#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gre n HIS 4 N 0.00 -1.07 -0.04 -1.40 -0.00 -1.26 -4.78 115.22 106.67 2gre n HIS 4 Ca 0.00 0.19 -0.15 0.00 -0.00 0.00 0.00 57.72 57.76 2gre n HIS 4 Cb 0.00 0.41 -0.08 0.00 -0.00 0.00 0.00 29.99 30.32 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 1.36 -0.65 1.59 2.02 -1.99 -2.07 112.91 113.17 2gre h THR 5 Ca 0.00 -1.69 0.14 0.00 0.77 0.00 0.00 66.41 65.62 2gre h THR 5 Cb 0.12 2.07 -0.10 0.00 -1.74 0.00 0.00 68.15 68.50 2gre h THR 5 CO 0.00 0.51 0.05 0.07 0.37 0.00 0.00 175.52 176.52 2gre h LYS 6 N 0.12 0.16 -0.62 6.66 2.10 -1.97 -2.09 116.57 120.93 2gre h LYS 6 Ca -0.01 -0.01 -0.09 0.00 -2.00 0.00 0.00 60.65 58.53 2gre h LYS 6 Cb 1.02 -0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 32.29 2gre h LYS 6 CO 0.09 0.11 0.02 0.93 -2.00 0.00 0.00 179.45 178.59 2gre h GLU 7 N 0.16 1.09 0.00 0.07 5.08 -1.85 0.11 114.58 119.25 2gre h GLU 7 Ca 0.35 -0.34 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2gre h GLU 7 Cb 0.57 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2gre h GLU 7 CO -0.52 1.05 0.00 2.41 -1.00 0.00 0.00 179.01 180.95 2gre n THR 8 N -4.19 0.00 0.00 1.13 -1.04 -0.79 -1.82 114.28 107.57 2gre n THR 8 Ca 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 2gre n THR 8 Cb 0.34 -0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.85 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 0.25 0.00 -0.09 -2.82 -0.58 0.39 -1.28 120.64 116.51 2gre n GLU 10 Ca 0.00 0.00 -0.09 0.00 -0.42 0.00 0.00 57.16 56.65 2gre n GLU 10 Cb 0.00 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 30.85 2gre n GLU 10 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2gre h LEU 11 N 0.00 0.36 -0.95 -4.62 5.85 -1.64 0.98 115.31 115.28 2gre h LEU 11 Ca 0.00 -0.04 0.24 0.00 0.84 0.00 0.00 57.88 58.92 2gre h LEU 11 Cb 0.00 -0.09 -0.13 0.00 0.37 0.00 0.00 40.66 40.81 2gre h LEU 11 CO 0.00 0.29 0.50 0.40 -0.34 0.00 0.00 178.44 179.30 2gre h ILE 12 N 0.40 0.50 -0.05 4.05 2.04 -1.47 0.17 117.51 123.15 2gre h ILE 12 Ca 0.11 -0.17 -0.17 0.00 1.00 0.00 0.00 64.86 65.63 2gre h ILE 12 Cb -0.00 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.03 2gre h ILE 12 CO -0.02 0.09 -0.71 0.50 0.00 0.00 0.00 178.15 178.01 2gre h LYS 13 N 0.49 0.27 -0.20 2.37 3.64 -1.53 0.28 116.57 121.89 2gre h LYS 13 Ca 0.61 -0.22 -0.02 0.00 -1.27 0.00 0.00 60.65 59.75 2gre h LYS 13 Cb 1.17 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 33.03 2gre h LYS 13 CO -0.51 0.87 0.06 0.93 -2.27 0.00 0.00 179.45 178.54 2gre h GLU 14 N 0.19 0.31 0.42 1.90 5.08 0.72 -2.73 114.58 120.48 2gre h GLU 14 Ca -0.02 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 2gre h GLU 14 Cb 1.26 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.47 2gre h GLU 14 CO 0.11 0.41 -0.20 -0.07 -1.00 0.00 0.00 179.01 178.26 2gre h LEU 15 N 0.15 -0.48 -1.67 1.33 3.38 -0.49 -2.78 115.31 114.76 2gre h LEU 15 Ca 0.07 -0.11 0.35 0.00 0.09 0.00 0.00 57.88 58.27 2gre h LEU 15 Cb 0.22 0.12 -0.08 0.00 0.09 0.00 0.00 40.66 41.02 2gre h LEU 15 CO -0.00 -0.09 0.82 0.58 0.09 0.00 0.00 178.44 179.84 2gre h VAL 16 N -0.94 0.37 0.00 1.22 2.07 -0.57 -0.45 116.25 117.95 2gre h VAL 16 Ca -0.06 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.41 2gre h VAL 16 Cb 0.56 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 2gre h VAL 16 CO 0.10 0.03 0.00 -1.20 0.02 0.00 0.00 177.57 176.51 2gre n SER 17 N -4.41 0.05 -4.31 0.57 7.64 -1.03 -4.51 113.62 107.62 2gre n SER 17 Ca 0.29 0.51 -0.40 0.00 1.01 0.00 0.00 58.87 60.27 2gre n SER 17 Cb 1.20 -0.52 -0.11 0.00 -1.01 0.00 0.00 64.21 63.77 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 -3.01 4.31 0.26 0.44 1.01 -0.18 -5.07 121.20 118.97 2gre s ILE 18 Ca 0.12 -1.18 -0.31 0.00 0.00 0.00 0.00 60.65 59.28 2gre s ILE 18 Cb 0.16 -3.54 -0.13 0.00 0.01 0.00 0.00 42.46 38.96 2gre s ILE 18 CO 0.46 -0.38 1.42 -2.65 0.00 0.00 0.00 174.94 173.79 2gre n PRO 19 N 4.94 2.16 -2.81 2.79 -0.02 -1.26 -4.88 135.00 135.92 2gre n PRO 19 Ca -0.11 0.77 -0.10 0.00 -2.02 0.00 0.00 63.50 62.03 2gre n PRO 19 Cb 0.44 -2.43 0.05 0.00 -0.02 0.00 0.00 33.50 31.53 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 1.99 -2.26 -4.78 2.55 3.41 -1.26 -4.66 113.62 108.61 2gre n SER 20 Ca 0.10 -3.35 -0.33 0.00 -0.26 0.00 0.00 58.87 55.03 2gre n SER 20 Cb 0.33 1.50 0.03 0.00 -0.26 0.00 0.00 64.21 65.81 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 0.23 3.02 0.16 4.33 0.04 -1.25 -1.89 135.00 139.65 2gre s PRO 21 Ca 0.30 1.35 -0.33 0.00 0.04 0.00 0.00 61.00 62.36 2gre s PRO 21 Cb 0.25 -1.98 -0.15 0.00 0.04 0.00 0.00 34.50 32.65 2gre s PRO 21 CO -0.17 -1.07 1.26 0.43 0.04 0.00 0.00 177.00 177.49 2gre n SER 22 N -2.18 1.73 0.00 6.66 7.64 -0.49 -1.19 113.62 125.79 2gre n SER 22 Ca 0.10 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.11 2gre n SER 22 Cb 0.52 -1.26 0.00 0.00 -1.01 0.00 0.00 64.21 62.47 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 2.23 3.10 2.27 0.23 0.00 -1.26 -4.93 105.19 106.83 2gre n GLY 23 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 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 0.47 -0.04 1.61 5.15 -0.34 -4.93 115.26 117.18 2gre n ASN 24 Ca 0.00 -2.71 0.00 0.00 -0.60 0.00 0.00 54.58 51.27 2gre n ASN 24 Cb 0.00 -0.63 0.01 0.00 -0.53 0.00 0.00 39.78 38.63 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 1.66 0.23 -0.31 -0.44 -2.24 -1.26 -3.79 114.28 108.14 2gre n THR 25 Ca 0.24 -0.62 0.31 0.00 -2.27 0.00 0.00 64.05 61.71 2gre n THR 25 Cb 0.50 0.90 0.68 0.00 -2.10 0.00 0.00 70.33 70.31 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 0.18 2.85 0.50 6.98 0.00 -1.92 -2.16 119.26 125.70 2gre h ALA 26 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2gre h ALA 26 Cb 0.15 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2gre h ALA 26 CO 0.00 -1.20 -0.24 -0.22 0.00 0.00 0.00 179.25 177.59 2gre h LYS 27 N 0.11 -0.65 -0.24 0.00 3.11 -1.89 -2.30 116.57 114.71 2gre h LYS 27 Ca 0.56 0.04 -0.02 0.00 -2.81 0.00 0.00 60.65 58.43 2gre h LYS 27 Cb 2.01 0.15 -0.01 0.00 -1.00 0.00 0.00 32.23 33.37 2gre h LYS 27 CO -0.09 -0.35 0.07 0.97 -2.81 0.00 0.00 179.45 177.23 2gre h ILE 28 N -1.04 1.11 -0.21 2.00 2.10 -1.73 0.37 117.51 120.13 2gre h ILE 28 Ca -0.07 -0.39 -0.04 0.00 1.08 0.00 0.00 64.86 65.44 2gre h ILE 28 Cb 0.60 0.87 -0.01 0.00 -1.09 0.00 0.00 36.82 37.19 2gre h ILE 28 CO 0.11 0.14 -0.02 0.40 -1.08 0.00 0.00 178.15 177.70 2gre h ILE 29 N 0.33 1.27 -0.46 2.19 5.03 -1.42 -0.21 117.51 124.24 2gre h ILE 29 Ca 0.08 -0.95 0.08 0.00 -0.12 0.00 0.00 64.86 63.94 2gre h ILE 29 Cb 0.12 1.49 -0.06 0.00 -3.03 0.00 0.00 36.82 35.33 2gre h ILE 29 CO -0.00 0.29 0.08 0.78 -0.68 0.00 0.00 178.15 178.62 2gre h ASN 30 N 0.12 -0.02 -0.58 1.72 4.21 -0.71 0.51 115.58 120.82 2gre h ASN 30 Ca 0.06 0.08 0.11 0.00 1.21 0.00 0.00 56.30 57.76 2gre h ASN 30 Cb 0.45 0.12 -0.09 0.00 -1.12 0.00 0.00 38.32 37.68 2gre h ASN 30 CO 0.02 0.02 0.08 0.15 -1.29 0.00 0.00 177.43 176.40 2gre h PHE 31 N 0.21 0.11 -0.29 1.19 3.04 -0.61 0.24 116.94 120.82 2gre h PHE 31 Ca 0.23 0.04 -0.09 0.00 3.98 0.00 0.00 57.97 62.12 2gre h PHE 31 Cb 0.30 0.04 -0.01 0.00 2.56 0.00 0.00 35.95 38.84 2gre h PHE 31 CO -0.23 -0.07 -0.17 0.82 -2.02 0.00 0.00 178.31 176.64 2gre h ILE 32 N 0.20 1.30 -0.61 1.41 2.04 -0.12 -0.18 117.51 121.54 2gre h ILE 32 Ca 0.30 -1.28 0.12 0.00 1.00 0.00 0.00 64.86 65.00 2gre h ILE 32 Cb 0.46 1.49 -0.12 0.00 -0.74 0.00 0.00 36.82 37.91 2gre h ILE 32 CO -0.43 0.41 -0.20 -0.33 0.00 0.00 0.00 178.15 177.60 2gre h GLU 33 N 0.38 -0.04 -0.54 2.37 5.08 0.12 -0.99 114.58 120.95 2gre h GLU 33 Ca 0.06 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 2gre h GLU 33 Cb 0.70 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.93 2gre h GLU 33 CO 0.05 -0.03 0.16 -0.91 -1.00 0.00 0.00 179.01 177.28 2gre h ASN 34 N -0.05 0.75 -0.25 1.42 4.21 -0.30 -2.92 115.58 118.44 2gre h ASN 34 Ca 0.29 -0.12 -0.02 0.00 1.21 0.00 0.00 56.30 57.65 2gre h ASN 34 Cb 0.49 -0.19 -0.02 0.00 -1.12 0.00 0.00 38.32 37.48 2gre h ASN 34 CO -0.65 0.72 0.10 0.22 -1.29 0.00 0.00 177.43 176.52 2gre h TYR 35 N 0.79 0.45 -0.47 1.19 3.20 0.31 -2.21 116.97 120.23 2gre h TYR 35 Ca 0.18 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.03 2gre h TYR 35 Cb 0.25 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.38 2gre h TYR 35 CO 0.01 0.39 0.00 1.33 -1.64 0.00 0.00 178.16 178.25 2gre n VAL 36 N -4.38 0.62 -0.27 1.81 0.24 -0.92 -4.72 118.33 110.70 2gre n VAL 36 Ca 0.02 -0.76 0.03 0.00 -2.04 0.00 0.00 64.34 61.59 2gre n VAL 36 Cb 0.16 0.71 0.12 0.00 -1.47 0.00 0.00 33.84 33.36 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 4.01 -0.62 0.33 -1.34 4.64 -1.20 -1.10 113.55 118.27 2gre h SER 37 Ca 0.00 0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2gre h SER 37 Cb 0.89 0.45 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 2gre h SER 37 CO 0.00 -0.24 -0.22 -0.62 -0.87 0.00 0.00 176.83 174.87 2gre n GLU 38 N -5.47 0.68 -2.01 4.77 -0.58 -1.26 -4.94 120.64 111.82 2gre n GLU 38 Ca 0.12 -0.34 -0.32 0.00 -0.42 0.00 0.00 57.16 56.20 2gre n GLU 38 Cb 0.43 -1.49 0.01 0.00 -0.57 0.00 0.00 31.44 29.82 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 -2.56 3.20 0.48 -0.32 0.52 -0.42 -4.94 118.94 114.90 2gre s TRP 39 Ca 0.24 1.46 0.26 0.00 0.02 0.00 0.00 56.10 58.07 2gre s TRP 39 Cb 0.19 -2.89 1.31 0.00 -1.15 0.00 0.00 33.47 30.93 2gre s TRP 39 CO 0.52 -0.91 1.86 -0.91 0.02 0.00 0.00 176.95 177.53 2gre h ASN 40 N 0.22 0.19 -3.03 2.95 2.35 -1.92 -3.45 115.58 112.89 2gre h ASN 40 Ca -0.46 0.03 -0.53 0.00 -0.55 0.00 0.00 56.30 54.79 2gre h ASN 40 Cb 1.21 -0.01 0.08 0.00 0.05 0.00 0.00 38.32 39.64 2gre h ASN 40 CO 0.59 0.06 0.93 0.55 -1.65 0.00 0.00 177.43 177.91 2gre n VAL 41 N -4.39 0.62 -2.07 2.81 3.14 -1.26 -4.95 118.33 112.23 2gre n VAL 41 Ca 0.20 -0.16 -0.42 0.00 -2.96 0.00 0.00 64.34 61.00 2gre n VAL 41 Cb 0.89 -1.96 -0.03 0.00 -1.06 0.00 0.00 33.84 31.68 2gre n VAL 41 CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 2gre s GLU 42 N 0.14 4.23 -0.03 1.45 2.12 -0.91 -4.89 118.70 120.80 2gre s GLU 42 Ca 0.68 2.14 0.06 0.00 0.36 0.00 0.00 54.97 58.22 2gre s GLU 42 Cb -0.50 -3.67 -0.02 0.00 0.26 0.00 0.00 34.13 30.19 2gre s GLU 42 CO 0.42 -0.70 -0.21 -0.08 -0.54 0.00 0.00 175.26 174.15 2gre s THR 43 N 2.86 2.44 -0.07 -1.70 -1.32 -1.26 -0.22 115.64 116.37 2gre s THR 43 Ca 0.69 -0.96 -0.27 0.00 -1.21 0.00 0.00 61.69 59.94 2gre s THR 43 Cb -0.35 -1.89 0.06 0.00 -1.51 0.00 0.00 72.50 68.81 2gre s THR 43 CO 0.29 0.58 0.62 -0.75 -2.21 0.00 0.00 174.62 173.15 2gre s LYS 44 N -0.61 0.96 -0.38 7.08 2.20 -0.81 -4.96 119.74 123.22 2gre s LYS 44 Ca 0.09 0.28 -0.07 0.00 -0.36 0.00 0.00 55.97 55.92 2gre s LYS 44 Cb -0.11 0.45 0.07 0.00 -1.51 0.00 0.00 37.83 36.73 2gre s LYS 44 CO -0.00 -0.28 0.18 1.03 -0.36 0.00 0.00 175.35 175.92 2gre s ARG 45 N -1.00 2.52 0.06 4.03 0.52 -1.26 0.06 118.95 123.88 2gre s ARG 45 Ca -0.10 -1.39 -0.01 0.00 -0.52 0.00 0.00 55.73 53.71 2gre s ARG 45 Cb -0.01 -3.60 -0.01 0.00 0.52 0.00 0.00 34.95 31.85 2gre s ARG 45 CO 0.08 -0.84 -0.05 0.09 0.02 0.00 0.00 175.30 174.60 2gre n ASN 46 N 4.81 -0.38 0.15 0.23 5.03 -0.90 -4.86 115.26 119.34 2gre n ASN 46 Ca -0.10 0.02 0.00 0.00 0.87 0.00 0.00 54.58 55.37 2gre n ASN 46 Cb 0.43 -0.05 0.19 0.00 -1.02 0.00 0.00 39.78 39.33 2gre n ASN 46 CO 0.00 0.00 0.00 0.78 -1.83 0.00 0.00 177.26 176.21 2gre h ASN 47 N -0.05 0.00 0.36 6.41 2.35 -2.00 -3.07 115.58 119.58 2gre h ASN 47 Ca -0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2gre h ASN 47 Cb 0.