#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gag h SER 2 N 0.00 0.99 -3.94 7.83 0.02 -1.97 -1.51 113.55 114.98 2gag h SER 2 Ca 0.00 -0.50 -0.53 0.00 -0.84 0.00 0.00 61.79 59.93 2gag h SER 2 Cb 0.00 -0.28 0.08 0.00 0.14 0.00 0.00 62.40 62.34 2gag h SER 2 CO 0.00 1.30 0.62 -0.54 -1.14 0.00 0.00 176.83 177.07 2gag s LYS 3 N -4.25 4.01 0.77 3.45 1.02 -1.26 -4.61 119.74 118.86 2gag s LYS 3 Ca -0.11 2.16 -0.11 0.00 0.02 0.00 0.00 55.97 57.93 2gag s LYS 3 Cb 0.11 -2.79 0.05 0.00 -0.52 0.00 0.00 37.83 34.68 2gag s LYS 3 CO 0.89 -0.46 1.08 -1.25 -0.92 0.00 0.00 175.35 174.69 2gag s PRO 4 N -2.19 2.30 0.12 -1.68 0.04 -1.25 -4.63 135.00 127.70 2gag s PRO 4 Ca 0.56 0.96 -0.25 0.00 0.04 0.00 0.00 61.00 62.32 2gag s PRO 4 Cb -0.38 -1.92 0.07 0.00 0.04 0.00 0.00 34.50 32.32 2gag s PRO 4 CO 0.49 -1.55 0.65 1.14 0.04 0.00 0.00 177.00 177.77 2gag s GLN 5 N -4.99 1.20 0.09 4.56 -2.07 -0.66 -2.95 119.66 114.84 2gag s GLN 5 Ca 0.60 -0.37 -0.28 0.00 -1.82 0.00 0.00 55.36 53.49 2gag s GLN 5 Cb -0.16 0.55 -0.06 0.00 -1.09 0.00 0.00 33.01 32.26 2gag s GLN 5 CO 0.56 -0.51 0.90 0.50 -1.32 0.00 0.00 175.29 175.42 2gag s ARG 6 N -3.39 4.64 0.91 9.60 6.06 -1.17 -0.51 118.95 135.08 2gag s ARG 6 Ca 0.00 1.33 -0.12 0.00 -2.50 0.00 0.00 55.73 54.44 2gag s ARG 6 Cb -0.01 -3.37 0.14 0.00 0.06 0.00 0.00 34.95 31.77 2gag s ARG 6 CO -0.10 0.24 1.14 -0.51 -2.50 0.00 0.00 175.30 173.57 2gag s LEU 7 N -0.05 2.01 0.64 -0.88 1.43 0.19 -4.90 118.68 117.11 2gag s LEU 7 Ca 0.44 0.96 -0.13 0.00 -1.03 0.00 0.00 54.13 54.37 2gag s LEU 7 Cb -0.23 -3.27 -0.02 0.00 0.03 0.00 0.00 46.19 42.70 2gag s LEU 7 CO 0.28 -2.56 1.05 -0.94 0.23 0.00 0.00 176.35 174.40 2gag s SER 8 N -4.03 5.70 0.38 2.29 1.04 -1.26 -4.86 113.70 112.96 2gag s SER 8 Ca 0.64 1.65 0.11 0.00 0.48 0.00 0.00 55.95 58.83 2gag s SER 8 Cb -0.15 -2.50 0.89 0.00 0.10 0.00 0.00 66.02 64.36 2gag s SER 8 CO 0.53 -1.22 1.91 0.00 0.98 0.00 0.00 173.24 175.44 2gag h ALA 9 N -0.19 1.91 -0.56 5.32 0.00 -1.96 -0.67 119.26 123.11 2gag h ALA 9 Ca -0.45 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.49 2gag h ALA 9 Cb 1.21 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 2gag h ALA 9 CO 0.58 -0.11 0.34 1.49 0.00 0.00 0.00 179.25 181.55 2gag h GLU 10 N 0.60 0.65 -0.54 0.00 4.57 -2.02 -2.65 114.58 115.19 2gag h GLU 10 Ca 0.39 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.53 2gag h GLU 10 Cb 0.67 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.12 2gag h GLU 10 CO -0.15 0.43 0.00 1.04 -1.18 0.00 0.00 179.01 179.15 2gag n GLN 11 N -4.77 2.46 -2.80 1.92 6.02 -0.34 -4.24 117.38 115.64 2gag n GLN 11 Ca 0.04 -1.81 -0.02 0.00 -0.01 0.00 0.00 57.00 55.21 2gag n GLN 11 Cb 0.08 -1.53 0.05 0.00 1.02 0.00 0.00 30.24 29.86 2gag n GLN 11 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2gag n SER 12 N 0.79 1.44 0.29 1.08 3.41 -0.69 -4.82 113.62 115.12 2gag n SER 12 Ca 0.17 -2.18 0.15 0.00 -0.26 0.00 0.00 58.87 56.75 2gag n SER 12 Cb 0.52 -0.45 0.90 0.00 -0.26 0.00 0.00 64.21 64.92 2gag n SER 12 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2gag h SER 13 N 2.65 0.00 0.15 4.04 4.64 -1.72 -2.47 113.55 120.84 2gag h SER 13 Ca -0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 2gag h SER 13 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2gag h SER 13 CO 0.24 0.03 -0.21 0.54 -0.87 0.00 0.00 176.83 176.56 2gag n ARG 14 N -3.69 1.11 -1.69 4.77 1.74 -1.26 -4.97 116.66 112.66 2gag n ARG 14 Ca -0.03 -0.69 -0.43 0.00 -0.77 0.00 0.00 57.85 55.93 2gag n ARG 14 Cb 0.13 -1.49 -0.01 0.00 -1.02 0.00 0.00 32.46 30.07 2gag n ARG 14 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2gag n ALA 15 N -0.34 1.30 -1.37 7.54 0.00 -0.93 -4.74 120.51 121.96 2gag n ALA 15 Ca 0.13 0.37 -0.25 0.00 0.00 0.00 0.00 53.44 53.69 2gag n ALA 15 Cb 0.37 -2.26 -0.03 0.00 0.00 0.00 0.00 19.45 17.53 2gag n ALA 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2gag n ARG 16 N 0.92 2.29 -4.27 0.00 5.12 0.33 -4.87 116.66 116.19 2gag n ARG 16 Ca 0.06 -2.25 -0.21 0.00 -1.93 0.00 0.00 57.85 53.52 2gag n ARG 16 Cb 0.35 -2.04 -0.12 0.00 -1.16 0.00 0.00 32.46 29.50 2gag n ARG 16 CO 0.00 0.00 0.00 0.96 -1.93 0.00 0.00 177.63 176.66 2gag s ILE 17 N -2.47 1.54 -0.52 0.55 -4.36 -1.26 -4.63 121.20 110.04 2gag s ILE 17 Ca 0.53 -1.63 -0.14 0.00 -0.26 0.00 0.00 60.65 59.15 2gag s ILE 17 Cb 0.36 -1.53 0.13 0.00 1.25 0.00 0.00 42.46 42.67 2gag s ILE 17 CO -0.17 -0.23 0.46 0.21 0.24 0.00 0.00 174.94 175.45 2gag s ASN 18 N -2.18 6.06 0.07 4.36 3.84 -0.55 -4.91 114.94 121.64 2gag s ASN 18 Ca 0.08 -1.83 0.11 0.00 0.21 0.00 0.00 52.86 51.43 2gag s ASN 18 Cb -0.08 -2.16 0.51 0.00 -0.55 0.00 0.00 41.25 38.98 2gag s ASN 18 CO 0.04 -0.81 1.36 0.54 -2.79 0.00 0.00 177.10 175.44 2gag n ARG 19 N 5.14 0.04 0.03 0.43 1.74 -1.26 -1.37 116.66 121.41 2gag n ARG 19 Ca -0.12 0.40 0.14 0.00 -0.77 0.00 0.00 57.85 57.50 2gag n ARG 19 Cb 0.40 -1.60 0.54 0.00 -1.02 0.00 0.00 32.46 30.78 2gag n ARG 19 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2gag n GLU 20 N -1.68 0.07 -3.75 5.56 -0.58 -1.26 -4.35 120.64 114.65 2gag n GLU 20 Ca 0.02 0.05 -0.29 0.00 -0.42 0.00 0.00 57.16 56.52 2gag n GLU 20 Cb 0.10 -1.58 -0.12 0.00 -0.57 0.00 0.00 31.44 29.27 2gag n GLU 20 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 2gag s GLU 21 N -3.03 1.67 0.46 3.49 2.12 -0.47 -5.10 118.70 117.84 2gag s GLU 21 Ca 0.13 -2.51 -0.22 0.00 0.36 0.00 0.00 54.97 52.73 2gag s GLU 21 Cb 0.17 -2.65 -0.08 0.00 0.26 0.00 0.00 34.13 31.84 2gag s GLU 21 CO 0.56 -1.23 1.12 0.00 -0.54 0.00 0.00 175.26 175.17 2gag s ALA 22 N -0.32 2.95 0.05 6.30 0.00 -1.26 -1.87 121.76 127.60 2gag s ALA 22 Ca 0.22 0.83 0.03 0.00 0.00 0.00 0.00 51.96 53.04 2gag s ALA 22 Cb -0.14 -3.34 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 2gag s ALA 22 CO -0.08 -0.54 -0.09 -0.51 0.00 0.00 0.00 175.76 174.54 2gag s LEU 23 N -3.11 2.24 0.04 0.00 1.43 0.23 -4.88 118.68 114.64 2gag s LEU 23 Ca 0.64 -0.53 0.02 0.00 -1.03 0.00 0.00 54.13 53.23 2gag s LEU 23 Cb -0.25 -0.27 -0.04 0.00 0.03 0.00 0.00 46.19 45.66 2gag s LEU 23 CO 0.30 -0.15 0.05 -0.55 0.23 0.00 0.00 176.35 176.23 2gag s SER 24 N -1.51 5.36 0.20 2.29 0.15 -1.26 0.40 113.70 119.32 2gag s SER 24 Ca -0.07 -0.01 -0.19 0.00 0.70 0.00 0.00 55.95 56.38 2gag s SER 24 Cb -0.09 -1.42 0.04 0.00 -1.71 0.00 0.00 66.02 62.83 2gag s SER 24 CO 0.01 0.22 0.57 -1.48 1.20 0.00 0.00 173.24 173.76 2gag s LEU 25 N -2.03 -0.14 -0.05 3.45 2.34 -0.94 0.75 118.68 122.07 2gag s LEU 25 Ca 0.25 -0.37 0.02 0.00 0.06 0.00 0.00 54.13 54.09 2gag s LEU 25 Cb -0.12 2.35 0.01 0.00 -0.56 0.00 0.00 46.19 47.87 2gag s LEU 25 CO 0.17 -1.07 -0.10 -0.89 -1.06 0.00 0.00 176.35 173.40 2gag s THR 26 N -3.84 0.90 -0.09 5.48 2.01 0.93 -0.11 115.64 120.92 2gag s THR 26 Ca 0.07 -0.37 0.00 0.00 0.31 0.00 0.00 61.69 61.70 2gag s THR 26 Cb -0.02 -0.84 0.02 0.00 0.01 0.00 0.00 72.50 71.68 2gag s THR 26 CO -0.04 0.30 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.41 2gag s VAL 27 N 0.57 0.99 -1.55 3.82 1.01 -0.69 -0.56 120.40 123.99 2gag s VAL 27 Ca -0.10 -0.31 -0.13 0.00 0.00 0.00 0.00 61.98 61.43 2gag s VAL 27 Cb -0.13 -0.99 0.09 0.00 0.00 0.00 0.00 36.38 35.35 2gag s VAL 27 CO 0.02 0.35 0.89 0.47 0.00 0.00 0.00 175.10 176.83 2gag n ASP 28 N 4.56 -3.98 0.00 3.32 8.00 -0.50 -1.13 116.55 126.81 2gag n ASP 28 Ca -0.16 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.49 2gag n ASP 28 Cb 0.51 -3.61 0.00 0.00 -0.02 0.00 0.00 41.12 38.00 2gag n ASP 28 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gag n GLY 29 N -1.64 2.79 3.72 0.44 0.00 -1.26 -5.01 105.19 104.22 2gag n GLY 29 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 2gag n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gag s ALA 30 N -2.64 3.44 0.02 4.61 0.00 -0.28 -5.04 121.76 121.87 2gag s ALA 30 Ca 0.00 -0.11 -0.30 0.00 0.00 0.00 0.00 51.96 51.55 2gag s ALA 30 Cb 0.00 -2.75 -0.04 0.00 0.00 0.00 0.00 23.12 20.32 2gag s ALA 30 CO 0.00 -0.07 1.14 0.15 0.00 0.00 0.00 175.76 176.98 2gag s LYS 31 N 0.76 4.45 0.23 0.00 3.01 -1.26 -1.71 119.74 125.22 2gag s LYS 31 Ca 0.29 1.65 0.07 0.00 -1.01 0.00 0.00 55.97 56.97 2gag s LYS 31 Cb -0.16 -3.43 -0.05 0.00 -1.01 0.00 0.00 37.83 33.19 2gag s LYS 31 CO 0.12 -0.25 -0.11 -0.51 0.51 0.00 0.00 175.35 175.12 2gag s LEU 32 N 1.32 2.51 -0.02 3.17 1.43 0.84 -5.00 118.68 122.93 2gag s LEU 32 Ca 0.56 -1.09 0.07 0.00 -1.03 0.00 0.00 54.13 52.64 2gag s LEU 32 Cb -0.26 -0.63 -0.02 0.00 0.03 0.00 0.00 46.19 45.31 2gag s LEU 32 CO 0.27 -0.25 -0.22 -0.94 0.23 0.00 0.00 176.35 175.44 2gag s SER 33 N -3.35 3.36 0.25 2.29 1.04 -1.26 -2.20 113.70 113.83 2gag s SER 33 Ca 0.25 -0.40 0.03 0.00 0.48 0.00 0.00 55.95 56.31 2gag s SER 33 Cb 0.01 -0.49 -0.01 0.00 0.10 0.00 0.00 66.02 65.63 2gag s SER 33 CO 0.08 0.32 0.26 0.00 0.98 0.00 0.00 173.24 174.88 2gag n ALA 34 N 2.31 0.27 -2.63 5.32 0.00 0.16 -4.80 120.51 121.14 2gag n ALA 34 Ca -0.16 -1.35 -0.18 0.00 0.00 0.00 0.00 53.44 51.74 2gag n ALA 34 Cb 0.51 1.09 -0.12 0.00 0.00 0.00 0.00 19.45 20.94 2gag n ALA 34 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2gag s PHE 35 N -3.14 1.28 0.24 0.00 0.08 -1.26 0.76 117.98 115.94 2gag s PHE 35 Ca 0.27 -0.49 -0.31 0.00 0.12 0.00 0.00 56.93 56.51 2gag s PHE 35 Cb 0.01 -0.70 -0.12 0.00 -0.57 0.00 0.00 43.02 41.63 2gag s PHE 35 CO 0.19 0.08 1.57 -2.13 -0.10 0.00 0.00 175.22 174.83 2gag n ARG 36 N 1.06 2.47 0.00 0.44 3.00 -0.78 -1.47 116.66 121.37 2gag n ARG 36 Ca -0.19 0.88 0.00 0.00 -0.00 0.00 0.00 57.85 58.54 2gag n ARG 36 Cb 0.55 -2.64 0.00 0.00 0.00 0.00 0.00 32.46 30.37 2gag n ARG 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2gag n GLY 37 N 2.69 1.82 3.80 5.14 0.00 -1.26 -1.48 105.19 115.90 2gag n GLY 37 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 2gag n GLY 37 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gag s ASP 38 N -1.30 5.32 0.36 1.61 1.01 -0.54 -4.86 116.67 118.28 2gag s ASP 38 Ca 0.00 1.72 0.08 0.00 0.71 0.00 0.00 52.55 55.06 2gag s ASP 38 Cb 0.00 -2.51 -0.03 0.00 1.01 0.00 0.00 42.92 41.38 2gag s ASP 38 CO 0.00 -1.49 0.24 0.42 0.21 0.00 0.00 175.17 174.55 2gag s THR 39 N -2.84 2.99 0.42 -1.27 -4.23 -1.26 -1.95 115.64 107.50 2gag s THR 39 Ca 0.60 -1.53 0.08 0.00 -1.18 0.00 0.00 61.69 59.66 2gag s THR 39 Cb -0.15 -3.04 0.27 0.00 1.34 0.00 0.00 72.50 70.92 2gag s THR 39 CO 0.50 -0.12 2.06 0.58 -0.54 0.00 0.00 174.62 177.10 2gag h VAL 40 N 1.34 1.09 0.38 2.29 2.07 -1.02 0.09 116.25 122.50 2gag h VAL 40 Ca -0.43 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 2gag h VAL 40 Cb 1.26 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 2gag h VAL 40 CO 0.62 0.09 -0.18 0.00 0.02 0.00 0.00 177.57 178.12 2gag h ALA 41 N 1.76 -0.52 -0.45 1.67 0.00 -1.53 -0.84 119.26 119.36 2gag h ALA 41 Ca 0.15 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2gag h ALA 41 Cb -0.03 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2gag h ALA 41 CO -0.03 -0.67 0.21 0.66 0.00 0.00 0.00 179.25 179.42 2gag h SER 42 N -0.75 0.56 -0.31 0.00 4.64 -1.76 -2.43 113.55 113.49 2gag h SER 42 Ca -0.05 -0.05 -0.04 0.00 -0.47 0.00 0.00 61.79 61.18 2gag h SER 42 Cb 0.52 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 2gag h SER 42 CO 0.09 0.48 0.03 0.00 -0.87 0.00 0.00 176.83 176.56 2gag h ALA 43 N 1.61 0.42 -0.12 5.18 0.00 -0.85 -0.26 119.26 125.23 2gag h ALA 43 Ca 0.16 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 54.89 2gag h ALA 43 Cb 0.07 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2gag h ALA 43 CO -0.02 0.14 -0.06 -0.07 0.00 0.00 0.00 179.25 179.23 2gag h LEU 44 N 0.35 -0.20 -0.91 0.00 3.38 -0.77 -1.21 115.31 115.95 2gag h LEU 44 Ca 0.09 0.05 -0.05 0.00 0.09 0.00 0.00 57.88 58.07 2gag h LEU 44 Cb 0.38 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 2gag h LEU 44 CO 0.01 -0.08 0.24 -0.07 0.09 0.00 0.00 178.44 178.63 2gag h LEU 45 N -0.05 0.96 -1.99 1.67 3.38 -1.36 -0.85 115.31 117.08 2gag h LEU 45 Ca 0.07 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 2gag h LEU 45 Cb 0.16 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 2gag h LEU 45 CO -0.16 0.88 -0.01 0.00 0.09 0.00 0.00 178.44 179.25 2gag h ALA 46 N 1.25 1.98 -0.60 1.53 0.00 -0.49 -2.07 119.26 120.86 2gag h ALA 46 Ca 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2gag h ALA 46 Cb 0.24 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2gag h ALA 46 CO -0.01 0.01 0.00 0.09 0.00 0.00 0.00 179.25 179.34 2gag n ASN 47 N -4.53 4.06 -0.05 0.00 3.02 -0.51 -3.05 115.26 114.21 2gag n ASN 47 Ca -0.03 -2.29 -0.01 0.00 -0.03 0.00 0.00 54.58 52.23 2gag n ASN 47 Cb 0.10 -0.51 -0.00 0.00 -0.61 0.00 0.00 39.78 38.75 2gag n ASN 47 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2gag n GLY 48 N 1.18 0.46 3.50 7.41 0.00 -0.79 -5.02 105.19 111.93 2gag n GLY 48 Ca 0.23 -0.66 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 2gag n GLY 48 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gag s VAL 49 N -2.01 5.17 -0.18 1.61 1.01 -0.42 -4.48 120.40 121.11 2gag s VAL 49 Ca 0.00 -0.34 -0.00 0.00 0.00 0.00 0.00 61.98 61.63 2gag s VAL 49 Cb 0.00 -3.70 -0.22 0.00 0.00 0.00 0.00 36.38 32.46 2gag s VAL 49 CO 0.00 -0.06 0.12 -1.14 0.00 0.00 0.00 175.10 174.02 2gag n ARG 50 N 5.10 0.70 -2.62 2.72 0.63 -1.26 -3.77 116.66 118.16 2gag n ARG 50 Ca -0.12 0.20 -0.39 0.00 -0.92 0.00 0.00 57.85 56.62 2gag n ARG 50 Cb 0.49 -1.62 -0.05 0.00 0.45 0.00 0.00 32.46 31.73 2gag n ARG 50 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2gag s ARG 51 N -2.54 4.60 0.00 -0.14 0.52 -1.26 -3.32 118.95 116.81 2gag s ARG 51 Ca -0.26 1.58 0.00 0.00 -0.52 0.00 0.00 55.73 56.53 2gag s ARG 51 Cb 0.08 -3.03 0.00 0.00 0.52 0.00 0.00 34.95 32.52 2gag s ARG 51 CO 0.71 0.24 0.00 0.00 0.02 0.00 0.00 175.30 176.27 2gag n ALA 52 N 0.93 0.00 -1.47 2.13 0.00 0.13 -4.87 120.51 117.37 2gag n ALA 52 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 2gag n ALA 52 Cb 0.47 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.98 2gag n ALA 52 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2gag s GLY 53 N -1.26 2.01 0.78 0.00 0.00 -1.24 -4.58 107.32 103.02 2gag s GLY 53 Ca 0.00 0.44 -0.12 0.00 0.00 0.00 0.00 44.72 45.03 2gag s GLY 53 CO 0.00 0.78 1.14 -1.31 0.00 0.00 0.00 173.10 173.71 2gag s ASN 54 N -2.87 4.05 0.68 1.64 -0.87 -1.26 -4.17 114.94 112.14 2gag s ASN 54 Ca 0.65 2.10 -0.17 0.00 -1.57 0.00 0.00 52.86 53.86 2gag s ASN 54 Cb -0.19 -2.56 -0.00 0.00 -0.02 0.00 0.00 41.25 38.48 2gag s ASN 54 CO 0.45 -2.35 1.13 -1.54 -2.57 0.00 0.00 177.10 172.23 2gag n SER 55 N -3.35 1.25 -0.21 -1.22 3.41 0.11 -4.49 113.62 109.12 2gag n SER 55 Ca 0.11 0.75 -0.02 0.00 -0.26 0.00 0.00 58.87 59.45 2gag n SER 55 Cb 0.52 -1.48 0.09 0.00 -0.26 0.00 0.00 64.21 63.08 2gag n SER 55 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2gag h LEU 56 N 0.12 0.45 0.00 1.04 5.85 -1.79 -2.94 115.31 118.04 2gag h LEU 56 Ca -0.49 0.04 -0.12 0.00 0.84 0.00 0.00 57.88 58.15 2gag h LEU 56 Cb 1.34 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.30 2gag h LEU 56 CO 0.50 0.29 -1.47 -1.22 -0.34 0.00 0.00 178.44 176.21 2gag n TYR 57 N -4.84 0.00 1.01 1.25 4.01 -1.26 -4.67 117.16 112.65 2gag n TYR 57 Ca 0.07 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.94 2gag n TYR 57 Cb 0.18 -0.32 0.34 0.00 -0.31 0.00 0.00 39.34 39.23 2gag n TYR 57 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2gag n LEU 58 N -2.70 0.40 -3.72 7.72 4.77 -1.26 -4.94 117.00 117.26 2gag n LEU 58 Ca -0.14 0.11 -0.25 0.00 -0.03 0.00 0.00 56.01 55.70 2gag n LEU 58 Cb 0.66 -0.30 0.05 0.00 -2.33 0.00 0.00 43.42 41.50 2gag n LEU 58 CO 0.09 0.10 0.10 -0.67 -1.33 0.00 0.00 177.39 175.67 2gag n ASP 59 N -1.48 -3.86 -4.87 -1.43 2.03 -1.11 -4.95 116.55 100.87 2gag n ASP 59 Ca 0.06 -0.71 -0.31 0.00 0.52 0.00 0.00 54.79 54.35 2gag n ASP 59 Cb 0.34 -4.37 -0.05 0.00 -0.72 0.00 0.00 41.12 36.31 2gag n ASP 59 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2gag s ARG 60 N -6.21 3.82 0.36 -0.67 1.81 -1.26 -4.64 118.95 112.15 2gag s ARG 60 Ca 0.38 0.35 -0.28 0.00 -1.72 0.00 0.00 55.73 54.47 2gag s ARG 60 Cb -0.18 -2.55 -0.10 0.00 -0.45 0.00 0.00 34.95 31.67 2gag s ARG 60 CO 0.79 0.20 1.28 -2.14 -0.68 0.00 0.00 175.30 174.75 2gag s PRO 61 N -3.15 4.24 0.04 3.54 0.02 -1.26 0.06 135.00 138.49 2gag s PRO 61 Ca 0.49 2.14 -0.03 0.00 0.02 0.00 0.00 61.00 63.62 2gag s PRO 61 Cb -0.11 -2.95 -0.02 0.00 0.02 0.00 0.00 34.50 31.44 2gag s PRO 61 CO 0.23 -0.26 0.02 1.03 -0.33 0.00 0.00 177.00 177.70 2gag s ARG 62 N -1.95 0.57 0.40 5.54 1.81 -1.26 -4.25 118.95 119.82 2gag s ARG 62 Ca 0.52 -0.95 0.05 0.00 -1.72 0.00 0.00 55.73 53.62 2gag s ARG 62 Cb -0.38 0.21 -0.02 0.00 -0.45 0.00 0.00 34.95 34.31 2gag s ARG 62 CO 0.50 -0.12 0.18 0.20 -0.68 0.00 0.00 175.30 175.37 2gag s GLY 63 N -2.42 2.61 0.23 -3.53 0.00 -1.26 0.20 107.32 103.15 2gag s GLY 63 Ca -0.01 -1.39 -0.30 0.00 0.00 0.00 0.00 44.72 43.02 2gag s GLY 63 CO -0.07 -1.74 1.51 -0.42 0.00 0.00 0.00 173.10 172.38 2gag s ILE 64 N -3.25 2.53 -0.15 0.90 1.01 -1.21 -4.51 121.20 116.53 2gag s ILE 64 Ca 0.27 0.43 0.06 0.00 0.00 0.00 0.00 60.65 61.41 2gag s ILE 