -4.88 115.22 110.76 2gre n HIS 268 Ca 0.07 0.59 -0.18 0.00 0.46 0.00 0.00 57.72 58.66 2gre n HIS 268 Cb 0.55 -2.35 -0.14 0.00 -0.12 0.00 0.00 29.99 27.93 2gre n HIS 268 CO 0.00 0.00 0.00 -0.92 0.46 0.00 0.00 176.34 175.88 2gre h TYR 269 N 4.29 0.35 -0.18 1.57 -0.00 -1.92 -2.19 116.97 118.88 2gre h TYR 269 Ca -0.46 -0.25 0.03 0.00 -0.00 0.00 0.00 58.73 58.05 2gre h TYR 269 Cb 1.32 -0.01 -0.03 0.00 -0.00 0.00 0.00 36.73 38.01 2gre h TYR 269 CO 0.58 1.24 0.01 0.00 -0.00 0.00 0.00 178.16 179.99 2gre h ALA 270 N 0.03 0.17 -0.42 1.82 0.00 -1.99 -0.26 119.26 118.61 2gre h ALA 270 Ca -0.12 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2gre h ALA 270 Cb 1.44 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 2gre h ALA 270 CO 0.08 -0.42 0.13 1.25 0.00 0.00 0.00 179.25 180.29 2gre h LEU 271 N 0.08 0.56 -0.16 0.00 5.85 -1.91 -1.99 115.31 117.74 2gre h LEU 271 Ca 0.08 -0.07 -0.19 0.00 0.84 0.00 0.00 57.88 58.54 2gre h LEU 271 Cb 0.09 -0.14 0.01 0.00 0.37 0.00 0.00 40.66 40.99 2gre h LEU 271 CO -0.13 0.55 -0.65 -0.09 -0.34 0.00 0.00 178.44 177.77 2gre h ARG 272 N 0.61 0.72 -0.70 1.25 2.43 -1.09 -2.35 114.38 115.26 2gre h ARG 272 Ca 0.14 -0.57 0.05 0.00 -0.81 0.00 0.00 59.98 58.80 2gre h ARG 272 Cb 0.19 0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.81 2gre h ARG 272 CO -0.01 1.18 0.46 0.87 -1.51 0.00 0.00 179.97 180.96 2gre h LYS 273 N 0.43 0.74 0.20 0.20 1.57 -0.91 -2.08 116.57 116.70 2gre h LYS 273 Ca -0.04 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.71 2gre h LYS 273 Cb 1.29 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 33.40 2gre h LYS 273 CO 0.14 0.49 -0.26 1.25 -0.57 0.00 0.00 179.45 180.50 2gre h HIS 274 N 0.76 -0.68 -0.80 -1.35 2.76 -1.13 -0.87 115.15 113.83 2gre h HIS 274 Ca 0.29 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.46 2gre h HIS 274 Cb 0.20 0.27 -0.04 0.00 1.55 0.00 0.00 27.41 29.39 2gre h HIS 274 CO -0.00 -0.37 0.47 -0.07 -1.30 0.00 0.00 177.93 176.66 2gre h LEU 275 N -0.51 0.97 -0.35 0.26 3.38 -0.85 0.36 115.31 118.57 2gre h LEU 275 Ca 0.01 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 2gre h LEU 275 Cb 0.50 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2gre h LEU 275 CO -0.10 0.76 0.16 0.58 0.09 0.00 0.00 178.44 179.93 2gre h VAL 276 N 1.11 1.17 -0.41 1.22 2.07 -1.28 0.78 116.25 120.91 2gre h VAL 276 Ca 0.29 -0.49 -0.12 0.00 0.82 0.00 0.00 66.70 67.20 2gre h VAL 276 Cb -0.02 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 2gre h VAL 276 CO -0.05 0.18 -0.22 -0.08 0.02 0.00 0.00 177.57 177.42 2gre h GLU 277 N 0.43 0.82 -0.63 1.57 4.57 -0.28 -1.07 114.58 119.99 2gre h GLU 277 Ca 0.12 -0.33 0.06 0.00 -1.18 0.00 0.00 59.36 58.03 2gre h GLU 277 Cb 0.13 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.65 