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.46 2gre h ASN 47 CO 0.02 0.58 0.00 0.29 -1.65 0.00 0.00 177.43 176.66 2gre n LYS 48 N -3.70 0.15 -0.48 0.81 5.02 -1.26 -4.91 118.16 113.78 2gre n LYS 48 Ca -0.01 0.18 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 2gre n LYS 48 Cb 0.61 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.12 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 0.01 0.76 3.91 0.72 0.00 -1.16 -5.00 105.19 104.43 2gre n GLY 49 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.06 3.21 0.01 4.61 0.00 -1.26 -4.90 121.76 121.36 2gre s ALA 50 Ca 0.00 -0.66 0.02 0.00 0.00 0.00 0.00 51.96 51.32 2gre s ALA 50 Cb 0.00 -2.68 -0.04 0.00 0.00 0.00 0.00 23.12 20.41 2gre s ALA 50 CO 0.00 -0.93 -0.01 -0.51 0.00 0.00 0.00 175.76 174.31 2gre s LEU 51 N -5.09 3.45 -0.22 0.00 1.43 -1.11 -2.12 118.68 115.02 2gre s LEU 51 Ca 0.55 -0.05 0.02 0.00 -1.03 0.00 0.00 54.13 53.63 2gre s LEU 51 Cb -0.11 -1.99 0.04 0.00 0.03 0.00 0.00 46.19 44.16 2gre s LEU 51 CO 0.46 0.27 -0.13 -0.63 0.23 0.00 0.00 176.35 176.55 2gre s ILE 52 N -1.09 1.95 -0.25 -0.59 -1.09 0.11 -1.80 121.20 118.45 2gre s ILE 52 Ca 0.20 -1.23 -0.10 0.00 -2.23 0.00 0.00 60.65 57.29 2gre s ILE 52 Cb -0.11 -1.97 -0.04 0.00 -1.58 0.00 0.00 42.46 38.75 2gre s ILE 52 CO 0.10 0.19 0.14 -0.76 -1.23 0.00 0.00 174.94 173.38 2gre s LEU 53 N 1.26 3.89 -0.17 2.97 1.43 0.58 -1.93 118.68 126.71 2gre s LEU 53 Ca -0.03 -0.01 0.01 0.00 -1.03 0.00 0.00 54.13 53.07 2gre s LEU 53 Cb -0.17 -2.05 0.01 0.00 0.03 0.00 0.00 46.19 44.01 2gre s LEU 53 CO -0.08 0.01 -0.17 -0.89 0.23 0.00 0.00 176.35 175.45 2gre s THR 54 N 1.38 2.39 -0.24 5.49 2.01 0.69 0.41 115.64 127.77 2gre s THR 54 Ca 0.06 -0.85 -0.09 0.00 0.31 0.00 0.00 61.69 61.13 2gre s THR 54 Cb -0.15 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.31 2gre s THR 54 CO 0.06 0.52 0.11 -0.69 -0.69 0.00 0.00 174.62 173.93 2gre s VAL 55 N 1.08 4.83 0.24 3.82 1.01 -0.63 -2.14 120.40 128.60 2gre s VAL 55 Ca -0.00 -0.00 -0.30 0.00 0.00 0.00 0.00 61.98 61.67 2gre s VAL 55 Cb -0.14 -3.25 -0.10 0.00 0.00 0.00 0.00 36.38 32.89 2gre s VAL 55 CO -0.06 0.35 1.43 -0.54 0.00 0.00 0.00 175.10 176.28 2gre s LYS 56 N 1.25 4.28 0.45 2.72 1.02 -1.26 -1.07 119.74 127.13 2gre s LYS 56 Ca 0.06 2.28 0.07 0.00 0.02 0.00 0.00 55.97 58.39 2gre s LYS 56 Cb -0.14 -3.12 -0.02 0.00 -0.52 0.00 0.00 37.83 34.03 2gre s LYS 56 CO 0.05 -0.41 0.31 0.20 -0.92 0.00 0.00 175.35 174.58 2gre s GLY 57 N 0.39 2.29 0.21 -3.33 0.00 -1.24 -4.65 107.32 100.99 2gre s GLY 57 Ca 0.59 -1.76 -0.11 0.00 0.00 0.00 0.00 44.72 43.44 2gre s GLY 57 CO 0.42 -1.85 1.69 1.70 0.00 0.00 0.00 173.10 175.06 2gre h LYS 58 N 1.10 0.20 -5.38 2.90 3.64 -1.38 -3.32 116.57 114.33 2gre h LYS 58 Ca -0.41 -0.01 -0.66 0.00 -1.27 0.00 0.00 60.65 58.31 2gre h LYS 58 Cb 1.27 -0.04 -0.15 0.00 -0.41 0.00 0.00 32.23 32.89 2gre h LYS 58 CO 0.62 0.13 0.13 1.21 -2.27 0.00 0.00 179.45 179.27 2gre s ASN 59 N -5.27 6.31 0.00 4.20 3.84 -0.65 -4.89 114.94 118.49 2gre s ASN 59 Ca -0.13 -0.39 0.22 0.00 0.21 0.00 0.00 52.86 52.77 2gre s ASN 59 Cb 0.18 -2.32 0.46 0.00 -0.55 0.00 0.00 41.25 39.02 2gre s ASN 59 CO 0.74 -0.80 1.41 -0.67 -2.79 0.00 0.00 177.10 174.99 2gre n ASP 60 N 6.29 3.53 0.08 -4.21 2.03 -1.25 -2.16 116.55 120.86 2gre n ASP 60 Ca -0.02 -1.98 -0.03 0.00 0.52 0.00 0.00 54.79 53.28 2gre n ASP 60 Cb 0.48 -0.30 -0.07 0.00 -0.72 0.00 0.00 41.12 40.51 2gre n ASP 60 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2gre h ALA 61 N 4.29 0.52 -3.38 -1.67 0.00 -1.93 -3.45 119.26 113.64 2gre h ALA 61 Ca 0.00 -0.78 -0.41 0.00 0.00 0.00 0.00 54.91 53.72 2gre h ALA 61 Cb 0.97 -0.05 -0.36 0.00 0.00 0.00 0.00 17.79 18.35 2gre h ALA 61 CO 0.00 1.03 -0.76 -0.65 0.00 0.00 0.00 179.25 178.86 2gre s GLN 62 N -2.81 0.59 0.38 0.00 -0.21 -1.26 -4.72 119.66 111.63 2gre s GLN 62 Ca 0.01 0.04 0.08 0.00 0.02 0.00 0.00 55.36 55.51 2gre s GLN 62 Cb 0.09 -0.81 -0.05 0.00 1.00 0.00 0.00 33.01 33.25 2gre s GLN 62 CO 0.79 -0.19 0.17 -1.01 -2.12 0.00 0.00 175.29 172.93 2gre s HIS 63 N 1.42 2.65 0.03 0.91 3.76 0.11 -4.23 115.29 119.94 2gre s HIS 63 Ca -0.04 -0.48 0.04 0.00 -0.15 0.00 0.00 55.06 54.44 2gre s HIS 63 Cb -0.13 -1.81 -0.02 0.00 1.11 0.00 0.00 32.58 31.72 2gre s HIS 63 CO -0.03 0.24 -0.13 0.50 -0.85 0.00 0.00 174.74 174.47 2gre s ARG 64 N -3.89 0.89 -0.05 1.40 6.06 -0.81 0.32 118.95 122.88 2gre s ARG 64 Ca 0.40 -0.68 -0.01 0.00 -2.50 0.00 0.00 55.73 52.94 2gre s ARG 64 Cb 0.00 -0.87 0.03 0.00 0.06 0.00 0.00 34.95 34.17 2gre s ARG 64 CO 0.23 0.22 0.03 -1.17 -2.50 0.00 0.00 175.30 172.11 2gre s LEU 65 N -0.98 0.49 -0.12 -0.88 2.96 -0.21 -0.62 118.68 119.32 2gre s LEU 65 Ca 0.01 0.01 -0.05 0.00 -0.22 0.00 0.00 54.13 53.88 2gre s LEU 65 Cb -0.07 -0.24 -0.04 0.00 0.50 0.00 0.00 46.19 46.34 2gre s LEU 65 CO 0.01 -0.20 0.08 -0.76 -1.32 0.00 0.00 176.35 174.16 2gre s LEU 66 N 1.87 4.05 0.04 -0.68 1.02 0.17 -0.65 118.68 124.50 2gre s LEU 66 Ca 0.02 0.32 0.05 0.00 0.02 0.00 0.00 54.13 54.53 2gre s LEU 66 Cb -0.12 -1.97 -0.02 0.00 0.02 0.00 0.00 46.19 44.09 2gre s LEU 66 CO -0.03 0.37 -0.14 0.28 0.02 0.00 0.00 176.35 176.85 2gre s THR 67 N -0.81 1.10 -0.09 5.49 -1.32 0.53 -0.31 115.64 120.22 2gre s THR 67 Ca 0.13 -0.99 -0.14 0.00 -1.21 0.00 0.00 61.69 59.47 2gre s THR 67 Cb -0.12 -1.00 0.03 0.00 -1.51 0.00 0.00 72.50 69.91 2gre s THR 67 CO 0.03 0.00 0.37 0.00 -2.21 0.00 0.00 174.62 172.81 2gre s ALA 68 N -0.85 -0.92 -0.06 11.08 0.00 -0.29 0.16 121.76 130.89 2gre s ALA 68 Ca 0.01 0.82 0.02 0.00 0.00 0.00 0.00 51.96 52.81 2gre s ALA 68 Cb -0.08 -0.36 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 2gre s ALA 68 CO 0.01 -0.22 -0.09 -3.38 0.00 0.00 0.00 175.76 172.09 2gre s HIS 69 N -0.39 2.86 -0.69 0.00 -3.43 -1.26 -0.40 115.29 111.99 2gre s HIS 69 Ca -0.05 -0.03 0.23 0.00 -0.80 0.00 0.00 55.06 54.40 2gre s HIS 69 Cb -0.03 -1.68 0.03 0.00 -1.43 0.00 0.00 32.58 29.46 2gre s HIS 69 CO 0.02 0.29 1.02 1.33 -2.00 0.00 0.00 174.74 175.40 2gre n VAL 70 N 2.23 0.11 -2.07 -5.38 0.24 -0.02 -4.18 118.33 109.26 2gre n VAL 70 Ca -0.18 -0.19 -0.33 0.00 -2.04 0.00 0.00 64.34 61.61 2gre n VAL 70 Cb 0.53 0.34 0.01 0.00 -1.47 0.00 0.00 33.84 33.25 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 -3.69 5.75 0.24 -1.34 -4.77 -1.26 -4.79 116.67 106.82 2gre s ASP 71 Ca 0.05 1.88 0.02 0.00 -3.30 0.00 0.00 52.55 51.19 2gre s ASP 71 Cb 0.15 -2.54 -0.05 0.00 -1.09 0.00 0.00 42.92 39.39 2gre s ASP 71 CO 0.81 -1.19 0.06 0.42 0.70 0.00 0.00 175.17 175.97 2gre s THR 72 N -2.34 0.70 0.54 2.11 -4.23 -0.79 -4.58 115.64 107.05 2gre s THR 72 Ca 0.65 -2.00 -0.20 0.00 -1.18 0.00 0.00 61.69 58.96 2gre s THR 72 Cb -0.17 -2.52 -0.07 0.00 1.34 0.00 0.00 72.50 71.08 2gre s THR 72 CO 0.35 -0.13 0.91 0.18 -0.54 0.00 0.00 174.62 175.39 2gre n LEU 73 N -0.44 2.92 0.00 4.79 4.77 -1.26 -1.39 117.00 126.39 2gre n LEU 73 Ca -0.02 0.86 0.00 0.00 -0.03 0.00 0.00 56.01 56.82 2gre n LEU 73 Cb 0.65 -1.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.40 2gre n LEU 73 CO 0.37 -1.93 0.00 0.61 -1.33 0.00 0.00 177.39 175.11 2gre n GLY 74 N 1.33 1.26 0.00 -0.72 0.00 -0.77 -4.68 105.19 101.61 2gre n GLY 74 Ca 0.12 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.87 4.61 0.00 -0.74 0.94 120.51 119.45 2gre n ALA 75 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 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 1.13 4.59 -0.01 0.00 1.01 -0.72 -0.23 120.40 126.17 2gre s VAL 77 Ca 0.00 -0.10 0.04 0.00 0.00 0.00 0.00 61.98 61.92 2gre s VAL 77 Cb 0.00 -3.08 -0.06 0.00 0.00 0.00 0.00 36.38 33.24 2gre s VAL 77 CO 0.00 0.44 0.08 2.29 0.00 0.00 0.00 175.10 177.91 2gre n LYS 78 N 3.83 0.17 -3.57 2.72 2.85 -0.84 -1.43 118.16 121.89 2gre n LYS 78 Ca -0.16 -0.03 -0.14 0.00 -1.05 0.00 0.00 58.31 56.92 2gre n LYS 78 Cb 0.52 -1.08 -0.06 0.00 -0.65 0.00 0.00 35.03 33.76 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 -2.25 0.82 -0.47 -1.58 2.12 -1.25 -4.95 118.70 111.14 2gre s GLU 79 Ca -0.01 0.37 -0.14 0.00 0.36 0.00 0.00 54.97 55.55 2gre s GLU 79 Cb 0.02 0.39 0.09 0.00 0.26 0.00 0.00 34.13 34.89 2gre s GLU 79 CO 0.15 -0.22 0.38 0.42 -0.54 0.00 0.00 175.26 175.45 2gre s ILE 80 N -0.77 4.92 0.52 -3.70 1.01 -1.26 -1.60 121.20 120.32 2gre s ILE 80 Ca -0.05 -1.28 -0.21 0.00 0.00 0.00 0.00 60.65 59.12 2gre s ILE 80 Cb -0.01 -4.02 -0.06 0.00 0.01 0.00 0.00 42.46 38.38 2gre s ILE 80 CO 0.04 -0.63 1.19 -0.54 0.00 0.00 0.00 174.94 175.01 2gre s LYS 81 N 1.56 3.39 0.35 2.79 1.02 -0.82 -4.71 119.74 123.32 2gre s LYS 81 Ca 0.04 1.82 0.14 0.00 0.02 0.00 0.00 55.97 57.98 2gre s LYS 81 Cb -0.25 -2.18 1.03 0.00 -0.52 0.00 0.00 37.83 35.91 2gre s LYS 81 CO 0.04 -0.86 1.71 -1.35 -0.92 0.00 0.00 175.35 173.96 2gre h PRO 82 N 1.50 0.42 0.00 -1.68 0.10 -1.95 0.84 132.00 131.22 2gre h PRO 82 Ca -0.50 -0.02 0.00 0.00 0.10 0.00 0.00 66.00 65.58 2gre h PRO 82 Cb 1.27 -0.09 0.00 0.00 0.10 0.00 0.00 31.00 32.28 2gre h PRO 82 CO 0.58 0.27 0.00 -0.40 0.10 0.00 0.00 178.00 178.55 2gre n ASP 83 N -4.89 0.00 0.00 -2.05 3.85 -1.26 -3.50 116.55 108.70 2gre n ASP 83 Ca 0.29 0.34 0.00 0.00 -0.71 0.00 0.00 54.79 54.71 2gre n ASP 83 Cb 0.90 -0.44 0.00 0.00 -1.35 0.00 0.00 41.12 40.23 2gre n ASP 83 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2gre n GLY 84 N 0.84 0.75 3.93 6.12 0.00 0.29 -3.62 105.19 113.48 2gre n GLY 84 Ca 0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.65 3.48 -0.15 1.61 0.52 -1.26 -4.75 118.95 117.74 2gre s ARG 85 Ca 0.00 -0.10 -0.06 0.00 -0.52 0.00 0.00 55.73 55.06 2gre s ARG 85 Cb 0.00 -2.52 -0.04 0.00 0.52 0.00 0.00 34.95 32.91 2gre s ARG 85 CO 0.00 -0.05 0.05 -0.51 0.02 0.00 0.00 175.30 174.81 2gre s LEU 86 N -4.54 3.79 0.45 2.53 1.02 -0.93 -1.95 118.68 119.05 2gre s LEU 86 Ca 0.44 0.13 -0.16 0.00 0.02 0.00 0.00 54.13 54.56 2gre s LEU 86 Cb -0.10 -1.93 -0.09 0.00 0.02 0.00 0.00 46.19 44.10 2gre s LEU 86 CO 0.40 0.25 0.90 -0.55 0.02 0.00 0.00 176.35 177.38 2gre s SER 87 N -0.10 6.70 0.06 2.29 0.15 -0.63 -0.92 113.70 121.26 2gre s SER 87 Ca 0.06 1.48 0.05 0.00 0.70 0.00 0.00 55.95 58.24 2gre s SER 87 Cb -0.12 -2.46 -0.03 0.00 -1.71 0.00 0.00 66.02 61.70 2gre s SER 87 CO 0.01 -0.45 -0.14 -0.76 1.20 0.00 0.00 173.24 173.11 2gre s LEU 88 N -3.67 2.25 0.00 3.45 1.43 -1.26 -1.98 118.68 118.90 2gre s LEU 88 Ca 0.58 -0.58 0.00 0.00 -1.03 0.00 0.00 54.13 53.10 2gre s LEU 88 Cb -0.10 -0.50 0.00 0.00 0.03 0.00 0.00 46.19 45.62 2gre s LEU 88 CO 0.25 -0.07 0.00 -0.24 0.23 0.00 0.00 176.35 176.52 2gre n SER 89 N 1.42 0.00 -3.59 2.29 2.88 -1.26 -4.79 113.62 110.57 2gre n SER 89 Ca -0.21 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.30 2gre n SER 89 Cb 0.54 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.94 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 2.54 -0.85 0.00 2.46 1.01 0.27 -4.36 121.20 122.26 2gre s ILE 91 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.71 2gre s ILE 91 Cb 0.00 -0.87 0.00 0.00 0.01 0.00 0.00 42.46 41.60 2gre s ILE 91 CO 0.00 0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.57 2gre n GLY 92 N 5.42 -2.55 3.07 6.18 0.00 -1.26 -1.84 105.19 114.20 2gre n GLY 92 Ca -0.09 -1.96 -0.33 0.00 0.00 0.00 0.00 46.02 43.64 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 -0.27 1.86 0.10 -0.02 0.00 -1.26 -5.00 107.32 102.74 2gre s GLY 93 Ca 0.00 -2.28 0.00 0.00 0.00 0.00 0.00 44.72 42.45 2gre s GLY 93 CO 0.00 0.85 0.13 1.97 0.00 0.00 0.00 173.10 176.05 2gre n PHE 94 N 4.39 -0.56 -4.43 1.90 -1.74 -1.26 -5.01 117.46 110.75 2gre n PHE 94 Ca -0.03 -0.75 -0.34 0.00 -0.56 0.00 0.00 57.45 55.77 2gre n PHE 94 Cb 0.42 0.14 -0.12 0.00 1.52 0.00 0.00 39.48 41.44 2gre n PHE 94 CO 0.00 0.00 0.00 -0.98 -0.56 0.00 0.00 176.76 175.22 2gre s ARG 95 N -2.30 3.53 0.46 3.97 1.70 -1.26 -5.02 118.95 120.04 2gre s ARG 95 Ca 0.10 -0.52 0.13 0.00 -0.47 0.00 0.00 55.73 54.97 2gre s ARG 95 Cb 0.00 -2.87 1.07 0.00 -0.57 0.00 0.00 34.95 32.59 2gre s ARG 95 CO 0.07 0.32 2.07 -1.49 -1.08 0.00 0.00 175.30 175.19 2gre h TRP 96 N 6.44 0.28 -0.84 5.89 -0.00 -2.00 -1.04 115.95 124.68 2gre h TRP 96 Ca -0.34 0.01 0.21 0.00 -0.00 0.00 0.00 58.89 58.77 2gre h TRP 96 Cb 1.19 -0.09 -0.13 0.00 -0.00 0.00 0.00 29.16 30.12 2gre h TRP 96 CO 0.54 0.17 0.21 -0.91 -0.00 0.00 0.00 178.44 178.45 2gre h ASN 97 N 0.29 -0.00 0.30 -3.49 4.21 -2.00 -2.23 115.58 112.66 2gre h ASN 97 Ca 0.13 0.18 0.00 0.00 1.21 0.00 0.00 56.30 57.82 2gre h ASN 97 Cb 0.14 0.25 0.00 0.00 -1.12 0.00 0.00 38.32 37.59 2gre h ASN 97 CO -0.03 -0.12 0.00 -1.54 -1.29 0.00 0.00 177.43 174.46 2gre n SER 98 N -5.21 0.00 -0.25 5.81 3.41 -0.39 -1.44 113.62 115.55 2gre n SER 98 Ca 0.19 0.22 0.08 0.00 -0.26 0.00 0.00 58.87 59.10 2gre n SER 98 Cb 0.61 -0.35 0.12 0.00 -0.26 0.00 0.00 64.21 64.33 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 -1.35 1.56 -1.98 -3.33 0.24 -0.84 -4.82 118.33 107.81 2gre n VAL 99 Ca 0.05 -1.99 -0.42 0.00 -2.04 0.00 0.00 64.34 59.95 2gre n VAL 99 Cb 0.12 -0.08 -0.03 0.00 -1.47 0.00 0.00 33.84 32.38 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 -2.37 4.24 0.00 7.34 2.12 -0.52 -2.80 118.70 126.70 2gre s GLU 100 Ca 0.28 2.32 0.00 0.00 0.36 0.00 0.00 54.97 57.92 2gre s GLU 100 Cb 0.25 -3.16 0.00 0.00 0.26 0.00 0.00 34.13 31.48 2gre s GLU 100 CO 0.01 -0.55 0.00 0.41 -0.54 0.00 0.00 175.26 174.58 2gre n GLY 101 N 3.45 0.46 3.81 -1.50 0.00 -0.14 -5.02 105.19 106.25 2gre n GLY 101 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.38 3.99 0.18 1.61 2.02 -1.12 -4.80 118.70 120.20 2gre s GLU 102 Ca 0.00 1.19 -0.22 0.00 0.02 0.00 0.00 54.97 55.97 2gre s GLU 102 Cb 0.00 -2.13 -0.08 0.00 0.10 0.00 0.00 34.13 32.02 2gre s GLU 102 CO 0.00 -0.25 0.73 0.71 0.02 0.00 0.00 175.26 176.47 2gre s TYR 103 N -2.17 3.77 0.22 1.61 4.12 -1.26 -1.84 117.35 121.79 2gre s TYR 103 Ca 0.64 1.47 0.01 0.00 0.02 0.00 0.00 57.07 59.21 2gre s TYR 103 Cb -0.12 -2.66 -0.05 0.00 -1.52 0.00 0.00 41.96 37.61 2gre s TYR 103 CO 0.19 0.43 0.06 0.00 0.02 0.00 0.00 175.55 176.25 2gre s GLU 105 N -4.00 1.81 -0.14 0.00 2.02 -0.24 -1.51 118.70 116.63 2gre s GLU 105 Ca 0.33 -1.05 -0.00 0.00 0.02 0.00 0.00 54.97 54.27 2gre s GLU 105 Cb 0.07 -1.93 -0.01 0.00 0.10 0.00 0.00 34.13 32.36 2gre s GLU 105 CO 0.10 0.50 -0.13 0.42 0.02 0.00 0.00 175.26 176.17 2gre s ILE 106 N -0.76 2.96 -0.12 -1.63 1.09 0.87 -1.77 121.20 121.84 2gre s ILE 106 Ca 0.11 -0.68 -0.02 0.00 -1.10 0.00 0.00 60.65 58.95 2gre s ILE 106 Cb -0.10 -2.25 -0.03 0.00 -1.06 0.00 0.00 42.46 39.02 2gre s ILE 106 CO 0.01 0.52 -0.04 -0.70 -0.10 0.00 0.00 174.94 174.63 2gre s GLU 107 N 0.53 3.34 0.14 2.79 2.12 -0.66 0.36 118.70 127.33 2gre s GLU 107 Ca -0.09 -0.52 -0.02 0.00 0.36 0.00 0.00 54.97 54.71 2gre s GLU 107 Cb -0.16 -2.81 -0.05 0.00 0.26 0.00 0.00 34.13 31.38 2gre s GLU 107 CO 0.04 0.41 0.33 0.95 -0.54 0.00 0.00 175.26 176.45 2gre s THR 108 N -0.09 5.24 0.43 -1.70 -4.23 0.16 -3.77 115.64 111.68 2gre s THR 108 Ca 0.02 -0.24 0.35 0.00 -1.18 0.00 0.00 61.69 60.63 2gre s THR 108 Cb -0.13 -3.67 0.51 0.00 1.34 0.00 0.00 72.50 70.55 2gre s THR 108 CO 0.03 -0.01 1.14 -1.20 -0.54 0.00 0.00 174.62 174.04 2gre n SER 109 N -0.13 0.00 -1.67 3.99 7.64 -1.26 0.41 113.62 122.60 2gre n SER 109 Ca -0.04 0.72 0.02 0.00 1.01 0.00 0.00 58.87 60.57 2gre n SER 109 Cb 0.52 -0.34 0.32 0.00 -1.01 0.00 0.00 64.21 63.71 2gre n SER 109 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2gre n SER 110 N -3.32 4.79 0.00 6.43 3.41 -1.26 -4.91 113.62 118.76 2gre n SER 110 Ca 0.31 -3.12 0.00 0.00 -0.26 0.00 0.00 58.87 55.79 2gre n SER 110 Cb 1.46 -0.68 0.00 0.00 -0.26 0.00 0.00 64.21 64.73 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 -0.05 0.60 3.70 5.00 0.00 0.17 -4.99 105.19 109.62 2gre n GLY 111 Ca 0.32 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.40 4.31 0.10 1.61 2.36 -1.25 -4.78 119.74 121.70 2gre s LYS 112 Ca 0.00 1.95 0.02 0.00 -2.55 0.00 0.00 55.97 55.38 2gre s LYS 112 Cb 0.00 -3.47 -0.04 0.00 -1.05 0.00 0.00 37.83 33.27 2gre s LYS 112 CO 0.00 -0.49 0.21 0.95 1.55 0.00 0.00 175.35 177.57 2gre s THR 113 N 1.92 5.19 0.05 3.43 -4.23 -1.26 0.38 115.64 121.13 2gre s THR 113 Ca 0.63 -0.59 0.02 0.00 -1.18 0.00 0.00 61.69 60.56 2gre s THR 113 Cb -0.32 -3.59 -0.03 0.00 1.34 0.00 0.00 72.50 69.90 2gre s THR 113 CO 0.27 0.04 -0.07 -0.31 -0.54 0.00 0.00 174.62 174.02 2gre s TYR 114 N -1.60 0.62 0.48 3.99 1.51 0.16 -4.93 117.35 117.57 2gre s TYR 114 Ca 0.34 -0.59 0.02 0.00 -1.01 0.00 0.00 57.07 55.83 2gre s TYR 114 Cb -0.12 -0.38 0.01 0.00 -0.11 0.00 0.00 41.96 41.37 2gre s TYR 114 CO 0.27 -0.13 0.69 0.95 -1.11 0.00 0.00 175.55 176.22 2gre s THR 115 N -1.81 3.27 -0.10 -0.71 -4.23 -1.26 0.30 115.64 111.09 2gre s THR 115 Ca -0.07 -0.69 0.00 0.00 -1.18 0.00 0.00 61.69 59.75 2gre s THR 115 Cb -0.07 -3.19 0.00 0.00 1.34 0.00 0.00 72.50 70.58 2gre s THR 115 CO -0.01 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.56 2gre n GLY 116 N -2.13 -1.18 3.07 3.99 0.00 -0.57 -2.50 105.19 105.87 2gre n GLY 116 Ca 0.05 -0.92 -0.20 0.00 0.00 0.00 0.00 46.02 44.95 2gre n GLY 116 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gre s THR 117 N -2.48 0.90 -0.06 2.61 2.01 -0.69 0.46 115.64 118.39 2gre s THR 117 Ca 0.00 -0.55 -0.22 0.00 0.31 0.00 0.00 61.69 61.23 2gre s THR 117 Cb 0.00 -0.77 -0.04 0.00 0.01 0.00 0.00 72.50 71.70 2gre s THR 117 CO 0.00 0.21 0.64 -0.63 -0.69 0.00 0.00 174.62 174.15 2gre s ILE 118 N -0.35 5.04 0.00 1.82 1.01 -0.77 -0.38 121.20 127.57 2gre s ILE 118 Ca 0.04 1.32 0.07 0.00 0.00 0.00 0.00 60.65 62.08 2gre s ILE 118 Cb -0.05 -3.98 0.12 0.00 0.01 0.00 0.00 42.46 38.56 2gre s ILE 118 CO -0.00 0.30 1.00 0.18 0.00 0.00 0.00 174.94 176.42 2gre n LEU 119 N 3.56 0.24 0.00 2.97 4.77 0.10 -0.96 117.00 127.67 2gre n LEU 119 Ca -0.03 -1.33 0.00 0.00 -0.03 0.00 0.00 56.01 54.62 2gre n LEU 119 Cb 0.51 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 2gre n LEU 119 CO 0.46 0.45 0.00 2.29 -1.33 0.00 0.00 177.39 179.25 2gre n LYS 139 N 0.14 0.00 0.09 3.23 -0.00 -1.26 -0.96 118.16 119.40 2gre n LYS 139 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 58.31 58.41 2gre n LYS 139 Cb 0.81 0.00 0.43 0.00 -0.00 0.00 0.00 35.03 36.27 2gre n LYS 139 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2gre n ASN 140 N 0.00 0.45 -4.75 -5.58 3.02 -1.26 -4.89 115.26 102.25 2gre n ASN 140 Ca 0.00 0.62 -0.34 0.00 -0.03 0.00 0.00 54.58 54.83 2gre n ASN 140 Cb 0.00 -0.71 0.05 0.00 -0.61 0.00 0.00 39.78 38.51 2gre n ASN 140 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2gre s ILE 141 N -3.24 2.86 -0.16 2.41 1.09 -1.26 -5.05 121.20 117.84 2gre s ILE 141 Ca 0.04 0.45 -0.35 0.00 -1.10 0.00 0.00 60.65 59.69 2gre s ILE 141 Cb 0.09 -3.03 0.14 0.00 -1.06 0.00 0.00 42.46 38.59 2gre s ILE 141 CO 0.32 -0.20 1.29 -1.83 -0.10 0.00 0.00 174.94 174.42 2gre s GLU 142 N -3.78 0.24 -0.23 2.79 -1.05 -0.14 -4.51 118.70 112.02 2gre s GLU 142 Ca 0.72 -0.11 -0.06 0.00 -0.15 0.00 0.00 54.97 55.38 2gre