64 Cb 0.02 -3.27 -0.13 0.00 0.01 0.00 0.00 42.46 39.08 2gag s ILE 64 CO 0.18 0.06 -0.06 0.33 0.00 0.00 0.00 174.94 175.45 2gag n PHE 65 N 2.76 0.00 -3.89 3.97 7.35 -1.26 -4.73 117.46 121.66 2gag n PHE 65 Ca 0.09 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.78 2gag n PHE 65 Cb 0.39 -0.63 0.00 0.00 0.35 0.00 0.00 39.48 39.59 2gag n PHE 65 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2gag n ALA 66 N -2.75 0.00 -0.49 3.13 0.00 -1.26 -1.50 120.51 117.63 2gag n ALA 66 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2gag n ALA 66 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.31 2gag n ALA 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gag n ALA 67 N -3.00 1.30 -3.00 0.00 0.00 -1.26 -4.94 120.51 109.61 2gag n ALA 67 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.13 2gag n ALA 67 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2gag n ALA 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gag n GLY 68 N -0.03 5.40 0.14 0.00 0.00 -1.26 -4.78 105.19 104.65 2gag n GLY 68 Ca 0.00 -1.30 0.11 0.00 0.00 0.00 0.00 46.02 44.83 2gag n GLY 68 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2gag n VAL 69 N 0.00 0.96 1.36 1.61 0.24 -1.26 -2.20 118.33 119.03 2gag n VAL 69 Ca 0.00 0.44 0.06 0.00 -2.04 0.00 0.00 64.34 62.80 2gag n VAL 69 Cb 0.00 -1.40 0.20 0.00 -1.47 0.00 0.00 33.84 31.17 2gag n VAL 69 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 2gag n GLU 70 N -2.20 1.49 -1.69 7.34 0.00 -1.26 -4.90 120.64 119.43 2gag n GLU 70 Ca 0.01 -0.76 -0.43 0.00 0.00 0.00 0.00 57.16 55.97 2gag n GLU 70 Cb 0.14 -1.23 -0.03 0.00 0.00 0.00 0.00 31.44 30.32 2gag n GLU 70 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 2gag n GLU 71 N 0.07 2.64 -0.02 3.44 4.07 -0.94 -4.71 120.64 125.19 2gag n GLU 71 Ca 0.10 0.96 0.06 0.00 -0.06 0.00 0.00 57.16 58.21 2gag n GLU 71 Cb 0.20 -2.83 -0.13 0.00 -0.06 0.00 0.00 31.44 28.63 2gag n GLU 71 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 2gag n PRO 72 N 5.26 0.67 -0.12 5.31 -0.04 -1.26 -4.79 135.00 140.03 2gag n PRO 72 Ca 0.18 -0.13 -0.19 0.00 -0.04 0.00 0.00 63.50 63.33 2gag n PRO 72 Cb 0.35 -1.39 -0.10 0.00 -0.04 0.00 0.00 33.50 32.32 2gag n PRO 72 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2gag n ASN 73 N -2.16 2.08 -4.45 3.54 3.02 -1.26 -4.24 115.26 111.79 2gag n ASN 73 Ca -0.07 0.01 -0.44 0.00 -0.03 0.00 0.00 54.58 54.05 2gag n ASN 73 Cb 0.53 -0.46 -0.03 0.00 -0.61 0.00 0.00 39.78 39.20 2gag n ASN 73 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2gag s ALA 74 N -2.45 3.28 0.05 5.41 0.00 -1.26 -4.49 121.76 122.31 2gag s ALA 74 Ca -0.31 -2.44 0.07 0.00 0.00 0.00 0.00 51.96 49.28 2gag s ALA 74 Cb 0.09 -3.96 -0.03 0.00 0.00 0.00 0.00 23.12 19.22 2gag s ALA 74 CO 0.49 -2.88 -0.17 -0.51 0.00 0.00 0.00 175.76 172.69 2gag s LEU 75 N 3.14 2.67 0.09 0.00 1.43 -1.26 -0.47 118.68 124.28 2gag s LEU 75 Ca 0.28 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 52.96 2gag s LEU 75 Cb -0.10 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.53 2gag s LEU 75 CO -0.02 0.24 -0.04 0.68 0.23 0.00 0.00 176.35 177.44 2gag s VAL 76 N -0.97 0.50 -0.23 -1.59 -7.23 0.15 -0.08 120.40 110.95 2gag s VAL 76 Ca 0.15 -1.90 -0.08 0.00 -1.81 0.00 0.00 61.98 58.34 2gag s VAL 76 Cb -0.11 -1.71 -0.04 0.00 0.56 0.00 0.00 36.38 35.08 2gag s VAL 76 CO 0.06 -0.83 0.09 -0.89 -0.31 0.00 0.00 175.10 173.22 2gag s THR 77 N -3.75 4.66 -0.18 5.32 2.01 -0.54 -1.87 115.64 121.29 2gag s THR 77 Ca 0.13 -0.06 -0.13 0.00 0.31 0.00 0.00 61.69 61.94 2gag s THR 77 Cb 0.06 -3.16 -0.05 0.00 0.01 0.00 0.00 72.50 69.37 2gag s THR 77 CO -0.05 0.37 0.26 -0.69 -0.69 0.00 0.00 174.62 173.82 2gag s VAL 78 N 1.17 5.32 0.41 3.82 1.01 0.18 -1.62 120.40 130.71 2gag s VAL 78 Ca 0.05 0.46 -0.23 0.00 0.00 0.00 0.00 61.98 62.26 2gag s VAL 78 Cb -0.14 -3.60 -0.09 0.00 0.00 0.00 0.00 36.38 32.55 2gag s VAL 78 CO 0.04 0.39 1.02 -0.44 0.00 0.00 0.00 175.10 176.10 2gag s SER 79 N 0.52 6.76 0.04 3.32 0.01 0.10 -0.75 113.70 123.72 2gag s SER 79 Ca 0.14 1.93 -0.38 0.00 1.31 0.00 0.00 55.95 58.96 2gag s SER 79 Cb -0.13 -2.57 -0.19 0.00 0.21 0.00 0.00 66.02 63.34 2gag s SER 79 CO 0.03 -0.48 1.06 0.00 0.41 0.00 0.00 173.24 174.25 2gag n ALA 80 N -0.29 -3.08 0.27 1.44 0.00 -1.19 -4.72 120.51 112.94 2gag n ALA 80 Ca 0.06 0.57 0.12 0.00 0.00 0.00 0.00 53.44 54.18 2gag n ALA 80 Cb 0.51 -1.80 0.10 0.00 0.00 0.00 0.00 19.45 18.26 2gag n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gag h ARG 81 N 3.02 0.00 -2.44 0.00 3.08 -1.88 -3.48 114.38 112.68 2gag h ARG 81 Ca -0.48 0.00 0.21 0.00 0.07 0.00 0.00 59.98 59.78 2gag h ARG 81 Cb 1.41 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.42 2gag h ARG 81 CO 0.66 0.00 0.68 -3.38 -1.07 0.00 0.00 179.97 176.86 2gag s HIS 82 N -3.27 0.07 0.31 3.04 -3.43 -1.26 -4.85 115.29 105.90 2gag s HIS 82 Ca 0.03 -0.39 0.34 0.00 -0.80 0.00 0.00 55.06 54.24 2gag s HIS 82 Cb 0.10 0.66 1.86 0.00 -1.43 0.00 0.00 32.58 33.77 2gag s HIS 82 CO 0.74 -0.75 2.05 1.05 -2.00 0.00 0.00 174.74 175.83 2gag h GLU 83 N 2.00 0.00 -0.78 -0.38 9.09 -1.97 -1.13 114.58 121.40 2gag h GLU 83 Ca -0.26 0.00 -0.40 0.00 0.05 0.00 0.00 59.36 58.75 2gag h GLU 83 Cb 1.21 0.00 -0.24 0.00 -1.65 0.00 0.00 28.75 28.07 2gag h GLU 83 CO 0.35 0.00 0.41 1.04 0.05 0.00 0.00 179.01 180.86 2gag n GLN 84 N -2.72 2.21 -4.24 1.06 1.13 -1.26 -4.91 117.38 108.64 2gag n GLN 84 Ca -0.02 -3.07 -0.14 0.00 -1.94 0.00 0.00 57.00 51.83 2gag n GLN 84 Cb 0.08 -2.07 -0.10 0.00 0.11 0.00 0.00 30.24 28.26 2gag n GLN 84 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2gag s ASP 85 N -1.67 0.71 0.32 1.08 2.15 -0.43 -3.74 116.67 115.09 2gag s ASP 85 Ca 0.53 -1.34 0.06 0.00 0.43 0.00 0.00 52.55 52.23 2gag s ASP 85 Cb 0.45 0.25 -0.03 0.00 -0.30 0.00 0.00 42.92 43.30 2gag s ASP 85 CO 0.08 -0.75 0.24 0.27 -0.17 0.00 0.00 175.17 174.84 2gag s ILE 86 N -3.93 0.07 0.32 4.11 -4.36 -1.26 -4.79 121.20 111.36 2gag s ILE 86 Ca 0.35 -2.00 -0.27 0.00 -0.26 0.00 0.00 60.65 58.47 2gag s ILE 86 Cb 0.07 -2.48 -0.09 0.00 1.25 0.00 0.00 42.46 41.21 2gag s ILE 86 CO 0.10 0.00 1.05 -1.81 0.24 0.00 0.00 174.94 174.52 2gag s ASP 87 N -3.38 7.14 -0.07 4.36 1.01 -1.26 -3.19 116.67 121.29 2gag s ASP 87 Ca 0.39 2.11 0.02 0.00 0.71 0.00 0.00 52.55 55.78 2gag s ASP 87 Cb 0.03 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.37 2gag s ASP 87 CO 0.24 -0.22 -0.13 -0.70 0.21 0.00 0.00 175.17 174.58 2gag s GLU 88 N -1.84 1.76 0.37 8.23 2.12 0.07 -4.45 118.70 124.96 2gag s GLU 88 Ca 0.49 -0.43 0.08 0.00 0.36 0.00 0.00 54.97 55.47 2gag s GLU 88 Cb -0.27 -1.46 -0.04 0.00 0.26 0.00 0.00 34.13 32.63 2gag s GLU 88 CO 0.34 0.02 0.17 0.45 -0.54 0.00 0.00 175.26 175.70 2gag s SER 89 N 0.69 4.63 -1.50 -1.70 0.15 -1.26 0.50 113.70 115.22 2gag s SER 89 Ca -0.14 -0.86 -0.06 0.00 0.70 0.00 0.00 55.95 55.59 2gag s SER 89 Cb -0.16 -0.64 0.01 0.00 -1.71 0.00 0.00 66.02 63.52 2gag s SER 89 CO 0.03 -0.40 0.78 0.23 1.20 0.00 0.00 173.24 175.08 2gag n MET 90 N -1.21 -5.79 -3.75 5.44 2.81 -1.02 -4.94 117.12 108.66 2gag n MET 90 Ca -0.02 0.89 -0.36 0.00 -1.81 0.00 0.00 57.70 56.39 2gag n MET 90 Cb 0.62 -5.79 -0.07 0.00 -0.71 0.00 0.00 33.22 27.27 2gag n MET 90 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2gag s LEU 91 N -6.83 4.32 0.10 4.03 1.43 -0.78 -4.84 118.68 116.12 2gag s LEU 91 Ca 0.38 0.45 -0.31 0.00 -1.03 0.00 0.00 54.13 53.62 2gag s LEU 91 Cb -0.17 -2.17 -0.08 0.00 0.03 0.00 0.00 46.19 43.80 2gag s LEU 91 CO 0.48 0.29 1.52 -2.84 0.23 0.00 0.00 176.35 176.02 2gag s PRO 92 N -0.39 4.25 0.55 1.29 0.02 -1.26 0.32 135.00 139.78 2gag s PRO 92 Ca 0.14 2.21 0.25 0.00 0.02 0.00 0.00 61.00 63.62 2gag s PRO 92 Cb -0.12 -3.36 1.49 0.00 0.02 0.00 0.00 34.50 32.53 2gag s PRO 92 CO 0.03 -0.59 2.09 0.00 -0.33 0.00 0.00 177.00 178.20 2gag h ALA 93 N 7.37 2.04 0.00 -1.55 0.00 -1.10 -1.08 119.26 124.95 2gag h ALA 93 Ca -0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2gag h ALA 93 Cb 1.20 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2gag h ALA 93 CO 0.90 -0.31 0.00 1.79 0.00 0.00 0.00 179.25 181.63 2gag h THR 94 N 0.00 0.00 0.00 0.00 1.35 -1.86 -1.26 112.91 111.13 2gag h THR 94 Ca 0.11 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 2gag h THR 94 Cb 0.49 1.09 0.00 0.00 -1.73 0.00 0.00 68.15 68.00 2gag h THR 94 CO -0.00 0.00 0.00 0.35 -0.25 0.00 0.00 175.52 175.62 2gag n THR 95 N -2.42 0.49 -3.06 6.82 -2.24 -0.44 -4.62 114.28 108.81 2gag n THR 95 Ca 0.02 -0.67 -0.40 0.00 -2.27 0.00 0.00 64.05 60.72 2gag n THR 95 Cb 0.25 0.82 -0.05 0.00 -2.10 0.00 0.00 70.33 69.24 2gag n THR 95 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2gag s VAL 96 N -0.49 4.99 0.07 2.28 1.01 -1.03 -5.00 120.40 122.23 2gag s VAL 96 Ca 0.00 1.29 -0.30 0.00 0.00 0.00 0.00 61.98 62.97 2gag s VAL 96 Cb 0.00 -3.99 -0.05 0.00 0.00 0.00 0.00 36.38 32.34 2gag s VAL 96 CO 0.00 0.09 1.00 -2.16 0.00 0.00 0.00 175.10 174.03 2gag s PRO 97 N 1.97 4.62 0.12 2.72 0.04 -1.26 -1.77 135.00 141.45 2gag s PRO 97 Ca 0.31 1.49 -0.30 0.00 0.04 0.00 0.00 61.00 62.53 2gag s PRO 97 Cb -0.16 -3.40 -0.07 0.00 0.04 0.00 0.00 34.50 30.91 2gag s PRO 97 CO 0.11 0.07 1.25 0.08 0.04 0.00 0.00 177.00 178.55 2gag s VAL 98 N 0.44 3.64 0.23 -0.36 1.01 -0.82 -4.84 120.40 119.69 2gag s VAL 98 Ca 0.50 1.25 0.10 0.00 0.00 0.00 0.00 61.98 63.83 2gag s VAL 98 Cb -0.23 -3.80 -0.05 0.00 0.00 0.00 0.00 36.38 32.30 2gag s VAL 98 CO 0.30 0.14 -0.17 0.42 0.00 0.00 0.00 175.10 175.78 2gag s THR 99 N 0.63 2.04 0.07 3.92 -4.23 -1.26 -4.77 115.64 112.04 2gag s THR 99 Ca 0.58 -2.23 -0.36 0.00 -1.18 0.00 0.00 61.69 58.50 2gag s THR 99 Cb -0.33 -2.11 -0.15 0.00 1.34 0.00 0.00 72.50 71.25 2gag s THR 99 CO 0.33 -0.47 1.51 1.21 -0.54 0.00 0.00 174.62 176.66 2gag n GLU 100 N -0.34 1.63 -1.57 3.99 4.07 -1.26 -1.15 120.64 126.01 2gag n GLU 100 Ca -0.08 0.59 -0.18 0.00 -0.06 0.00 0.00 57.16 57.43 2gag n GLU 100 Cb 0.60 -2.30 -0.07 0.00 -0.06 0.00 0.00 31.44 29.60 2gag n GLU 100 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 2gag n ASP 101 N 3.44 -5.18 -4.70 4.31 9.92 0.23 -4.94 116.55 119.63 2gag n ASP 101 Ca 0.19 0.42 -0.39 0.00 -0.53 0.00 0.00 54.79 54.47 2gag n ASP 101 Cb 0.23 -4.27 0.03 0.00 -0.64 0.00 0.00 41.12 36.48 2gag n ASP 101 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 2gag n LEU 102 N -2.09 4.56 -4.04 0.64 7.94 -0.30 -4.72 117.00 118.99 2gag n LEU 102 Ca -0.18 0.99 -0.27 0.00 -1.11 0.00 0.00 56.01 55.44 2gag n LEU 102 Cb 0.60 -1.51 -0.17 0.00 0.53 0.00 0.00 43.42 42.87 2gag n LEU 102 CO 0.27 -0.88 -0.48 0.21 -1.11 0.00 0.00 177.39 175.40 2gag s ASN 103 N -0.84 2.12 0.05 1.96 3.84 -1.26 -0.05 114.94 120.76 2gag s ASN 103 Ca 0.69 -0.36 -0.01 0.00 0.21 0.00 0.00 52.86 53.39 2gag s ASN 103 Cb -0.45 -0.96 -0.04 0.00 -0.55 0.00 0.00 41.25 39.25 2gag s ASN 103 CO 0.52 0.03 -0.03 0.00 -2.79 0.00 0.00 177.10 174.82 2gag s ALA 104 N 0.81 0.51 -0.07 1.71 0.00 0.28 -0.72 121.76 124.29 2gag s ALA 104 Ca -0.11 -1.14 0.02 0.00 0.00 0.00 0.00 51.96 50.73 2gag s ALA 104 Cb -0.15 0.24 0.01 0.00 0.00 0.00 0.00 23.12 23.22 2gag s ALA 104 CO 0.02 -0.32 -0.12 0.99 0.00 0.00 0.00 175.76 176.33 2gag s THR 105 N -3.53 1.12 0.12 0.00 2.01 -0.64 -1.42 115.64 113.31 2gag s THR 105 Ca 0.04 -0.47 -0.30 0.00 0.31 0.00 0.00 61.69 61.28 2gag s THR 105 Cb 0.05 -1.04 -0.06 0.00 0.01 0.00 0.00 72.50 71.46 2gag s THR 105 CO -0.08 0.35 1.12 -0.76 -0.69 0.00 0.00 174.62 174.57 2gag s LEU 106 N 0.73 4.43 0.35 4.42 1.43 -1.26 -1.47 118.68 127.31 2gag s LEU 106 Ca -0.13 2.02 0.07 0.00 -1.03 0.00 0.00 54.13 55.06 2gag s LEU 106 Cb -0.16 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.46 2gag s LEU 106 CO 0.03 -0.31 0.47 -0.76 0.23 0.00 0.00 176.35 176.00 2gag s LEU 107 N 0.28 3.88 -0.49 1.79 1.43 0.89 -4.78 118.68 121.69 2gag s LEU 107 Ca 0.53 -0.26 0.05 0.00 -1.03 0.00 0.00 54.13 53.42 2gag s LEU 107 Cb -0.29 -2.68 0.40 0.00 0.03 0.00 0.00 46.19 43.66 2gag s LEU 107 CO 0.32 -0.48 1.11 -1.20 0.23 0.00 0.00 176.35 176.33 2gag n SER 108 N -1.65 4.77 0.00 2.29 7.64 -1.26 -3.71 113.62 121.71 2gag n SER 108 Ca 0.01 -3.72 0.00 0.00 1.01 0.00 0.00 58.87 56.17 2gag n SER 108 Cb 0.58 -0.50 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 2gag n SER 108 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gag n GLY 109 N -0.43 0.63 2.86 0.23 0.00 -1.26 -4.05 105.19 103.16 2gag n GLY 109 Ca 0.38 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.19 2gag n GLY 109 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2gag s LEU 110 N 0.00 1.15 0.72 0.99 2.96 -1.26 -5.03 118.68 118.20 2gag s LEU 110 Ca 0.00 -0.11 0.02 0.00 -0.22 0.00 0.00 54.13 53.81 2gag s LEU 110 Cb 0.00 -0.44 0.14 0.00 0.50 0.00 0.00 46.19 46.39 2gag s LEU 110 CO 0.00 -0.09 0.98 -0.83 -1.32 0.00 0.00 176.35 175.09 2gag s GLY 111 N 1.17 1.74 -0.09 7.98 0.00 -1.26 -4.94 107.32 111.92 2gag s GLY 111 Ca -0.07 -1.94 -0.01 0.00 0.00 0.00 0.00 44.72 42.70 2gag s GLY 111 CO -0.01 -1.34 -0.04 0.14 0.00 0.00 0.00 173.10 171.84 2gag s VAL 112 N -3.09 0.72 -0.08 1.40 1.01 -1.26 -5.05 120.40 114.06 2gag s VAL 112 Ca 0.67 -0.11 -0.26 0.00 0.00 0.00 0.00 61.98 62.28 2gag s VAL 112 Cb -0.04 -0.80 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 2gag s VAL 112 CO 0.44 0.31 0.82 -0.76 0.00 0.00 0.00 175.10 175.91 2gag s LEU 113 N 1.74 4.29 -0.11 3.92 1.43 -1.26 -4.43 118.68 124.27 2gag s LEU 113 Ca 0.03 1.31 -0.30 0.00 -1.03 0.00 0.00 54.13 54.15 2gag s LEU 113 Cb -0.13 -3.26 -0.03 0.00 0.03 0.00 0.00 46.19 42.80 2gag s LEU 113 CO -0.06 -0.24 1.40 -0.62 0.23 0.00 0.00 176.35 177.06 2gag s ASP 114 N 0.96 6.85 0.30 2.29 -1.08 -1.26 -4.90 116.67 119.84 2gag s ASP 114 Ca 0.42 1.92 0.24 0.00 -0.52 0.00 0.00 52.55 54.61 2gag s ASP 114 Cb -0.18 -2.54 1.08 0.00 -1.46 0.00 0.00 42.92 39.82 2gag s ASP 114 CO 0.19 -0.80 1.73 1.55 0.52 0.00 0.00 175.17 178.36 2gag h PRO 115 N 8.53 0.00 -6.73 4.34 0.13 -1.96 -3.44 132.00 132.87 2gag h PRO 115 Ca -0.32 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.28 2gag h PRO 115 Cb 1.14 0.00 0.05 0.00 0.13 0.00 0.00 31.00 32.32 2gag h PRO 115 CO 0.95 0.00 0.74 0.99 -0.23 0.00 0.00 178.00 180.45 2gag s THR 116 N -3.41 2.75 0.23 1.56 2.01 -1.26 -4.95 115.64 112.57 2gag s THR 116 Ca 0.02 0.63 -0.31 0.00 0.31 0.00 0.00 61.69 62.34 2gag s THR 116 Cb 0.09 -3.40 -0.11 0.00 0.01 0.00 0.00 72.50 69.08 2gag s THR 116 CO 0.36 0.10 1.63 -0.75 -0.69 0.00 0.00 174.62 175.27 2gag s LYS 117 N -0.33 4.15 -0.24 4.92 2.20 -1.26 -4.93 119.74 124.25 2gag s LYS 117 Ca 0.59 2.53 -0.29 0.00 -0.36 0.00 0.00 55.97 58.44 2gag s LYS 117 Cb -0.41 -3.08 0.00 0.00 -1.51 0.00 0.00 37.83 32.84 2gag s LYS 117 CO 0.42 -0.66 1.14 0.34 -0.36 0.00 0.00 175.35 176.23 2gag s ASP 118 N 0.89 6.97 0.00 1.43 -1.08 -1.26 -4.91 116.67 118.70 2gag s ASP 118 Ca 0.69 1.36 0.26 0.00 -0.52 0.00 0.00 52.55 54.34 2gag s ASP 118 Cb -0.47 -2.54 0.76 0.00 -1.46 0.00 0.00 42.92 39.21 2gag s ASP 118 CO 0.38 -0.80 1.59 -0.81 0.52 0.00 0.00 175.17 176.05 2gag n PRO 119 N 6.65 0.15 -1.57 4.34 -0.04 -1.26 -4.95 135.00 138.32 2gag n PRO 119 Ca 0.13 -0.07 -0.37 0.00 -0.04 0.00 0.00 63.50 63.15 2gag n PRO 119 Cb 0.46 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.50 2gag n PRO 119 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2gag n ALA 120 N -1.37 0.52 -2.73 0.55 0.00 -1.25 -4.97 120.51 111.27 2gag n ALA 120 Ca 0.07 -0.07 -0.36 0.00 0.00 0.00 0.00 53.44 53.09 2gag n ALA 120 Cb 0.33 -2.22 -0.08 0.00 0.00 0.00 0.00 19.45 17.48 2gag n ALA 120 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2gag s TYR 121 N -1.57 3.43 -0.01 0.00 5.04 -1.26 -5.00 117.35 117.98 2gag s TYR 121 Ca 0.79 0.44 0.04 0.00 -2.44 0.00 0.00 57.07 55.89 2gag s TYR 121 Cb -0.37 -2.24 -0.01 0.00 0.35 0.00 0.00 41.96 39.69 2gag s TYR 121 CO 0.45 0.26 -0.12 0.71 -1.34 0.00 0.00 175.55 175.51 2gag s TYR 122 N 0.42 1.12 0.30 4.97 2.02 -1.26 -0.58 117.35 124.34 2gag s TYR 122 Ca 0.11 -0.22 -0.06 0.00 -0.37 0.00 0.00 57.07 56.53 2gag s TYR 122 Cb -0.12 -0.73 -0.00 0.00 -0.40 0.00 0.00 41.96 40.71 2gag s TYR 122 CO 0.00 -0.03 0.46 0.16 -1.57 0.00 0.00 175.55 174.58 2gag s ASP 123 N -0.25 0.48 0.17 2.29 1.47 -1.20 -2.90 116.67 116.74 2gag s ASP 123 Ca 0.04 -1.28 0.07 0.00 1.18 0.00 0.00 52.55 52.55 2gag s ASP 123 Cb -0.05 0.62 -0.04 0.00 -0.34 0.00 0.00 42.92 43.11 2gag s ASP 123 CO -0.00 -1.23 -0.14 -1.00 0.68 0.00 0.00 175.17 173.48 2gag s HIS 124 N -3.42 1.56 0.06 2.11 3.76 -1.26 -1.60 115.29 116.49 2gag s HIS 124 Ca 0.28 -0.60 0.03 0.00 -0.15 0.00 0.00 55.06 54.63 2gag s HIS 124 Cb -0.00 -0.76 -0.03 0.00 1.11 0.00 0.00 32.58 32.90 2gag s HIS 124 CO 0.16 0.25 -0.11 0.14 -0.85 0.00 0.00 174.74 174.33 2gag s VAL 125 N -2.78 0.80 -0.17 -0.90 -7.23 -0.28 -4.91 120.40 104.93 2gag s VAL 125 Ca 0.18 -1.21 0.00 0.00 -1.81 0.00 0.00 61.98 59.14 2gag s VAL 125 Cb -0.01 -0.85 0.04 0.00 0.56 0.00 0.00 36.38 36.11 2gag s VAL 125 CO 0.05 -0.33 -0.10 -1.00 -0.31 0.00 0.00 175.10 173.40 2gag s HIS 126 N -1.42 2.12 0.12 2.82 3.76 -1.26 -0.86 115.29 120.56 2gag s HIS 126 Ca -0.06 -1.32 0.02 0.00 -0.15 0.00 0.00 55.06 53.55 2gag s HIS 126 Cb -0.09 -1.52 -0.04 0.00 1.11 0.00 0.00 32.58 32.03 2gag s HIS 126 CO 0.01 -0.68 -0.04 0.14 -0.85 0.00 0.00 174.74 173.32 2gag s VAL 127 N 1.50 0.66 0.19 -0.90 -7.23 -0.41 -4.98 120.40 109.22 2gag s VAL 127 Ca 0.01 -1.95 0.08 0.00 -1.81 0.00 0.00 61.98 58.32 2gag s VAL 127 Cb -0.15 -1.81 -0.04 0.00 0.56 0.00 0.00 36.38 34.94 2gag s VAL 127 CO -0.09 -0.75 -0.03 -1.00 -0.31 0.00 0.00 175.10 172.92 2gag s HIS 128 N -3.65 2.75 0.09 2.82 3.76 -1.26 -1.56 115.29 118.24 2gag s HIS 128 Ca 0.15 -0.18 -0.17 0.00 -0.15 0.00 0.00 55.06 54.72 2gag s HIS 128 Cb 0.06 -1.33 0.04 0.00 1.11 0.00 0.00 32.58 32.46 2gag s HIS 128 CO -0.02 0.53 0.42 -0.08 -0.85 0.00 0.00 174.74 174.73 2gag s THR 129 N -1.78 0.06 -0.01 1.30 -1.32 -0.77 -4.92 115.64 108.19 2gag s THR 129 Ca 0.27 -0.49 -0.18 0.00 -1.21 0.00 0.00 61.69 60.07 2gag s THR 129 Cb -0.09 -1.06 -0.34 0.00 -1.51 0.00 0.00 72.50 69.51 2gag s THR 129 CO 0.17 -0.27 0.93 0.44 -2.21 0.00 0.00 174.62 173.68 2gag h ASP 130 N 2.66 0.67 -3.29 8.08 3.32 -1.55 -1.08 116.42 125.22 2gag h ASP 130 Ca -0.33 -0.93 -0.41 0.00 0.02 0.00 0.00 57.03 55.38 2gag h ASP 130 Cb 1.23 -0.22 -0.38 0.00 0.22 0.00 0.00 39.33 40.19 2gag h ASP 130 CO 0.45 1.58 -0.76 -0.69 -1.72 0.00 0.00 179.24 178.10 2gag s VAL 131 N -2.52 0.24 -0.20 -1.35 1.01 -0.57 -0.68 120.40 116.32 2gag s VAL 131 Ca -0.12 0.20 -0.07 0.00 0.00 0.00 0.00 61.98 61.99 2gag s VAL 131 Cb 0.03 -0.42 -0.04 0.00 0.00 0.00 0.00 36.38 35.95 2gag s VAL 131 CO 0.89 0.23 0.07 -0.22 0.00 0.00 0.00 175.10 176.07 2gag s LEU 132 N 1.95 3.71 -0.19 3.92 2.96 -0.43 -1.24 118.68 129.36 2gag s LEU 132 Ca 0.04 -0.01 -0.03 0.00 -0.22 0.00 0.00 54.13 53.91 2gag s LEU 132 Cb -0.12 -1.96 -0.01 0.00 0.50 0.00 0.00 46.19 44.60 2gag s LEU 132 CO -0.04 0.11 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.33 2gag s VAL 133 N 0.77 3.28 -0.28 1.68 1.01 0.11 0.14 120.40 127.11 2gag s VAL 133 Ca 0.04 -0.54 -0.09 0.00 0.00 0.00 0.00 61.98 61.39 2gag s VAL 133 Cb -0.13 -2.46 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 2gag s VAL 133 CO 0.02 0.46 0.13 -0.69 0.00 0.00 0.00 175.10 175.01 2gag s VAL 134 N 1.13 4.59 0.00 2.92 1.01 0.26 -1.44 120.40 128.87 2gag s VAL 134 Ca 0.01 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 61.75 2gag s VAL 134 Cb -0.15 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 32.99 2gag s VAL 134 CO -0.01 0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.90 2gag n GLY 135 N 4.97 2.43 1.71 4.51 0.00 0.44 -0.66 105.19 118.58 2gag n GLY 135 Ca -0.15 -1.31 -0.18 0.00 0.00 0.00 0.00 46.02 44.38 2gag n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gag n ALA 136 N 1.92 4.94 -1.09 4.61 0.00 -1.26 -3.92 120.51 125.71 2gag n ALA 136 Ca 0.00 -3.52 0.00 0.00 0.00 0.00 0.00 53.44 49.92 2gag n ALA 136 Cb 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 19.45 18.76 2gag n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gag n GLY 137 N -0.90 -0.90 0.34 0.00 0.00 -1.26 -0.03 105.19 102.44 2gag n GLY 137 Ca 0.42 -1.68 0.06 0.00 0.00 0.00 0.00 46.02 44.81 2gag n GLY 137 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gag h PRO 138 N 0.00 0.69 -0.04 1.61 0.13 -1.95 -1.38 132.00 131.06 2gag h PRO 138 Ca 0.00 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.08 2gag h PRO 138 Cb 0.00 -0.16 -0.00 0.00 0.13 0.00 0.00 31.00 30.97 2gag h PRO 138 CO 0.00 0.46 0.00 0.00 -0.23 0.00 0.00 178.00 178.23 2gag h ALA 139 N 1.64 0.06 -0.29 -0.56 0.00 -1.92 -1.64 119.26 116.54 2gag h ALA 139 Ca 0.26 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 2gag h ALA 139 Cb 0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2gag h ALA 139 CO -0.08 -0.29 -0.25 0.78 0.00 0.00 0.00 179.25 179.41 2gag h GLY 140 N -0.20 0.62 0.92 0.00 0.00 -1.63 -0.60 103.07 102.18 2gag h GLY 140 Ca 0.01 -0.52 -0.02 0.00 0.00 0.00 0.00 47.33 46.80 2gag h GLY 140 CO 0.00 0.47 0.12 1.41 0.00 0.00 0.00 176.54 178.54 2gag h LEU 141 N 0.50 0.48 -0.47 3.11 3.38 -1.22 0.31 115.31 121.40 2gag h LEU 141 Ca 0.07 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 2gag h LEU 141 Cb 0.70 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 2gag h LEU 141 CO 0.05 0.54 0.21 0.00 0.09 0.00 0.00 178.44 179.34 2gag h ALA 142 N 0.96 0.61 -0.20 1.53 0.00 -1.14 0.57 119.26 121.59 2gag h ALA 142 Ca 0.11 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2gag h ALA 142 Cb 0.23 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2gag h ALA 142 CO -0.01 0.19 0.12 0.00 0.00 0.00 0.00 179.25 179.56 2gag h ALA 143 N 1.05 0.25 -0.73 0.00 0.00 -0.79 -0.64 119.26 118.41 2gag h ALA 143 Ca 0.16 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 2gag h ALA 143 Cb 0.15 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2gag h ALA 143 CO -0.02 -0.24 0.29 0.00 0.00 0.00 0.00 179.25 179.28 2gag h ALA 144 N 1.04 1.14 -0.30 0.00 0.00 -0.21 -0.67 119.26 120.24 2gag h ALA 144 Ca 0.07 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 2gag h ALA 144 Cb 0.02 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2gag h ALA 144 CO -0.01 0.62 0.02 -0.09 0.00 0.00 0.00 179.25 179.79 2gag h ARG 145 N 1.06 0.52 -0.00 0.00 2.43 -0.56 0.66 114.38 118.48 2gag h ARG 145 Ca 0.25 -0.15 -0.13 0.00 -0.81 0.00 0.00 59.98 59.14 2gag h ARG 145 Cb 0.20 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 2gag h ARG 145 CO -0.02 0.64 -0.60 0.93 -1.51 0.00 0.00 179.97 179.42 2gag h GLU 146 N 0.33 0.02 0.03 0.20 4.39 -0.89 -2.05 114.58 116.60 2gag h GLU 146 Ca 0.09 -0.01 -0.27 0.00 0.34 0.00 0.00 59.36 59.51 2gag h GLU 146 Cb 0.39 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.07 2gag h GLU 146 CO 0.01 0.61 -1.08 0.00 -1.16 0.00 0.00 179.01 177.39 2gag h ALA 147 N 1.39 0.12 -0.55 3.43 0.00 -1.09 -3.27 119.26 119.30 2gag h ALA 147 Ca -0.01 -0.72 -0.01 0.00 0.00 0.00 0.00 54.91 54.17 2gag h ALA 147 Cb 1.06 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 2gag h ALA 147 CO 0.08 0.70 0.29 1.03 0.00 0.00 0.00 179.25 181.35 2gag h SER 148 N 0.36 0.67 -0.49 0.00 0.87 -0.74 -2.61 113.55 111.61 2gag h SER 148 Ca -0.14 -0.05 0.05 0.00 -1.23 0.00 0.00 61.79 60.42 2gag h SER 148 Cb 1.74 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 63.50 2gag h SER 148 CO 0.21 0.55 0.33 -0.09 -0.53 0.00 0.00 176.83 177.30 2gag h ARG 149 N 0.76 0.45 0.00 2.24 2.43 -1.42 -2.72 114.38 116.12 2gag h ARG 149 Ca 0.19 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 2gag h ARG 149 Cb 0.04 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 2gag h ARG 149 CO -0.03 0.30 0.00 -1.13 -1.51 0.00 0.00 179.97 177.60 2gag n SER 150 N -4.48 0.28 0.00 -3.80 3.41 -0.98 -4.86 113.62 103.19 2gag n SER 150 Ca 0.06 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.23 2gag n SER 150 Cb 0.21 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 63.54 2gag n SER 150 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gag n GLY 151 N 0.24 0.85 3.74 5.00 0.00 -1.03 -4.88 105.19 109.12 2gag n GLY 151 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 2gag n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gag s ALA 152 N -2.75 2.10 -0.03 4.61 0.00 -1.26 -4.91 121.76 119.52 2gag s ALA 152 Ca 0.00 0.47 -0.30 0.00 0.00 0.00 0.00 51.96 52.13 2gag s ALA 152 Cb 0.00 -3.35 -0.03 0.00 0.00 0.00 0.00 23.12 19.75 2gag s ALA 152 CO 0.00 -1.92 1.05 1.03 0.00 0.00 0.00 175.76 175.92 2gag s ARG 153 N -4.57 4.47 0.01 0.00 0.52 -1.26 -4.67 118.95 113.45 2gag s ARG 153 Ca 0.65 1.49 0.03 0.00 -0.52 0.00 0.00 55.73 57.38 2gag s ARG 153 Cb -0.20 -3.49 -0.01 0.00 0.52 0.00 0.00 34.95 31.77 2gag s ARG 153 CO 0.52 -0.22 -0.10 0.08 0.02 0.00 0.00 175.30 175.61 2gag s VAL 154 N 1.51 0.74 -0.05 3.52 1.01 -0.17 -1.41 120.40 125.55 2gag s VAL 154 Ca 0.52 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.90 2gag s VAL 154 Cb -0.22 -0.66 0.01 0.00 0.00 0.00 0.00 36.38 35.50 2gag s VAL 154 CO 0.24 0.04 -0.13 -0.04 0.00 0.00 0.00 175.10 175.21 2gag s MET 155 N -0.66 1.51 -0.24 2.72 -1.94 -0.37 -0.02 119.30 120.31 2gag s MET 155 Ca 0.00 -0.44 0.01 0.00 -1.71 0.00 0.00 55.69 53.55 2gag s MET 155 Cb -0.05 -1.31 0.04 0.00 2.01 0.00 0.00 34.83 35.52 2gag s MET 155 CO 0.00 0.11 -0.12 -1.17 -0.01 0.00 0.00 175.02 173.84 2gag s LEU 156 N 0.35 3.02 -0.07 -0.03 2.96 0.87 0.07 118.68 125.86 2gag s LEU 156 Ca -0.08 -1.03 0.03 0.00 -0.22 0.00 0.00 54.13 52.83 2gag s LEU 156 Cb -0.13 -1.57 -0.02 0.00 0.50 0.00 0.00 46.19 44.97 2gag s LEU 156 CO 0.02 -0.12 -0.16 -0.76 -1.32 0.00 0.00 176.35 174.01 2gag s LEU 157 N 1.23 2.60 -0.12 -0.68 1.02 -0.52 -0.30 118.68 121.90 2gag s LEU 157 Ca -0.02 -0.29 -0.09 0.00 0.02 0.00 0.00 54.13 53.75 2gag s LEU 157 Cb -0.17 -1.53 0.04 0.00 0.02 0.00 0.00 46.19 44.54 2gag s LEU 157 CO -0.07 0.28 0.29 -0.62 0.02 0.00 0.00 176.35 176.26 2gag s ASP 158 N -0.35 -0.32 0.10 2.29 2.15 -0.52 -0.42 116.67 119.60 2gag s ASP 158 Ca 0.03 0.61 0.19 0.00 0.43 0.00 0.00 52.55 53.81 2gag s ASP 158 Cb -0.12 0.57 0.80 0.00 -0.30 0.00 0.00 42.92 43.87 2gag s ASP 158 CO 0.02 -0.13 1.60 -1.84 -0.17 0.00 0.00 175.17 174.66 2gag n GLU 159 N 3.41 0.08 -2.44 4.34 0.28 -0.76 -0.99 120.64 124.55 2gag n GLU 159 Ca -0.17 0.29 -0.23 0.00 -0.16 0.00 0.00 57.16 56.88 2gag n GLU 159 Cb 0.56 -1.64 0.06 0.00 1.43 0.00 0.00 31.44 31.85 2gag n GLU 159 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 2gag s ARG 160 N -3.11 2.32 0.29 3.44 0.52 -1.26 -4.14 118.95 117.00 2gag s ARG 160 Ca 0.07 -0.58 0.00 0.00 -0.52 0.00 0.00 55.73 54.70 2gag s ARG 160 Cb 0.10 -2.34 0.45 0.00 0.52 0.00 0.00 34.95 33.69 2gag s ARG 160 CO 0.35 -1.01 1.84 0.00 0.02 0.00 0.00 175.30 176.50 2gag h ALA 161 N -0.27 1.26 -2.36 2.13 0.00 -1.95 0.13 119.26 118.19 2gag h ALA 161 Ca -0.43 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.16 2gag h ALA 161 Cb 1.30 -0.20 -0.16 0.00 0.00 0.00 0.00 17.79 18.73 2gag h ALA 161 CO 0.55 0.51 -0.65 -1.83 0.00 0.00 0.00 179.25 177.83 2gag s GLU 162 N -5.17 0.59 0.70 0.00 -1.05 -1.26 -4.66 118.70 107.86 2gag s GLU 162 Ca -0.09 -1.11 -0.14 0.00 -0.15 0.00 0.00 54.97 53.48 2gag s GLU 162 Cb 0.16 0.21 0.02 0.00 -0.44 0.00 0.00 34.13 34.08 2gag s GLU 162 CO 0.79 -0.12 1.14 0.00 0.95 0.00 0.00 175.26 178.03 2gag s ALA 163 N -3.56 2.30 0.00 -0.84 0.00 -1.26 -4.41 121.76 113.99 2gag s ALA 163 Ca 0.04 0.63 0.00 0.00 0.00 0.00 0.00 51.96 52.63 2gag s ALA 163 Cb 0.05 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.80 2gag s ALA 163 CO -0.09 -1.56 0.00 0.41 0.00 0.00 0.00 175.76 174.52 2gag n GLY 164 N -0.24 1.36 7.00 0.00 0.00 0.96 -4.95 105.19 109.31 2gag n GLY 164 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2gag n GLY 164 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gag n GLY 165 N 0.00 2.94 0.00 -0.02 0.00 -0.94 -1.60 105.19 105.57 2gag n GLY 165 Ca 0.00 -0.18 0.13 0.00 0.00 0.00 0.00 46.02 45.97 2gag n GLY 165 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gag n THR 166 N 0.00 0.13 0.22 2.61 -2.24 -1.26 -3.65 114.28 110.10 2gag n THR 166 Ca 0.00 0.03 0.07 0.00 -2.27 0.00 0.00 64.05 61.89 2gag n THR 166 Cb 0.00 -0.58 0.60 0.00 -2.10 0.00 0.00 70.33 68.25 2gag n THR 166 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2gag h LEU 167 N 0.00 0.07 0.00 3.22 3.38 -1.71 0.10 115.31 120.37 2gag h LEU 167 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2gag h LEU 167 Cb 0.31 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.04 2gag h LEU 167 CO 0.00 0.06 0.00 0.18 0.09 0.00 0.00 178.44 178.77 2gag n LEU 168 N -4.52 0.00 -0.95 1.67 4.77 -1.24 -2.11 117.00 114.63 2gag n LEU 168 Ca -0.02 0.22 0.12 0.00 -0.03 0.00 0.00 56.01 56.30 2gag n LEU 168 Cb 0.10 -0.22 0.11 0.00 -2.33 0.00 0.00 43.42 41.08 2gag n LEU 168 CO 0.34 -0.05 0.63 0.47 -1.33 0.00 0.00 177.39 177.45 2gag n ASP 169 N -1.22 2.96 -4.99 -1.43 8.00 0.02 -3.49 116.55 116.41 2gag n ASP 169 Ca 0.13 -1.99 -0.21 0.00 0.71 0.00 0.00 54.79 53.43 2gag n ASP 169 Cb 0.16 0.01 0.03 0.00 -0.02 0.00 0.00 41.12 41.29 2gag n ASP 169 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2gag s THR 170 N -2.01 2.24 -1.40 -3.53 -4.23 -0.90 -4.10 115.64 101.72 2gag s THR 170 Ca 0.28 -1.14 0.09 0.00 -1.18 0.00 0.00 61.69 59.75 2gag s THR 170 Cb 0.20 -2.38 0.36 0.00 1.34 0.00 0.00 72.50 72.02 2gag s THR 170 CO 0.30 0.00 1.21 0.00 -0.54 0.00 0.00 174.62 175.59 2gag n ALA 171 N -2.00 2.77 0.00 3.99 0.00 -1.26 -4.83 120.51 119.17 2gag n ALA 171 Ca 0.10 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.75 2gag n ALA 171 Cb 0.62 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 19.06 2gag n ALA 171 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gag n GLY 172 N 0.75 1.25 3.11 0.00 0.00 -1.26 -5.09 105.19 103.95 2gag n GLY 172 Ca 0.13 -1.60 -0.08 0.00 0.00 0.00 0.00 46.02 44.47 2gag n GLY 172 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gag s GLU 173 N -4.44 0.66 -0.06 1.61 2.02 -1.26 -4.94 118.70 112.29 2gag s GLU 173 Ca 0.00 -1.23 -0.21 0.00 0.02 0.00 0.00 54.97 53.55 2gag s GLU 173 Cb 0.00 0.08 -0.04 0.00 0.10 0.00 0.00 34.13 34.26 2gag s GLU 173 CO 0.00 -0.08 0.62 -0.65 0.02 0.00 0.00 175.26 175.17 2gag s GLN 174 N -3.78 4.38 -0.06 1.61 -1.52 -1.26 0.78 119.66 119.82 2gag s GLN 174 Ca 0.07 0.73 -0.01 0.00 -1.95 0.00 0.00 55.36 54.21 2gag s GLN 174 Cb 0.06 -3.41 0.03 0.00 -0.22 0.00 0.00 33.01 29.47 2gag s GLN 174 CO -0.08 0.18 -0.00 0.42 -0.25 0.00 0.00 175.29 175.55 2gag s ILE 175 N 0.47 0.34 -1.48 1.08 1.01 0.12 -4.39 121.20 118.35 2gag s ILE 175 Ca 0.33 0.11 -0.12 0.00 0.00 0.00 0.00 60.65 60.97 2gag s ILE 175 Cb -0.17 -0.48 0.07 0.00 0.01 0.00 0.00 42.46 41.89 2gag s ILE 175 CO 0.16 0.24 0.83 0.47 0.00 0.00 0.00 174.94 176.63 2gag n ASP 176 N 4.90 -4.78 -0.10 3.58 8.00 0.34 -0.82 116.55 127.67 2gag n ASP 176 Ca -0.11 -0.62 -0.01 0.00 0.71 0.00 0.00 54.79 54.75 2gag n ASP 176 Cb 0.50 -3.84 -0.01 0.00 -0.02 0.00 0.00 41.12 37.75 2gag n ASP 176 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gag n GLY 177 N -1.56 0.43 3.42 0.44 0.00 -1.26 -5.01 105.19 101.66 2gag n GLY 177 Ca 0.01 -0.12 -0.26 0.00 0.00 0.00 0.00 46.02 45.65 2gag n GLY 177 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2gag s MET 178 N -1.06 1.53 0.20 1.61 -1.94 -0.00 -5.09 119.30 114.55 2gag s MET 178 Ca 0.00 -1.57 -0.30 0.00 -1.71 0.00 0.00 55.69 52.10 2gag s MET 178 Cb 0.00 -1.77 -0.09 0.00 2.01 0.00 0.00 34.83 34.98 2gag s MET 178 CO 0.00 0.37 1.43 0.34 -0.01 0.00 0.00 175.02 177.14 2gag s ASP 179 N -2.87 6.72 0.36 3.03 2.15 -1.26 0.15 116.67 124.94 2gag s ASP 179 Ca 0.22 2.54 0.14 0.00 0.43 0.00 0.00 52.55 55.89 2gag s ASP 179 Cb -0.07 -2.61 0.99 0.00 -0.30 0.00 0.00 42.92 40.93 2gag s ASP 179 CO 0.11 -0.68 1.75 0.77 -0.17 0.00 0.00 175.17 176.95 2gag h SER 180 N 5.72 0.57 -0.09 -0.34 4.64 0.05 0.15 113.55 124.25 2gag h SER 180 Ca -0.44 0.11 -0.05 0.00 -0.47 0.00 0.00 61.79 60.93 2gag h SER 180 Cb 1.21 0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 2gag h SER 180 CO 0.82 0.11 -0.08 0.28 -0.87 0.00 0.00 176.83 177.08 2gag h SER 181 N 0.50 0.36 0.13 4.97 0.02 -1.90 -0.81 113.55 116.82 2gag h SER 181 Ca 0.62 -0.07 -0.23 0.00 -0.84 0.00 0.00 61.79 61.27 2gag h SER 181 Cb 1.35 -0.09 0.01 0.00 0.14 0.00 0.00 62.40 63.80 2gag h SER 181 CO -0.38 0.48 -0.88 0.00 -1.14 0.00 0.00 176.83 174.91 2gag h ALA 182 N 1.57 0.35 -0.58 3.77 0.00 -1.11 -2.50 119.26 120.76 2gag h ALA 182 Ca 0.07 -0.66 -0.04 0.00 0.00 0.00 0.00 54.91 54.29 2gag h ALA 182 Cb 0.37 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 2gag h ALA 182 CO 0.02 0.75 0.22 2.35 0.00 0.00 0.00 179.25 182.58 2gag h TRP 183 N 0.35 0.89 -0.07 0.00 7.01 -0.73 -0.97 115.95 122.43 2gag h TRP 183 Ca -0.07 -0.07 0.00 0.00 2.11 0.00 0.00 58.89 60.85 2gag h TRP 183 Cb 1.50 -0.26 -0.00 0.00 -2.10 0.00 0.00 29.16 28.30 2gag h TRP 183 CO 0.07 0.73 0.05 0.82 -2.79 0.00 0.00 178.44 177.31 2gag h ILE 184 N 0.80 1.02 -1.01 2.65 2.04 -1.15 0.10 117.51 121.96 2gag h ILE 184 Ca 0.19 -0.04 0.07 0.00 1.00 0.00 0.00 64.86 66.08 2gag h ILE 184 Cb 0.22 0.92 -0.07 0.00 -0.74 0.00 0.00 36.82 37.16 2gag h ILE 184 CO -0.01 0.02 0.65 -0.08 0.00 0.00 0.00 178.15 178.72 2gag h GLU 185 N 0.09 1.13 -0.40 2.37 4.81 -1.28 0.14 114.58 121.45 2gag h GLU 185 Ca 0.03 -0.07 -0.13 0.00 -0.13 0.00 0.00 59.36 59.05 2gag h GLU 185 Cb -0.01 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.11 2gag h GLU 185 CO -0.01 0.75 -0.27 0.37 -0.73 0.00 0.00 179.01 179.12 2gag h GLN 186 N 1.17 0.89 -0.58 1.92 4.15 -0.62 -1.88 115.11 120.16 2gag h GLN 186 Ca 0.44 -0.43 -0.10 0.00 0.77 0.00 0.00 58.65 59.34 2gag h GLN 186 Cb 0.19 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.85 2gag h GLN 186 CO -0.18 1.08 -0.02 0.28 -1.93 0.00 0.00 178.83 178.05 2gag h VAL 187 N 0.71 1.27 -0.45 2.39 2.07 -0.18 -2.09 116.25 119.97 2gag h VAL 187 Ca 0.08 -1.17 -0.02 0.00 0.82 0.00 0.00 66.70 66.41 2gag h VAL 187 Cb 0.85 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 2gag h VAL 187 CO 0.07 0.42 0.19 0.71 0.02 0.00 0.00 177.57 178.99 2gag h THR 188 N 0.92 1.16 -0.44 2.57 1.35 -0.59 -1.26 112.91 116.63 2gag h THR 188 Ca 0.16 -0.48 -0.14 0.00 -0.55 0.00 0.00 66.41 65.40 2gag h THR 188 Cb 0.58 0.62 -0.01 0.00 -1.73 0.00 0.00 68.15 67.60 2gag h THR 188 CO 0.03 0.19 -0.27 0.28 -0.25 0.00 0.00 175.52 175.51 2gag h SER 189 N 0.63 0.98 -0.76 5.36 0.02 -1.01 -1.60 113.55 117.18 2gag h SER 189 Ca 0.16 -0.39 -0.06 0.00 -0.84 0.00 0.00 61.79 60.65 2gag h SER 189 Cb 0.10 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.34 2gag h SER 189 CO -0.02 1.18 0.25 -0.33 -1.14 0.00 0.00 176.83 176.78 2gag h GLU 190 N 0.80 1.17 -0.47 3.45 5.08 -0.70 -1.20 114.58 122.71 2gag h GLU 190 Ca 0.09 -0.24 -0.11 0.00 -1.00 0.00 0.00 59.36 58.10 2gag h GLU 190 Cb 0.85 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.91 2gag h GLU 190 CO 0.07 0.98 -0.15 -0.07 -1.00 0.00 0.00 179.01 178.85 2gag h LEU 191 N 1.12 0.89 -0.61 1.33 3.38 -1.09 -1.59 115.31 118.74 2gag h LEU 191 Ca 0.25 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 2gag h LEU 191 Cb 0.29 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 2gag h LEU 191 CO -0.01 1.03 0.24 0.00 0.09 0.00 0.00 178.44 179.79 2gag h ALA 192 N 1.04 0.79 0.00 1.53 0.00 -0.92 -2.79 119.26 118.91 2gag h ALA 192 Ca 0.12 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 2gag h ALA 192 Cb 0.67 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2gag h ALA 192 CO 0.05 0.40 -0.30 0.93 0.00 0.00 0.00 179.25 180.34 2gag h GLU 193 N 0.84 0.00 -6.25 0.00 4.39 -1.00 -3.42 114.58 109.14 2gag h GLU 193 Ca 0.20 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 59.35 2gag h GLU 193 Cb 0.20 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 2gag h GLU 193 CO -0.02 0.30 0.95 0.00 -1.16 0.00 0.00 179.01 179.08 2gag s ALA 194 N -3.66 3.62 0.25 3.43 0.00 -0.62 -4.91 121.76 119.87 2gag s ALA 194 Ca 0.00 0.76 -0.04 0.00 0.00 0.00 0.00 51.96 52.67 2gag s ALA 194 Cb 0.11 -3.66 0.39 0.00 0.00 0.00 0.00 23.12 19.96 2gag s ALA 194 CO 0.66 -1.19 1.82 0.93 0.00 0.00 0.00 175.76 177.98 2gag h GLU 195 N 8.61 0.81 -0.67 0.00 3.07 -1.85 -2.89 114.58 121.66 2gag h GLU 195 Ca -0.34 -0.05 -0.06 0.00 -0.50 0.00 0.00 59.36 58.41 2gag h GLU 195 Cb 1.15 -0.18 -0.04 0.00 -0.84 0.00 0.00 28.75 28.84 2gag h GLU 195 CO 0.95 0.54 0.08 0.39 -1.40 0.00 0.00 179.01 179.56 2gag n GLU 196 N -4.71 4.25 -4.73 2.33 -0.58 -1.26 -4.89 120.64 111.04 2gag n GLU 196 Ca 0.14 -2.85 -0.33 0.00 -0.42 0.00 0.00 57.16 53.69 2gag n GLU 196 Cb 0.26 -2.19 -0.14 0.00 -0.57 0.00 0.00 31.44 28.80 2gag n GLU 196 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2gag s THR 197 N -2.66 3.06 -0.15 2.62 2.01 -1.09 -1.00 115.64 118.43 2gag s THR 197 Ca 0.50 -0.66 0.00 0.00 0.31 0.00 0.00 61.69 61.85 2gag s THR 197 Cb 0.39 -2.29 -0.00 0.00 0.01 0.00 0.00 72.50 70.61 2gag s THR 197 CO 0.14 0.52 -0.16 -0.89 -0.69 0.00 0.00 174.62 173.54 2gag s THR 198 N 0.41 2.65 -0.21 -0.82 2.01 0.97 -4.83 115.64 115.83 2gag s THR 198 Ca -0.10 -0.78 0.01 0.00 0.31 0.00 0.00 61.69 61.13 2gag s THR 198 Cb -0.16 -2.11 0.03 0.00 0.01 0.00 0.00 72.50 70.27 2gag s THR 198 CO 0.05 0.52 -0.16 -2.28 -0.69 0.00 0.00 174.62 172.06 2gag s HIS 199 N 0.74 2.94 -0.19 4.92 2.46 -1.26 -0.09 115.29 124.81 2gag s HIS 199 Ca -0.07 -1.77 0.01 0.00 0.47 0.00 0.00 55.06 53.70 2gag s HIS 199 Cb -0.16 -1.95 0.03 0.00 -0.13 0.00 0.00 32.58 30.38 2gag s HIS 199 CO 0.01 -0.81 -0.16 -0.51 -2.47 0.00 0.00 174.74 170.80 2gag s LEU 200 N 1.26 2.30 0.60 8.88 1.43 0.58 -4.97 118.68 128.75 2gag s LEU 200 Ca 0.01 -0.79 0.02 0.00 -1.03 0.00 0.00 54.13 52.35 2gag s LEU 200 Cb -0.15 -1.40 0.07 0.00 0.03 0.00 0.00 46.19 44.74 2gag s LEU 200 CO -0.10 -0.07 0.83 -1.10 0.23 0.00 0.00 176.35 176.15 2gag s GLN 201 N 1.31 2.26 -1.46 1.70 -1.52 -1.26 -1.44 119.66 119.26 2gag s GLN 201 Ca 0.02 -1.04 0.00 0.00 -1.95 0.00 0.00 55.36 52.39 2gag s GLN 201 Cb -0.15 -2.48 0.00 0.00 -0.22 0.00 0.00 33.01 30.16 2gag s GLN 201 CO -0.10 -0.93 0.00 0.54 -0.25 0.00 0.00 175.29 174.55 2gag n ARG 202 N -2.44 -1.78 -4.49 2.91 1.74 0.45 -4.74 116.66 108.31 2gag n ARG 202 Ca 0.11 0.82 -0.31 0.00 -0.77 0.00 0.00 57.85 57.70 2gag n ARG 202 Cb 0.60 -5.33 -0.16 0.00 -1.02 0.00 0.00 32.46 26.55 2gag n ARG 202 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2gag s THR 203 N -2.63 1.85 -0.25 0.55 2.01 -0.20 -1.33 115.64 115.65 2gag s THR 203 Ca 0.00 -0.85 -0.07 0.00 0.31 0.00 0.00 61.69 61.08 2gag s THR 203 Cb 0.00 -1.66 -0.03 0.00 0.01 0.00 0.00 72.50 70.82 2gag s THR 203 CO 0.00 0.51 0.07 -0.89 -0.69 0.00 0.00 174.62 173.62 2gag s THR 204 N 0.98 4.30 -0.56 -0.82 2.01 -0.52 -1.83 115.64 119.20 2gag s THR 204 Ca -0.04 -0.19 -0.28 0.00 0.31 0.00 0.00 61.69 61.49 2gag s THR 204 Cb -0.15 -3.02 0.03 0.00 0.01 0.00 0.00 72.50 69.37 2gag s THR 204 CO -0.04 0.33 1.16 -0.69 -0.69 0.00 0.00 174.62 174.69 2gag s VAL 205 N 1.61 4.08 -0.12 3.82 1.01 -1.26 -1.17 120.40 128.36 2gag s VAL 205 Ca 0.06 0.89 0.20 0.00 0.00 0.00 0.00 61.98 63.12 2gag s VAL 205 Cb -0.15 -4.69 -0.21 0.00 0.00 0.00 0.00 36.38 31.33 2gag s VAL 205 CO 0.04 -1.28 0.59 2.22 0.00 0.00 0.00 175.10 176.67 2gag n PHE 206 N 8.27 0.45 -4.26 5.22 1.16 -0.39 -4.71 117.46 123.20 2gag n PHE 206 Ca 0.08 0.15 -0.17 0.00 -1.87 0.00 0.00 57.45 55.64 2gag n PHE 206 Cb 0.49 -0.86 -0.15 0.00 -1.61 0.00 0.00 39.48 37.36 2gag n PHE 206 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 2gag s GLY 207 N -4.78 0.35 -0.15 4.97 0.00 -1.04 -1.16 107.32 105.51 2gag s GLY 207 Ca -0.06 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.37 2gag s GLY 207 CO 0.84 -0.24 -0.11 -0.45 0.00 0.00 0.00 173.10 173.15 2gag s SER 208 N -0.14 2.76 0.47 1.64 0.15 -1.26 -1.54 113.70 115.77 2gag s SER 208 Ca 0.02 -0.56 0.02 0.00 0.70 0.00 0.00 55.95 56.14 2gag s SER 208 Cb -0.03 -1.09 -0.02 0.00 -1.71 0.00 0.00 66.02 63.17 2gag s SER 208 CO -0.00 -0.11 0.04 -0.31 1.20 0.00 0.00 173.24 174.06 2gag s TYR 209 N 1.53 1.91 0.16 3.44 2.02 0.12 -4.40 117.35 122.13 2gag s TYR 209 Ca 0.03 -1.02 -0.30 0.00 -0.37 0.00 0.00 57.07 55.41 2gag s TYR 209 Cb -0.14 -1.50 -0.18 0.00 -0.40 0.00 0.00 41.96 39.75 2gag s TYR 209 CO -0.09 0.11 0.63 -0.25 -1.57 0.00 0.00 175.55 174.37 2gag n ASP 210 N -1.23 -0.99 -3.88 2.29 8.00 -1.26 -2.24 116.55 117.24 2gag n ASP 210 Ca -0.14 1.14 -0.27 0.00 0.71 0.00 0.00 54.79 56.22 2gag n ASP 210 Cb 0.66 -0.95 0.02 0.00 -0.02 0.00 0.00 41.12 40.83 2gag n ASP 210 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2gag n ALA 211 N 0.28 -1.62 -3.59 2.24 0.00 -1.26 -2.82 120.51 113.74 2gag n ALA 211 Ca 0.18 -0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.42 2gag n ALA 211 Cb 0.22 -3.17 0.06 0.00 0.00 0.00 0.00 19.45 16.56 2gag n ALA 211 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2gag n ASN 212 N -2.91 -2.44 -4.40 0.00 5.03 -1.12 -4.73 115.26 104.69 2gag n ASN 212 Ca -0.11 -0.70 -0.40 0.00 0.87 0.00 0.00 54.58 54.24 2gag n ASN 212 Cb 0.59 -4.61 -0.11 0.00 -1.02 0.00 0.00 39.78 34.63 2gag n ASN 212 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 2gag s TYR 213 N -3.47 3.22 0.08 3.10 5.04 -0.95 -1.47 117.35 122.91 2gag s TYR 213 Ca 0.13 -0.80 0.10 0.00 -2.44 0.00 0.00 57.07 54.06 2gag s TYR 213 Cb -0.06 -2.42 -0.03 0.00 0.35 0.00 0.00 41.96 39.80 2gag s TYR 213 CO 0.77 -0.58 -0.26 -0.51 -1.34 0.00 0.00 175.55 173.63 2gag s LEU 214 N 1.58 2.24 -0.07 6.97 1.02 0.80 0.14 118.68 131.37 2gag s LEU 214 Ca 0.03 -0.66 0.03 0.00 0.02 0.00 0.00 54.13 53.55 2gag s LEU 214 Cb -0.18 -1.23 0.01 0.00 0.02 0.00 0.00 46.19 44.80 2gag s LEU 214 CO 0.07 0.21 -0.16 -0.63 0.02 0.00 0.00 176.35 175.87 2gag s ILE 215 N -0.93 1.39 0.15 -0.59 1.01 -0.59 0.31 121.20 121.95 2gag s ILE 215 Ca 0.12 -0.64 0.07 0.00 0.00 0.00 0.00 60.65 60.21 2gag s ILE 215 Cb -0.10 -1.24 -0.04 0.00 0.01 0.00 0.00 42.46 41.09 2gag s ILE 215 CO 0.04 0.41 -0.15 0.00 0.00 0.00 0.00 174.94 175.24 2gag s ALA 216 N 0.51 1.72 -0.26 9.38 0.00 0.14 -1.26 121.76 131.99 2gag s ALA 216 Ca -0.14 -1.43 -0.01 0.00 0.00 0.00 0.00 51.96 50.37 2gag s ALA 216 Cb -0.16 -0.09 0.04 0.00 0.00 0.00 0.00 23.12 22.91 2gag s ALA 216 CO 0.05 0.11 -0.06 0.00 0.00 0.00 0.00 175.76 175.86 2gag s ALA 217 N -2.39 2.70 -0.24 0.00 0.00 -0.32 -0.78 121.76 120.72 2gag s ALA 217 Ca 0.14 -1.58 -0.14 0.00 0.00 0.00 0.00 51.96 50.38 2gag s ALA 217 Cb -0.04 -1.72 -0.04 0.00 0.00 0.00 0.00 23.12 21.32 2gag s ALA 217 CO 0.04 -0.98 0.32 -1.14 0.00 0.00 0.00 175.76 174.01 2gag s GLN 218 N 1.27 4.07 -0.61 0.00 0.74 0.60 -1.43 119.66 124.30 2gag s GLN 218 Ca -0.02 0.00 -0.19 0.00 0.05 0.00 0.00 55.36 55.20 2gag s GLN 218 Cb -0.18 -3.59 0.10 0.00 1.10 0.00 0.00 33.01 30.44 2gag s GLN 218 CO -0.04 -0.12 0.76 1.03 -0.55 0.00 0.00 175.29 176.36 2gag s ARG 219 N 1.59 3.07 -0.04 1.67 3.00 -0.44 -0.89 118.95 126.91 2gag s ARG 219 Ca 0.14 -1.27 -0.14 0.00 0.00 0.00 0.00 55.73 54.46 2gag s ARG 219 Cb -0.15 -4.28 -0.31 0.00 0.00 0.00 0.00 34.95 30.21 2gag s ARG 219 CO 0.08 -1.59 0.74 0.00 0.00 0.00 0.00 175.30 174.53 2gag h ARG 220 N 9.22 0.39 0.00 3.54 3.08 -1.34 -3.42 114.38 125.86 2gag h ARG 220 Ca -0.28 -0.67 0.00 0.00 0.07 0.00 0.00 59.98 59.10 2gag h ARG 220 Cb 1.08 0.25 0.00 0.00 0.08 0.00 0.00 29.97 31.38 2gag h ARG 220 CO 1.11 1.32 -0.14 0.25 -1.07 0.00 0.00 179.97 181.44 2gag n THR 221 N -3.74 0.96 0.19 2.04 -2.24 -0.91 -4.77 114.28 105.82 2gag n THR 221 Ca -0.22 -1.12 0.03 0.00 -2.27 0.00 0.00 64.05 60.47 2gag n THR 221 Cb 1.02 0.25 0.40 0.00 -2.10 0.00 0.00 70.33 69.91 2gag n THR 221 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2gag h VAL 222 N 2.34 1.23 -0.40 2.28 2.07 -1.81 -2.58 116.25 119.37 2gag h VAL 222 Ca 0.00 -1.07 0.00 0.00 0.82 0.00 0.00 66.70 66.45 2gag h VAL 222 Cb 1.02 1.57 0.00 0.00 -1.52 0.00 0.00 31.29 32.36 2gag h VAL 222 CO 0.00 0.31 0.00 0.00 0.02 0.00 0.00 177.57 177.90 2gag n HIS 223 N -4.17 0.69 -3.50 1.57 1.44 -1.26 -4.89 115.22 105.11 2gag n HIS 223 Ca -0.02 -0.31 -0.36 0.00 -2.01 0.00 0.00 57.72 55.02 2gag n HIS 223 Cb 0.36 -0.07 -0.06 0.00 0.12 0.00 0.00 29.99 30.34 2gag n HIS 223 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2gag s LEU 224 N -1.12 4.39 0.15 2.39 1.43 -0.97 -4.88 118.68 120.06 2gag s LEU 224 Ca 0.29 0.92 -0.09 0.00 -1.03 0.00 0.00 54.13 54.21 2gag s LEU 224 Cb 0.16 -2.94 -0.02 0.00 0.03 0.00 0.00 46.19 43.43 2gag s LEU 224 CO 0.17 0.20 1.47 0.44 0.23 0.00 0.00 176.35 178.86 2gag h ASP 225 N 3.98 0.92 -0.21 2.29 3.32 -1.91 -3.47 116.42 121.34 2gag h ASP 225 Ca -0.50 -0.45 -0.67 0.00 0.02 0.00 0.00 57.03 55.43 2gag h ASP 225 Cb 1.20 -0.26 -0.12 0.00 0.22 0.00 0.00 39.33 40.37 2gag h ASP 225 CO 0.65 1.23 -0.46 -0.83 -1.72 0.00 0.00 179.24 178.11 2gag s GLY 226 N -3.94 2.98 0.65 2.75 0.00 -1.26 -4.71 107.32 103.80 2gag s GLY 226 Ca -0.10 -0.27 -0.14 0.00 0.00 0.00 0.00 44.72 44.20 2gag s GLY 226 CO 0.88 -2.17 1.09 2.56 0.00 0.00 0.00 173.10 175.45 2gag s PRO 227 N -3.98 2.91 0.51 2.90 0.04 -1.26 -5.04 135.00 131.08 2gag s PRO 227 Ca 0.07 1.27 0.09 0.00 0.04 0.00 0.00 61.00 62.47 2gag s PRO 227 Cb -0.00 -1.97 0.05 0.00 0.04 0.00 0.00 34.50 32.62 2gag s PRO 227 CO 0.04 -1.15 0.70 -1.12 0.04 0.00 0.00 177.00 175.52 2gag s SER 228 N -2.84 5.33 0.95 6.66 0.01 -1.26 -5.10 113.70 117.44 2gag s SER 228 Ca 0.64 -0.65 -0.12 0.00 1.31 0.00 0.00 55.95 57.14 2gag s SER 228 Cb -0.18 -0.13 0.16 0.00 0.21 0.00 0.00 66.02 66.08 2gag s SER 228 CO 0.43 -1.10 1.09 -0.83 0.41 0.00 0.00 173.24 173.23 2gag s GLY 229 N -4.53 1.61 0.39 3.44 0.00 -1.26 -4.93 107.32 102.04 2gag s GLY 229 Ca 0.59 -0.04 -0.27 0.00 0.00 0.00 0.00 44.72 45.00 2gag s GLY 229 CO 0.37 0.49 1.36 -1.05 0.00 0.00 0.00 173.10 174.26 2gag n PRO 230 N -4.10 2.22 -1.22 2.90 -0.02 -1.26 -2.55 135.00 130.97 2gag n PRO 230 Ca 0.07 0.78 -0.08 0.00 -2.02 0.00 0.00 63.50 62.25 2gag n PRO 230 Cb 0.55 -2.48 -0.03 0.00 -0.02 0.00 0.00 33.50 31.51 2gag n PRO 230 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gag n GLY 231 N 0.67 0.93 3.38 -1.23 0.00 -1.26 -4.99 105.19 102.70 2gag n GLY 231 Ca 0.04 -0.36 -0.40 0.00 0.00 0.00 0.00 46.02 45.31 2gag n GLY 231 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gag s VAL 232 N -2.12 4.53 0.39 1.61 1.01 -1.05 -5.08 120.40 119.69 2gag s VAL 232 Ca 0.00 -0.79 -0.26 0.00 0.00 0.00 0.00 61.98 60.94 2gag s VAL 232 Cb 0.00 -3.49 -0.09 0.00 0.00 0.00 0.00 36.38 32.81 2gag s VAL 232 CO 0.00 -0.17 1.20 -0.94 0.00 0.00 0.00 175.10 175.19 2gag s SER 233 N 1.56 6.52 0.01 3.32 1.04 -1.26 -4.70 113.70 120.19 2gag s SER 233 Ca 0.02 2.43 -0.23 0.00 0.48 0.00 0.00 55.95 58.66 2gag s SER 233 Cb -0.19 -2.62 -0.17 0.00 0.10 0.00 0.00 66.02 63.14 2gag s SER 233 CO 0.06 -0.68 1.33 -0.09 0.98 0.00 0.00 173.24 174.84 2gag h ARG 234 N 2.74 0.19 -4.83 4.02 2.43 -1.23 -3.39 114.38 114.32 2gag h ARG 234 Ca -0.49 -0.09 -0.36 0.00 -0.81 0.00 0.00 59.98 58.23 2gag h ARG 234 Cb 1.24 0.00 -0.25 0.00 -0.42 0.00 0.00 29.97 30.54 2gag h ARG 234 CO 0.63 0.60 -0.77 -1.21 -1.51 0.00 0.00 179.97 177.71 2gag s GLU 235 N -4.36 0.69 -0.05 0.20 2.02 -1.26 -1.02 118.70 114.91 2gag s GLU 235 Ca -0.15 -0.60 0.02 0.00 0.02 0.00 0.00 54.97 54.27 2gag s GLU 235 Cb 0.04 -0.61 0.01 0.00 0.10 0.00 0.00 34.13 33.66 2gag s GLU 235 CO 0.71 0.15 -0.11 0.50 0.02 0.00 0.00 175.26 176.53 2gag s ARG 236 N -0.97 1.44 -0.28 1.61 3.52 -0.06 -3.24 118.95 120.95 2gag s ARG 236 Ca -0.02 -0.37 -0.12 0.00 -0.13 0.00 0.00 55.73 55.09 2gag s ARG 236 Cb -0.07 -1.24 -0.04 0.00 -1.56 0.00 0.00 34.95 32.04 2gag s ARG 236 CO 0.01 0.06 0.25 0.42 -0.81 0.00 0.00 175.30 175.22 2gag s ILE 237 N 0.51 5.27 -0.19 4.11 -1.09 -0.63 -0.29 121.20 128.89 2gag s ILE 237 Ca -0.10 0.26 -0.13 0.00 -2.23 0.00 0.00 60.65 58.44 2gag s ILE 237 Cb -0.14 -3.60 -0.05 0.00 -1.58 0.00 0.00 42.46 37.10 2gag s ILE 237 CO 0.02 0.20 0.27 0.26 -1.23 0.00 0.00 174.94 174.46 2gag s TRP 238 N 1.85 3.41 -0.32 3.97 0.52 0.04 -1.13 118.94 127.28 2gag s TRP 238 Ca 0.09 0.49 -0.06 0.00 0.02 0.00 0.00 56.10 56.65 2gag s TRP 238 Cb -0.16 -2.34 0.03 0.00 -1.15 0.00 0.00 33.47 29.85 2gag s TRP 238 CO 0.11 0.16 0.09 -1.01 0.02 0.00 0.00 176.95 176.31 2gag s HIS 239 N 0.75 3.21 -0.17 -1.98 3.76 -0.04 -0.68 115.29 120.14 2gag s HIS 239 Ca 0.14 -1.31 -0.01 0.00 -0.15 0.00 0.00 55.06 53.73 2gag s HIS 239 Cb -0.13 -2.25 -0.00 0.00 1.11 0.00 0.00 32.58 31.30 2gag s HIS 239 CO 0.04 -0.69 -0.13 0.42 -0.85 0.00 0.00 174.74 173.54 2gag s ILE 240 N 1.42 2.84 -0.40 0.60 1.01 0.15 -1.29 121.20 125.53 2gag s ILE 240 Ca -0.00 -0.70 -0.10 0.00 0.00 0.00 0.00 60.65 59.84 2gag s ILE 240 Cb -0.19 -2.22 0.06 0.00 0.01 0.00 0.00 42.46 40.12 2gag s ILE 240 CO 0.02 0.50 0.24 -0.60 0.00 0.00 0.00 174.94 175.10 2gag s ARG 241 N 0.95 2.71 -0.13 2.79 6.06 -0.60 -0.14 118.95 130.59 2gag s ARG 241 Ca -0.02 -1.31 -0.03 0.00 -2.50 0.00 0.00 55.73 51.87 2gag s ARG 241 Cb -0.15 -3.78 -0.03 0.00 0.06 0.00 0.00 34.95 31.05 2gag s ARG 241 CO -0.01 -0.86 -0.00 0.00 -2.50 0.00 0.00 175.30 171.92 2gag s ALA 242 N 1.49 3.21 0.12 6.12 0.00 -0.54 -1.86 121.76 130.29 2gag s ALA 242 Ca 0.02 -0.80 -0.17 0.00 0.00 0.00 0.00 51.96 51.01 2gag s ALA 242 Cb -0.22 -1.58 -0.04 0.00 0.00 0.00 0.00 23.12 21.29 2gag s ALA 242 CO 0.04 0.39 1.64 0.87 0.00 0.00 0.00 175.76 178.70 2gag h LYS 243 N 5.94 0.52 -4.61 0.00 1.57 -1.17 -3.43 116.57 115.40 2gag h LYS 243 Ca -0.42 -0.11 -0.34 0.00 -1.87 0.00 0.00 60.65 57.91 2gag h LYS 243 Cb 1.19 -0.08 -0.26 0.00 0.08 0.00 0.00 32.23 33.16 2gag h LYS 243 CO 0.60 0.55 -0.76 -0.65 -0.57 0.00 0.00 179.45 178.62 2gag s GLN 244 N -5.41 0.59 -0.07 3.15 -1.52 0.14 -4.89 119.66 111.64 2gag s GLN 244 Ca -0.13 -0.46 0.05 0.00 -1.95 0.00 0.00 55.36 52.86 2gag s GLN 244 Cb 0.09 -0.51 -0.00 0.00 -0.22 0.00 0.00 33.01 32.37 2gag s GLN 244 CO 0.75 0.13 -0.23 0.08 -0.25 0.00 0.00 175.29 175.77 2gag s VAL 245 N -0.61 1.90 -0.23 1.09 1.01 -0.58 -1.31 120.40 121.67 2gag s VAL 245 Ca -0.01 -0.96 -0.04 0.00 0.00 0.00 0.00 61.98 60.97 2gag s VAL 245 Cb -0.05 -1.63 -0.00 0.00 0.00 0.00 0.00 36.38 34.70 2gag s VAL 245 CO 0.00 0.53 -0.04 -0.69 0.00 0.00 0.00 175.10 174.90 2gag s VAL 246 N 0.10 3.31 -0.20 2.92 1.01 0.12 -0.53 120.40 127.13 2gag s VAL 246 Ca -0.10 -0.58 -0.14 0.00 0.00 0.00 0.00 61.98 61.16 2gag s VAL 246 Cb -0.15 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 2gag s VAL 246 CO 0.05 0.38 0.30 -0.76 0.00 0.00 0.00 175.10 175.07 2gag s LEU 247 N 1.46 4.17 -0.39 3.92 1.43 -0.13 -0.58 118.68 128.56 2gag s LEU 247 Ca 0.05 0.40 0.11 0.00 -1.03 0.00 0.00 54.13 53.65 2gag s LEU 247 Cb -0.15 -2.36 0.33 0.00 0.03 0.00 0.00 46.19 44.05 2gag s LEU 247 CO -0.03 0.02 0.76 0.00 0.23 0.00 0.00 176.35 177.32 2gag n ALA 248 N 4.15 1.62 1.20 4.21 0.00 0.16 -1.40 120.51 130.45 2gag n ALA 248 Ca -0.11 -3.11 0.10 0.00 0.00 0.00 0.00 53.44 50.32 2gag n ALA 248 Cb 0.52 -0.95 0.34 0.00 0.00 0.00 0.00 19.45 19.36 2gag n ALA 248 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2gag n THR 249 N 0.45 0.24 -4.48 0.00 -2.24 -1.24 -4.27 114.28 102.75 2gag n THR 249 Ca 0.22 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 2gag n THR 249 Cb 0.65 0.33 0.00 0.00 -2.10 0.00 0.00 70.33 69.21 2gag n THR 249 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gag n GLY 250 N 1.11 -0.24 3.00 3.38 0.00 -1.26 -4.64 105.19 106.54 2gag n GLY 250 Ca 0.15 -1.05 -0.12 0.00 0.00 0.00 0.00 