2gre h GLU 277 CO -0.01 0.96 0.42 -0.07 -1.18 0.00 0.00 179.01 179.13 2gre h LEU 278 N 0.72 0.54 -0.07 1.64 3.38 0.02 -0.72 115.31 120.81 2gre h LEU 278 Ca 0.10 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 2gre h LEU 278 Cb 0.74 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2gre h LEU 278 CO 0.06 0.35 -0.27 0.00 0.09 0.00 0.00 178.44 178.67 2gre h ALA 279 N 1.66 0.13 -0.46 1.53 0.00 0.06 -2.92 119.26 119.25 2gre h ALA 279 Ca 0.27 -0.42 0.05 0.00 0.00 0.00 0.00 54.91 54.82 2gre h ALA 279 Cb 0.29 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 2gre h ALA 279 CO -0.08 0.14 0.18 0.87 0.00 0.00 0.00 179.25 180.36 2gre h LYS 280 N -0.19 0.36 -0.98 0.00 1.57 -0.88 0.14 116.57 116.59 2gre h LYS 280 Ca -0.01 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.79 2gre h LYS 280 Cb 0.90 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 33.07 2gre h LYS 280 CO 0.06 0.24 0.64 1.15 -0.57 0.00 0.00 179.45 180.96 2gre h THR 281 N 0.37 1.14 -0.38 -0.16 2.02 -1.19 -2.80 112.91 111.90 2gre h THR 281 Ca 0.21 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 66.98 2gre h THR 281 Cb 0.19 -0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.43 2gre h THR 281 CO -0.20 0.22 0.00 0.59 0.37 0.00 0.00 175.52 176.50 2gre n ASN 282 N -4.46 3.89 -2.66 4.18 3.02 -0.88 -4.96 115.26 113.39 2gre n ASN 282 Ca 0.14 -2.59 -0.21 0.00 -0.03 0.00 0.00 54.58 51.88 2gre n ASN 282 Cb 0.13 -0.47 0.01 0.00 -0.61 0.00 0.00 39.78 38.84 2gre n ASN 282 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2gre n HIS 283 N 0.19 -1.42 -3.02 3.10 8.25 0.35 -4.94 115.22 117.74 2gre n HIS 283 Ca 0.20 0.21 -0.40 0.00 -0.26 0.00 0.00 57.72 57.47 2gre n HIS 283 Cb 0.77 -4.13 -0.05 0.00 1.12 0.00 0.00 29.99 27.71 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 -3.08 4.98 -0.16 1.59 1.01 -0.44 -5.01 121.20 120.09 2gre s ILE 284 Ca 0.13 1.42 -0.29 0.00 0.00 0.00 0.00 60.65 61.91 2gre s ILE 284 Cb -0.06 -4.04 -0.05 0.00 0.01 0.00 0.00 42.46 38.33 2gre s ILE 284 CO 0.16 0.13 1.86 -1.61 0.00 0.00 0.00 174.94 175.48 2gre s GLU 285 N 1.61 3.70 0.38 2.79 0.41 -1.26 -4.55 118.70 121.78 2gre s GLU 285 Ca 0.35 1.98 0.04 0.00 -0.41 0.00 0.00 54.97 56.93 2gre s GLU 285 Cb -0.17 -4.16 -0.05 0.00 -1.78 0.00 0.00 34.13 27.98 2gre s GLU 285 CO 0.14 -1.43 0.07 1.52 -0.49 0.00 0.00 175.26 175.06 2gre s TYR 286 N 5.86 1.96 -0.16 1.61 1.13 -1.26 -1.32 117.35 125.17 2gre s TYR 286 Ca 0.83 -1.02 -0.09 0.00 -1.41 0.00 0.00 57.07 55.38 2gre s TYR 286 Cb -0.31 -1.34 0.06 0.00 -1.10 0.00 0.00 41.96 39.26 2gre s TYR 286 CO 0.34 -0.00 0.39 0.21 -2.51 0.00 0.00 175.55 173.98 2gre s LYS 287 N -3.82 0.38 0.03 -3.49 2.20 -0.47 -4.80 119.74 109.77 2gre s LYS 287 Ca 0.29 0.74 -0.14 0.00 -0.36 0.00 0.00 55.97 56.50 2gre s LYS 287 Cb 0.06 -0.01 -0.06 0.00 -1.51 0.00 0.00 37.83 36.31 2gre s LYS 287 CO 0.14 -0.15 0.42 0.14 -0.36 0.00 0.00 175.35 175.54 2gre s VAL 288 N 1.29 5.02 0.04 4.02 -7.23 -1.26 -2.02 120.40 120.26 2gre s VAL 288 Ca -0.09 0.76 0.01 0.00 -1.81 0.00 0.00 61.98 60.85 2gre s VAL 288 Cb -0.08 -3.70 -0.02 0.00 0.56 0.00 0.00 36.38 33.13 2gre s VAL 288 CO -0.11 0.48 -0.06 -1.81 -0.31 0.00 0.00 175.10 173.29 2gre s ASP 289 N -1.29 0.64 -0.25 4.85 1.01 0.13 -4.94 116.67 116.82 2gre s ASP 289 Ca 0.27 -0.57 -0.05 0.00 0.71 0.00 0.00 52.55 52.91 2gre s ASP 289 Cb -0.16 0.07 -0.00 0.00 1.01 0.00 0.00 42.92 43.84 2gre s ASP 289 CO 0.15 -0.27 -0.00 -0.63 0.21 0.00 0.00 175.17 174.63 2gre s ILE 290 N -1.62 3.57 -0.61 0.77 1.01 -1.26 -0.74 121.20 122.31 2gre s ILE 290 Ca -0.10 -0.57 -0.21 0.00 0.00 0.00 0.00 60.65 59.77 2gre s ILE 290 Cb -0.09 -2.71 0.08 0.00 0.01 0.00 0.00 42.46 39.76 2gre s ILE 290 CO -0.01 0.30 0.81 -0.31 0.00 0.00 0.00 174.94 175.73 2gre s TYR 291 N 1.48 2.86 -0.29 3.97 2.02 -1.00 -4.55 117.35 121.84 2gre s TYR 291 Ca 0.04 -0.73 0.25 0.00 -0.37 0.00 0.00 57.07 56.27 2gre s TYR 291 Cb -0.15 -4.09 1.14 0.00 -0.40 0.00 0.00 41.96 38.46 2gre s TYR 291 CO -0.01 -1.42 1.77 -1.35 -1.57 0.00 0.00 175.55 172.97 2gre h PRO 292 N 9.33 0.00 -0.62 -1.71 0.11 -1.86 -2.92 132.00 134.33 2gre h PRO 292 Ca -0.29 0.00 -0.45 0.00 0.11 0.00 0.00 66.00 65.37 2gre h PRO 292 Cb 1.08 0.00 -0.37 0.00 0.11 0.00 0.00 31.00 31.82 2gre h PRO 292 CO 1.12 0.00 -0.80 0.66 -0.21 0.00 0.00 178.00 178.77 2gre n TYR 293 N -2.40 2.25 -2.23 0.65 4.01 -1.26 -4.08 117.16 114.10 2gre n TYR 293 Ca 0.01 -2.10 0.00 0.00 -0.16 0.00 0.00 57.90 55.65 2gre n TYR 293 Cb 0.19 -0.32 0.00 0.00 -0.31 0.00 0.00 39.34 38.90 2gre n TYR 293 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2gre n TYR 294 N -0.74 0.00 0.00 -0.72 4.02 -1.24 -4.91 117.16 113.57 2gre n TYR 294 Ca 0.38 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.27 2gre n TYR 294 Cb 0.92 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.24 2gre n TYR 294 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2gre n ARG 303 N 0.00 0.00 -2.34 -0.72 3.00 -1.26 -4.71 116.66 110.63 2gre n ARG 303 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.85 57.42 2gre n ARG 303 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.44 2gre n ARG 303 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2gre s ALA 304 N 0.00 2.86 0.00 7.54 0.00 -1.26 -4.46 121.76 126.44 2gre s ALA 304 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 51.51 2gre s ALA 304 Cb 0.00 -4.05 0.00 0.00 0.00 0.00 0.00 23.12 19.07 2gre s ALA 304 CO 0.00 -2.79 0.43 0.41 0.00 0.00 0.00 175.76 173.81 2gre n GLY 305 N 5.23 -1.01 3.74 0.00 0.00 -1.26 -5.10 105.19 106.80 2gre n GLY 305 Ca 0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.13 2.95 -1.34 1.61 0.40 -1.26 -5.05 117.98 115.17 2gre s PHE 306 Ca 0.00 -0.13 -0.07 0.00 -0.60 0.00 0.00 56.93 56.13 2gre s PHE 306 Cb 0.00 -1.36 0.05 0.00 0.51 0.00 0.00 43.02 42.22 2gre s PHE 306 CO 0.00 0.55 2.60 -3.47 0.70 0.00 0.00 175.22 175.60 2gre n ASP 307 N -0.77 8.12 -4.08 1.36 -0.08 -1.26 -4.92 116.55 114.92 2gre n ASP 307 Ca -0.08 -2.97 -0.10 0.00 -1.51 0.00 0.00 54.79 50.14 2gre n ASP 307 Cb 0.57 -1.41 -0.11 0.00 2.34 0.00 0.00 41.12 42.51 2gre n ASP 307 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2gre s VAL 308 N -0.21 0.41 -0.25 5.18 1.01 -1.26 -4.93 120.40 120.35 2gre s VAL 308 Ca 0.59 -1.49 -0.19 0.00 0.00 0.00 0.00 61.98 60.89 2gre s VAL 308 Cb 0.20 -1.10 -0.02 0.00 0.00 0.00 0.00 36.38 35.45 2gre s VAL 308 CO -0.09 -0.72 0.56 -0.54 0.00 0.00 0.00 175.10 174.31 2gre s LYS 309 N -2.85 4.10 -0.06 2.72 1.02 0.61 -4.92 119.74 120.36 2gre s LYS 309 Ca -0.00 0.42 -0.05 0.00 0.02 0.00 0.00 55.97 56.35 2gre s LYS 309 Cb -0.01 -3.64 -0.04 0.00 -0.52 0.00 0.00 37.83 33.63 2gre s LYS 309 CO -0.04 -0.34 0.17 -1.01 -0.92 0.00 0.00 175.35 173.21 2gre s HIS 310 N 2.28 3.58 0.06 3.18 3.76 -1.26 0.89 115.29 127.78 2gre s HIS 310 Ca 0.23 0.48 -0.06 0.00 -0.15 0.00 0.00 55.06 55.56 2gre s HIS 310 Cb -0.16 -1.91 -0.01 0.00 1.11 0.00 0.00 32.58 31.61 2gre s HIS 310 CO 0.09 0.69 0.11 0.00 -0.85 0.00 0.00 174.74 174.78 2gre s ALA 311 N -1.17 0.02 -0.06 -1.40 0.00 0.11 -2.25 121.76 117.01 2gre s ALA 311 Ca 0.21 -0.76 -0.03 0.00 0.00 0.00 0.00 51.96 51.38 2gre s ALA 311 Cb -0.12 0.36 0.04 0.00 0.00 0.00 0.00 23.12 23.40 2gre s ALA 311 CO 0.11 -0.42 0.12 -1.17 0.00 0.00 0.00 175.76 174.39 2gre s LEU 312 N -2.68 0.15 0.38 0.00 0.20 -1.26 -0.29 118.68 115.18 2gre s LEU 312 Ca 0.03 0.23 0.04 0.00 0.69 0.00 0.00 54.13 55.11 2gre s LEU 312 Cb 0.04 0.12 -0.05 0.00 -0.43 0.00 0.00 46.19 45.87 2gre s LEU 312 CO -0.09 -0.23 0.06 0.27 -0.29 0.00 0.00 176.35 176.07 2gre s ILE 313 N 2.06 1.17 0.00 6.68 -4.36 -0.67 -0.58 121.20 125.50 2gre s ILE 313 Ca 0.02 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.41 2gre s ILE 313 Cb -0.12 -2.65 0.00 0.00 1.25 0.00 0.00 42.46 40.94 2gre s ILE 313 CO -0.05 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.74 2gre n GLY 314 N -0.85 0.75 3.55 6.27 0.00 -0.57 -1.28 105.19 113.06 2gre n GLY 314 Ca -0.06 -0.74 -0.45 0.00 0.00 0.00 0.00 46.02 44.77 2gre n GLY 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gre n ALA 315 N -0.11 -0.73 -2.65 4.61 0.00 -1.26 -0.94 120.51 119.43 2gre n ALA 315 Ca 0.00 0.40 -0.43 0.00 0.00 0.00 0.00 53.44 53.41 2gre n ALA 315 Cb 0.00 -1.94 -0.02 0.00 0.00 0.00 