s GLU 142 Cb -0.25 0.10 -0.02 0.00 -0.44 0.00 0.00 34.13 33.52 2gre s GLU 142 CO 0.39 -0.11 0.01 0.08 0.95 0.00 0.00 175.26 176.58 2gre s VAL 143 N -2.30 3.84 -0.40 1.83 1.01 -0.09 0.01 120.40 124.30 2gre s VAL 143 Ca 0.12 -0.33 -0.22 0.00 0.00 0.00 0.00 61.98 61.54 2gre s VAL 143 Cb 0.01 -2.77 0.02 0.00 0.00 0.00 0.00 36.38 33.63 2gre s VAL 143 CO -0.04 0.38 0.73 -0.60 0.00 0.00 0.00 175.10 175.57 2gre s ARG 144 N 1.51 3.55 0.19 2.72 3.00 0.49 -2.19 118.95 128.21 2gre s ARG 144 Ca 0.06 0.01 -0.24 0.00 -1.00 0.00 0.00 55.73 54.55 2gre s ARG 144 Cb -0.15 -3.87 -0.08 0.00 0.00 0.00 0.00 34.95 30.85 2gre s ARG 144 CO 0.00 -0.94 0.78 0.42 0.00 0.00 0.00 175.30 175.56 2gre s ILE 145 N 3.03 4.39 -0.32 4.11 1.01 -1.26 -1.70 121.20 130.46 2gre s ILE 145 Ca 0.28 1.64 -0.04 0.00 0.00 0.00 0.00 60.65 62.53 2gre s ILE 145 Cb -0.13 -4.08 0.00 0.00 0.01 0.00 0.00 42.46 38.26 2gre s ILE 145 CO 0.19 0.44 2.84 0.47 0.00 0.00 0.00 174.94 178.88 2gre n ASP 146 N 1.36 6.15 -3.91 3.58 9.92 -1.04 -4.75 116.55 127.86 2gre n ASP 146 Ca -0.05 -2.99 -0.11 0.00 -0.53 0.00 0.00 54.79 51.11 2gre n ASP 146 Cb 0.49 -1.25 -0.13 0.00 -0.64 0.00 0.00 41.12 39.59 2gre n ASP 146 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 2gre s GLU 147 N -1.05 0.12 -0.68 -1.24 2.56 -1.26 -4.94 118.70 112.21 2gre s GLU 147 Ca 0.55 -0.22 -0.19 0.00 0.00 0.00 0.00 54.97 55.10 2gre s GLU 147 Cb 0.34 0.03 -0.16 0.00 2.00 0.00 0.00 34.13 36.34 2gre s GLU 147 CO -0.13 -0.02 1.89 0.54 -0.56 0.00 0.00 175.26 176.98 2gre n ARG 148 N 2.54 1.38 -4.30 4.30 1.74 -1.26 -4.87 116.66 116.20 2gre n ARG 148 Ca -0.16 -1.64 -0.24 0.00 -0.77 0.00 0.00 57.85 55.03 2gre n ARG 148 Cb 0.58 -2.76 -0.08 0.00 -1.02 0.00 0.00 32.46 29.18 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 4.95 3.36 0.00 1.55 -7.23 -1.26 -5.05 120.40 116.72 2gre s VAL 149 Ca 0.53 -1.83 0.00 0.00 -1.81 0.00 0.00 61.98 58.87 2gre s VAL 149 Cb 0.13 -2.75 0.00 0.00 0.56 0.00 0.00 36.38 34.32 2gre s VAL 149 CO 0.11 -0.29 0.44 0.49 -0.31 0.00 0.00 175.10 175.55 2gre n PHE 150 N -0.58 0.00 -3.55 2.82 0.99 -1.26 -4.91 117.46 110.97 2gre n PHE 150 Ca -0.08 0.00 -0.07 0.00 -0.00 0.00 0.00 57.45 57.30 2gre n PHE 150 Cb 0.58 0.08 -0.03 0.00 -1.00 0.00 0.00 39.48 39.11 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 -0.19 -0.29 0.03 4.37 1.04 -1.24 -4.31 113.70 113.12 2gre s SER 151 Ca 0.00 0.10 -0.06 0.00 0.48 0.00 0.00 55.95 56.47 2gre s SER 151 Cb 0.00 0.28 -0.01 0.00 0.10 0.00 0.00 66.02 66.39 2gre s SER 151 CO 0.00 -0.42 0.80 0.00 0.98 0.00 0.00 173.24 174.60 2gre n ALA 152 N 0.06 -0.12 0.00 5.32 0.00 -1.22 -1.48 120.51 123.07 2gre n ALA 152 Ca -0.06 0.15 -0.10 0.00 0.00 0.00 0.00 53.44 53.43 2gre n ALA 152 Cb 0.60 0.24 -0.04 0.00 0.00 0.00 0.00 19.45 20.24 2gre n ALA 152 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2gre h ASP 153 N 0.00 -0.19 -0.97 0.00 5.19 -1.93 -0.74 116.42 117.78 2gre h ASP 153 Ca 0.03 0.05 0.16 0.00 -0.62 0.00 0.00 57.03 56.65 2gre h ASP 153 Cb 0.07 0.11 -0.10 0.00 0.18 0.00 0.00 39.33 39.59 2gre h ASP 153 CO -0.17 -0.08 0.58 -0.33 -3.12 0.00 0.00 179.24 176.12 2gre h GLU 154 N -0.06 0.77 -0.53 3.56 5.08 -1.92 -1.11 114.58 120.38 2gre h GLU 154 Ca 0.06 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 2gre h GLU 154 Cb 0.15 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2gre h GLU 154 CO -0.14 0.51 0.09 0.28 -1.00 0.00 0.00 179.01 178.75 2gre h VAL 155 N 0.80 1.25 -0.58 3.13 2.07 -0.05 -3.08 116.25 119.79 2gre h VAL 155 Ca 0.53 -0.95 -0.03 0.00 0.82 0.00 0.00 66.70 67.07 2gre h VAL 155 Cb 0.73 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 2gre h VAL 155 CO -0.35 0.34 0.23 0.03 0.02 0.00 0.00 177.57 177.84 2gre h ARG 156 N 0.76 0.87 -1.07 1.57 3.08 -0.10 -2.19 114.38 117.30 2gre h ARG 156 Ca 0.16 -0.16 0.29 0.00 0.07 0.00 0.00 59.98 60.34 2gre h ARG 156 Cb 0.40 -0.14 -0.11 0.00 0.08 0.00 0.00 29.97 30.20 2gre h ARG 156 CO 0.01 0.75 0.67 0.93 -1.07 0.00 0.00 179.97 181.26 2gre h GLU 157 N 0.80 0.37 0.00 0.04 4.39 -1.25 0.69 114.58 119.62 2gre h GLU 157 Ca 0.19 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.87 2gre h GLU 157 Cb 0.21 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 28.78 2gre h GLU 157 CO -0.01 0.24 -0.01 -0.07 -1.16 0.00 0.00 179.01 178.00 2gre h LEU 158 N 0.38 0.00 0.00 1.33 4.07 -1.31 -3.46 115.31 116.32 2gre h LEU 158 Ca 0.65 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.61 2gre h LEU 158 Cb 1.62 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.36 2gre h LEU 158 CO -0.38 0.01 0.00 0.61 -1.08 0.00 0.00 178.44 177.60 2gre n GLY 159 N -1.14 0.52 3.75 0.83 0.00 0.24 -5.07 105.19 104.32 2gre n GLY 159 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 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 3.42 0.03 -0.61 1.01 -1.22 -4.55 121.20 117.28 2gre s ILE 160 Ca 0.00 1.32 -0.11 0.00 0.00 0.00 0.00 60.65 61.86 2gre s ILE 160 Cb 0.00 -3.84 0.01 0.00 0.01 0.00 0.00 42.46 38.64 2gre s ILE 160 CO 0.00 0.27 0.24 -0.70 0.00 0.00 0.00 174.94 174.75 2gre s GLU 161 N -0.98 0.71 0.26 2.79 2.56 -1.26 -4.12 118.70 118.65 2gre s GLU 161 Ca 0.48 -0.52 -0.30 0.00 0.00 0.00 0.00 54.97 54.64 2gre s GLU 161 Cb -0.33 0.30 -0.14 0.00 2.00 0.00 0.00 34.13 35.96 2gre s GLU 161 CO 0.41 -0.21 1.16 0.28 -0.56 0.00 0.00 175.26 176.34 2gre n VAL 162 N 0.80 1.56 0.00 3.70 0.31 -1.26 -1.77 118.33 121.66 2gre n VAL 162 Ca -0.19 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 63.75 2gre n VAL 162 Cb 0.58 -1.14 0.00 0.00 -0.91 0.00 0.00 33.84 32.38 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 1.51 0.62 3.76 2.92 0.00 -0.51 -4.99 105.19 108.49 2gre n GLY 163 Ca 0.10 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 -1.88 6.82 0.21 1.61 1.01 -0.73 -4.80 116.67 118.91 2gre s ASP 164 Ca 0.00 2.60 -0.29 0.00 0.71 0.00 0.00 52.55 55.57 2gre s ASP 164 Cb 0.00 -2.64 -0.08 0.00 1.01 0.00 0.00 42.92 41.21 2gre s ASP 164 CO 0.00 -0.52 0.90 -0.36 0.21 0.00 0.00 175.17 175.40 2gre s PHE 165 N -0.78 3.95 -0.06 4.23 0.40 -1.25 -1.76 117.98 122.72 2gre s PHE 165 Ca 0.51 1.84 0.05 0.00 -0.60 0.00 0.00 56.93 58.73 2gre s PHE 165 Cb -0.39 -2.93 -0.01 0.00 0.51 0.00 0.00 43.02 40.20 2gre s PHE 165 CO 0.48 0.45 -0.21 0.08 0.70 0.00 0.00 175.22 176.72 2gre s VAL 166 N -1.06 1.78 0.18 -0.44 1.01 0.68 -1.65 120.40 120.88 2gre s VAL 166 Ca 0.40 -0.90 0.11 0.00 0.00 0.00 0.00 61.98 61.59 2gre s VAL 166 Cb -0.25 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 2gre s VAL 166 CO 0.30 0.50 -0.23 -0.94 0.00 0.00 0.00 175.10 174.73 2gre s SER 167 N -0.00 3.52 -0.13 3.32 1.04 -0.73 -1.79 113.70 118.94 2gre s SER 167 Ca -0.06 -0.80 -0.09 0.00 0.48 0.00 0.00 55.95 55.48 2gre s SER 167 Cb -0.13 -0.31 -0.05 0.00 0.10 0.00 0.00 66.02 65.63 2gre s SER 167 CO 0.04 0.13 0.19 -0.36 0.98 0.00 0.00 173.24 174.22 2gre s PHE 168 N -1.53 3.56 0.17 5.02 2.99 -1.26 -1.08 117.98 125.84 2gre s PHE 168 Ca 0.20 0.56 -0.32 0.00 0.00 0.00 0.00 56.93 57.37 2gre s PHE 168 Cb -0.09 -2.08 -0.11 0.00 0.00 0.00 0.00 43.02 40.75 2gre s PHE 168 CO 0.10 0.58 1.64 -0.51 -0.00 0.00 0.00 175.22 177.02 2gre s ASP 169 N -0.57 6.51 0.00 1.36 1.11 0.85 -4.82 116.67 121.11 2gre s ASP 169 Ca 0.15 2.69 0.29 0.00 0.18 0.00 0.00 52.55 55.87 2gre s ASP 169 Cb -0.13 -2.59 1.36 0.00 1.07 0.00 0.00 42.92 42.63 2gre s ASP 169 CO 0.04 -0.89 1.97 -0.81 1.18 0.00 0.00 175.17 176.66 2gre n PRO 170 N 4.19 0.31 -3.95 8.23 -0.04 -1.26 -4.84 135.00 137.63 2gre n PRO 170 Ca 0.15 -0.03 -0.25 0.00 -0.04 0.00 0.00 63.50 63.33 2gre n PRO 170 Cb 0.38 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.26 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 -1.32 -0.95 -2.55 0.54 1.74 -1.26 -2.51 116.66 110.35 2gre n ARG 171 Ca 0.12 0.07 -0.37 0.00 -0.77 0.00 0.00 57.85 56.90 2gre n ARG 171 Cb 0.28 -2.87 -0.04 0.00 -1.02 0.00 0.00 32.46 28.81 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 -4.09 3.72 -0.21 1.55 0.11 -1.26 -4.43 120.40 115.80 2gre s VAL 172 Ca 0.01 1.35 -0.10 0.00 -2.93 0.00 0.00 61.98 60.31 2gre s VAL 172 Cb -0.01 -3.72 0.08 0.00 -1.53 0.00 0.00 36.38 31.21 2gre s VAL 172 CO 0.80 0.04 0.48 -1.10 -3.33 0.00 0.00 175.10 171.99 2gre s GLN 173 N -2.39 0.45 -0.28 1.54 -0.21 -0.60 -4.99 119.66 113.17 2gre s GLN 173 Ca 0.56 0.99 -0.16 0.00 0.02 0.00 0.00 55.36 56.78 2gre s GLN 173 Cb -0.23 0.18 -0.03 0.00 1.00 0.00 0.00 33.01 33.94 2gre s GLN 173 CO 0.28 -0.19 0.43 0.42 -2.12 0.00 0.00 175.29 174.12 2gre s ILE 174 N 1.91 5.12 0.36 1.08 1.09 -1.26 -0.56 121.20 128.94 2gre s ILE 174 Ca -0.07 0.57 -0.21 0.00 -1.10 0.00 0.00 60.65 59.85 2gre s ILE 174 Cb -0.09 -3.78 -0.10 0.00 -1.06 0.00 0.00 42.46 37.43 2gre s ILE 174 CO -0.15 0.07 0.87 -0.89 -0.10 0.00 0.00 174.94 174.74 2gre s THR 175 N 2.17 4.44 0.30 2.92 2.01 0.15 -4.95 115.64 122.68 2gre s THR 175 Ca 0.17 1.42 0.05 0.00 0.31 0.00 0.00 61.69 63.64 2gre s THR 175 Cb -0.16 -3.73 0.30 0.00 0.01 0.00 0.00 72.50 68.92 2gre s THR 175 CO 0.10 -0.12 1.80 -0.33 -0.69 0.00 0.00 174.62 175.39 2gre h GLU 176 N 2.47 0.80 0.00 4.92 3.07 -1.98 -0.23 114.58 123.63 2gre h GLU 176 Ca -0.48 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.33 2gre h GLU 176 Cb 1.18 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 28.91 2gre h GLU 176 CO 0.63 0.53 0.00 -1.13 -1.40 0.00 0.00 179.01 177.64 2gre n SER 177 N -4.70 0.00 0.00 1.42 3.41 -1.26 -4.82 113.62 107.67 2gre n SER 177 Ca 0.22 -0.22 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2gre n SER 177 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 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 -0.56 0.61 3.87 5.00 0.00 -0.10 -4.99 105.19 109.03 2gre n GLY 178 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.12 3.57 -0.24 1.61 1.51 -1.25 -1.34 117.35 119.10 2gre s TYR 179 Ca 0.00 0.72 -0.06 0.00 -1.01 0.00 0.00 57.07 56.72 2gre s TYR 179 Cb 0.00 -2.11 -0.02 0.00 -0.11 0.00 0.00 41.96 39.72 2gre s TYR 179 CO 0.00 0.53 0.03 -1.50 -1.11 0.00 0.00 175.55 173.50 2gre s ILE 180 N -1.41 4.03 0.00 2.71 2.07 -0.80 0.30 121.20 128.11 2gre s ILE 180 Ca 0.33 -0.27 0.02 0.00 -1.41 0.00 0.00 60.65 59.32 2gre s ILE 180 Cb -0.14 -2.87 -0.04 0.00 0.13 0.00 0.00 42.46 39.55 2gre s ILE 180 CO 0.18 0.37 -0.02 -0.54 -1.91 0.00 0.00 174.94 173.02 2gre s LYS 181 N 1.54 2.70 0.00 3.50 1.02 0.27 -2.08 119.74 126.69 2gre s LYS 181 Ca 0.06 -0.66 0.00 0.00 0.02 0.00 0.00 55.97 55.39 2gre s LYS 181 Cb -0.15 -2.61 0.00 0.00 -0.52 0.00 0.00 37.83 34.55 2gre s LYS 181 CO 0.02 0.61 0.00 0.45 -0.92 0.00 0.00 175.35 175.51 2gre n SER 182 N 1.41 0.00 -2.67 2.83 2.88 0.11 -1.55 113.62 116.62 2gre n SER 182 Ca -0.15 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.31 2gre n SER 182 Cb 0.53 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 64.03 2gre n SER 182 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 2gre n ARG 183 N 0.00 1.18 0.04 -1.46 0.00 -1.04 -1.15 116.66 114.23 2gre n ARG 183 Ca 0.00 -3.08 0.00 0.00 -0.00 0.00 0.00 57.85 54.77 2gre n ARG 183 Cb 0.00 -1.10 0.00 0.00 -0.00 0.00 0.00 32.46 31.36 2gre n ARG 183 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 2gre n HIS 184 N -0.16 -0.69 0.00 2.89 8.25 -1.26 -4.80 115.22 119.45 2gre n HIS 184 Ca 0.07 0.12 0.00 0.00 -0.26 0.00 0.00 57.72 57.65 2gre n HIS 184 Cb 0.82 0.53 0.00 0.00 1.12 0.00 0.00 29.99 32.47 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 -2.75 0.00 -0.12 2.41 4.77 -1.26 -4.37 117.00 115.68 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 0.00 0.00 -0.67 -1.33 0.00 0.00 177.39 175.39 2gre n ASP 186 N -0.50 0.00 -0.45 -1.43 2.03 -1.26 -3.27 116.55 111.67 2gre n ASP 186 Ca 0.00 0.00 0.07 0.00 0.52 0.00 0.00 54.79 55.38 2gre n ASP 186 Cb 0.00 0.00 0.12 0.00 -0.72 0.00 0.00 41.12 40.52 2gre n ASP 186 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2gre n ASP 187 N 0.78 1.62 0.17 1.67 4.64 -1.26 -4.90 116.55 119.27 2gre n ASP 187 Ca 0.00 -3.02 0.13 0.00 -1.38 0.00 0.00 54.79 50.52 2gre n ASP 187 Cb 0.00 -0.41 0.52 0.00 -1.04 0.00 0.00 41.12 40.20 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 0.40 0.00 -0.30 -0.67 1.79 -1.72 -0.90 116.57 115.17 2gre h LYS 188 Ca -0.03 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.44 2gre h LYS 188 Cb 1.17 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.80 2gre h LYS 188 CO 0.01 0.00 0.17 0.28 -1.08 0.00 0.00 179.45 178.83 2gre h VAL 189 N 0.00 1.13 -0.10 0.50 2.07 -1.92 -2.13 116.25 115.80 2gre h VAL 189 Ca 0.00 -0.34 -0.12 0.00 0.82 0.00 0.00 66.70 67.05 2gre h VAL 189 Cb 0.46 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 2gre h VAL 189 CO 0.00 0.13 -0.49 0.28 0.02 0.00 0.00 177.57 177.52 2gre h SER 190 N 0.37 0.26 -0.45 0.57 0.02 -1.48 -2.44 113.55 110.41 2gre h SER 190 Ca 0.11 -0.13 0.02 0.00 -0.84 0.00 0.00 61.79 60.95 2gre h SER 190 Cb 0.06 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.50 2gre h SER 190 CO -0.02 0.71 0.28 0.58 -1.14 0.00 0.00 176.83 177.24 2gre h VAL 191 N 0.20 1.07 -0.44 2.27 2.07 -1.11 0.43 116.25 120.73 2gre h VAL 191 Ca 0.01 -0.19 0.03 0.00 0.82 0.00 0.00 66.70 67.37 2gre h VAL 191 Cb 0.93 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 31.12 2gre h VAL 191 CO 0.08 0.10 0.23 0.00 0.02 0.00 0.00 177.57 177.99 2gre h ALA 192 N 1.19 0.55 -0.04 1.67 0.00 -1.28 -1.15 119.26 120.20 2gre h ALA 192 Ca 0.18 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.12 2gre h ALA 192 Cb -0.01 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2gre h ALA 192 CO -0.07 -0.12 -0.10 0.82 0.00 0.00 0.00 179.25 179.77 2gre h ILE 193 N 0.45 0.72 -0.88 0.00 2.04 -0.74 0.65 117.51 119.76 2gre h ILE 193 Ca 0.19 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.05 2gre h ILE 193 Cb 0.09 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 36.85 2gre h ILE 193 CO -0.13 0.00 0.56 -0.07 0.00 0.00 0.00 178.15 178.52 2gre h LEU 194 N -0.16 1.03 -0.76 1.44 3.38 -0.70 0.72 115.31 120.27 2gre h LEU 194 Ca 0.05 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2gre h LEU 194 Cb 0.23 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 2gre h LEU 194 CO -0.13 0.76 0.43 -0.07 0.09 0.00 0.00 178.44 179.52 2gre h LEU 195 N 1.20 0.94 -0.37 1.67 4.07 -0.65 -1.56 115.31 120.61 2gre h LEU 195 Ca 0.32 -0.09 -0.08 0.00 0.08 0.00 0.00 57.88 58.11 2gre h LEU 195 Cb -0.10 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 41.39 2gre h LEU 195 CO -0.07 0.75 -0.08 0.11 -1.08 0.00 0.00 178.44 178.07 2gre h LYS 196 N 1.05 0.71 -0.79 1.13 1.79 -0.17 -1.80 116.57 118.48 2gre h LYS 196 Ca 0.27 -0.27 0.14 0.00 -2.18 0.00 0.00 60.65 58.61 2gre h LYS 196 Cb 0.01 -0.04 -0.09 0.00 -1.58 0.00 0.00 32.23 30.53 2gre h LYS 196 CO -0.05 0.86 0.37 1.25 -1.08 0.00 0.00 179.45 180.80 2gre h LEU 197 N 0.51 0.41 0.09 2.94 5.85 -0.59 0.32 115.31 124.83 2gre h LEU 197 Ca 0.09 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.91 2gre h LEU 197 Cb 0.59 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 2gre h LEU 197 CO 0.04 0.17 -0.08 0.40 -0.34 0.00 0.00 178.44 178.62 2gre h ILE 198 N 0.54 0.81 -0.21 4.05 1.08 -0.53 -1.91 117.51 121.34 2gre h ILE 198 Ca 0.43 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.87 2gre h ILE 198 Cb 0.62 0.81 -0.01 0.00 -3.07 0.00 0.00 36.82 35.16 2gre h ILE 198 CO -0.37 0.00 0.02 0.50 -0.69 0.00 0.00 178.15 177.60 2gre h LYS 199 N -0.19 0.31 0.08 2.37 1.63 -0.33 -1.94 116.57 118.50 2gre h LYS 199 Ca 0.00 -0.05 -0.00 0.00 -0.85 0.00 0.00 60.65 59.75 2gre h LYS 199 Cb 0.18 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 31.75 2gre h LYS 199 CO -0.02 0.32 -0.04 0.00 -3.45 0.00 0.00 179.45 176.27 2gre h ARG 200 N 0.31 -0.10 -0.95 1.90 3.08 0.30 0.23 114.38 119.16 2gre h ARG 200 Ca 0.07 0.01 0.10 0.00 0.07 0.00 0.00 59.98 60.23 2gre h ARG 200 Cb 0.18 0.02 -0.08 0.00 0.08 0.00 0.00 29.97 30.18 2gre h ARG 200 CO 0.00 -0.03 0.59 -0.07 -1.07 0.00 0.00 179.97 179.39 2gre h LEU 201 N -0.14 0.88 -0.29 3.04 3.38 -0.72 0.17 115.31 121.64 2gre h LEU 201 Ca -0.01 0.04 -0.17 0.00 0.09 0.00 0.00 57.88 57.83 2gre h LEU 201 Cb 0.11 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 2gre h LEU 201 CO 0.02 0.50 -0.48 -0.61 0.09 0.00 0.00 178.44 177.96 2gre h GLN 202 N 0.98 0.84 -0.19 1.13 4.15 -1.30 -1.79 115.11 118.93 2gre h GLN 202 Ca 0.45 -0.52 -0.21 0.00 0.77 0.00 0.00 58.65 59.15 2gre h GLN 202 Cb 0.37 0.05 0.01 0.00 0.21 0.00 0.00 27.48 28.12 2gre h GLN 202 CO -0.24 1.15 -0.70 -0.44 -1.93 0.00 0.00 178.83 176.68 2gre h ASP 203 N 0.62 0.89 -0.06 -0.69 3.32 0.33 -2.89 116.42 117.94 2gre h ASP 203 Ca 0.02 -0.55 0.00 0.00 0.02 0.00 0.00 57.03 56.52 2gre h ASP 203 Cb 1.09 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.37 2gre h ASP 203 CO 0.11 1.34 0.00 -0.62 -1.72 0.00 0.00 179.24 178.35 2gre n GLU 204 N -3.95 1.33 -3.95 3.56 1.02 0.49 -4.93 120.64 114.21 2gre n GLU 204 Ca -0.06 -0.49 -0.28 0.00 -0.02 0.00 0.00 57.16 56.31 2gre n GLU 204 Cb 0.70 -1.37 -0.00 0.00 -0.02 0.00 0.00 31.44 30.75 2gre n GLU 204 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2gre n ASN 205 N -0.32 -2.04 -4.83 1.62 5.15 -0.75 -4.92 115.26 109.16 2gre n ASN 205 Ca 0.16 -0.92 -0.36 0.00 -0.60 0.00 0.00 54.58 52.87 2gre n ASN 205 Cb 0.19 -3.39 -0.06 0.00 -0.53 0.00 0.00 39.78 36.00 2gre n ASN 205 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2gre s VAL 206 N -3.63 4.74 -0.27 3.44 1.01 -0.75 -5.06 120.40 119.88 2gre s VAL 206 Ca 0.29 1.02 -0.11 0.00 0.00 0.00 0.00 61.98 63.18 2gre s VAL 206 Cb -0.15 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.39 2gre s VAL 206 CO 0.87 0.24 0.18 -0.89 0.00 0.00 0.00 175.10 175.50 2gre s THR 207 N -1.47 5.29 0.33 3.92 2.01 -1.26 -4.84 115.64 119.62 2gre s THR 207 Ca 0.39 0.16 -0.28 0.00 0.31 0.00 0.00 61.69 62.27 2gre s THR 207 Cb -0.16 -3.51 -0.10 0.00 0.01 0.00 0.00 72.50 68.74 2gre s THR 207 CO 0.20 0.27 1.18 -0.76 -0.69 0.00 0.00 174.62 174.82 2gre s LEU 208 N 1.66 4.42 0.47 4.42 1.43 -1.26 -4.94 118.68 124.88 2gre s LEU 208 Ca 0.07 2.42 0.26 0.00 -1.03 0.00 0.00 54.13 55.86 2gre s LEU 208 Cb -0.16 -3.73 0.70 0.00 0.03 0.00 0.00 46.19 43.03 2gre s LEU 208 CO 0.10 -0.40 1.74 1.55 0.23 0.00 0.00 176.35 179.57 2gre h PRO 209 N 3.38 0.00 -5.22 1.29 0.13 -1.88 -1.64 132.00 128.06 2gre h PRO 209 Ca -0.48 0.00 -0.38 0.00 -0.87 0.00 0.00 66.00 64.27 2gre h PRO 209 Cb 1.22 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.15 2gre h PRO 209 CO 0.65 0.03 -0.76 0.71 -0.23 0.00 0.00 178.00 178.40 2gre s TYR 210 N -3.37 1.19 0.16 1.56 1.51 -1.26 -1.63 117.35 115.51 2gre s TYR 210 Ca 0.05 -0.54 -0.32 0.00 -1.01 0.00 0.00 57.07 55.25 2gre s TYR 210 Cb 0.07 -0.65 -0.10 0.00 -0.11 0.00 0.00 41.96 41.16 2gre s TYR 210 CO 0.63 0.06 1.58 0.99 -1.11 0.00 0.00 175.55 177.69 2gre s THR 211 N -1.81 2.61 -0.08 -0.71 2.01 -0.92 -3.67 115.64 113.07 2gre s THR 211 Ca 0.02 0.43 0.03 0.00 0.31 0.00 0.00 61.69 62.48 2gre s THR 211 Cb -0.07 -3.27 0.01 0.00 0.01 0.00 0.00 72.50 69.18 2gre s THR 211 CO 0.02 0.03 -0.15 -0.89 -0.69 0.00 0.00 174.62 172.94 2gre s THR 212 N 1.19 1.39 -0.11 -0.82 2.01 -0.24 -1.92 115.64 117.14 2gre s THR 212 Ca 0.70 -0.62 -0.05 0.00 0.31 0.00 0.00 61.69 62.04 2gre s THR 212 Cb -0.44 -1.25 -0.04 0.00 0.01 0.00 0.00 72.50 70.79 2gre s THR 212 CO 0.31 0.41 0.07 -1.00 -0.69 0.00 0.00 174.62 173.73 2gre s HIS 213 N 0.65 3.39 -0.25 4.92 3.76 0.21 -1.61 115.29 126.35 2gre s HIS 213 Ca -0.14 0.36 -0.02 0.00 -0.15 0.00 0.00 55.06 55.10 2gre s HIS 213 Cb -0.16 -1.87 0.02 0.00 1.11 0.00 0.00 32.58 31.68 2gre s HIS 213 CO 0.04 0.60 -0.04 -0.06 -0.85 0.00 0.00 174.74 174.43 2gre s PHE 214 N -0.91 3.08 -0.38 1.40 0.40 0.17 0.44 117.98 122.18 2gre s PHE 214 Ca 0.14 -1.47 -0.11 0.00 -0.60 0.00 0.00 56.93 54.89 2gre s PHE 214 Cb -0.12 -2.09 0.03 0.00 0.51 0.00 0.00 43.02 41.36 2gre s PHE 214 CO 0.03 -0.71 0.21 -1.17 0.70 0.00 0.00 175.22 174.28 2gre s LEU 215 N 1.35 4.73 -0.79 -0.37 2.96 0.58 -0.31 118.68 126.83 2gre s LEU 215 Ca 0.01 -1.01 -0.21 0.00 -0.22 0.00 0.00 54.13 52.70 2gre s LEU 215 Cb -0.17 -2.02 0.09 0.00 0.50 0.00 0.00 46.19 44.60 2gre s LEU 215 CO -0.03 -0.39 1.05 -0.63 -1.32 0.00 0.00 176.35 175.03 2gre s ILE 216 N 1.55 4.48 0.51 6.68 -1.09 -0.74 -1.13 121.20 131.45 2gre s ILE 216 Ca 0.02 -0.89 -0.12 0.00 -2.23 0.00 0.00 60.65 57.43 2gre s ILE 216 Cb -0.19 -4.74 -0.06 