46.02 45.00 2gag n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gag s ALA 251 N -1.48 -0.31 0.06 4.61 0.00 -1.26 -0.42 121.76 122.96 2gag s ALA 251 Ca 0.00 0.36 -0.21 0.00 0.00 0.00 0.00 51.96 52.11 2gag s ALA 251 Cb 0.00 -0.21 -0.06 0.00 0.00 0.00 0.00 23.12 22.84 2gag s ALA 251 CO 0.00 -0.06 0.62 -1.01 0.00 0.00 0.00 175.76 175.30 2gag s HIS 252 N 0.09 3.78 0.82 0.00 3.76 -0.12 -4.81 115.29 118.81 2gag s HIS 252 Ca -0.00 1.31 -0.11 0.00 -0.15 0.00 0.00 55.06 56.11 2gag s HIS 252 Cb -0.01 -2.59 0.08 0.00 1.11 0.00 0.00 32.58 31.18 2gag s HIS 252 CO 0.00 0.49 1.09 -2.00 -0.85 0.00 0.00 174.74 173.47 2gag s GLU 253 N -0.77 1.87 0.06 1.40 2.12 -1.26 -0.21 118.70 121.91 2gag s GLU 253 Ca 0.31 0.88 0.02 0.00 0.36 0.00 0.00 54.97 56.54 2gag s GLU 253 Cb -0.20 -1.87 -0.03 0.00 0.26 0.00 0.00 34.13 32.29 2gag s GLU 253 CO 0.20 -1.83 -0.08 -0.98 -0.54 0.00 0.00 175.26 172.02 2gag s ARG 254 N -4.99 0.65 0.86 4.30 1.70 -0.41 -4.77 118.95 116.30 2gag s ARG 254 Ca 0.62 -0.96 -0.15 0.00 -0.47 0.00 0.00 55.73 54.77 2gag s ARG 254 Cb -0.17 -0.31 0.20 0.00 -0.57 0.00 0.00 34.95 34.11 2gag s ARG 254 CO 0.56 0.04 1.04 -0.35 -1.08 0.00 0.00 175.30 175.51 2gag n PRO 255 N 0.97 -1.55 -4.97 3.89 -0.04 -1.26 -1.57 135.00 130.47 2gag n PRO 255 Ca -0.19 -1.62 -0.28 0.00 -0.04 0.00 0.00 63.50 61.37 2gag n PRO 255 Cb 0.57 -1.19 -0.16 0.00 -0.04 0.00 0.00 33.50 32.67 2gag n PRO 255 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2gag s ILE 256 N -3.18 1.62 -0.45 0.52 1.01 -1.26 -4.57 121.20 114.89 2gag s ILE 256 Ca 0.61 -0.82 -0.26 0.00 0.00 0.00 0.00 60.65 60.18 2gag s ILE 256 Cb -0.03 -1.38 0.03 0.00 0.01 0.00 0.00 42.46 41.09 2gag s ILE 256 CO 0.44 0.46 0.93 -0.69 0.00 0.00 0.00 174.94 176.08 2gag s VAL 257 N -0.04 4.47 0.24 2.92 1.01 -1.26 -4.95 120.40 122.79 2gag s VAL 257 Ca -0.03 0.79 -0.15 0.00 0.00 0.00 0.00 61.98 62.59 2gag s VAL 257 Cb -0.12 -4.43 0.01 0.00 0.00 0.00 0.00 36.38 31.83 2gag s VAL 257 CO 0.02 -0.82 0.52 0.72 0.00 0.00 0.00 175.10 175.54 2gag s PHE 258 N 3.75 0.18 0.20 5.22 -0.12 -1.26 -1.70 117.98 124.25 2gag s PHE 258 Ca 0.37 -0.56 -0.32 0.00 -0.05 0.00 0.00 56.93 56.38 2gag s PHE 258 Cb -0.10 0.30 -0.11 0.00 -0.63 0.00 0.00 43.02 42.48 2gag s PHE 258 CO 0.26 -1.01 1.68 -2.00 -0.05 0.00 0.00 175.22 174.10 2gag s GLU 259 N -3.97 4.15 -1.30 1.99 2.12 -1.25 -2.91 118.70 117.52 2gag s GLU 259 Ca 0.18 2.54 -0.02 0.00 0.36 0.00 0.00 54.97 58.03 2gag s GLU 259 Cb -0.01 -3.10 0.01 0.00 0.26 0.00 0.00 34.13 31.29 2gag s GLU 259 CO 0.06 -0.71 0.83 0.09 -0.54 0.00 0.00 175.26 174.99 2gag n ASN 260 N 3.99 -2.00 -1.36 -1.70 5.03 -0.15 -3.86 115.26 115.21 2gag n ASN 260 Ca 0.15 -0.75 0.05 0.00 0.87 0.00 0.00 54.58 54.91 2gag n ASN 260 Cb 0.36 -4.38 0.27 0.00 -1.02 0.00 0.00 39.78 35.01 2gag n ASN 260 CO 0.00 0.00 0.00 -0.46 -1.83 0.00 0.00 177.26 174.97 2gag n ASN 261 N -3.05 3.97 -0.21 6.41 6.94 -1.15 -4.29 115.26 123.89 2gag n ASN 261 Ca -0.25 -2.53 0.03 0.00 -0.02 0.00 0.00 54.58 51.81 2gag n ASN 261 Cb 0.66 -0.58 0.02 0.00 -2.36 0.00 0.00 39.78 37.51 2gag n ASN 261 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2gag n ASP 262 N 0.52 1.32 -4.74 0.53 5.75 -1.26 -4.95 116.55 113.72 2gag n ASP 262 Ca 0.19 -1.16 -0.37 0.00 -0.01 0.00 0.00 54.79 53.43 2gag n ASP 262 Cb 0.82 0.15 0.06 0.00 -1.03 0.00 0.00 41.12 41.12 2gag n ASP 262 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2gag s ARG 263 N -0.67 2.80 0.25 0.11 0.52 -1.26 -4.57 118.95 116.12 2gag s ARG 263 Ca 0.06 2.10 -0.31 0.00 -0.52 0.00 0.00 55.73 57.06 2gag s ARG 263 Cb 0.05 -1.99 -0.12 0.00 0.52 0.00 0.00 34.95 33.41 2gag s ARG 263 CO 0.10 -1.42 1.68 -2.14 0.02 0.00 0.00 175.30 173.54 2gag s PRO 264 N -3.21 4.12 0.00 3.54 0.02 -1.26 -1.78 135.00 136.42 2gag s PRO 264 Ca 0.78 2.61 0.00 0.00 0.02 0.00 0.00 61.00 64.42 2gag s PRO 264 Cb -0.38 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.09 2gag s PRO 264 CO 0.42 -0.72 0.00 0.41 -0.33 0.00 0.00 177.00 176.78 2gag n GLY 265 N 3.24 0.81 3.69 0.52 0.00 -1.26 -1.49 105.19 110.70 2gag n GLY 265 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2gag n GLY 265 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gag s ILE 266 N -1.29 4.90 0.10 -0.61 1.01 -0.74 -1.69 121.20 122.88 2gag s ILE 266 Ca 0.00 1.76 -0.09 0.00 0.00 0.00 0.00 60.65 62.32 2gag s ILE 266 Cb 0.00 -4.19 0.00 0.00 0.01 0.00 0.00 42.46 38.28 2gag s ILE 266 CO 0.00 0.10 0.22 -0.04 0.00 0.00 0.00 174.94 175.22 2gag s MET 267 N 1.58 0.91 0.29 2.79 -1.94 -0.29 -4.70 119.30 117.94 2gag s MET 267 Ca 0.43 -0.97 -0.29 0.00 -1.71 0.00 0.00 55.69 53.15 2gag s MET 267 Cb -0.18 0.36 -0.10 0.00 2.01 0.00 0.00 34.83 36.92 2gag s MET 267 CO 0.18 -0.30 1.36 -0.51 -0.01 0.00 0.00 175.02 175.73 2gag s LEU 268 N -2.87 4.41 0.26 -0.03 1.43 -0.56 0.39 118.68 121.70 2gag s LEU 268 Ca 0.07 2.66 -0.03 0.00 -1.03 0.00 0.00 54.13 55.80 2gag s LEU 268 Cb 0.04 -3.64 0.40 0.00 0.03 0.00 0.00 46.19 43.03 2gag s LEU 268 CO -0.09 -0.60 1.87 0.00 0.23 0.00 0.00 176.35 177.75 2gag h ALA 269 N 4.13 1.35 0.00 4.21 0.00 -1.23 -1.00 119.26 126.73 2gag h ALA 269 Ca -0.48 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 2gag h ALA 269 Cb 1.22 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 2gag h ALA 269 CO 0.71 0.38 -0.09 0.78 0.00 0.00 0.00 179.25 181.03 2gag h GLY 270 N 1.11 0.00 1.38 0.00 0.00 -1.91 -1.08 103.07 102.57 2gag h GLY 270 Ca 0.43 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.47 2gag h GLY 270 CO -0.18 0.00 -1.23 0.00 0.00 0.00 0.00 176.54 175.13 2gag h ALA 271 N 1.91 0.05 -0.69 3.60 0.00 -1.53 1.00 119.26 123.61 2gag h ALA 271 Ca -0.00 -0.80 -0.05 0.00 0.00 0.00 0.00 54.91 54.06 2gag h ALA 271 Cb 0.37 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2gag h ALA 271 CO 0.01 0.77 0.24 0.28 0.00 0.00 0.00 179.25 180.55 2gag h VAL 272 N 0.21 1.25 -0.35 0.00 2.07 -0.97 -0.43 116.25 118.04 2gag h VAL 272 Ca -0.17 -0.85 -0.04 0.00 0.82 0.00 0.00 66.70 66.47 2gag h VAL 272 Cb 1.91 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 32.16 2gag h VAL 272 CO 0.22 0.33 0.07 -0.09 0.02 0.00 0.00 177.57 178.13 2gag h ARG 273 N 1.01 0.57 -0.08 1.57 2.43 -1.12 -1.54 114.38 117.22 2gag h ARG 273 Ca 0.23 -0.15 0.03 0.00 -0.81 0.00 0.00 59.98 59.28 2gag h ARG 273 Cb 0.27 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 2gag h ARG 273 CO -0.01 0.64 -0.08 1.03 -1.51 0.00 0.00 179.97 180.04 2gag h SER 274 N 0.42 -0.24 -0.85 -3.80 0.87 -0.48 -0.05 113.55 109.43 2gag h SER 274 Ca 0.11 0.05 0.03 0.00 -1.23 0.00 0.00 61.79 60.75 2gag h SER 274 Cb 0.33 0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 62.36 2gag h SER 274 CO 0.00 -0.11 0.56 1.88 -0.53 0.00 0.00 176.83 178.63 2gag h TYR 275 N -0.10 1.02 0.51 2.24 0.05 -1.01 0.23 116.97 119.92 2gag h TYR 275 Ca 0.06 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.84 2gag h TYR 275 Cb 0.18 -0.34 0.01 0.00 1.01 0.00 0.00 36.73 37.59 2gag h TYR 275 CO -0.18 0.59 -0.25 1.25 -1.05 0.00 0.00 178.16 178.52 2gag h LEU 276 N 1.05 -0.58 0.12 3.88 5.85 -0.59 0.17 115.31 125.21 2gag h LEU 276 Ca 0.34 -0.06 -0.23 0.00 0.84 0.00 0.00 57.88 58.77 2gag h LEU 276 Cb 0.03 0.15 0.01 0.00 0.37 0.00 0.00 40.66 41.22 2gag h LEU 276 CO -0.10 -0.26 -1.11 0.78 -0.34 0.00 0.00 178.44 177.41 2gag h ASN 277 N -0.93 0.41 0.34 1.25 -0.26 -0.91 -2.34 115.58 113.13 2gag h ASN 277 Ca -0.07 -0.89 -0.27 0.00 -0.56 0.00 0.00 56.30 54.51 2gag h ASN 277 Cb 0.61 -0.13 0.01 0.00 -1.06 0.00 0.00 38.32 37.75 2gag h ASN 277 CO 0.12 1.50 -1.14 -0.09 -1.06 0.00 0.00 177.43 176.76 2gag h ARG 278 N -0.36 0.45 -0.01 0.81 2.43 -0.57 -2.99 114.38 114.14 2gag h ARG 278 Ca -0.23 -0.60 0.00 0.00 -0.81 0.00 0.00 59.98 58.35 2gag h ARG 278 Cb 1.69 0.20 0.00 0.00 -0.42 0.00 0.00 29.97 31.43 2gag h ARG 278 CO 0.10 1.24 -0.06 0.66 -1.51 0.00 0.00 179.97 180.39 2gag n TYR 279 N -3.71 0.00 -3.60 2.20 4.01 -1.12 0.12 117.16 115.07 2gag n TYR 279 Ca -0.10 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.42 2gag n TYR 279 Cb 0.94 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 40.05 2gag n TYR 279 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2gag n GLY 280 N 0.63 -0.46 3.12 2.72 0.00 -0.52 -4.92 105.19 105.76 2gag n GLY 280 Ca 0.05 0.19 -0.26 0.00 0.00 0.00 0.00 46.02 46.00 2gag n GLY 280 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gag s VAL 281 N -3.36 1.39 -0.29 1.61 1.01 0.50 -0.64 120.40 120.62 2gag s VAL 281 Ca 0.37 -0.69 -0.10 0.00 0.00 0.00 0.00 61.98 61.56 2gag s VAL 281 Cb -0.17 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.98 2gag s VAL 281 CO 0.75 0.40 0.17 -0.60 0.00 0.00 0.00 175.10 175.82 2gag s ARG 282 N 0.11 3.65 0.54 2.72 3.52 0.33 -2.32 118.95 127.50 2gag s ARG 282 Ca -0.05 -0.51 0.24 0.00 -0.13 0.00 0.00 55.73 55.27 2gag s ARG 282 Cb -0.12 -3.60 1.42 0.00 -1.56 0.00 0.00 34.95 31.09 2gag s ARG 282 CO 0.02 -0.29 2.05 0.00 -0.81 0.00 0.00 175.30 176.28 2gag h ALA 283 N 8.36 2.23 -2.63 6.12 0.00 -1.88 -1.77 119.26 129.69 2gag h ALA 283 Ca -0.34 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 54.68 2gag h ALA 283 Cb 1.17 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 2gag h ALA 283 CO 0.59 -0.42 0.52 0.20 0.00 0.00 0.00 179.25 180.14 2gag s GLY 284 N -4.02 0.16 -0.04 0.00 0.00 -1.26 -3.83 107.32 98.33 2gag s GLY 284 Ca -0.05 -0.41 0.20 0.00 0.00 0.00 0.00 44.72 44.46 2gag s GLY 284 CO 0.67 1.83 0.42 0.00 0.00 0.00 0.00 173.10 176.03 2gag n ALA 285 N -0.66 2.68 -3.70 3.20 0.00 -0.57 -4.68 120.51 116.78 2gag n ALA 285 Ca -0.04 -0.54 -0.28 0.00 0.00 0.00 0.00 53.44 52.59 2gag n ALA 285 Cb 0.60 -0.67 -0.11 0.00 0.00 0.00 0.00 19.45 19.27 2gag n ALA 285 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2gag s ARG 286 N -3.36 1.83 -0.22 0.00 1.81 -1.26 -4.98 118.95 112.77 2gag s ARG 286 Ca -0.08 -2.84 -0.22 0.00 -1.72 0.00 0.00 55.73 50.88 2gag s ARG 286 Cb 0.13 -2.61 -0.02 0.00 -0.45 0.00 0.00 34.95 32.00 2gag s ARG 286 CO 0.85 -1.32 0.68 0.42 -0.68 0.00 0.00 175.30 175.24 2gag s ILE 287 N -0.83 4.97 0.14 1.52 1.01 -1.26 -0.79 121.20 125.95 2gag s ILE 287 Ca 0.28 1.27 0.02 0.00 0.00 0.00 0.00 60.65 62.23 2gag s ILE 287 Cb -0.01 -3.99 -0.04 0.00 0.01 0.00 0.00 42.46 38.43 2gag s ILE 287 CO -0.18 0.05 0.28 0.00 0.00 0.00 0.00 174.94 175.09 2gag s ALA 288 N 2.27 3.97 -0.07 9.38 0.00 0.12 -0.69 121.76 136.74 2gag s ALA 288 Ca 0.30 -1.01 0.03 0.00 0.00 0.00 0.00 51.96 51.27 2gag s ALA 288 Cb -0.16 -1.78 0.01 0.00 0.00 0.00 0.00 23.12 21.19 2gag s ALA 288 CO 0.09 0.57 -0.15 0.08 0.00 0.00 0.00 175.76 176.35 2gag s VAL 289 N -1.72 1.32 -0.14 0.00 1.01 -0.18 -0.76 120.40 119.94 2gag s VAL 289 Ca 0.35 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.75 2gag s VAL 289 Cb -0.11 -1.18 0.00 0.00 0.00 0.00 0.00 36.38 35.09 2gag s VAL 289 CO 0.28 0.40 -0.19 0.00 0.00 0.00 0.00 175.10 175.59 2gag s ALA 290 N 0.54 2.36 0.04 5.51 0.00 -0.46 0.86 121.76 130.62 2gag s ALA 290 Ca -0.14 -1.05 -0.00 0.00 0.00 0.00 0.00 51.96 50.77 2gag s ALA 290 Cb -0.16 -1.08 -0.03 0.00 0.00 0.00 0.00 23.12 21.85 2gag s ALA 290 CO 0.04 0.03 -0.03 -0.08 0.00 0.00 0.00 175.76 175.72 2gag s THR 291 N 0.72 0.23 -0.52 0.00 -1.32 0.11 -0.14 115.64 114.72 2gag s THR 291 Ca -0.08 -1.52 0.04 0.00 -1.21 0.00 0.00 61.69 58.92 2gag s THR 291 Cb -0.16 -1.12 0.03 0.00 -1.51 0.00 0.00 72.50 69.74 2gag s THR 291 CO 0.01 -0.82 0.64 0.35 -2.21 0.00 0.00 174.62 172.59 2gag n THR 292 N 0.59 0.02 -3.90 5.08 -2.24 -0.53 -1.30 114.28 112.00 2gag n THR 292 Ca -0.17 -0.51 -0.11 0.00 -2.27 0.00 0.00 64.05 60.99 2gag n THR 292 Cb 0.59 1.08 0.00 0.00 -2.10 0.00 0.00 70.33 69.90 2gag n THR 292 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2gag s ASN 293 N -0.36 0.37 0.52 3.42 4.22 -1.26 -1.69 114.94 120.16 2gag s ASN 293 Ca 0.05 -1.30 0.31 0.00 -2.14 0.00 0.00 52.86 49.78 2gag s ASN 293 Cb 0.04 0.80 1.21 0.00 1.28 0.00 0.00 41.25 44.57 2gag s ASN 293 CO 0.05 -1.58 1.93 0.44 -2.04 0.00 0.00 177.10 175.90 2gag h ASP 294 N 2.03 0.00 -1.00 3.54 3.32 -1.97 -3.33 116.42 119.01 2gag h ASP 294 Ca -0.31 0.00 0.21 0.00 0.02 0.00 0.00 57.03 56.95 2gag h ASP 294 Cb 1.25 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.69 2gag h ASP 294 CO 0.41 0.04 0.62 0.77 -1.72 0.00 0.00 179.24 179.35 2gag h SER 295 N 0.00 0.68 -0.04 6.45 4.64 -1.97 -1.37 113.55 121.94 2gag h SER 295 Ca -0.00 0.09 0.01 0.00 -0.47 0.00 0.00 61.79 61.43 2gag h SER 295 Cb 0.59 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.65 2gag h SER 295 CO 0.00 0.22 0.04 0.00 -0.87 0.00 0.00 176.83 176.22 2gag h ALA 296 N 1.65 1.78 0.00 5.18 0.00 -1.94 -2.87 119.26 123.07 2gag h ALA 296 Ca 0.58 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.49 2gag h ALA 296 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2gag h ALA 296 CO -0.36 -0.06 0.00 1.88 0.00 0.00 0.00 179.25 180.71 2gag h TYR 297 N 0.00 0.00 0.01 0.00 0.05 -1.53 -1.65 116.97 113.86 2gag h TYR 297 Ca 0.02 0.00 -0.24 0.00 0.05 0.00 0.00 58.73 58.56 2gag h TYR 297 Cb 0.10 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.85 2gag h TYR 297 CO 0.00 0.00 -0.99 0.93 -1.05 0.00 0.00 178.16 177.05 2gag h GLU 298 N 0.00 0.47 -0.33 4.88 5.08 -1.68 -2.23 114.58 120.77 2gag h GLU 298 Ca 0.00 -0.52 -0.07 0.00 -1.00 0.00 0.00 59.36 57.77 2gag h GLU 298 Cb 0.37 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 2gag h GLU 298 CO 0.00 1.17 -0.06 1.25 -1.00 0.00 0.00 179.01 180.37 2gag h LEU 299 N 0.26 0.63 -0.19 1.33 5.85 -1.49 -1.42 115.31 120.27 2gag h LEU 299 Ca -0.10 -0.35 0.05 0.00 0.84 0.00 0.00 57.88 58.32 2gag h LEU 299 Cb 1.64 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 42.45 2gag h LEU 299 CO 0.18 0.83 -0.14 0.58 -0.34 0.00 0.00 178.44 179.55 2gag h VAL 300 N 0.41 0.59 -0.96 1.05 2.07 -1.35 -1.23 116.25 116.85 2gag h VAL 300 Ca 0.09 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.62 2gag h VAL 300 Cb 0.55 0.59 -0.05 0.00 -1.52 0.00 0.00 31.29 30.86 2gag h VAL 300 CO 0.03 0.00 0.63 -0.09 0.02 0.00 0.00 177.57 178.16 2gag h ARG 301 N -0.15 1.25 0.00 1.57 2.43 -1.28 -2.33 114.38 115.87 2gag h ARG 301 Ca 0.11 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2gag h ARG 301 Cb 0.32 -0.28 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 2gag h ARG 301 CO -0.28 0.83 0.00 0.93 -1.51 0.00 0.00 179.97 179.94 2gag h GLU 302 N 1.29 0.00 0.00 0.20 5.08 -0.52 -2.83 114.58 117.80 2gag h GLU 302 Ca 0.35 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 2gag h GLU 302 Cb -0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.11 2gag h GLU 302 CO -0.08 0.00 -0.72 1.28 -1.00 0.00 0.00 179.01 178.49 2gag n LEU 303 N -2.90 0.63 -0.13 1.33 4.77 -0.53 -4.39 117.00 115.77 2gag n LEU 303 Ca 0.01 -0.07 -0.05 0.00 -0.03 0.00 0.00 56.01 55.88 2gag n LEU 303 Cb 0.28 -0.17 0.02 0.00 -2.33 0.00 0.00 43.42 41.22 2gag n LEU 303 CO 0.25 0.11 0.78 0.00 -1.33 0.00 0.00 177.39 177.20 2gag h ALA 304 N 2.84 0.26 -0.26 -1.18 0.00 -1.32 0.23 119.26 119.84 2gag h ALA 304 Ca 0.00 0.16 0.07 0.00 0.00 0.00 0.00 54.91 55.15 2gag h ALA 304 Cb 0.58 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2gag h ALA 304 CO 0.00 -0.46 0.24 0.00 0.00 0.00 0.00 179.25 179.03 2gag h ALA 305 N 1.40 2.00 -0.18 0.00 0.00 -1.79 -2.50 119.26 118.18 2gag h ALA 305 Ca 0.20 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2gag h ALA 305 Cb 0.31 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2gag h ALA 305 CO -0.43 -0.37 -0.00 0.25 0.00 0.00 0.00 179.25 178.70 2gag n THR 306 N -3.99 2.18 0.00 0.00 -2.24 -0.87 -4.92 114.28 104.44 2gag n THR 306 Ca 0.03 -2.00 0.00 0.00 -2.27 0.00 0.00 64.05 59.82 2gag n THR 306 Cb 0.39 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 2gag n THR 306 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gag n GLY 307 N -0.78 0.81 7.00 3.38 0.00 -0.95 -5.09 105.19 109.55 2gag n GLY 307 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2gag n GLY 307 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gag n GLY 308 N 0.00 0.48 3.40 -0.02 0.00 0.76 -4.90 105.19 104.91 2gag n GLY 308 Ca 0.00 -0.91 -0.21 0.00 0.00 0.00 0.00 46.02 44.91 2gag n GLY 308 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2gag s VAL 309 N 0.00 1.80 0.10 1.61 -7.23 -1.26 -4.64 120.40 110.78 2gag s VAL 309 Ca 0.00 -2.20 -0.15 0.00 -1.81 0.00 0.00 61.98 57.82 2gag s VAL 309 Cb 0.00 -2.27 -0.08 0.00 0.56 0.00 0.00 36.38 34.59 2gag s VAL 309 CO 0.00 -0.43 1.43 0.58 -0.31 0.00 0.00 175.10 176.37 2gag h VAL 310 N 2.39 1.30 0.00 1.32 2.07 -1.23 -3.46 116.25 118.64 2gag h VAL 310 Ca -0.39 -1.40 0.00 0.00 0.82 0.00 0.00 66.70 65.73 2gag h VAL 310 Cb 1.23 1.55 0.00 0.00 -1.52 0.00 0.00 31.29 32.56 2gag h VAL 310 CO 0.64 0.45 0.00 0.00 0.02 0.00 0.00 177.57 178.68 2gag n ALA 311 N -2.48 0.00 -3.38 1.67 0.00 -1.26 -4.70 120.51 110.36 2gag n ALA 311 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.06 2gag n ALA 311 Cb 0.44 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.75 2gag n ALA 311 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2gag s VAL 312 N -2.00 3.16 -0.49 0.00 1.01 -0.03 -1.01 120.40 121.04 2gag s VAL 312 