0.00 19.45 17.49 2gre n ALA 315 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2gre s GLY 316 N -0.64 1.66 -0.05 0.00 0.00 -1.21 -4.75 107.32 102.33 2gre s GLY 316 Ca 0.60 0.12 0.01 0.00 0.00 0.00 0.00 44.72 45.44 2gre s GLY 316 CO 0.59 2.21 -0.05 -0.26 0.00 0.00 0.00 173.10 175.60 2gre s ILE 317 N 3.32 3.88 0.39 0.90 -0.00 -1.26 -4.09 121.20 124.34 2gre s ILE 317 Ca 0.44 -0.49 -0.17 0.00 -0.00 0.00 0.00 60.65 60.43 2gre s ILE 317 Cb -0.14 -2.63 -0.10 0.00 -0.00 0.00 0.00 42.46 39.59 2gre s ILE 317 CO 0.09 0.54 0.85 -0.62 -0.00 0.00 0.00 174.94 175.80 2gre s ASP 318 N -1.01 6.81 -1.23 4.36 2.15 0.45 -4.62 116.67 123.58 2gre s ASP 318 Ca 0.14 1.47 -0.04 0.00 0.43 0.00 0.00 52.55 54.55 2gre s ASP 318 Cb -0.11 -2.45 -0.01 0.00 -0.30 0.00 0.00 42.92 40.05 2gre s ASP 318 CO 0.04 -0.32 0.78 -0.24 -0.17 0.00 0.00 175.17 175.25 2gre n SER 319 N -0.66 -2.61 -3.17 -0.34 2.88 -1.26 -2.30 113.62 106.17 2gre n SER 319 Ca 0.05 -0.81 -0.21 0.00 -1.33 0.00 0.00 58.87 56.57 2gre n SER 319 Cb 0.54 -4.24 -0.02 0.00 -0.75 0.00 0.00 64.21 59.74 2gre n SER 319 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2gre n SER 320 N -3.03 4.82 -2.71 -3.46 3.41 -1.26 -3.38 113.62 108.00 2gre n SER 320 Ca -0.24 -2.31 -0.27 0.00 -0.26 0.00 0.00 58.87 55.79 2gre n SER 320 Cb 0.66 -1.08 -0.09 0.00 -0.26 0.00 0.00 64.21 63.44 2gre n SER 320 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2gre n PHE 323 N 4.22 0.39 -4.23 7.33 3.01 -1.26 -4.96 117.46 121.97 2gre n PHE 323 Ca 0.43 0.27 -0.25 0.00 1.01 0.00 0.00 57.45 58.91 2gre n PHE 323 Cb 0.13 -1.44 -0.07 0.00 -0.01 0.00 0.00 39.48 38.08 2gre n PHE 323 CO 0.00 0.00 0.00 -1.83 1.01 0.00 0.00 176.76 175.94 2gre s GLU 324 N 5.20 2.38 0.04 -1.08 -1.05 -1.14 -4.90 118.70 118.16 2gre s GLU 324 Ca 0.81 -1.20 -0.20 0.00 -0.15 0.00 0.00 54.97 54.23 2gre s GLU 324 Cb -0.79 -2.30 0.04 0.00 -0.44 0.00 0.00 34.13 30.64 2gre s GLU 324 CO 0.31 0.43 0.47 0.50 0.95 0.00 0.00 175.26 177.92 2gre s ARG 325 N -3.19 0.97 0.15 -4.83 3.52 -0.97 -2.25 118.95 112.35 2gre s ARG 325 Ca 0.29 -0.28 -0.14 0.00 -0.13 0.00 0.00 55.73 55.47 2gre s ARG 325 Cb -0.08 0.44 0.02 0.00 -1.56 0.00 0.00 34.95 33.76 2gre s ARG 325 CO 0.19 -0.34 0.38 -0.08 -0.81 0.00 0.00 175.30 174.64 2gre s THR 326 N -2.39 0.07 0.10 4.11 -1.32 -0.92 -0.41 115.64 114.88 2gre s THR 326 Ca -0.06 -0.89 -0.03 0.00 -1.21 0.00 0.00 61.69 59.50 2gre s THR 326 Cb -0.01 -1.46 -0.05 0.00 -1.51 0.00 0.00 72.50 69.47 2gre s THR 326 CO -0.01 -0.30 0.30 -2.28 -2.21 0.00 0.00 174.62 170.12 2gre s HIS 327 N -3.87 3.50 0.39 9.09 2.46 -1.01 -1.01 115.29 124.84 2gre s HIS 327 Ca 0.08 0.44 0.15 0.00 0.47 0.00 0.00 55.06 56.20 2gre s HIS 327 Cb 0.02 -1.91 1.01 0.00 -0.13 0.00 0.00 32.58 31.57 2gre s HIS 