0.00 -1.58 0.00 0.00 42.46 35.89 2gre s ILE 216 CO 0.07 -1.50 0.92 -0.55 -1.23 0.00 0.00 174.94 172.64 2gre s SER 217 N 3.73 6.44 -0.13 3.58 0.15 0.47 -2.76 113.70 125.18 2gre s SER 217 Ca 0.27 1.33 0.15 0.00 0.70 0.00 0.00 55.95 58.41 2gre s SER 217 Cb -0.11 -2.42 0.30 0.00 -1.71 0.00 0.00 66.02 62.08 2gre s SER 217 CO 0.01 -0.62 1.15 -0.46 1.20 0.00 0.00 173.24 174.52 2gre n ASN 218 N -1.94 1.88 -4.35 5.45 2.04 -1.26 -0.84 115.26 116.24 2gre n ASN 218 Ca 0.05 -3.13 -0.18 0.00 -0.44 0.00 0.00 54.58 50.88 2gre n ASN 218 Cb 0.54 -0.42 -0.10 0.00 -2.53 0.00 0.00 39.78 37.27 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 -2.73 2.43 0.00 0.53 0.01 -1.26 -4.48 114.94 109.45 2gre s ASN 219 Ca 0.30 -1.08 0.00 0.00 -0.71 0.00 0.00 52.86 51.37 2gre s ASN 219 Cb 0.28 -0.11 0.00 0.00 0.41 0.00 0.00 41.25 41.83 2gre s ASN 219 CO -0.01 -0.27 0.67 -0.62 -1.51 0.00 0.00 177.10 175.37 2gre n GLU 220 N -0.40 0.00 -2.88 -0.60 4.71 -1.26 -4.92 120.64 115.28 2gre n GLU 220 Ca -0.07 0.22 -0.02 0.00 -0.01 0.00 0.00 57.16 57.28 2gre n GLU 220 Cb 0.61 -1.62 0.01 0.00 -1.01 0.00 0.00 31.44 29.43 2gre n GLU 220 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 2gre s SER 228 N -2.34 -1.23 -1.17 1.62 0.01 -1.26 -5.00 113.70 104.32 2gre s SER 228 Ca 0.00 -1.14 -0.05 0.00 1.31 0.00 0.00 55.95 56.07 2gre s SER 228 Cb 0.00 1.60 0.23 0.00 0.21 0.00 0.00 66.02 68.06 2gre s SER 228 CO 0.00 -0.08 1.88 -3.20 0.41 0.00 0.00 173.24 172.25 2gre n ASN 229 N 3.40 6.76 -4.58 2.44 5.15 -1.26 -4.94 115.26 122.23 2gre n ASN 229 Ca 0.14 -3.35 -0.43 0.00 -0.60 0.00 0.00 54.58 50.34 2gre n ASN 229 Cb 0.58 -1.31 -0.04 0.00 -0.53 0.00 0.00 39.78 38.47 2gre n ASN 229 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2gre s ILE 230 N -2.07 4.58 0.39 -1.44 1.09 -1.26 -5.04 121.20 117.45 2gre s ILE 230 Ca 0.41 0.85 -0.27 0.00 -1.10 0.00 0.00 60.65 60.54 2gre s ILE 230 Cb 0.13 -4.35 -0.11 0.00 -1.06 0.00 0.00 42.46 37.08 2gre s ILE 230 CO -0.02 -0.66 1.46 -2.65 -0.10 0.00 0.00 174.94 172.97 2gre n PRO 231 N 6.85 2.55 -0.35 2.79 -0.02 -1.26 -4.90 135.00 140.66 2gre n PRO 231 Ca 0.05 0.90 0.26 0.00 -2.02 0.00 0.00 63.50 62.69 2gre n PRO 231 Cb 0.48 -2.64 0.51 0.00 -0.02 0.00 0.00 33.50 31.84 2gre n PRO 231 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2gre h GLU 232 N 2.78 0.27 -0.00 -0.52 3.07 -2.00 -1.37 114.58 116.80 2gre h GLU 232 Ca -0.50 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.34 2gre h GLU 232 Cb 1.25 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 29.10 2gre h GLU 232 CO 0.63 0.18 -0.08 -0.85 -1.40 0.00 0.00 179.01 177.49 2gre n GLU 233 N -4.97 0.89 -1.68 2.33 0.00 -1.26 -4.84 120.64 111.11 2gre n GLU 233 Ca 0.32 -0.32 -0.44 0.00 0.00 0.00 0.00 57.16 56.73 2gre n GLU 233 Cb 1.05 -1.49 -0.04 0.00 0.00 0.00 0.00 31.44 30.96 2gre n GLU 233 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 2gre n THR 234 N -0.78 0.35 -0.02 3.84 -1.04 -0.52 0.05 114.28 116.17 2gre n THR 234 Ca 0.17 -0.06 -0.03 0.00 -2.04 0.00 0.00 64.05 62.09 2gre n THR 234 Cb 0.26 -1.99 -0.03 0.00 -1.82 0.00 0.00 70.33 66.76 2gre n THR 234 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2gre n VAL 235 N 4.58 0.27 -4.27 12.58 0.31 0.15 -4.77 118.33 127.19 2gre n VAL 235 Ca 0.19 -0.14 -0.21 0.00 -0.01 0.00 0.00 64.34 64.17 2gre n VAL 235 Cb 0.35 -0.79 -0.12 0.00 -0.91 0.00 0.00 33.84 32.36 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 -2.09 1.00 -0.14 5.55 2.02 -1.20 -1.76 118.70 122.09 2gre s GLU 236 Ca -0.04 -1.03 -0.03 0.00 0.02 0.00 0.00 54.97 53.89 2gre s GLU 236 Cb 0.01 -1.14 0.05 0.00 0.10 0.00 0.00 34.13 33.15 2gre s GLU 236 CO 0.14 0.26 0.04 -0.47 0.02 0.00 0.00 175.26 175.25 2gre s TYR 237 N -1.16 0.68 -0.29 1.61 6.14 0.33 -1.05 117.35 123.61 2gre s TYR 237 Ca 0.03 -0.44 -0.02 0.00 0.64 0.00 0.00 57.07 57.28 2gre s TYR 237 Cb -0.10 -0.85 0.04 0.00 0.42 0.00 0.00 41.96 41.48 2gre s TYR 237 CO 0.03 -0.47 -0.02 -1.17 0.64 0.00 0.00 175.55 174.57 2gre s LEU 238 N 1.97 3.70 0.12 6.97 2.96 0.18 -1.07 118.68 133.51 2gre s LEU 238 Ca 0.02 -1.16 -0.28 0.00 -0.22 0.00 0.00 54.13 52.49 2gre s LEU 238 Cb -0.15 -1.70 -0.06 0.00 0.50 0.00 0.00 46.19 44.78 2gre s LEU 238 CO -0.07 -0.22 0.89 0.00 -1.32 0.00 0.00 176.35 175.63 2gre s ALA 239 N 1.27 3.31 -0.31 5.97 0.00 -0.54 -0.35 121.76 131.12 2gre s ALA 239 Ca -0.04 0.49 -0.04 0.00 0.00 0.00 0.00 51.96 52.37 2gre s ALA 239 Cb -0.19 -3.16 0.04 0.00 0.00 0.00 0.00 23.12 19.81 2gre s ALA 239 CO -0.02 0.07 0.04 0.08 0.00 0.00 0.00 175.76 175.93 2gre s VAL 240 N -0.33 3.35 0.00 0.00 1.01 0.12 -2.21 120.40 122.34 2gre s VAL 240 Ca 0.43 -1.19 0.00 0.00 0.00 0.00 0.00 61.98 61.22 2gre s VAL 240 Cb -0.23 -2.87 0.00 0.00 0.00 0.00 0.00 36.38 33.28 2gre s VAL 240 CO 0.28 -0.08 0.00 -0.67 0.00 0.00 0.00 175.10 174.63 2gre n ASP 241 N 4.72 0.00 0.00 3.32 2.03 -0.62 -4.52 116.55 121.48 2gre n ASP 241 Ca -0.13 -0.73 0.00 0.00 0.52 0.00 0.00 54.79 54.44 2gre n ASP 241 Cb 0.45 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.85 2gre n ASP 241 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2gre n GLY 243 N 0.00 0.93 3.79 0.27 0.00 -1.26 -3.39 105.19 105.53 2gre n GLY 243 Ca 0.00 -0.89 -0.30 0.00 0.00 0.00 0.00 46.02 44.83 2gre n GLY 243 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gre s ALA 244 N -2.00 3.62 0.38 4.61 0.00 -1.26 -4.51 121.76 122.59 2gre s ALA 244 Ca 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 50.95 2gre s ALA 244 Cb 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 23.12 21.65 2gre s ALA 244 CO 0.00 0.74 0.00 1.28 0.00 0.00 0.00 175.76 177.78 2gre n LEU 245 N 0.38 0.00 0.02 0.00 4.77 -1.26 -4.39 117.00 116.51 2gre n LEU 245 Ca -0.08 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.01 2gre n LEU 245 Cb 0.52 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.48 2gre n LEU 245 CO 0.45 0.00 -0.56 0.61 -1.33 0.00 0.00 177.39 176.56 2gre n GLY 246 N 3.04 -1.12 3.15 -0.72 0.00 -1.26 -4.75 105.19 103.53 2gre n GLY 246 Ca 0.00 -0.45 0.06 0.00 0.00 0.00 0.00 46.02 45.63 2gre n GLY 246 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2gre s ASP 247 N -4.70 -0.16 0.00 1.61 -4.77 -1.26 -5.21 116.67 102.17 2gre s ASP 247 Ca -0.06 0.07 0.00 0.00 -3.30 0.00 0.00 52.55 49.26 2gre s ASP 247 Cb 0.13 1.12 0.00 0.00 -1.09 0.00 0.00 42.92 43.08 2gre s ASP 247 CO 0.88 -0.03 0.00 0.61 0.70 0.00 0.00 175.17 177.33 2gre n GLY 248 N 5.32 -0.94 2.95 2.12 0.00 -1.26 -5.25 105.19 108.11 2gre n GLY 248 Ca -0.01 -1.55 -0.14 0.00 0.00 0.00 0.00 46.02 44.32 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 -1.14 -0.04 -0.05 1.61 -1.08 -1.26 -5.15 116.67 109.56 2gre s ASP 252 Ca 0.00 0.36 0.13 0.00 -0.52 0.00 0.00 52.55 52.52 2gre s ASP 252 Cb 0.00 0.26 0.46 0.00 -1.46 0.00 0.00 42.92 42.18 2gre s ASP 252 CO 0.00 -0.17 1.33 -0.62 0.52 0.00 0.00 175.17 176.24 2gre n GLU 253 N 4.36 2.57 -0.70 4.34 1.02 -1.26 -3.80 120.64 127.17 2gre n GLU 253 Ca -0.23 -1.82 0.04 0.00 -0.02 0.00 0.00 57.16 55.13 2gre n GLU 253 Cb 0.52 -1.58 0.06 0.00 -0.02 0.00 0.00 31.44 30.42 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 0.73 0.00 -3.50 -0.32 4.02 -1.26 -1.96 117.16 114.86 2gre n TYR 254 Ca 0.17 -0.53 -0.11 0.00 -0.01 0.00 0.00 57.90 57.42 2gre n TYR 254 Cb 0.55 -0.12 -0.02 0.00 -0.02 0.00 0.00 39.34 39.73 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 -0.99 0.01 -0.04 -0.72 -4.23 -1.26 -4.26 115.64 104.16 2gre s THR 255 Ca 0.20 -0.21 -0.20 0.00 -1.18 0.00 0.00 61.69 60.31 2gre s THR 255 Cb 0.21 -1.15 -0.05 0.00 1.34 0.00 0.00 72.50 72.85 2gre s THR 255 CO -0.05 -0.04 0.57 0.54 -0.54 0.00 0.00 174.62 175.10 2gre s VAL 256 N -3.78 4.99 -0.07 2.29 0.11 -0.38 -3.23 120.40 120.33 2gre s VAL 256 Ca 0.03 1.18 -0.09 0.00 -2.93 0.00 0.00 61.98 60.16 2gre s VAL 256 Cb -0.01 -3.90 -0.05 0.00 -1.53 0.00 0.00 36.38 30.89 2gre s VAL 256 CO -0.10 0.39 0.23 -0.94 -3.33 0.00 0.00 175.10 171.35 2gre s SER 257 N 0.04 6.51 -0.16 3.54 1.04 -0.51 -0.23 113.70 123.93 2gre s SER 257 Ca 0.30 0.61 -0.01 0.00 0.48 0.00 0.00 55.95 57.33 2gre s SER 257 Cb -0.17 -2.12 -0.01 0.00 0.10 0.00 0.00 66.02 63.82 2gre s SER 257 CO 0.15 0.36 -0.12 -0.63 0.98 0.00 0.00 173.24 173.99 2gre s ILE 258 N -1.09 3.00 -0.24 -1.02 1.01 0.71 -1.45 121.20 122.12 2gre s ILE 258 Ca 0.19 -0.66 -0.14 0.00 0.00 0.00 0.00 60.65 60.05 2gre s ILE 258 Cb -0.13 -2.29 -0.04 0.00 0.01 0.00 0.00 42.46 40.01 2gre s ILE 258 CO 0.09 0.50 0.33 0.00 0.00 0.00 0.00 174.94 175.85 2gre n ALA 260 N 4.87 2.70 -3.64 0.00 0.00 0.69 -4.51 120.51 120.62 2gre n ALA 260 Ca -0.10 -0.28 -0.05 0.00 0.00 0.00 0.00 53.44 53.01 2gre n ALA 260 Cb 0.51 -1.07 -0.07 0.00 0.00 0.00 0.00 19.45 18.83 2gre n ALA 260 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2gre s LYS 261 N -3.34 0.26 0.03 0.00 2.20 -1.25 -1.94 119.74 115.70 2gre s LYS 261 Ca 0.00 0.32 0.00 0.00 -0.36 0.00 0.00 55.97 55.94 2gre s LYS 261 Cb 0.11 0.12 -0.00 0.00 -1.51 0.00 0.00 37.83 36.55 2gre s LYS 261 CO 0.79 -0.03 0.01 -0.40 -0.36 0.00 0.00 175.35 175.36 2gre n ASP 262 N 2.08 1.08 0.22 1.43 3.85 -0.68 -1.38 116.55 123.17 2gre n ASP 262 Ca -0.12 -1.15 0.13 0.00 -0.71 0.00 0.00 54.79 52.94 2gre n ASP 262 Cb 0.56 0.07 0.51 0.00 -1.35 0.00 0.00 41.12 40.91 2gre n ASP 262 CO 0.00 0.00 0.00 -1.28 -1.01 0.00 0.00 177.20 174.91 2gre h SER 263 N 0.11 0.00 -0.02 -1.12 0.87 -1.63 0.53 113.55 112.28 2gre h SER 263 Ca -0.02 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.54 2gre h SER 263 Cb 0.08 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.04 2gre h SER 263 CO 0.04 0.00 -0.01 -1.54 -0.53 0.00 0.00 176.83 174.78 2gre n SER 264 N -2.95 2.47 0.00 6.23 3.41 -1.26 -4.93 113.62 116.58 2gre n SER 264 Ca 0.03 -3.11 0.00 0.00 -0.26 0.00 0.00 58.87 55.54 2gre n SER 264 Cb 0.75 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 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 -1.35 2.66 3.75 5.00 0.00 0.19 -5.04 105.19 110.40 2gre n GLY 265 Ca 0.17 -2.12 -0.41 0.00 0.00 0.00 0.00 46.02 43.65 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 -2.16 4.24 0.68 1.61 0.02 -1.26 -1.68 135.00 136.45 2gre s PRO 266 Ca 0.00 2.36 -0.12 0.00 0.02 0.00 0.00 61.00 63.26 2gre s PRO 266 Cb 0.00 -3.08 0.00 0.00 0.02 0.00 0.00 34.50 31.44 2gre s PRO 266 CO 0.00 -0.43 1.06 0.71 -0.33 0.00 0.00 177.00 178.01 2gre s TYR 267 N -0.26 3.05 -0.38 6.54 1.51 -0.82 -4.91 117.35 122.09 2gre s TYR 267 Ca 0.58 1.45 -0.41 0.00 -1.01 0.00 0.00 57.07 57.68 2gre s TYR 267 Cb -0.43 -2.92 -0.16 0.00 -0.11 0.00 0.00 41.96 38.34 2gre s TYR 267 CO 0.47 -1.23 1.87 1.58 -1.11 0.00 0.00 175.55 177.12 2gre n HIS 268 N -2.90 1.76 0.10 2.71 -0.00 -1.01 -4.87 115.22 111.01 2gre n HIS 268 Ca 0.08 0.65 -0.09 0.00 0.46 0.00 0.00 57.72 58.82 2gre n HIS 268 Cb 0.53 -2.40 -0.05 0.00 -0.12 0.00 0.00 29.99 27.95 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 8.03 -0.77 -0.88 1.57 -0.00 -1.91 0.26 116.97 123.27 2gre h TYR 269 Ca -0.36 0.01 0.14 0.00 -0.00 0.00 0.00 58.73 58.52 2gre h TYR 269 Cb 1.35 0.32 -0.07 0.00 -0.00 0.00 0.00 36.73 38.33 2gre h TYR 269 CO 0.82 -0.33 0.57 0.00 -0.00 0.00 0.00 178.16 179.22 2gre h ALA 270 N -1.14 1.83 -0.16 1.82 0.00 -2.00 -0.09 119.26 119.51 2gre h ALA 270 Ca -0.01 0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.69 2gre h ALA 270 Cb 0.42 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.09 2gre h ALA 270 CO -0.10 -0.06 -0.75 1.25 0.00 0.00 0.00 179.25 179.58 2gre h LEU 271 N 0.69 0.95 -0.50 0.00 5.85 -1.89 -1.79 115.31 118.63 2gre h LEU 271 Ca 0.44 -0.62 -0.04 0.00 0.84 0.00 0.00 57.88 58.49 2gre h LEU 271 Cb 0.69 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 2gre h LEU 271 CO -0.19 1.41 0.14 -0.09 -0.34 0.00 0.00 178.44 179.37 2gre h ARG 272 N 0.54 0.78 -0.69 1.25 2.43 0.56 -1.29 114.38 117.98 2gre h ARG 272 Ca -0.05 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 58.95 2gre h ARG 272 Cb 1.38 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 30.79 2gre h ARG 272 CO 0.16 0.74 0.44 0.87 -1.51 0.00 0.00 179.97 180.67 2gre h LYS 273 N 0.68 0.91 -0.13 0.20 1.57 -1.06 -1.08 116.57 117.67 2gre h LYS 273 Ca 0.16 -0.07 0.02 0.00 -1.87 0.00 0.00 60.65 58.89 2gre h LYS 273 Cb 0.30 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 2gre h LYS 273 CO -0.00 0.62 0.02 1.25 -0.57 0.00 0.00 179.45 180.77 2gre h HIS 274 N 0.94 0.03 -0.99 -1.35 2.76 -0.92 0.51 115.15 116.13 2gre h HIS 274 Ca 0.25 0.01 0.11 0.00 -2.20 0.00 0.00 60.37 58.54 2gre h HIS 274 Cb -0.08 0.00 -0.08 0.00 1.55 0.00 0.00 27.41 28.81 2gre h HIS 274 CO 0.00 0.01 0.63 -0.07 -1.30 0.00 0.00 177.93 177.20 2gre h LEU 275 N 0.07 0.92 -0.19 0.26 3.38 -0.40 -0.31 115.31 119.04 2gre h LEU 275 Ca 0.06 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 2gre h LEU 275 Cb 0.05 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2gre h LEU 275 CO -0.08 0.50 0.04 0.58 0.09 0.00 0.00 178.44 179.57 2gre h VAL 276 N 0.99 1.21 -0.28 1.22 2.07 -0.63 -2.19 116.25 118.64 2gre h VAL 276 Ca 0.48 -0.69 0.06 0.00 0.82 0.00 0.00 66.70 67.36 2gre h VAL 276 Cb 0.46 1.31 -0.05 0.00 -1.52 0.00 0.00 31.29 31.48 2gre h VAL 276 CO -0.24 0.21 -0.07 -0.08 0.02 0.00 0.00 177.57 177.41 2gre h GLU 277 N 0.11 -0.00 -1.00 1.57 4.57 -0.13 -1.58 114.58 118.12 2gre h GLU 277 Ca 0.06 0.00 0.14 0.00 -1.18 0.00 0.00 59.36 58.38 2gre h GLU 277 Cb 0.29 0.00 -0.09 0.00 -0.16 0.00 0.00 28.75 28.79 2gre h GLU 277 CO 0.00 -0.00 0.62 -0.07 -1.18 0.00 0.00 179.01 178.38 2gre h LEU 278 N -0.00 0.87 0.05 1.64 3.38 -0.86 0.49 115.31 120.87 2gre h LEU 278 Ca 0.14 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 2gre h LEU 278 Cb 0.21 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2gre h LEU 278 CO -0.29 0.42 -0.03 0.00 0.09 0.00 0.00 178.44 178.63 2gre h ALA 279 N 1.57 -0.07 -0.37 1.53 0.00 -0.71 -1.88 119.26 119.33 2gre h ALA 279 Ca 0.51 -0.21 0.07 0.00 0.00 0.00 0.00 54.91 55.29 2gre h ALA 279 Cb 0.62 0.03 -0.09 0.00 0.00 0.00 0.00 17.79 18.35 2gre h ALA 279 CO -0.29 -0.33 -0.34 0.87 0.00 0.00 0.00 179.25 179.16 2gre h LYS 280 N -0.50 -0.27 -0.72 0.00 1.57 -0.75 0.15 116.57 116.04 2gre h LYS 280 Ca -0.01 0.02 0.09 0.00 -1.87 0.00 0.00 60.65 58.88 2gre h LYS 280 Cb 0.45 0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.77 2gre h LYS 280 CO 0.01 -0.18 0.48 1.15 -0.57 0.00 0.00 179.45 180.34 2gre h THR 281 N -0.28 0.95 -0.59 -0.16 2.02 -0.80 -2.33 112.91 111.72 2gre h THR 281 Ca 0.16 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 67.11 2gre h THR 281 Cb 0.55 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 2gre h THR 281 CO -0.52 0.12 0.00 0.59 0.37 0.00 0.00 175.52 176.08 2gre n ASN 282 N -4.49 3.58 -3.67 4.18 3.02 -0.72 -4.93 115.26 112.23 2gre n ASN 282 Ca 0.12 -2.00 -0.23 0.00 -0.03 0.00 0.00 54.58 52.44 2gre n ASN 282 Cb 0.31 -0.39 0.05 0.00 -0.61 0.00 0.00 39.78 39.14 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 1.22 -2.21 -3.48 3.10 8.25 -0.39 -4.98 115.22 116.73 2gre n HIS 283 Ca 0.20 0.90 -0.38 0.00 -0.26 0.00 0.00 57.72 58.19 2gre n HIS 283 Cb 0.55 -4.56 -0.08 0.00 1.12 0.00 0.00 29.99 27.02 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 -3.47 5.26 -0.09 1.59 1.01 0.37 -5.03 121.20 120.84 2gre s ILE 284 Ca 0.24 0.53 -0.29 0.00 0.00 0.00 0.00 60.65 61.13 2gre s ILE 284 Cb -0.11 -3.65 -0.07 0.00 0.01 0.00 0.00 42.46 38.64 2gre s ILE 284 CO 0.79 0.29 2.09 -1.61 0.00 0.00 0.00 174.94 176.50 2gre s GLU 285 N 1.18 3.63 0.11 2.79 8.01 -1.26 -4.34 118.70 128.83 2gre s GLU 285 Ca 0.15 2.31 0.02 0.00 0.01 0.00 0.00 54.97 57.47 2gre s GLU 285 Cb -0.14 -4.27 -0.04 0.00 -4.31 0.00 0.00 34.13 25.37 2gre s GLU 285 CO 0.07 -1.54 -0.07 1.52 0.01 0.00 0.00 175.26 175.24 2gre s TYR 286 N 6.40 1.00 -0.04 1.61 1.13 -1.26 -1.25 117.35 124.95 2gre s TYR 286 Ca 0.94 -0.88 0.04 0.00 -1.41 0.00 0.00 57.07 55.76 2gre s TYR 286 Cb -0.38 -0.56 -0.00 0.00 -1.10 0.00 0.00 41.96 39.93 2gre s TYR 286 CO 0.38 -0.09 -0.15 0.21 -2.51 0.00 0.00 175.55 173.39 2gre s LYS 287 N -3.81 1.55 -0.23 -3.49 2.47 0.69 -4.85 119.74 112.06 2gre s LYS 287 Ca 0.14 -0.52 -0.21 0.00 -1.56 0.00 0.00 55.97 53.82 2gre s LYS 287 Cb 0.05 -1.37 -0.02 0.00 -1.46 0.00 0.00 37.83 35.03 2gre s LYS 287 CO -0.03 0.21 0.63 0.08 0.16 0.00 0.00 175.35 176.40 2gre s VAL 288 N 0.08 5.00 0.19 4.02 1.01 -1.26 -0.20 120.40 129.24 2gre s VAL 288 Ca -0.04 1.16 0.08 0.00 0.00 0.00 0.00 61.98 63.19 2gre s VAL 288 Cb -0.11 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 2gre s VAL 288 CO 0.02 0.07 -0.16 -1.81 0.00 0.00 0.00 175.10 173.21 2gre s ASP 289 N 1.34 2.67 -0.18 3.32 1.01 0.86 -4.93 116.67 120.76 2gre s ASP 289 Ca 0.27 -0.95 -0.00 0.00 0.71 0.00 0.00 52.55 52.58 2gre s ASP 289 Cb -0.16 -0.15 0.01 0.00 1.01 0.00 0.00 42.92 43.63 2gre s ASP 289 CO 0.09 -0.10 -0.15 -0.63 0.21 0.00 0.00 175.17 174.60 2gre s ILE 290 N -2.53 2.54 -0.33 0.77 1.01 -1.26 -0.23 121.20 121.17 2gre s ILE 290 Ca 0.20 -0.79 -0.12 0.00 0.00 0.00 0.00 60.65 59.94 2gre s ILE 290 Cb -0.03 -2.09 -0.02 0.00 0.01 0.00 0.00 42.46 40.32 2gre s ILE 290 CO 0.07 0.50 0.23 -0.31 0.00 0.00 0.00 174.94 175.43 2gre s TYR 291 N 1.21 3.22 -1.10 3.97 2.02 -0.48 -4.66 117.35 121.54 2gre s TYR 291 Ca 0.02 -0.22 0.27 0.00 -0.37 0.00 0.00 57.07 56.76 2gre s TYR 291 Cb -0.14 -2.46 1.18 0.00 -0.40 0.00 0.00 41.96 40.15 2gre s TYR 291 CO -0.07 -0.36 1.86 -0.35 -1.57 0.00 0.00 175.55 175.07 2gre n PRO 292 N 5.09 0.09 -0.33 -1.71 -0.04 -1.26 -2.38 135.00 134.46 2gre n PRO 292 Ca -0.13 0.04 0.08 0.00 -0.04 0.00 0.00 63.50 63.45 2gre n PRO 292 Cb 0.50 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.65 2gre n PRO 292 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2gre n TYR 293 N -1.45 0.47 0.00 0.54 4.01 -1.26 -4.17 117.16 115.30 2gre n TYR 293 Ca 0.08 -1.05 0.00 0.00 -0.16 0.00 0.00 57.90 56.77 2gre n TYR 293 Cb 0.29 -0.25 0.00 0.00 -0.31 0.00 0.00 39.34 39.06 2gre n TYR 293 CO 0.00 0.00 0.00 2.48 -0.46 0.00 0.00 176.86 178.88 2gre n TYR 294 N -1.03 0.00 0.00 -0.72 -0.00 -1.26 -4.90 117.16 109.25 2gre n TYR 294 Ca 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 58.10 2gre n TYR 294 Cb 0.78 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 40.12 2gre n TYR 294 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.86 179.75 2gre n ARG 303 N 0.00 0.00 -0.24 -3.48 -4.01 -1.26 -4.77 116.66 102.89 2gre n ARG 303 Ca 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.81 2gre n ARG 303 Cb 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.42 2gre n ARG 303 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2gre n ALA 304 N 0.00 0.00 -1.00 2.89 0.00 -1.26 -4.75 120.51 116.39 2gre n ALA 304 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2gre n ALA 304 Cb 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 18.79 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 -1.59 -0.64 0.00 0.00 0.00 -1.26 -4.99 105.19 96.71 2gre n GLY 305 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2gre n GLY 305 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2gre n PHE 306 N -0.03 0.00 -2.27 1.61 3.01 -1.26 -4.80 117.46 113.73 2gre n PHE 306 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.09 2gre n PHE 306 Cb 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.44 2gre n PHE 306 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 2gre n ASP 307 N 0.00 4.02 -4.04 4.37 2.03 -1.26 -4.92 116.55 116.75 2gre n ASP 307 Ca 0.00 -2.81 -0.08 0.00 0.52 0.00 0.00 54.79 52.42 2gre n ASP 307 Cb 0.00 -1.72 -0.10 0.00 -0.72 0.00 0.00 41.12 38.58 2gre n ASP 307 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2gre s VAL 308 N 7.06 0.18 -0.10 5.18 -7.23 -1.26 -4.79 120.40 119.43 2gre s VAL 308 Ca 0.60 -1.52 -0.30 0.00 -1.81 0.00 0.00 61.98 58.95 2gre s VAL 308 Cb 0.03 -1.19 -0.01 0.00 0.56 0.00 0.00 36.38 35.77 2gre s VAL 308 CO 0.10 -0.84 1.05 -0.54 -0.31 0.00 0.00 175.10 174.56 2gre s LYS 309 N -3.28 4.40 -0.10 4.82 1.02 -0.72 -4.93 119.74 120.95 2gre s LYS 309 Ca 0.01 1.45 -0.02 0.00 0.02 0.00 0.00 55.97 57.43 2gre s LYS 309 Cb 0.03 -3.55 -0.03 0.00 -0.52 0.00 0.00 37.83 33.76 2gre s LYS 309 CO -0.08 -0.36 -0.00 -3.38 -0.92 0.00 0.00 175.35 170.61 2gre s HIS 310 N 2.13 3.14 0.10 3.18 -3.43 -1.26 -0.51 115.29 118.64 2gre s HIS 310 Ca 0.50 0.11 0.00 0.00 -0.80 0.00 0.00 55.06 54.87 2gre s HIS 