Ca 0.00 -0.59 -0.15 0.00 0.00 0.00 0.00 61.98 61.24 2gag s VAL 312 Cb 0.00 -2.39 0.09 0.00 0.00 0.00 0.00 36.38 34.09 2gag s VAL 312 CO 0.00 0.48 0.42 -0.63 0.00 0.00 0.00 175.10 175.37 2gag s ILE 313 N 0.99 5.14 -0.30 2.22 -1.09 0.25 -0.74 121.20 127.66 2gag s ILE 313 Ca -0.01 -1.24 -0.12 0.00 -2.23 0.00 0.00 60.65 57.05 2gag s ILE 313 Cb -0.15 -4.15 -0.04 0.00 -1.58 0.00 0.00 42.46 36.54 2gag s ILE 313 CO -0.01 -0.67 0.21 -0.62 -1.23 0.00 0.00 174.94 172.62 2gag s ASP 314 N 2.90 6.04 0.57 3.58 -1.08 -0.49 -0.72 116.67 127.47 2gag s ASP 314 Ca 0.04 -0.17 0.30 0.00 -0.52 0.00 0.00 52.55 52.19 2gag s ASP 314 Cb -0.26 -2.13 1.70 0.00 -1.46 0.00 0.00 42.92 40.78 2gag s ASP 314 CO 0.05 -0.13 2.19 0.00 0.52 0.00 0.00 175.17 177.80 2gag h ALA 315 N 8.42 1.40 -2.33 3.66 0.00 -0.72 0.29 119.26 129.97 2gag h ALA 315 Ca -0.33 -0.04 -0.55 0.00 0.00 0.00 0.00 54.91 53.98 2gag h ALA 315 Cb 1.18 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 2gag h ALA 315 CO 0.58 0.06 0.64 1.03 0.00 0.00 0.00 179.25 181.56 2gag s ARG 316 N -4.43 4.39 0.43 0.00 0.52 -1.26 -3.86 118.95 114.75 2gag s ARG 316 Ca -0.04 1.61 0.28 0.00 -0.52 0.00 0.00 55.73 57.07 2gag s ARG 316 Cb 0.14 -3.53 0.99 0.00 0.52 0.00 0.00 34.95 33.08 2gag s ARG 316 CO 0.56 -0.38 1.82 0.66 0.02 0.00 0.00 175.30 177.98 2gag h SER 317 N 7.28 0.00 -3.31 0.23 4.64 -1.88 -0.57 113.55 119.94 2gag h SER 317 Ca -0.35 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.41 2gag h SER 317 Cb 1.17 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.22 2gag h SER 317 CO 0.86 0.00 -0.12 -0.44 -0.87 0.00 0.00 176.83 176.26 2gag s SER 318 N -5.42 6.74 -0.40 4.97 0.01 -1.26 -4.62 113.70 113.73 2gag s SER 318 Ca 0.04 0.99 -0.16 0.00 1.31 0.00 0.00 55.95 58.12 2gag s SER 318 Cb 0.08 -2.25 0.01 0.00 0.21 0.00 0.00 66.02 64.07 2gag s SER 318 CO 0.55 0.07 0.40 -0.63 0.41 0.00 0.00 173.24 174.04 2gag s ILE 319 N -1.54 5.13 1.05 1.44 1.01 -1.26 -4.90 121.20 122.13 2gag s ILE 319 Ca 0.39 -0.26 -0.15 0.00 0.00 0.00 0.00 60.65 60.64 2gag s ILE 319 Cb -0.14 -3.96 0.21 0.00 0.01 0.00 0.00 42.46 38.58 2gag s ILE 319 CO 0.19 -0.31 1.11 -0.94 0.00 0.00 0.00 174.94 175.00 2gag s SER 320 N 1.77 2.23 0.17 3.58 1.04 -1.26 -4.77 113.70 116.46 2gag s SER 320 Ca 0.11 0.93 -0.13 0.00 0.48 0.00 0.00 55.95 57.35 2gag s SER 320 Cb -0.17 -1.43 0.07 0.00 0.10 0.00 0.00 66.02 64.58 2gag s SER 320 CO 0.13 -3.35 1.76 0.00 0.98 0.00 0.00 173.24 172.76 2gag h ALA 321 N -2.05 0.73 -0.87 5.32 0.00 -1.97 -1.22 119.26 119.19 2gag h ALA 321 Ca -0.51 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.26 2gag h ALA 321 Cb 1.32 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 2gag h ALA 321 CO 0.51 0.28 0.45 0.00 0.00 0.00 0.00 179.25 180.48 2gag h ALA 322 N 1.12 1.14 -0.59 0.00 0.00 -1.97 -0.39 119.26 118.56 2gag h ALA 322 Ca 0.20 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 2gag h ALA 322 Cb 0.09 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2gag h ALA 322 CO -0.03 0.67 -0.03 0.00 0.00 0.00 0.00 179.25 179.86 2gag h ALA 323 N 1.25 0.80 -0.79 0.00 0.00 -1.85 -1.76 119.26 116.92 2gag h ALA 323 Ca 0.30 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2gag h ALA 323 Cb 0.08 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 2gag h ALA 323 CO -0.04 0.67 0.36 0.00 0.00 0.00 0.00 179.25 180.23 2gag h ALA 324 N 0.97 1.15 -0.54 0.00 0.00 -0.73 -0.07 119.26 120.04 2gag h ALA 324 Ca 0.16 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2gag h ALA 324 Cb 0.60 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2gag h ALA 324 CO 0.04 0.63 0.06 0.37 0.00 0.00 0.00 179.25 180.35 2gag h GLN 325 N 1.12 0.92 -0.01 0.00 5.75 -0.88 0.85 115.11 122.86 2gag h GLN 325 Ca 0.27 -0.26 0.01 0.00 -0.15 0.00 0.00 58.65 58.52 2gag h GLN 325 Cb 0.14 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.58 2gag h GLN 325 CO -0.03 0.90 -0.05 0.00 -2.65 0.00 0.00 178.83 177.00 2gag h ALA 326 N 0.98 -0.05 -0.90 3.38 0.00 -0.61 0.15 119.26 122.21 2gag h ALA 326 Ca 0.16 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.15 2gag h ALA 326 Cb 0.45 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.26 2gag h ALA 326 CO 0.02 -0.54 0.56 0.28 0.00 0.00 0.00 179.25 179.56 2gag h VAL 327 N -0.09 1.04 0.00 0.00 2.07 -0.81 -0.24 116.25 118.21 2gag h VAL 327 Ca 0.02 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.15 2gag h VAL 327 Cb 0.12 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 29.82 2gag h VAL 327 CO -0.06 0.18 -0.22 0.00 0.02 0.00 0.00 177.57 177.49 2gag h ALA 328 N 1.43 1.59 -0.00 1.67 0.00 0.17 -1.88 119.26 122.23 2gag h ALA 328 Ca 0.40 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2gag h ALA 328 Cb 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2gag h ALA 328 CO -0.18 0.28 -0.05 -0.25 0.00 0.00 0.00 179.25 179.04 2gag n ASP 329 N -4.21 0.41 0.00 0.00 8.00 0.42 -4.90 116.55 116.27 2gag n ASP 329 Ca -0.02 -0.74 0.00 0.00 0.71 0.00 0.00 54.79 54.74 2gag n ASP 329 Cb 0.28 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.31 2gag n ASP 329 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gag n GLY 330 N 1.20 0.97 3.75 0.44 0.00 -0.71 -5.08 105.19 105.76 2gag n GLY 330 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 2gag n GLY 330 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gag s VAL 331 N -2.00 4.65 -0.42 1.61 1.01 -0.52 -5.00 120.40 119.74 2gag s VAL 331 Ca 0.00 1.69 -0.29 0.00 0.00 0.00 0.00 61.98 63.38 2gag s VAL 331 Cb 0.00 -4.14 0.02 0.00 0.00 0.00 0.00 36.38 32.26 2gag s VAL 331 CO 0.00 0.38 1.17 -1.58 0.00 0.00 0.00 175.10 175.07 2gag s GLN 332 N -0.21 3.80 -0.23 2.72 0.74 -1.26 -4.05 119.66 121.17 2gag s GLN 332 Ca 0.39 0.78 -0.02 0.00 0.05 0.00 0.00 55.36 56.57 2gag s GLN 332 Cb -0.21 -3.88 0.01 0.00 1.10 0.00 0.00 33.01 30.03 2gag s GLN 332 CO 0.24 -1.27 -0.08 0.08 -0.55 0.00 0.00 175.29 173.71 2gag s VAL 333 N 4.38 2.85 -0.80 1.34 1.01 -1.26 -0.85 120.40 127.07 2gag s VAL 333 Ca 0.50 -0.84 -0.12 0.00 0.00 0.00 0.00 61.98 61.51 2gag s VAL 333 Cb -0.10 -2.36 0.21 0.00 0.00 0.00 0.00 36.38 34.14 2gag s VAL 333 CO 0.27 0.34 0.72 -0.63 0.00 0.00 0.00 175.10 175.80 2gag s ILE 334 N 1.36 5.34 0.71 2.22 -1.09 0.08 -4.98 121.20 124.83 2gag s ILE 334 Ca 0.03 -2.55 -0.11 0.00 -2.23 0.00 0.00 60.65 55.79 2gag s ILE 334 Cb -0.15 -4.31 0.02 0.00 -1.58 0.00 0.00 42.46 36.43 2gag s ILE 334 CO -0.06 -1.01 1.07 -0.44 -1.23 0.00 0.00 174.94 173.27 2gag s SER 335 N 1.94 5.23 -2.04 3.58 0.01 -1.26 -1.39 113.70 119.77 2gag s SER 335 Ca 0.18 1.66 0.00 0.00 1.31 0.00 0.00 55.95 59.09 2gag s SER 335 Cb -0.12 -2.50 0.00 0.00 0.21 0.00 0.00 66.02 63.61 2gag s SER 335 CO -0.08 -1.54 0.00 0.61 0.41 0.00 0.00 173.24 172.64 2gag n GLY 336 N -1.85 1.70 3.36 3.44 0.00 0.93 -4.86 105.19 107.91 2gag n GLY 336 Ca 0.08 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.91 2gag n GLY 336 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gag s SER 337 N -2.61 2.39 0.05 1.61 0.01 -0.68 -1.51 113.70 112.96 2gag s SER 337 Ca 0.00 -1.12 -0.05 0.00 1.31 0.00 0.00 55.95 56.09 2gag s SER 337 Cb 0.00 -0.10 -0.02 0.00 0.21 0.00 0.00 66.02 66.11 2gag s SER 337 CO 0.00 -0.32 0.07 0.68 0.41 0.00 0.00 173.24 174.08 2gag s VAL 338 N -3.12 0.16 0.02 3.43 -7.23 -0.27 -2.23 120.40 111.16 2gag s VAL 338 Ca 0.26 -1.28 -0.30 0.00 -1.81 0.00 0.00 61.98 58.84 2gag s VAL 338 Cb 0.03 -1.10 -0.05 0.00 0.56 0.00 0.00 36.38 35.82 2gag s VAL 338 CO 0.08 -0.71 1.28 -0.69 -0.31 0.00 0.00 175.10 174.75 2gag s VAL 339 N -3.10 3.90 -0.48 1.32 1.01 -1.26 -2.11 120.40 119.69 2gag s VAL 339 Ca -0.01 1.32 0.13 0.00 0.00 0.00 0.00 61.98 63.42 2gag s VAL 339 Cb 0.02 -3.85 -0.16 0.00 0.00 0.00 0.00 36.38 32.39 2gag s VAL 339 CO -0.07 0.05 0.50 1.33 0.00 0.00 0.00 175.10 176.91 2gag n VAL 340 N 4.30 0.00 -3.68 2.92 0.24 0.11 -4.83 118.33 117.40 2gag n VAL 340 Ca 0.11 -0.22 -0.03 0.00 -2.04 0.00 0.00 64.34 62.16 2gag n VAL 340 Cb 0.45 0.80 -0.01 0.00 -1.47 0.00 0.00 33.84 33.61 2gag n VAL 340 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2gag s ASP 341 N -2.56 -0.18 0.10 -1.34 -1.08 -1.12 -3.89 116.67 106.60 2gag s ASP 341 Ca 0.03 -0.26 -0.04 0.00 -0.52 0.00 0.00 52.55 51.75 2gag s ASP 341 Cb 0.10 0.39 -0.02 0.00 -1.46 0.00 0.00 42.92 41.92 2gag s ASP 341 CO 0.55 -0.70 0.10 0.42 0.52 0.00 0.00 175.17 176.07 2gag s THR 342 N -3.04 0.14 0.21 1.71 -4.23 -1.25 -0.22 115.64 108.97 2gag s THR 342 Ca 0.11 -1.60 0.10 0.00 -1.18 0.00 0.00 61.69 59.13 2gag s THR 342 Cb -0.00 -1.66 -0.05 0.00 1.34 0.00 0.00 72.50 72.13 2gag s THR 342 CO -0.01 -0.65 -0.20 -1.61 -0.54 0.00 0.00 174.62 171.60 2gag s GLU 343 N -3.95 1.48 0.20 3.99 2.02 0.55 -4.94 118.70 118.06 2gag s GLU 343 Ca 0.13 -1.57 0.11 0.00 0.02 0.00 0.00 54.97 53.65 2gag s GLU 343 Cb 0.06 -1.62 -0.04 0.00 0.10 0.00 0.00 34.13 32.63 2gag s GLU 343 CO -0.05 0.32 -0.21 0.00 0.02 0.00 0.00 175.26 175.34 2gag s ALA 344 N -2.13 2.40 0.54 5.21 0.00 -1.26 -0.03 121.76 126.50 2gag s ALA 344 Ca 0.22 -1.64 -0.01 0.00 0.00 0.00 0.00 51.96 50.54 2gag s ALA 344 Cb -0.06 -0.27 0.03 0.00 0.00 0.00 0.00 23.12 22.82 2gag s ALA 344 CO 0.10 0.34 0.19 -0.40 0.00 0.00 0.00 175.76 175.98 2gag n ASP 345 N 0.11 0.20 0.13 0.00 5.68 0.36 -4.76 116.55 118.26 2gag n ASP 345 Ca -0.11 -1.18 0.17 0.00 -0.50 0.00 0.00 54.79 53.17 2gag n ASP 345 Cb 0.57 -0.12 0.73 0.00 -1.14 0.00 0.00 41.12 41.16 2gag n ASP 345 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 2gag h GLU 346 N 0.00 0.00 -0.51 0.11 9.09 -2.01 -1.09 114.58 120.17 2gag h GLU 346 Ca -0.06 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.35 2gag h GLU 346 Cb 0.21 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.31 2gag h GLU 346 CO 0.06 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.21 2gag n ASN 347 N -4.17 2.73 0.00 3.06 4.13 -1.26 -4.91 115.26 114.83 2gag n ASN 347 Ca 0.04 -2.06 0.00 0.00 1.68 0.00 0.00 54.58 54.25 2gag n ASN 347 Cb 0.41 -0.35 0.00 0.00 -1.54 0.00 0.00 39.78 38.30 2gag n ASN 347 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2gag n GLY 348 N 1.18 0.57 3.90 7.41 0.00 -0.41 -5.02 105.19 112.83 2gag n GLY 348 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 2gag n GLY 348 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gag s GLU 349 N -0.28 3.65 0.14 1.61 2.02 -1.26 -4.23 118.70 120.34 2gag s GLU 349 Ca 0.00 0.01 -0.35 0.00 0.02 0.00 0.00 54.97 54.65 2gag s GLU 349 Cb 0.00 -2.68 -0.15 0.00 0.10 0.00 0.00 34.13 31.40 2gag s GLU 349 CO 0.00 0.27 1.50 -0.11 0.02 0.00 0.00 175.26 176.95 2gag n LEU 350 N -0.68 2.65 0.00 1.80 7.94 -0.55 -0.49 117.00 127.66 2gag n LEU 350 Ca -0.02 1.09 0.00 0.00 -1.11 0.00 0.00 56.01 55.98 2gag n LEU 350 Cb 0.53 -1.35 0.00 0.00 0.53 0.00 0.00 43.42 43.13 2gag n LEU 350 CO 0.48 -0.52 -0.38 -1.54 -1.11 0.00 0.00 177.39 174.31 2gag n SER 351 N 3.14 3.80 -3.44 1.96 3.41 0.96 -4.38 113.62 119.06 2gag n SER 351 Ca 0.17 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.67 2gag n SER 351 Cb 0.26 0.54 -0.02 0.00 -0.26 0.00 0.00 64.21 64.73 2gag n SER 351 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gag s ALA 352 N -1.66 -1.62 0.07 7.33 0.00 -1.18 -1.36 121.76 123.34 2gag s ALA 352 Ca 0.00 0.55 0.09 0.00 0.00 0.00 0.00 51.96 52.60 2gag s ALA 352 Cb 0.00 0.82 -0.03 0.00 0.00 0.00 0.00 23.12 23.91 2gag s ALA 352 CO 0.00 -0.76 -0.25 0.96 0.00 0.00 0.00 175.76 175.70 2gag s ILE 353 N -3.66 2.07 -0.19 0.00 -4.36 -0.16 -0.33 121.20 114.57 2gag s ILE 353 Ca 0.02 -1.47 -0.04 0.00 -0.26 0.00 0.00 60.65 58.90 2gag s ILE 353 Cb -0.01 -1.80 -0.02 0.00 1.25 0.00 0.00 42.46 41.88 2gag s ILE 353 CO -0.12 0.24 -0.04 -0.69 0.24 0.00 0.00 174.94 174.57 2gag s VAL 354 N -0.90 3.63 0.06 8.37 1.01 0.70 -1.69 120.40 131.57 2gag s VAL 354 Ca 0.11 -0.43 0.09 0.00 0.00 0.00 0.00 61.98 61.75 2gag s VAL 354 Cb -0.10 -2.62 -0.03 0.00 0.00 0.00 0.00 36.38 33.63 2gag s VAL 354 CO 0.03 0.45 -0.23 -0.69 0.00 0.00 0.00 175.10 174.66 2gag s VAL 355 N 0.96 2.43 0.12 2.92 1.01 0.45 0.06 120.40 128.36 2gag s VAL 355 Ca 0.00 -1.38 -0.15 0.00 0.00 0.00 0.00 61.98 60.45 2gag s VAL 355 Cb -0.15 -2.01 0.03 0.00 0.00 0.00 0.00 36.38 34.25 2gag s VAL 355 CO 0.01 0.30 0.37 0.00 0.00 0.00 0.00 175.10 175.78 2gag s ALA 356 N -0.91 -0.81 0.35 5.51 0.00 -0.90 -1.21 121.76 123.79 2gag s ALA 356 Ca 0.14 -0.15 -0.27 0.00 0.00 0.00 0.00 51.96 51.68 2gag s ALA 356 Cb -0.10 0.67 -0.09 0.00 0.00 0.00 0.00 23.12 23.60 2gag s ALA 356 CO 0.04 -0.63 1.12 -2.00 0.00 0.00 0.00 175.76 174.30 2gag s GLU 357 N -3.82 4.32 -0.29 0.00 2.12 -1.26 -1.11 118.70 118.65 2gag s GLU 357 Ca 0.04 1.77 0.03 0.00 0.36 0.00 0.00 54.97 57.16 2gag s GLU 357 Cb 0.02 -2.86 0.08 0.00 0.26 0.00 0.00 34.13 31.64 2gag s GLU 357 CO -0.11 -0.07 -0.01 -1.17 -0.54 0.00 0.00 175.26 173.35 2gag s LEU 358 N -2.10 3.78 0.90 2.70 2.96 -0.57 -1.48 118.68 124.87 2gag s LEU 358 Ca 0.52 -1.71 -0.13 0.00 -0.22 0.00 0.00 54.13 52.58 2gag s LEU 358 Cb -0.30 -1.47 0.17 0.00 0.50 0.00 0.00 46.19 45.09 2gag s LEU 358 CO 0.38 -0.30 1.25 1.51 -1.32 0.00 0.00 176.35 177.87 2gag s ASP 359 N 1.10 3.55 0.50 3.68 1.47 -0.46 -4.77 116.67 121.74 2gag s ASP 359 Ca 0.02 0.31 0.33 0.00 1.18 0.00 0.00 52.55 54.38 2gag s ASP 359 Cb -0.19 -0.48 1.80 0.00 -0.34 0.00 0.00 42.92 43.71 2gag s ASP 359 CO -0.08 -2.46 2.01 1.05 0.68 0.00 0.00 175.17 176.37 2gag h GLU 360 N -1.39 0.00 -0.15 2.11 4.11 -1.97 0.77 114.58 118.05 2gag h GLU 360 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.99 2gag h GLU 360 Cb 1.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.51 2gag h GLU 360 CO 0.44 0.00 0.00 0.00 0.07 0.00 0.00 179.01 179.52 2gag n ALA 361 N -1.93 2.52 -2.58 1.06 0.00 -1.26 -4.90 120.51 113.43 2gag n ALA 361 Ca -0.02 -0.52 -0.14 0.00 0.00 0.00 0.00 53.44 52.75 2gag n ALA 361 Cb 0.06 -1.09 0.01 0.00 0.00 0.00 0.00 19.45 18.43 2gag n ALA 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2gag n ARG 362 N 0.33 -2.48 -4.22 0.00 1.74 0.27 -5.01 116.66 107.29 2gag n ARG 362 Ca 0.16 0.62 -0.35 0.00 -0.77 0.00 0.00 57.85 57.52 2gag n ARG 362 Cb 0.34 -4.86 -0.08 0.00 -1.02 0.00 0.00 32.46 26.84 2gag n ARG 362 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2gag s GLU 363 N -5.08 3.07 0.12 5.56 2.56 -1.24 -4.82 118.70 118.87 2gag s GLU 363 Ca 0.13 -0.39 -0.16 0.00 0.00 0.00 0.00 54.97 54.55 2gag s GLU 363 Cb -0.06 -2.87 -0.07 0.00 2.00 0.00 0.00 34.13 33.14 2gag s GLU 363 CO 0.16 0.70 0.55 -0.51 -0.56 0.00 0.00 175.26 175.60 2gag s LEU 364 N -1.16 4.40 0.00 2.70 1.43 -1.26 -1.36 118.68 123.43 2gag s LEU 364 Ca 0.16 1.13 0.00 0.00 -1.03 0.00 0.00 54.13 54.39 2gag s LEU 364 Cb -0.12 -3.13 0.00 0.00 0.03 0.00 0.00 46.19 42.97 2gag s LEU 364 CO 0.06 0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.41 2gag n GLY 365 N 1.11 1.75 3.72 -3.19 0.00 -0.55 -4.95 105.19 103.07 2gag n GLY 365 Ca -0.07 -2.07 -0.32 0.00 0.00 0.00 0.00 46.02 43.56 2gag n GLY 365 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2gag s GLY 366 N -1.63 1.84 0.33 -0.02 0.00 -1.26 -4.55 107.32 102.03 2gag s GLY 366 Ca 0.00 0.54 0.07 0.00 0.00 0.00 0.00 44.72 45.33 2gag s GLY 366 CO 0.00 0.93 0.36 -0.51 0.00 0.00 0.00 173.10 173.89 2gag s THR 367 N -2.58 3.85 0.03 0.90 -4.23 -1.26 -4.29 115.64 108.06 2gag s THR 367 Ca 0.66 -1.20 -0.10 0.00 -1.18 0.00 0.00 61.69 59.87 2gag s THR 367 Cb -0.22 -3.31 0.01 0.00 1.34 0.00 0.00 72.50 70.32 2gag s THR 367 CO 0.54 -0.18 0.20 -1.58 -0.54 0.00 0.00 174.62 173.06 2gag s GLN 368 N -4.06 0.67 0.11 3.99 0.74 -0.35 -4.96 119.66 115.79 2gag s GLN 368 Ca 0.42 -0.57 0.07 0.00 0.05 0.00 0.00 55.36 55.33 2gag s GLN 368 Cb -0.07 0.28 -0.04 0.00 1.10 0.00 0.00 33.01 34.27 2gag s GLN 368 CO 0.28 -0.19 -0.11 1.03 -0.55 0.00 0.00 175.29 175.75 2gag s ARG 369 N -2.35 2.08 -0.04 1.67 0.52 -1.26 -0.41 118.95 119.16 2gag s ARG 369 Ca -0.07 -1.06 -0.01 0.00 -0.52 0.00 0.00 55.73 54.07 2gag s ARG 369 Cb -0.02 -2.27 0.03 0.00 0.52 0.00 0.00 34.95 33.21 2gag s ARG 369 CO -0.03 0.50 0.06 -0.06 0.02 0.00 0.00 175.30 175.79 2gag s PHE 370 N -1.23 0.04 0.29 -0.53 0.08 -0.68 -5.00 117.98 110.94 2gag s PHE 370 Ca 0.21 0.24 -0.29 0.00 0.12 0.00 0.00 56.93 57.21 2gag s PHE 370 Cb -0.11 -0.39 -0.09 0.00 -0.57 0.00 0.00 43.02 41.86 2gag s PHE 370 CO 0.13 -0.16 1.08 -1.21 -0.10 0.00 0.00 175.22 174.96 2gag s GLU 371 N 1.83 4.59 -0.08 0.44 0.41 -1.26 -0.99 118.70 123.64 2gag s GLU 371 Ca 0.00 1.75 -0.31 0.00 -0.41 0.00 0.00 54.97 56.01 2gag s GLU 371 Cb -0.12 -3.11 0.09 0.00 -1.78 0.00 0.00 34.13 29.20 2gag s GLU 371 CO -0.03 0.19 0.77 0.00 -0.49 0.00 0.00 175.26 175.70 2gag s ALA 372 N -1.22 -1.82 -1.01 5.21 0.00 -0.47 -4.90 121.76 117.55 2gag s ALA 372 Ca 0.46 1.40 0.17 0.00 0.00 0.00 0.00 51.96 53.99 2gag s ALA 372 Cb -0.30 -0.22 -0.13 0.00 0.00 0.00 0.00 23.12 22.47 2gag s ALA 372 CO 0.39 -0.35 0.75 -0.40 0.00 0.00 0.00 175.76 176.15 2gag n ASP 373 N 0.86 1.05 -3.83 0.00 5.68 0.03 -3.45 116.55 116.90 2gag n ASP 373 Ca -0.16 -1.02 -0.12 0.00 -0.50 0.00 0.00 54.79 52.98 2gag n ASP 373 Cb 0.57 0.84 -0.13 0.00 -1.14 0.00 0.00 41.12 41.27 2gag n ASP 373 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 