327 CO -0.07 0.51 1.84 1.05 -2.47 0.00 0.00 174.74 175.60 2gre h GLU 328 N 3.00 0.47 0.00 2.88 4.11 -1.03 -0.98 114.58 123.02 2gre h GLU 328 Ca -0.46 -0.03 -0.01 0.00 0.07 0.00 0.00 59.36 58.93 2gre h GLU 328 Cb 1.16 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 2gre h GLU 328 CO 0.74 0.31 -0.05 0.66 0.07 0.00 0.00 179.01 180.74 2gre h SER 329 N 0.48 0.00 1.47 3.06 4.64 -1.86 0.05 113.55 121.40 2gre h SER 329 Ca 0.49 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.71 2gre h SER 329 Cb 1.12 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.19 2gre h SER 329 CO -0.22 0.05 -0.54 -1.28 -0.87 0.00 0.00 176.83 173.98 2gre h SER 330 N 0.00 0.00 -0.03 4.97 0.87 -1.33 -1.47 113.55 116.57 2gre h SER 330 Ca -0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2gre h SER 330 Cb 0.09 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.05 2gre h SER 330 CO 0.01 0.46 -0.03 0.40 -0.53 0.00 0.00 176.83 177.13 2gre h ILE 331 N 0.00 1.40 -0.47 2.23 2.04 -1.06 -1.63 117.51 120.03 2gre h ILE 331 Ca -0.02 -1.24 0.08 0.00 1.00 0.00 0.00 64.86 64.69 2gre h ILE 331 Cb 1.36 2.18 -0.10 0.00 -0.74 0.00 0.00 36.82 39.53 2gre h ILE 331 CO 0.06 0.33 -0.37 0.00 0.00 0.00 0.00 178.15 178.17 2gre h ALA 332 N 0.50 -0.24 -0.44 1.87 0.00 -1.03 0.22 119.26 120.14 2gre h ALA 332 Ca 0.00 0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.05 2gre h ALA 332 Cb 0.55 0.81 -0.04 0.00 0.00 0.00 0.00 17.79 19.12 2gre h ALA 332 CO 0.01 -0.77 0.23 0.45 0.00 0.00 0.00 179.25 179.17 2gre h HIS 333 N -0.25 0.43 -0.66 0.00 3.86 -1.27 -1.48 115.15 115.78 2gre h HIS 333 Ca 0.18 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.39 2gre h HIS 333 Cb 0.56 -0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.87 2gre h HIS 333 CO -0.61 0.23 0.33 1.15 0.86 0.00 0.00 177.93 179.89 2gre h THR 334 N 0.47 1.21 -0.45 2.45 2.02 -0.52 -0.91 112.91 117.17 2gre h THR 334 Ca 0.19 -0.56 -0.06 0.00 0.77 0.00 0.00 66.41 66.75 2gre h THR 334 Cb 0.08 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 66.82 2gre h THR 334 CO -0.12 0.24 0.06 -0.33 0.37 0.00 0.00 175.52 175.74 2gre h GLU 335 N 0.92 0.76 -0.61 6.66 5.08 -0.07 -0.94 114.58 126.38 2gre h GLU 335 Ca 0.23 -0.21 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 2gre h GLU 335 Cb 0.07 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 2gre h GLU 335 CO -0.03 0.79 0.19 0.00 -1.00 0.00 0.00 179.01 178.95 2gre h ALA 336 N 0.94 0.80 -0.14 3.43 0.00 -0.71 -2.30 119.26 121.27 2gre h ALA 336 Ca 0.13 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2gre h ALA 336 Cb 0.41 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2gre h ALA 336 CO 0.01 0.47 0.04 1.25 0.00 0.00 0.00 179.25 181.02 2gre h LEU 337 N 0.87 0.22 -1.08 0.00 6.46 -0.94 0.26 115.31 121.10 2gre h LEU 337 Ca 0.20 -0.23 -0.00 0.00 -0.12 0.00 0.00 57.88 57.73 2gre h LEU 337 Cb 0.29 -0.06 -0.04 0.00 -0.73 0.00 0.00 40.66 40.13 2gre h LEU 337 CO -0.01 0.39 0.52 1.62 -0.62 0.00 0.00 178.44 180.34 2gre h VAL 338 N 0.04 1.23 0.18 1.05 3.04 -1.20 0.25 116.25 120.84 2gre h VAL 338 Ca 0.05 -0.50 -0.01 0.00 -1.01 0.00 0.00 66.70 65.23 2gre h VAL 338 Cb 0.25 0.03 0.00 0.00 -2.01 0.00 0.00 31.29 29.57 2gre h VAL 338 CO 0.00 0.24 -0.09 0.22 -1.01 0.00 0.00 177.57 176.94 2gre h TYR 339 N 1.16 -0.22 -0.67 3.17 5.03 -1.01 -1.21 116.97 123.23 2gre h TYR 339 Ca 0.30 -0.01 0.04 0.00 2.58 0.00 0.00 58.73 61.65 2gre h TYR 339 Cb -0.06 0.07 -0.05 0.00 1.55 0.00 0.00 36.73 38.25 2gre h TYR 339 CO 0.00 0.02 0.40 0.00 -1.32 0.00 0.00 178.16 177.27 2gre h ALA 340 N 0.33 0.88 -0.24 1.82 0.00 -0.08 -2.65 119.26 119.31 2gre h ALA 340 Ca -0.02 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.91 2gre h ALA 340 Cb 0.35 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2gre h ALA 340 CO 0.04 0.14 0.03 -0.92 0.00 0.00 0.00 179.25 178.54 2gre h TYR 341 N 0.78 0.04 0.00 0.00 5.03 -0.42 -1.48 116.97 120.92 2gre h TYR 341 Ca 0.28 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.60 2gre h TYR 341 Cb 0.07 0.02 0.00 0.00 1.55 0.00 0.00 36.73 38.37 2gre h TYR 341 CO -0.05 -0.00 0.00 0.28 -1.32 0.00 0.00 178.16 177.06 2gre n VAL 342 N -5.11 0.00 -0.90 1.81 0.31 -0.46 -4.79 118.33 109.19 2gre n VAL 342 Ca -0.01 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.35 2gre n VAL 342 Cb 0.12 -0.32 -0.02 0.00 -0.91 0.00 0.00 33.84 32.71 2gre n VAL 342 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2gre n SER 344 N 0.80 -2.43 -4.88 4.52 3.41 -0.56 -4.54 113.62 109.95 2gre n SER 344 Ca 0.00 0.48 -0.30 0.00 -0.26 0.00 0.00 58.87 58.79 2gre n SER 344 Cb 0.00 -2.58 -0.01 0.00 -0.26 0.00 0.00 64.21 61.36 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 -5.36 6.34 0.82 4.04 -0.87 -1.26 -4.92 114.94 113.73 2gre s ASN 345 Ca 0.00 1.25 -0.12 0.00 -1.57 0.00 0.00 52.86 52.42 2gre s ASN 345 Cb 0.00 -2.39 0.09 0.00 -0.02 0.00 0.00 41.25 38.93 2gre s ASN 345 CO 0.00 -0.67 1.18 -0.76 -2.57 0.00 0.00 177.10 174.28 2gre s LEU 346 N -4.69 3.09 -0.22 0.60 1.43 -1.26 -4.97 118.68 112.66 2gre s LEU 346 Ca 0.53 2.28 -0.21 0.00 -1.03 0.00 0.00 54.13 55.69 2gre s LEU 346 Cb -0.11 -4.58 -0.02 0.00 0.03 0.00 0.00 46.19 41.52 2gre s LEU 346 CO 0.45 -2.67 0.64 -0.51 0.23 0.00 0.00 176.35 174.49 2gre s ILE 347 N -2.31 5.00 -2.00 -0.59 1.10 -1.26 -5.23 121.20 115.90 2gre s ILE 347 Ca 0.71 1.20 0.30 0.00 -0.51 0.00 0.00 60.65 62.34 2gre s ILE 347 Cb -0.26 -3.95 0.84 0.00 0.15 0.00 0.00 42.46 39.23 2gre s ILE 347 CO 0.52 0.07 2.10 -1.84 -2.11 0.00 0.00 174.94 173.68