310 Cb -0.19 -1.83 -0.04 0.00 -1.43 0.00 0.00 32.58 29.08 2gre s HIS 310 CO 0.18 0.37 -0.03 0.00 -2.00 0.00 0.00 174.74 173.26 2gre s ALA 311 N -0.61 0.86 -0.08 -1.38 0.00 -0.23 -2.41 121.76 117.90 2gre s ALA 311 Ca 0.10 -1.35 -0.03 0.00 0.00 0.00 0.00 51.96 50.67 2gre s ALA 311 Cb -0.12 0.35 0.04 0.00 0.00 0.00 0.00 23.12 23.40 2gre s ALA 311 CO 0.02 -0.33 0.15 -1.17 0.00 0.00 0.00 175.76 174.44 2gre s LEU 312 N -3.02 0.09 0.24 0.00 0.20 -1.26 -1.47 118.68 113.46 2gre s LEU 312 Ca 0.14 0.32 0.02 0.00 0.69 0.00 0.00 54.13 55.30 2gre s LEU 312 Cb 0.07 0.28 -0.05 0.00 -0.43 0.00 0.00 46.19 46.06 2gre s LEU 312 CO -0.04 -0.22 0.06 0.27 -0.29 0.00 0.00 176.35 176.12 2gre s ILE 313 N 2.06 0.69 -0.27 6.68 -0.00 -0.94 -0.39 121.20 129.04 2gre s ILE 313 Ca 0.01 -2.00 -0.35 0.00 -0.00 0.00 0.00 60.65 58.30 2gre s ILE 313 Cb -0.12 -2.49 0.16 0.00 -0.00 0.00 0.00 42.46 40.02 2gre s ILE 313 CO -0.06 -0.16 1.35 -0.83 -0.00 0.00 0.00 174.94 175.24 2gre s GLY 314 N -3.29 -0.14 0.65 6.27 0.00 -0.53 -1.59 107.32 108.70 2gre s GLY 314 Ca 0.33 2.11 -0.18 0.00 0.00 0.00 0.00 44.72 46.99 2gre s GLY 314 CO 0.11 0.75 1.08 0.00 0.00 0.00 0.00 173.10 175.04 2gre n ALA 315 N 0.13 0.42 -2.62 3.20 0.00 -1.26 -1.43 120.51 118.95 2gre n ALA 315 Ca 0.03 -0.04 -0.42 0.00 0.00 0.00 0.00 53.44 53.01 2gre n ALA 315 Cb 0.57 -2.19 -0.03 0.00 0.00 0.00 0.00 19.45 17.81 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 -1.39 2.67 0.06 0.00 0.00 -1.20 -4.74 107.32 102.72 2gre s GLY 316 Ca 0.78 0.61 0.05 0.00 0.00 0.00 0.00 44.72 46.16 2gre s GLY 316 CO 0.45 1.84 -0.08 -0.26 0.00 0.00 0.00 173.10 175.04 2gre s ILE 317 N 1.21 3.49 0.22 0.90 -4.36 -1.26 -4.45 121.20 116.95 2gre s ILE 317 Ca 0.54 -1.05 0.02 0.00 -0.26 0.00 0.00 60.65 59.89 2gre s ILE 317 Cb -0.23 -2.58 -0.04 0.00 1.25 0.00 0.00 42.46 40.86 2gre s ILE 317 CO 0.27 0.24 0.38 -0.62 0.24 0.00 0.00 174.94 175.45 2gre s ASP 318 N -1.86 6.35 0.00 4.36 2.15 0.40 -4.66 116.67 123.41 2gre s ASP 318 Ca 0.20 0.28 0.00 0.00 0.43 0.00 0.00 52.55 53.46 2gre s ASP 318 Cb -0.11 -1.96 0.00 0.00 -0.30 0.00 0.00 42.92 40.55 2gre s ASP 318 CO 0.11 -0.07 0.00 -1.54 -0.17 0.00 0.00 175.17 173.50 2gre n SER 319 N -0.99 0.00 -4.47 -0.34 3.41 -1.26 -2.95 113.62 107.02 2gre n SER 319 Ca -0.06 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.14 2gre n SER 319 Cb 0.55 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.51 2gre n SER 319 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2gre n SER 320 N 0.81 -0.72 0.00 4.04 2.88 -1.26 -3.16 113.62 116.20 2gre n SER 320 Ca 0.00 0.89 0.00 0.00 -1.33 0.00 0.00 58.87 58.43 2gre n SER 320 Cb 0.00 -1.14 0.00 0.00 -0.75 0.00 0.00 64.21 62.32 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 -0.95 0.00 -3.35 0.66 8.25 -1.26 -4.83 115.22 113.73 2gre n HIS 321 Ca 0.11 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.51 2gre n HIS 321 Cb 0.41 -0.93 -0.07 0.00 1.12 0.00 0.00 29.99 30.52 2gre n HIS 321 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2gre s ALA 322 N -1.79 -1.32 -0.75 -1.41 0.00 -1.19 -4.84 121.76 110.46 2gre s ALA 322 Ca 0.00 1.16 -0.03 0.00 0.00 0.00 0.00 51.96 53.09 2gre s ALA 322 Cb 0.00 -1.73 0.00 0.00 0.00 0.00 0.00 23.12 21.40 2gre s ALA 322 CO 0.00 -1.22 0.65 1.19 0.00 0.00 0.00 175.76 176.38 2gre n PHE 323 N 5.38 -2.56 -2.77 0.00 3.01 -1.26 -4.66 117.46 114.60 2gre n PHE 323 Ca -0.04 1.01 -0.30 0.00 1.01 0.00 0.00 57.45 59.14 2gre n PHE 323 Cb 0.50 -3.39 -0.02 0.00 -0.01 0.00 0.00 39.48 36.56 2gre n PHE 323 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 2gre s GLU 324 N -3.85 3.73 -0.07 -1.08 2.02 -0.30 -4.62 118.70 114.53 2gre s GLU 324 Ca 0.03 0.43 -0.31 0.00 0.02 0.00 0.00 54.97 55.15 2gre s GLU 324 Cb -0.01 -2.37 0.07 0.00 0.10 0.00 0.00 34.13 31.93 2gre s GLU 324 CO 0.82 -0.09 0.70 0.50 0.02 0.00 0.00 175.26 177.21 2gre s ARG 325 N -4.08 1.02 0.36 1.61 3.52 -1.15 0.07 118.95 120.30 2gre s ARG 325 Ca 0.51 0.31 -0.06 0.00 -0.13 0.00 0.00 55.73 56.36 2gre s ARG 325 Cb -0.10 0.48 0.03 0.00 -1.56 0.00 0.00 34.95 33.79 2gre s ARG 325 CO 0.35 -0.31 0.58 -2.37 -0.81 0.00 0.00 175.30 172.74 2gre n THR 326 N 1.04 0.00 -4.78 4.11 5.66 -0.88 -0.45 114.28 118.97 2gre n THR 326 Ca -0.18 -1.49 -0.27 0.00 -3.05 0.00 0.00 64.05 59.06 2gre n THR 326 Cb 0.57 1.04 -0.14 0.00 -1.55 0.00 0.00 70.33 70.25 2gre n THR 326 CO 0.00 0.00 0.00 -2.28 -3.05 0.00 0.00 175.07 169.74 2gre s HIS 327 N -2.75 2.00 0.46 1.09 2.46 -0.83 -1.90 115.29 115.82 2gre s HIS 327 Ca 0.24 -0.39 0.31 0.00 0.47 0.00 0.00 55.06 55.69 2gre s HIS 327 Cb -0.02 -1.20 1.40 0.00 -0.13 0.00 0.00 32.58 32.62 2gre s HIS 327 CO 0.17 0.09 1.70 1.05 -2.47 0.00 0.00 174.74 175.28 2gre h GLU 328 N 4.94 0.14 -0.34 2.88 4.11 -1.50 0.42 114.58 125.22 2gre h GLU 328 Ca -0.43 -0.01 -0.05 0.00 0.07 0.00 0.00 59.36 58.93 2gre h GLU 328 Cb 1.15 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.35 2gre h GLU 328 CO 0.44 0.09 -0.02 0.66 0.07 0.00 0.00 179.01 180.25 2gre h SER 329 N 0.14 0.51 -0.16 3.06 4.64 -1.85 0.98 113.55 120.88 2gre h SER 329 Ca 0.71 -0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.92 2gre h SER 329 Cb 2.34 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 64.29 2gre h SER 329 CO -0.25 0.60 0.07 -1.28 -0.87 0.00 0.00 176.83 175.10 2gre h SER 330 N 0.52 0.21 -0.00 4.97 0.87 -0.31 -0.47 113.55 119.33 2gre h SER 330 Ca 0.11 -0.14 0.03 0.00 -1.23 0.00 0.00 61.79 60.55 2gre h SER 330 Cb 0.37 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.24 2gre h SER 330 CO 0.01 0.30 -0.17 0.40 -0.53 0.00 0.00 176.83 176.84 2gre h ILE 331 N 0.11 0.60 -0.38 2.23 1.08 -1.35 0.30 117.51 120.10 2gre h ILE 331 Ca 0.05 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.60 2gre h ILE 331 Cb 0.15 0.60 -0.09 0.00 -3.07 0.00 0.00 36.82 34.41 2gre h ILE 331 CO -0.01 0.00 -0.22 0.00 -0.69 0.00 0.00 178.15 177.23 2gre h ALA 332 N 0.66 0.02 -0.42 1.87 0.00 -0.61 0.39 119.26 121.16 2gre h ALA 332 Ca 0.05 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 2gre h ALA 332 Cb 0.34 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 2gre h ALA 332 CO -0.16 -0.60 0.09 0.45 0.00 0.00 0.00 179.25 179.02 2gre h HIS 333 N -0.17 0.72 -0.52 0.00 3.86 -0.88 0.16 115.15 118.33 2gre h HIS 333 Ca 0.18 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.29 2gre h HIS 333 Cb 0.45 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.70 2gre h HIS 333 CO -0.45 0.69 0.29 1.15 0.86 0.00 0.00 177.93 180.48 2gre h THR 334 N 0.55 1.17 -0.99 2.45 2.02 0.17 -1.10 112.91 117.17 2gre h THR 334 Ca 0.13 -0.41 0.09 0.00 0.77 0.00 0.00 66.41 66.99 2gre h THR 334 Cb 0.34 0.50 -0.08 0.00 -1.74 0.00 0.00 68.15 67.18 2gre h THR 334 CO 0.00 0.18 0.62 -0.33 0.37 0.00 0.00 175.52 176.37 2gre h GLU 335 N 0.69 1.03 -0.47 6.66 5.08 0.31 -2.27 114.58 125.61 2gre h GLU 335 Ca 0.18 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.40 2gre h GLU 335 Cb 0.03 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.03 2gre h GLU 335 CO -0.03 0.68 -0.05 0.00 -1.00 0.00 0.00 179.01 178.60 2gre h ALA 336 N 1.49 1.02 -0.24 3.43 0.00 0.49 -2.91 119.26 122.54 2gre h ALA 336 Ca 0.46 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 2gre h ALA 336 Cb 0.33 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2gre h ALA 336 CO -0.22 0.60 -0.14 1.25 0.00 0.00 0.00 179.25 180.73 2gre h LEU 337 N 0.75 0.54 -0.59 0.00 6.46 -0.73 -2.09 115.31 119.65 2gre h LEU 337 Ca 0.14 -0.42 0.01 0.00 -0.12 0.00 0.00 57.88 57.48 2gre h LEU 337 Cb 0.53 -0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 40.28 2gre h LEU 337 CO 0.03 0.85 0.38 0.58 -0.62 0.00 0.00 178.44 179.66 2gre h VAL 338 N 0.23 1.13 0.54 1.05 2.07 -1.50 0.81 116.25 120.58 2gre h VAL 338 Ca 0.05 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 2gre h VAL 338 Cb 0.65 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 2gre h VAL 338 CO 0.04 0.14 -0.38 0.22 0.02 0.00 0.00 177.57 177.61 2gre h TYR 339 N 0.78 -1.01 -0.97 1.57 5.03 -1.41 -0.21 116.97 120.75 2gre h TYR 339 Ca 0.22 -0.00 0.08 0.00 2.58 0.00 0.00 58.73 61.61 2gre h TYR 339 Cb -0.06 0.37 -0.07 0.00 1.55 0.00 0.00 36.73 38.52 2gre h TYR 339 CO -0.04 -0.56 0.61 0.00 -1.32 0.00 0.00 178.16 176.86 2gre h ALA 340 N -0.55 1.38 -0.32 1.82 0.00 -1.01 -1.18 119.26 119.40 2gre h ALA 340 Ca -0.06 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.86 2gre h ALA 340 Cb 0.74 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2gre h ALA 340 CO 0.03 0.34 0.17 -0.92 0.00 0.00 0.00 179.25 178.87 2gre h TYR 341 N 1.07 0.31 0.00 0.00 5.03 0.11 -1.99 116.97 121.51 2gre h TYR 341 Ca 0.44 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.76 2gre h TYR 341 Cb 0.26 -0.09 0.00 0.00 1.55 0.00 0.00 36.73 38.45 2gre h TYR 341 CO -0.01 0.17 0.00 0.28 -1.32 0.00 0.00 178.16 177.28 2gre n VAL 342 N -4.94 1.81 -0.76 1.81 0.31 -0.13 -4.68 118.33 111.75 2gre n VAL 342 Ca -0.00 -0.44 0.08 0.00 -0.01 0.00 0.00 64.34 63.97 2gre n VAL 342 Cb 0.07 -1.43 -0.02 0.00 -0.91 0.00 0.00 33.84 31.54 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 1.47 -3.46 -4.92 4.52 3.41 -0.75 -4.38 113.62 109.51 2gre n SER 344 Ca 0.00 0.34 -0.26 0.00 -0.26 0.00 0.00 58.87 58.69 2gre n SER 344 Cb 0.47 -2.49 0.03 0.00 -0.26 0.00 0.00 64.21 61.95 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 -4.19 5.67 0.81 4.04 0.01 -1.26 -4.84 114.94 115.18 2gre s ASN 345 Ca 0.00 0.70 -0.12 0.00 -0.71 0.00 0.00 52.86 52.73 2gre s ASN 345 Cb 0.00 -1.74 0.08 0.00 0.41 0.00 0.00 41.25 40.00 2gre s ASN 345 CO 0.00 -0.99 1.14 -0.76 -1.51 0.00 0.00 177.10 174.97 2gre s LEU 346 N -4.94 3.05 -0.12 0.60 1.43 -1.26 -4.98 118.68 112.46 2gre s LEU 346 Ca 0.53 2.08 -0.21 0.00 -1.03 0.00 0.00 54.13 55.49 2gre s LEU 346 Cb -0.10 -4.55 -0.03 0.00 0.03 0.00 0.00 46.19 41.53 2gre s LEU 346 CO 0.45 -2.44 0.63 -0.51 0.23 0.00 0.00 176.35 174.71 2gre s ILE 347 N -2.58 5.07 -2.00 -0.59 -1.16 -1.26 -5.23 121.20 113.45 2gre s ILE 347 Ca 0.66 1.26 0.26 0.00 -0.51 0.00 0.00 60.65 62.32 2gre s ILE 347 Cb -0.22 -3.96 0.73 0.00 0.61 0.00 0.00 42.46 39.62 2gre s ILE 347 CO 0.53 0.22 1.89 -1.84 -2.81 0.00 0.00 174.94 172.94