2gag s VAL 374 N -2.38 -0.00 -0.27 2.12 1.01 -1.18 -4.62 120.40 115.08 2gag s VAL 374 Ca 0.09 0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.09 2gag s VAL 374 Cb 0.13 -0.17 0.07 0.00 0.00 0.00 0.00 36.38 36.41 2gag s VAL 374 CO 0.60 0.00 -0.02 -0.22 0.00 0.00 0.00 175.10 175.46 2gag s LEU 375 N 0.13 3.06 -0.42 3.92 2.96 -0.68 0.15 118.68 127.80 2gag s LEU 375 Ca -0.01 -1.45 -0.25 0.00 -0.22 0.00 0.00 54.13 52.20 2gag s LEU 375 Cb -0.01 -1.27 0.02 0.00 0.50 0.00 0.00 46.19 45.42 2gag s LEU 375 CO -0.00 -0.28 0.88 0.00 -1.32 0.00 0.00 176.35 175.62 2gag s ALA 376 N 1.29 3.32 -0.32 5.97 0.00 0.06 -1.14 121.76 130.95 2gag s ALA 376 Ca -0.01 -0.71 -0.14 0.00 0.00 0.00 0.00 51.96 51.10 2gag s ALA 376 Cb -0.19 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.37 2gag s ALA 376 CO -0.09 -1.81 0.30 0.08 0.00 0.00 0.00 175.76 174.24 2gag s VAL 377 N 3.49 5.22 -0.98 0.00 1.01 0.16 -1.35 120.40 127.95 2gag s VAL 377 Ca 0.35 0.07 -0.04 0.00 0.00 0.00 0.00 61.98 62.36 2gag s VAL 377 Cb -0.11 -3.73 0.25 0.00 0.00 0.00 0.00 36.38 32.79 2gag s VAL 377 CO 0.22 0.02 0.99 0.00 0.00 0.00 0.00 175.10 176.33 2gag n ALA 378 N 5.25 4.16 1.86 5.51 0.00 0.80 -0.84 120.51 137.25 2gag n ALA 378 Ca -0.11 -4.66 0.10 0.00 0.00 0.00 0.00 53.44 48.77 2gag n ALA 378 Cb 0.50 -1.99 0.54 0.00 0.00 0.00 0.00 19.45 18.50 2gag n ALA 378 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gag n GLY 379 N 2.19 -0.76 0.00 0.00 0.00 -0.61 -1.46 105.19 104.56 2gag n GLY 379 Ca 0.24 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2gag n GLY 379 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gag n GLY 380 N 0.87 -0.85 3.06 -0.02 0.00 -1.26 -4.76 105.19 102.23 2gag n GLY 380 Ca 0.15 -2.21 -0.21 0.00 0.00 0.00 0.00 46.02 43.75 2gag n GLY 380 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gag s PHE 381 N -0.32 1.04 -0.39 1.61 0.08 -1.26 -1.29 117.98 117.46 2gag s PHE 381 Ca 0.00 -0.21 -0.04 0.00 0.12 0.00 0.00 56.93 56.80 2gag s PHE 381 Cb 0.00 -0.68 0.09 0.00 -0.57 0.00 0.00 43.02 41.86 2gag s PHE 381 CO 0.00 -0.03 0.17 -0.80 -0.10 0.00 0.00 175.22 174.46 2gag s ASN 382 N -0.22 5.26 0.23 1.36 0.02 0.71 -4.74 114.94 117.55 2gag s ASN 382 Ca 0.04 -1.74 -0.30 0.00 -1.02 0.00 0.00 52.86 49.83 2gag s ASN 382 Cb -0.05 -1.84 -0.15 0.00 0.02 0.00 0.00 41.25 39.24 2gag s ASN 382 CO -0.00 -0.48 1.10 -2.65 0.02 0.00 0.00 177.10 175.10 2gag n PRO 383 N 4.67 1.30 -2.67 -0.60 -0.02 -1.26 -0.94 135.00 135.48 2gag n PRO 383 Ca -0.06 0.46 -0.42 0.00 -2.02 0.00 0.00 63.50 61.45 2gag n PRO 383 Cb 0.42 -1.91 -0.02 0.00 -0.02 0.00 0.00 33.50 31.98 2gag n PRO 383 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2gag s VAL 384 N -0.57 4.21 -2.63 -1.45 1.01 0.45 -4.76 120.40 116.65 2gag s VAL 384 Ca 0.66 -1.33 0.26 0.00 0.00 0.00 0.00 61.98 61.58 2gag s VAL 384 Cb -0.77 -5.02 0.39 0.00 0.00 0.00 0.00 36.38 30.98 2gag s VAL 384 CO 0.55 -1.85 1.54 1.33 0.00 0.00 0.00 175.10 176.68 2gag n VAL 385 N 6.32 0.00 -0.34 2.92 0.24 -1.26 -4.69 118.33 121.52 2gag n VAL 385 Ca 0.35 -0.34 -0.07 0.00 -2.04 0.00 0.00 64.34 62.25 2gag n VAL 385 Cb 0.49 0.88 -0.05 0.00 -1.47 0.00 0.00 33.84 33.69 2gag n VAL 385 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2gag n HIS 386 N 0.56 -0.25 0.25 6.34 8.25 -1.26 -0.54 115.22 128.57 2gag n HIS 386 Ca 0.17 1.05 0.11 0.00 -0.26 0.00 0.00 57.72 58.78 2gag n HIS 386 Cb 0.45 -0.64 0.64 0.00 1.12 0.00 0.00 29.99 31.56 2gag n HIS 386 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2gag h LEU 387 N 0.00 0.00 -0.03 2.41 3.38 -1.95 -0.86 115.31 118.25 2gag h LEU 387 Ca 0.18 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 2gag h LEU 387 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2gag h LEU 387 CO -0.80 0.16 -0.09 -0.74 0.09 0.00 0.00 178.44 177.06 2gag h HIS 388 N 0.00 0.16 0.00 1.13 2.76 -1.16 -3.19 115.15 114.85 2gag h HIS 388 Ca -0.00 -0.06 -0.04 0.00 -2.20 0.00 0.00 60.37 58.07 2gag h HIS 388 Cb 0.43 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.35 2gag h HIS 388 CO 0.00 0.71 -0.20 0.77 -1.30 0.00 0.00 177.93 177.91 2gag h SER 389 N -0.44 0.00 0.30 3.26 0.02 -1.01 -0.35 113.55 115.33 2gag h SER 389 Ca -0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 2gag h SER 389 Cb 0.70 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.24 2gag h SER 389 CO 0.02 0.20 -0.09 1.56 -1.14 0.00 0.00 176.83 177.38 2gag h GLN 390 N 0.00 0.00 -0.69 3.45 4.20 -1.14 -0.34 115.11 120.58 2gag h GLN 390 Ca -0.00 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.58 2gag h GLN 390 Cb 0.41 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.12 2gag h GLN 390 CO 0.03 0.09 0.16 0.54 -0.67 0.00 0.00 178.83 178.98 2gag n ARG 391 N -3.66 4.18 -1.51 1.46 5.12 -0.83 -4.89 116.66 116.53 2gag n ARG 391 Ca -0.02 -3.05 -0.16 0.00 -1.93 0.00 0.00 57.85 52.70 2gag n ARG 391 Cb 0.20 -2.23 -0.06 0.00 -1.16 0.00 0.00 32.46 29.21 2gag n ARG 391 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2gag n GLN 392 N 0.18 -1.10 -1.83 5.56 3.00 -0.14 -4.97 117.38 118.09 2gag n GLN 392 Ca 0.35 1.03 -0.39 0.00 -0.01 0.00 0.00 57.00 57.98 2gag n GLN 392 Cb 1.30 -5.21 0.03 0.00 0.00 0.00 0.00 30.24 26.35 2gag n GLN 392 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 2gag s GLY 393 N -2.80 2.90 0.50 1.08 0.00 -0.20 -4.96 107.32 103.84 2gag s GLY 393 Ca 0.00 1.37 -0.03 0.00 0.00 0.00 0.00 44.72 46.06 2gag s GLY 393 CO 0.00 1.93 0.77 0.54 0.00 0.00 0.00 173.10 176.34 2gag s LYS 394 N -2.65 3.08 0.04 2.90 1.02 -1.26 -4.36 119.74 118.51 2gag s LYS 394 Ca 0.66 -0.22 0.07 0.00 0.02 0.00 0.00 55.97 56.50 2gag s LYS 394 Cb -0.41 -2.43 -0.02 0.00 -0.52 0.00 0.00 37.83 34.44 2gag s LYS 394 CO 0.51 -0.41 -0.19 -0.51 -0.92 0.00 0.00 175.35 173.82 2gag s LEU 395 N -4.73 2.16 0.12 3.17 1.43 -1.26 -0.70 118.68 118.86 2gag s LEU 395 Ca 0.50 -0.50 0.08 0.00 -1.03 0.00 0.00 54.13 53.18 2gag s LEU 395 Cb -0.10 -0.91 -0.04 0.00 0.03 0.00 0.00 46.19 45.17 2gag s LEU 395 CO 0.41 0.14 -0.11 -1.81 0.23 0.00 0.00 176.35 175.22 2gag s ASP 396 N -1.13 4.31 -0.24 2.29 1.01 0.14 -4.79 116.67 118.26 2gag s ASP 396 Ca 0.06 -0.44 -0.20 0.00 0.71 0.00 0.00 52.55 52.68 2gag s ASP 396 Cb -0.09 -0.78 -0.02 0.00 1.01 0.00 0.00 42.92 43.04 2gag s ASP 396 CO 0.02 0.16 0.63 0.86 0.21 0.00 0.00 175.17 177.05 2gag s TRP 397 N -1.29 3.31 -0.22 4.23 -0.11 -1.26 -0.05 118.94 123.55 2gag s TRP 397 Ca 0.22 0.85 -0.19 0.00 1.22 0.00 0.00 56.10 58.19 2gag s TRP 397 Cb -0.11 -2.83 -0.03 0.00 -1.50 0.00 0.00 33.47 29.01 2gag s TRP 397 CO 0.14 -0.28 0.58 0.34 -4.62 0.00 0.00 176.95 173.11 2gag s ASP 398 N 1.38 6.58 0.00 5.86 -1.08 0.12 -4.95 116.67 124.58 2gag s ASP 398 Ca 0.27 0.70 0.21 0.00 -0.52 0.00 0.00 52.55 53.20 2gag s ASP 398 Cb -0.16 -2.32 0.81 0.00 -1.46 0.00 0.00 42.92 39.80 2gag s ASP 398 CO 0.09 -0.27 1.58 0.35 0.52 0.00 0.00 175.17 177.43 2gag n THR 399 N 4.86 0.17 -0.07 1.71 -2.24 -1.26 -1.08 114.28 116.36 2gag n THR 399 Ca -0.03 -0.29 -0.21 0.00 -2.27 0.00 0.00 64.05 61.25 2gag n THR 399 Cb 0.50 0.27 -0.12 0.00 -2.10 0.00 0.00 70.33 68.87 2gag n THR 399 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2gag n THR 400 N 0.14 1.62 0.76 4.28 -1.04 -1.26 -4.42 114.28 114.36 2gag n THR 400 Ca 0.16 -0.50 0.09 0.00 -2.04 0.00 0.00 64.05 61.75 2gag n THR 400 Cb 0.29 -1.70 0.02 0.00 -1.82 0.00 0.00 70.33 67.12 2gag n THR 400 CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 2gag n ILE 401 N -3.64 0.00 -3.40 12.58 -5.35 -1.25 -3.97 119.36 114.32 2gag n ILE 401 Ca -0.39 -0.38 -0.16 0.00 -0.27 0.00 0.00 62.75 61.54 2gag n ILE 401 Cb 0.96 1.26 0.03 0.00 -1.74 0.00 0.00 39.64 40.15 2gag n ILE 401 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 2gag n HIS 402 N 0.28 -2.41 -3.60 4.28 8.25 -0.24 -4.72 115.22 117.05 2gag n HIS 402 Ca 0.08 0.83 -0.10 0.00 -0.26 0.00 0.00 57.72 58.27 2gag n HIS 402 Cb 0.39 -3.71 -0.02 0.00 1.12 0.00 0.00 29.99 27.77 2gag n HIS 402 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2gag s ALA 403 N -3.22 -1.41 -0.08 -1.41 0.00 -1.03 -4.93 121.76 109.67 2gag s ALA 403 Ca 0.24 0.15 -0.27 0.00 0.00 0.00 0.00 51.96 52.08 2gag s ALA 403 Cb -0.06 0.87 -0.02 0.00 0.00 0.00 0.00 23.12 23.90 2gag s ALA 403 CO 0.80 -0.87 0.88 -0.06 0.00 0.00 0.00 175.76 176.51 2gag s PHE 404 N -3.82 3.54 0.27 0.00 0.08 -1.26 0.16 117.98 116.95 2gag s PHE 404 Ca 0.05 1.45 0.11 0.00 0.12 0.00 0.00 56.93 58.66 2gag s PHE 404 Cb -0.03 -3.03 -0.05 0.00 -0.57 0.00 0.00 43.02 39.34 2gag s PHE 404 CO -0.05 -0.10 -0.18 0.14 -0.10 0.00 0.00 175.22 174.93 2gag s VAL 405 N 1.49 2.28 0.40 -0.44 -7.23 0.93 -4.25 120.40 113.58 2gag s VAL 405 Ca 0.44 -2.35 -0.25 0.00 -1.81 0.00 0.00 61.98 58.02 2gag s VAL 405 Cb -0.18 -2.26 -0.09 0.00 0.56 0.00 0.00 36.38 34.41 2gag s VAL 405 CO 0.19 -0.43 1.08 -2.16 -0.31 0.00 0.00 175.10 173.47 2gag s PRO 406 N -3.55 4.15 0.00 4.82 0.04 -1.26 0.28 135.00 139.47 2gag s PRO 406 Ca 0.28 1.61 0.00 0.00 0.04 0.00 0.00 61.00 62.94 2gag s PRO 406 Cb -0.03 -2.60 0.00 0.00 0.04 0.00 0.00 34.50 31.90 2gag s PRO 406 CO 0.13 -0.18 0.00 0.00 0.04 0.00 0.00 177.00 176.99 2gag n ALA 407 N 0.02 0.00 -1.78 8.56 0.00 0.12 -4.61 120.51 122.82 2gag n ALA 407 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.08 2gag n ALA 407 Cb 0.49 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.92 2gag n ALA 407 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2gag s ASP 408 N -1.00 6.54 0.68 0.00 1.01 -1.26 -4.95 116.67 117.68 2gag s ASP 408 Ca 0.00 2.88 -0.17 0.00 0.71 0.00 0.00 52.55 55.97 2gag s ASP 408 Cb 0.00 -2.66 0.01 0.00 1.01 0.00 0.00 42.92 41.28 2gag s ASP 408 CO 0.00 -0.72 1.25 0.00 0.21 0.00 0.00 175.17 175.90 2gag s ALA 409 N -1.05 2.28 0.68 5.23 0.00 -1.26 -4.52 121.76 123.12 2gag s ALA 409 Ca 0.52 1.06 -0.14 0.00 0.00 0.00 0.00 51.96 53.39 2gag s ALA 409 Cb -0.43 -3.51 0.01 0.00 0.00 0.00 0.00 23.12 19.19 2gag s ALA 409 CO 0.58 -1.68 1.12 0.08 0.00 0.00 0.00 175.76 175.86 2gag s VAL 410 N -1.66 3.17 0.22 0.00 1.01 -1.26 -4.90 120.40 116.98 2gag s VAL 410 Ca 0.79 0.52 -0.31 0.00 0.00 0.00 0.00 61.98 62.98 2gag s VAL 410 Cb -0.33 -3.04 -0.15 0.00 0.00 0.00 0.00 36.38 32.86 2gag s VAL 410 CO 0.41 -0.36 1.18 0.00 0.00 0.00 0.00 175.10 176.34 2gag n ALA 411 N -2.58 -0.16 -2.12 5.51 0.00 -1.26 -1.34 120.51 118.55 2gag n ALA 411 Ca 0.10 0.43 -0.19 0.00 0.00 0.00 0.00 53.44 53.78 2gag n ALA 411 Cb 0.52 -2.09 -0.03 0.00 0.00 0.00 0.00 19.45 17.85 2gag n ALA 411 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2gag n ASN 412 N 1.83 -5.35 -4.34 0.00 5.03 -1.26 -4.91 115.26 106.26 2gag n ASN 412 Ca 0.13 0.18 -0.19 0.00 0.87 0.00 0.00 54.58 55.57 2gag n ASN 412 Cb 0.28 -4.56 -0.10 0.00 -1.02 0.00 0.00 39.78 34.38 2gag n ASN 412 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 2gag s GLN 413 N -4.56 1.31 0.02 3.52 -0.21 -0.45 -1.53 119.66 117.75 2gag s GLN 413 Ca 0.00 -1.56 0.00 0.00 0.02 0.00 0.00 55.36 53.82 2gag s GLN 413 Cb 0.00 -1.11 -0.02 0.00 1.00 0.00 0.00 33.01 32.88 2gag s GLN 413 CO 0.00 0.19 -0.03 -1.01 -2.12 0.00 0.00 175.29 172.32 2gag s HIS 414 N -2.89 0.25 -0.07 0.91 3.76 0.31 -4.60 115.29 112.95 2gag s HIS 414 Ca 0.21 -0.49 0.05 0.00 -0.15 0.00 0.00 55.06 54.69 2gag s HIS 414 Cb -0.01 -0.18 -0.01 0.00 1.11 0.00 0.00 32.58 33.49 2gag s HIS 414 CO 0.06 -0.17 -0.24 -0.51 -0.85 0.00 0.00 174.74 173.03 2gag s LEU 415 N -1.34 2.06 0.01 0.89 1.43 -1.26 -0.96 118.68 119.50 2gag s LEU 415 Ca -0.15 -0.52 -0.06 0.00 -1.03 0.00 0.00 54.13 52.38 2gag s LEU 415 Cb -0.09 -1.36 -0.00 0.00 0.03 0.00 0.00 46.19 44.77 2gag s LEU 415 CO -0.01 0.20 0.11 0.00 0.23 0.00 0.00 176.35 176.88 2gag s ALA 416 N 0.05 -0.24 0.00 4.21 0.00 -0.50 -4.92 121.76 120.36 2gag s ALA 416 Ca -0.10 -0.21 0.00 0.00 0.00 0.00 0.00 51.96 51.65 2gag s ALA 416 Cb -0.15 0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.08 2gag s ALA 416 CO 0.06 -0.20 0.00 0.41 0.00 0.00 0.00 175.76 176.03 2gag n GLY 417 N 1.50 -1.23 0.34 0.00 0.00 -1.26 -4.20 105.19 100.34 2gag n GLY 417 Ca -0.23 -1.36 0.23 0.00 0.00 0.00 0.00 46.02 44.66 2gag n GLY 417 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gag h ALA 418 N 0.00 1.03 0.00 4.61 0.00 -1.86 -0.85 119.26 122.19 2gag h ALA 418 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2gag h ALA 418 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2gag h ALA 418 CO 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 2gag n MET 419 N -3.12 0.12 0.00 0.00 -0.00 -1.18 -1.40 117.12 111.55 2gag n MET 419 Ca -0.03 0.37 0.12 0.00 -0.00 0.00 0.00 57.70 58.16 2gag n MET 419 Cb 0.07 -1.74 0.28 0.00 -0.00 0.00 0.00 33.22 31.83 2gag n MET 419 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 2gag n THR 420 N -1.98 0.00 -0.00 3.17 -2.24 -0.32 -4.33 114.28 108.58 2gag n THR 420 Ca 0.02 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 2gag n THR 420 Cb 0.20 0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 2gag n THR 420 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gag n GLY 421 N 1.42 0.11 3.55 3.38 0.00 -0.50 -4.71 105.19 108.44 2gag n GLY 421 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2gag n GLY 421 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gag s ARG 422 N -1.00 3.56 -0.02 1.61 0.52 -1.26 -4.93 118.95 117.44 2gag s ARG 422 Ca 0.00 -0.08 0.18 0.00 -0.52 0.00 0.00 55.73 55.31 2gag s ARG 422 Cb 0.00 -3.85 0.53 0.00 0.52 0.00 0.00 34.95 32.15 2gag s ARG 422 CO 0.00 -0.82 1.44 1.28 0.02 0.00 0.00 175.30 177.22 2gag n LEU 423 N 6.11 3.30 -4.91 2.53 4.77 -1.26 -3.40 117.00 124.14 2gag n LEU 423 Ca -0.01 -1.65 -0.26 0.00 -0.03 0.00 0.00 56.01 54.05 2gag n LEU 423 Cb 0.48 -0.42 -0.04 0.00 -2.33 0.00 0.00 43.42 41.12 2gag n LEU 423 CO 0.50 0.77 -0.13 1.51 -1.33 0.00 0.00 177.39 178.71 2gag s ASP 424 N -0.97 6.13 0.15 -1.43 -4.77 -1.26 -4.98 116.67 109.54 2gag s ASP 424 Ca 0.40 0.10 -0.14 0.00 -3.30 0.00 0.00 52.55 49.60 2gag s ASP 424 Cb 0.22 -1.79 0.03 0.00 -1.09 0.00 0.00 42.92 40.28 2gag s ASP 424 CO 0.26 0.06 1.70 0.74 0.70 0.00 0.00 175.17 178.63 2gag h THR 425 N 1.74 1.21 -0.51 2.11 2.02 -1.93 -2.51 112.91 115.04 2gag h THR 425 Ca -0.48 -0.64 0.09 0.00 0.77 0.00 0.00 66.41 66.15 2gag h THR 425 Cb 1.20 0.73 -0.08 0.00 -1.74 0.00 0.00 68.15 68.26 2gag h THR 425 CO 0.67 0.24 0.07 0.00 0.37 0.00 0.00 175.52 176.87 2gag h ALA 426 N 1.04 0.54 0.00 6.16 0.00 -1.87 -0.26 119.26 124.88 2gag h ALA 426 Ca 0.16 0.12 -0.10 0.00 0.00 0.00 0.00 54.91 55.09 2gag h ALA 426 Cb 0.19 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2gag h ALA 426 CO -0.01 -0.34 -0.49 0.66 0.00 0.00 0.00 179.25 179.07 2gag h SER 427 N 0.20 0.00 -0.51 0.00 4.64 -1.93 -0.45 113.55 115.50 2gag h SER 427 Ca 0.26 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.54 2gag h SER 427 Cb 0.36 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 2gag h SER 427 CO -0.36 0.49 0.18 0.00 -0.87 0.00 0.00 176.83 176.26 2gag h ALA 428 N 1.51 0.66 -0.30 5.18 0.00 -0.86 0.57 119.26 126.02 2gag h ALA 428 Ca -0.00 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 2gag h ALA 428 Cb 1.13 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2gag h ALA 428 CO 0.06 0.30 -0.11 -0.07 0.00 0.00 0.00 179.25 179.44 2gag h LEU 429 N 0.69 0.62 -0.19 0.00 3.38 -0.85 0.17 115.31 119.12 2gag h LEU 429 Ca 0.17 -0.39 -0.07 0.00 0.09 0.00 0.00 57.88 57.68 2gag h LEU 429 Cb 0.25 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 2gag h LEU 429 CO -0.01 0.86 -0.14 0.77 0.09 0.00 0.00 178.44 180.01 2gag h SER 430 N 0.37 0.46 -0.19 -0.43 4.64 -0.97 -0.83 113.55 116.59 2gag h SER 430 Ca 0.07 -0.45 -0.10 0.00 -0.47 0.00 0.00 61.79 60.84 2gag h SER 430 Cb 0.61 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.56 2gag h SER 430 CO 0.04 0.81 -0.20 0.71 -0.87 0.00 0.00 176.83 177.32 2gag h THR 431 N 0.11 1.26 -0.08 2.95 1.35 -0.94 -0.01 112.91 117.55 2gag h THR 431 Ca 0.04 -1.25 -0.01 0.00 -0.55 0.00 0.00 66.41 64.65 2gag h THR 431 Cb 0.66 1.22 -0.00 0.00 -1.73 0.00 0.00 68.15 68.30 2gag h THR 431 CO 0.04 0.41 0.03 1.23 -0.25 0.00 0.00 175.52 176.98 2gag h GLY 432 N 0.99 0.13 0.91 5.82 0.00 -0.89 -0.23 103.07 109.79 2gag h GLY 432 Ca 0.09 -0.07 0.02 0.00 0.00 0.00 0.00 47.33 47.36 2gag h GLY 432 CO 0.05 0.07 0.18 0.00 0.00 0.00 0.00 176.54 176.84 2gag h ALA 433 N 0.86 0.41 -0.34 3.60 0.00 -0.94 -0.55 119.26 122.29 2gag h ALA 433 Ca 0.03 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2gag h ALA 433 Cb 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2gag h ALA 433 CO -0.00 -0.18 0.11 0.00 0.00 0.00 0.00 179.25 179.18 2gag h ALA 434 N 1.15 0.45 -0.48 0.00 0.00 -0.91 -2.12 119.26 117.36 2gag h ALA 434 Ca 0.13 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 2gag h ALA 434 Cb 0.01 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2gag h ALA 434 CO -0.07 0.09 -0.13 1.79 0.00 0.00 0.00 179.25 180.93 2gag h THR 435 N 0.40 1.27 -0.78 0.00 1.35 -0.90 -0.07 112.91 114.17 2gag h THR 435 Ca 0.11 -1.25 -0.01 0.00 -0.55 0.00 0.00 66.41 64.71 2gag h THR 435 Cb 0.25 1.03 -0.04 0.00 -1.73 0.00 0.00 68.15 67.67 2gag h THR 435 CO -0.00 0.43 0.45 1.23 -0.25 0.00 0.00 175.52 177.38 2gag h GLY 436 N 0.96 1.15 1.05 5.82 0.00 -1.00 0.18 103.07 111.23 2gag h GLY 436 Ca 0.13 -0.50 -0.13 0.00 0.00 0.00 0.00 47.33 46.82 2gag h GLY 436 CO 0.05 0.48 -0.29 0.00 0.00 0.00 0.00 176.54 176.78 2gag h ALA 437 N 1.24 0.53 -0.72 3.60 0.00 -1.18 -2.23 119.26 120.50 2gag h ALA 437 Ca 0.28 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 2gag h ALA 437 Cb -0.01 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2gag h ALA 437 CO -0.05 0.56 0.17 0.00 0.00 0.00 0.00 179.25 179.94 2gag h ALA 438 N 0.77 0.94 -0.03 0.00 0.00 -0.59 -1.05 119.26 119.31 2gag h ALA 438 Ca 0.07 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2gag h ALA 438 Cb 0.87 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2gag h ALA 438 CO 0.08 0.67 0.01 0.00 0.00 0.00 0.00 179.25 180.01 2gag h ALA 439 N 1.09 0.03 -0.58 0.00 0.00 -0.60 0.11 119.26 119.32 2gag h ALA 439 Ca 0.22 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2gag h ALA 439 Cb 0.38 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 2gag h ALA 439 CO 0.00 -0.36 0.38 0.00 0.00 0.00 0.00 179.25 179.27 2gag h ALA 440 N 0.81 0.74 -0.42 0.00 0.00 -1.30 -0.91 119.26 118.18 2gag h ALA 440 Ca 0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2gag h ALA 440 Cb 0.20 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2gag h ALA 440 CO -0.00 0.18 0.24 1.15 0.00 0.00 0.00 179.25 180.82 2gag h THR 441 N 0.79 1.15 0.00 0.00 2.02 -1.03 0.23 112.91 116.07 2gag h THR 441 Ca 0.21 -0.36 -0.02 0.00 0.77 0.00 0.00 66.41 67.02 2gag h THR 441 Cb -0.08 0.63 -0.00 0.00 -1.74 0.00 0.00 68.15 66.95 2gag h THR 441 CO -0.04 0.15 -0.10 0.00 0.37 0.00 0.00 175.52 175.90 2gag h ALA 442 N 1.10 1.31 -0.01 6.16 0.00 -0.54 -0.43 119.26 126.84 2gag h ALA 442 Ca 0.15 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2gag h ALA 442 Cb 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2gag h ALA 442 CO -0.03 0.12 -0.00 0.00 0.00 0.00 0.00 179.25 179.34 2gag n ALA 443 N -2.28 2.62 -0.04 0.00 0.00 -0.38 -4.89 120.51 115.54 2gag n ALA 443 Ca -0.02 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.08 2gag n ALA 443 Cb 0.21 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.35 2gag n ALA 443 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gag n GLY 444 N 1.10 0.98 2.64 0.00 0.00 -0.17 -5.03 105.19 104.70 2gag n GLY 444 Ca 0.21 -0.02 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 2gag n GLY 444 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2gag n PHE 445 N -2.04 2.29 -1.65 1.61 3.72 0.74 -4.98 117.46 117.14 2gag n PHE 445 Ca 0.00 -4.03 -0.45 0.00 -0.05 0.00 0.00 57.45 52.92 2gag n PHE 445 Cb 0.00 -0.43 -0.02 0.00 -0.94 0.00 0.00 39.48 38.09 2gag n PHE 445 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2gag n ALA 446 N 1.81 0.69 -3.52 4.37 0.00 -1.26 -3.08 120.51 119.52 2gag n ALA 446 Ca 0.24 0.40 -0.14 0.00 0.00 0.00 0.00 53.44 53.95 2gag n ALA 446 Cb 0.40 -2.19 -0.05 0.00 0.00 0.00 0.00 19.45 17.61 2gag n ALA 446 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2gag s THR 447 N -0.53 0.00 -0.17 0.00 -1.32 -1.26 -4.91 115.64 107.45 2gag s THR 447 Ca 0.64 0.00 -0.06 0.00 -1.21 0.00 0.00 61.69 61.05 2gag s THR 447 Cb -0.66 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.29 2gag s THR 447 CO 0.55 0.00 0.03 -0.69 -2.21 0.00 0.00 174.62 172.30 2gag s VAL 448 N -1.73 4.52 0.28 5.08 1.01 -1.26 -4.79 120.40 123.52 2gag s VAL 448 Ca -0.04 -0.13 -0.30 0.00 0.00 0.00 0.00 61.98 61.50 2gag s VAL 448 Cb -0.00 -3.02 -0.11 0.00 0.00 0.00 0.00 36.38 33.25 2gag s VAL 448 CO 0.02 0.48 1.56 0.00 0.00 0.00 0.00 175.10 177.16 2gag s ALA 449 N 0.32 3.72 -0.29 5.51 0.00 -1.26 -5.00 121.76 124.76 2gag s ALA 449 Ca 0.01 1.52 -0.09 0.00 0.00 0.00 0.00 51.96 53.40 2gag s ALA 449 Cb -0.13 -3.63 -0.02 0.00 0.00 0.00 0.00 23.12 19.34 2gag s ALA 449 CO 0.01 -0.93 0.14 1.03 0.00 0.00 0.00 175.76 176.01 2gag s ARG 450 N -0.46 3.51 -0.30 0.00 3.00 -1.26 -5.03 118.95 118.41 2gag s ARG 450 Ca 0.62 -0.60 -0.18 0.00 0.00 0.00 0.00 55.73 55.58 2gag s ARG 450 Cb -0.46 -3.52 -0.02 0.00 0.00 0.00 0.00 34.95 30.94 2gag s ARG 450 CO 0.47 -0.32 0.50 0.99 0.00 0.00 0.00 175.30 176.94 2gag s THR 451 N 1.64 5.05 0.40 0.02 2.01 -1.26 -4.89 115.64 118.61 2gag s THR 451 Ca 0.05 0.60 -0.27 0.00 0.31 0.00 0.00 61.69 62.39 2gag s THR 451 Cb -0.16 -3.88 -0.10 0.00 0.01 0.00 0.00 72.50 68.37 2gag s THR 451 CO 0.06 -0.05 1.45 -2.84 -0.69 0.00 0.00 174.62 172.55 2gag s PRO 452 N 2.34 3.97 -0.14 4.92 0.02 -1.26 -4.98 135.00 139.86 2gag s PRO 452 Ca 0.19 2.48 -0.08 0.00 0.02 0.00 0.00 61.00 63.62 2gag s PRO 452 Cb -0.15 -2.86 -0.04 0.00 0.02 0.00 0.00 34.50 31.47 2gag s PRO 452 CO 0.11 -0.61 0.13 -0.65 -0.33 0.00 0.00 177.00 175.65 2gag s GLN 453 N -2.21 3.64 0.06 5.54 -1.52 -1.26 -4.61 119.66 119.31 2gag s GLN 453 Ca 0.56 -0.17 -0.09 0.00 -1.95 0.00 0.00 55.36 53.71 2gag s GLN 453 Cb -0.45 -3.24 0.00 0.00 -0.22 0.00 0.00 33.01 29.10 2gag s GLN 453 CO 0.60 0.64 0.19 0.00 -0.25 0.00 0.00 175.29 176.46 2gag s ALA 454 N -0.62 -0.29 0.29 6.09 0.00 -1.26 -0.50 121.76 125.48 2gag s ALA 454 Ca 0.13 -0.45 -0.30 0.00 0.00 0.00 0.00 51.96 51.34 2gag s ALA 454 Cb -0.12 0.38 -0.11 0.00 0.00 0.00 0.00 23.12 23.26 2gag s ALA 454 CO 0.02 -0.43 1.61 -0.51 0.00 0.00 0.00 175.76 176.45 2gag s LEU 455 N -2.46 4.34 0.43 0.00 1.02 -1.26 -4.79 118.68 115.96 2gag s LEU 455 Ca -0.00 2.97 -0.24 0.00 0.02 0.00 0.00 54.13 56.88 2gag s LEU 455 Cb 0.02 -3.63 -0.08 0.00 0.02 0.00 0.00 46.19 42.51 2gag s LEU 455 CO -0.07 -0.93 1.14 -1.83 0.02 0.00 0.00 176.35 174.67 2gag s GLU 456 N -0.46 3.94 0.05 1.70 -1.05 -1.26 -4.50 118.70 117.11 2gag s GLU 456 Ca 0.64 1.72 -0.01 0.00 -0.15 0.00 0.00 54.97 57.17 2gag s GLU 456 Cb -0.48 -2.51 -0.04 0.00 -0.44 0.00 0.00 34.13 30.66 2gag s GLU 456 CO 0.48 -0.39 0.22 0.99 0.95 0.00 0.00 175.26 177.51 2gag s THR 457 N -1.54 5.38 0.11 1.83 2.01 -1.26 -5.06 115.64 117.10 2gag s THR 457 Ca 0.60 -0.30 -0.31 0.00 0.31 0.00 0.00 61.69 62.00 2gag s THR 457 Cb -0.27 -3.61 -0.08 0.00 0.01 0.00 0.00 72.50 68.54 2gag s THR 457 CO 0.34 0.17 1.45 0.00 -0.69 0.00 0.00 174.62 175.89 2gag s ALA 458 N -1.48 3.64 0.12 7.40 0.00 -1.26 -4.92 121.76 125.26 2gag s ALA 458 Ca 0.34 1.16 -0.31 0.00 0.00 0.00 0.00 51.96 53.14 2gag s ALA 458 Cb -0.13 -3.57 -0.10 0.00 0.00 0.00 0.00 23.12 19.31 2gag s ALA 458 CO 0.26 -0.72 1.81 -1.17 0.00 0.00 0.00 175.76 175.94 2gag s LEU 459 N 1.37 4.40 0.22 0.00 2.96 -1.26 -4.96 118.68 121.41 2gag s LEU 459 Ca 0.66 2.74 0.07 0.00 -0.22 0.00 0.00 54.13 57.39 2gag s LEU 459 Cb -0.38 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.70 2gag s LEU 459 CO 0.30 -1.00 0.09 -0.83 -1.32 0.00 0.00 176.35 173.60 2gag s GLY 460 N 2.66 1.60 -0.02 7.98 0.00 -1.26 -5.06 107.32 113.22 2gag s GLY 460 Ca 0.80 -1.42 -0.06 0.00 0.00 0.00 0.00 44.72 44.04 2gag s GLY 460 CO 0.36 -1.45 0.24 1.85 0.00 0.00 0.00 173.10 174.09 2gag s GLU 461 N -3.44 3.55 -0.09 2.90 2.12 -1.26 -4.99 118.70 117.49 2gag s GLU 461 Ca 0.31 -0.11 0.02 0.00 0.36 0.00 0.00 54.97 55.55 2gag s GLU 461 Cb -0.08 -3.11 0.01 0.00 0.26 0.00 0.00 34.13 31.21 2gag s GLU 461 CO 0.22 0.68 -0.15 0.99 -0.54 0.00 0.00 175.26 176.46 2gag s THR 462 N -1.25 1.38 -0.17 -1.70 2.01 -1.25 -4.37 115.64 110.29 2gag s THR 462 Ca 0.25 -0.60 -0.14 0.00 0.31 0.00 0.00 61.69 61.51 2gag s THR 462 Cb -0.13 -1.25 -0.04 0.00 0.01 0.00 0.00 72.50 71.08 2gag s THR 462 CO 0.14 0.41 0.32 -0.60 -0.69 0.00 0.00 174.62 174.21 2gag s ARG 463 N 0.76 4.25 -0.05 4.92 3.52 -0.68 -4.88 118.95 126.79 2gag s ARG 463 Ca -0.12 0.13 -0.30 0.00 -0.13 0.00 0.00 55.73 55.31 2gag s ARG 463 Cb -0.16 -3.45 -0.02 0.00 -1.56 0.00 0.00 34.95 29.76 2gag s ARG 463 CO 0.02 0.18 1.02 -1.25 -0.81 0.00 0.00 175.30 174.47 2gag s PRO 464 N 0.62 4.47 -0.41 5.12 0.04 -1.26 -4.86 135.00 138.72 2gag s PRO 464 Ca 0.17 1.45 0.02 0.00 0.04 0.00 0.00 61.00 62.68 2gag s PRO 464 Cb -0.13 -3.50 0.13 0.00 0.04 0.00 0.00 34.50 31.03 2gag s PRO 464 CO 0.05 -0.22 0.20 0.08 0.04 0.00 0.00 177.00 177.15 2gag s VAL 465 N 1.58 1.37 -0.19 -0.36 1.01 -1.26 -4.98 120.40 117.58 2gag s VAL 465 Ca 0.51 -2.35 0.19 0.00 0.00 0.00 0.00 61.98 60.33 2gag s VAL 465 Cb -0.20 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 2gag s VAL 465 CO 0.23 -0.84 1.04 -0.50 0.00 0.00 0.00 175.10 175.03 2gag h TRP 466 N 7.02 0.00 -1.04 5.22 -0.00 -1.93 -3.42 115.95 121.80 2gag h TRP 466 Ca -0.04 0.00 0.02 0.00 -0.00 0.00 0.00 58.89 58.88 2gag h TRP 466 Cb 0.95 0.00 -0.21 0.00 -0.00 0.00 0.00 29.16 29.89 2gag h TRP 466 CO 0.46 0.34 -0.38 -1.17 -0.00 0.00 0.00 178.44 177.69 2gag s LEU 467 N -5.77 -1.57 -0.03 -4.49 0.20 -1.26 -4.17 118.68 101.58 2gag s LEU 467 Ca -0.00 0.23 -0.30 0.00 0.69 0.00 0.00 54.13 54.74 2gag s LEU 467 Cb 0.09 2.00 -0.04 0.00 -0.43 0.00 0.00 46.19 47.81 2gag s LEU 467 CO 0.79 -0.30 1.25 -0.69 -0.29 0.00 0.00 176.35 177.11 2gag s VAL 468 N 2.82 4.09 0.82 1.68 1.01 -0.69 -4.98 120.40 125.14 2gag s VAL 468 Ca 0.11 1.44 -0.12 0.00 0.00 0.00 0.00 61.98 63.41 2gag s VAL 468 Cb -0.11 -3.93 0.09 0.00 0.00 0.00 0.00 36.38 32.44 2gag s VAL 468 CO -0.26 0.01 1.17 -2.84 0.00 0.00 0.00 175.10 173.18 2gag s PRO 469 N 2.12 1.66 0.15 2.72 0.02 -1.26 -4.65 135.00 135.76 2gag s PRO 469 Ca 0.58 1.60 -0.23 0.00 0.02 0.00 0.00 61.00 62.97 2gag s PRO 469 Cb -0.27 -1.79 -0.08 0.00 0.02 0.00 0.00 34.50 32.38 2gag s PRO 469 CO 0.24 -2.17 0.72 0.45 -0.33 0.00 0.00 177.00 175.91 2gag s SER 470 N -2.47 7.28 0.44 2.53 0.15 -1.26 -4.83 113.70 115.54 2gag s SER 470 Ca 0.69 1.53 0.10 0.00 0.70 0.00 0.00 55.95 58.98 2gag s SER 470 Cb -0.25 -2.46 0.99 0.00 -1.71 0.00 0.00 66.02 62.59 2gag s SER 470 CO 0.52 0.21 2.07 0.58 1.20 0.00 0.00 173.24 177.82 2gag h VAL 471 N 3.31 1.04 0.00 4.45 2.07 -1.94 -1.79 116.25 123.40 2gag h VAL 471 Ca -0.48 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 66.91 2gag h VAL 471 Cb 1.21 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 2gag h VAL 471 CO 0.65 0.07 0.00 -1.20 0.02 0.00 0.00 177.57 177.11 2gag n SER 472 N -4.49 0.00 0.00 0.57 7.64 -1.26 -4.99 113.62 111.09 2gag n SER 472 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.91 2gag n SER 472 Cb 0.12 -0.26 0.00 0.00 -1.01 0.00 0.00 64.21 63.06 2gag n SER 472 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gag n GLY 473 N 0.11 -0.07 0.23 0.23 0.00 -0.67 -4.82 105.19 100.19 2gag n GLY 473 Ca 0.08 -2.27 0.13 0.00 0.00 0.00 0.00 46.02 43.96 2gag n GLY 473 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2gag n ASP 474 N 0.00 1.02 -4.77 1.61 10.43 -1.26 -4.25 116.55 119.33 2gag n ASP 474 Ca 0.00 -0.86 -0.40 0.00 2.57 0.00 0.00 54.79 56.09 2gag n ASP 474 Cb 0.00 0.17 -0.01 0.00 1.84 0.00 0.00 41.12 43.12 2gag n ASP 474 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 2gag s ASP 475 N -2.55 6.61 0.52 -2.24 1.01 -1.26 -4.88 116.67 113.88 2gag s ASP 475 Ca 0.23 2.75 0.24 0.00 0.71 0.00 0.00 52.55 56.48 2gag s ASP 475 Cb 0.19 -2.65 1.35 0.00 1.01 0.00 0.00 42.92 42.82 2gag s ASP 475 CO 0.54 -0.65 1.99 0.00 0.21 0.00 0.00 175.17 177.26 2gag h ALA 476 N 3.18 2.45 0.00 5.23 0.00 -2.00 0.34 119.26 128.47 2gag h ALA 476 Ca -0.49 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2gag h ALA 476 Cb 1.23 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2gag h ALA 476 CO 0.65 -0.61 0.00 -0.24 0.00 0.00 0.00 179.25 179.05 2gag h VAL 477 N 0.05 0.00 -0.00 0.00 3.04 -1.97 -1.86 116.25 115.50 2gag h VAL 477 Ca 0.27 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.86 2gag h VAL 477 Cb 0.99 1.02 0.00 0.00 -2.01 0.00 0.00 31.29 31.29 2gag h VAL 477 CO -0.02 0.00 -0.04 0.59 -1.01 0.00 0.00 177.57 177.10 2gag n ASN 478 N -2.97 0.30 -0.80 3.17 5.03 0.11 -3.88 115.26 116.22 2gag n ASN 478 Ca -0.02 -0.70 0.08 0.00 0.87 0.00 0.00 54.58 54.81 2gag n ASN 478 Cb 0.11 -0.09 0.24 0.00 -1.02 0.00 0.00 39.78 39.01 2gag n ASN 478 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2gag n TYR 479 N -0.94 0.82 1.17 3.10 4.01 -0.70 -4.64 117.16 119.97 2gag n TYR 479 Ca 0.18 -0.82 0.11 0.00 -0.16 0.00 0.00 57.90 57.21 2gag n TYR 479 Cb 0.22 -0.26 0.59 0.00 -0.31 0.00 0.00 39.34 39.58 2gag n TYR 479 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2gag n LYS 480 N -0.40 0.46 0.00 -0.72 5.02 -1.25 -2.57 118.16 118.69 2gag n LYS 480 Ca 0.19 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.53 2gag n LYS 480 Cb 0.80 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.31 2gag n LYS 480 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2gag n PHE 481 N -1.18 0.00 -2.86 2.13 3.72 -1.26 -4.90 117.46 113.11 2gag n PHE 481 Ca 0.13 -0.43 -0.43 0.00 -0.05 0.00 0.00 57.45 56.66 2gag n PHE 481 Cb 0.14 -0.04 -0.03 0.00 -0.94 0.00 0.00 39.48 38.60 2gag n PHE 481 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 2gag s HIS 482 N -0.87 2.91 0.02 1.38 3.76 -1.12 -0.98 115.29 120.40 2gag s HIS 482 Ca 0.00 -1.07 -0.30 0.00 -0.15 0.00 0.00 55.06 53.54 2gag s HIS 482 Cb 0.00 -4.34 -0.04 0.00 1.11 0.00 0.00 32.58 29.31 2gag s HIS 482 CO 0.00 -1.60 1.11 -0.06 -0.85 0.00 0.00 174.74 173.34 2gag s PHE 483 N 3.39 3.51 -0.24 1.40 0.08 -1.26 -1.38 117.98 123.48 2gag s PHE 483 Ca 0.31 1.46 -0.07 0.00 0.12 0.00 0.00 56.93 58.76 2gag s PHE 483 Cb -0.08 -3.29 -0.13 0.00 -0.57 0.00 0.00 43.02 38.95 2gag s PHE 483 CO -0.04 -0.74 -0.27 0.28 -0.10 0.00 0.00 175.22 174.35 2gag n VAL 484 N 3.98 1.35 -4.00 -0.44 0.31 0.05 -4.73 118.33 114.86 2gag n VAL 484 Ca 0.08 -0.41 -0.31 0.00 -0.01 0.00 0.00 64.34 63.68 2gag n VAL 484 Cb 0.48 -1.63 -0.15 0.00 -0.91 0.00 0.00 33.84 31.63 2gag n VAL 484 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2gag s ASP 485 N -6.84 4.24 0.05 4.52 -1.08 -0.95 -4.40 116.67 112.20 2gag s ASP 485 Ca -0.33 -1.41 -0.22 0.00 -0.52 0.00 0.00 52.55 50.07 2gag s ASP 485 Cb 0.11 -1.39 -0.14 0.00 -1.46 0.00 0.00 42.92 40.04 2gag s ASP 485 CO 0.48 -0.24 1.47 -0.07 0.52 0.00 0.00 175.17 177.33 2gag h LEU 486 N 7.83 0.21 -1.20 -1.34 3.38 -1.89 -0.99 115.31 121.32 2gag h LEU 486 Ca -0.17 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.43 2gag h LEU 486 Cb 1.05 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 2gag h LEU 486 CO 0.45 0.48 -0.08 -0.61 0.09 0.00 0.00 178.44 178.77 2gag h GLN 487 N -0.06 0.46 -0.01 1.13 4.15 -1.97 -2.17 115.11 116.64 2gag h GLN 487 Ca 0.03 -0.11 0.00 0.00 0.77 0.00 0.00 58.65 59.34 2gag h GLN 487 Cb 0.37 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.01 2gag h GLN 487 CO 0.01 0.55 -0.03 0.54 -1.93 0.00 0.00 178.83 177.97 2gag n ARG 488 N -4.24 1.29 -3.54 1.69 5.12 -1.20 -4.50 116.66 111.28 2gag n ARG 488 Ca 0.01 -0.55 -0.26 0.00 -1.93 0.00 0.00 57.85 55.12 2gag n ARG 488 Cb 0.28 -1.49 0.03 0.00 -1.16 0.00 0.00 32.46 30.12 2gag n ARG 488 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2gag n ASP 489 N -0.38 -5.10 -4.89 0.55 8.00 -0.59 -4.89 116.55 109.25 2gag n ASP 489 Ca 0.20 -0.54 -0.34 0.00 0.71 0.00 0.00 54.79 54.81 2gag n ASP 489 Cb 0.27 -4.10 -0.05 0.00 -0.02 0.00 0.00 41.12 37.21 2gag n ASP 489 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2gag s GLN 490 N -6.23 3.41 0.44 -1.24 -1.52 -0.48 -4.95 119.66 109.09 2gag s GLN 490 Ca 0.51 -0.28 0.03 0.00 -1.95 0.00 0.00 55.36 53.68 2gag s GLN 490 Cb -0.25 -3.11 -0.01 0.00 -0.22 0.00 0.00 33.01 29.42 2gag s GLN 490 CO 0.63 0.70 0.12 0.25 -0.25 0.00 0.00 175.29 176.75 2gag n THR 491 N 1.27 0.00 -0.03 -0.19 -2.24 -1.26 -0.77 114.28 111.06 2gag n THR 491 Ca -0.14 -2.44 0.00 0.00 -2.27 0.00 0.00 64.05 59.21 2gag n THR 491 Cb 0.53 0.80 0.30 0.00 -2.10 0.00 0.00 70.33 69.87 2gag n THR 491 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2gag h VAL 492 N 1.61 1.18 -0.16 2.28 2.07 -1.30 -0.58 116.25 121.36 2gag h VAL 492 Ca -0.35 -0.64 -0.05 0.00 0.82 0.00 0.00 66.70 66.49 2gag h VAL 492 Cb 1.26 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 2gag h VAL 492 CO 0.55 0.23 -0.13 0.00 0.02 0.00 0.00 177.57 178.25 2gag h ALA 493 N 1.53 1.50 -0.08 1.67 0.00 -1.77 0.24 119.26 122.35 2gag h ALA 493 Ca 0.14 -0.21 -0.20 0.00 0.00 0.00 0.00 54.91 54.64 2gag h ALA 493 Cb 0.21 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2gag h ALA 493 CO -0.00 0.36 -0.77 -0.44 0.00 0.00 0.00 179.25 178.39 2gag h ASP 494 N 0.23 0.58 -0.44 0.00 3.32 -1.44 -2.53 116.42 116.14 2gag h ASP 494 Ca 0.05 -0.40 -0.11 0.00 0.02 0.00 0.00 57.03 56.59 2gag h ASP 494 Cb 0.38 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 2gag h ASP 494 CO 0.02 1.16 -0.15 0.58 -1.72 0.00 0.00 179.24 179.12 2gag h VAL 495 N 0.32 1.27 0.00 -1.35 2.07 -0.57 -2.84 116.25 115.15 2gag h VAL 495 Ca -0.04 -1.29 -0.04 0.00 0.82 0.00 0.00 66.70 66.15 2gag h VAL 495 Cb 1.37 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.19 2gag h VAL 495 CO 0.14 0.45 -0.18 -0.07 0.02 0.00 0.00 177.57 177.93 2gag h LEU 496 N 0.82 0.00 -0.39 2.57 3.38 -0.86 -1.08 115.31 119.75 2gag h LEU 496 Ca 0.12 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.91 2gag h LEU 496 Cb 0.70 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 2gag h LEU 496 CO 0.05 0.18 -0.66 -0.09 0.09 0.00 0.00 178.44 178.01 2gag h ARG 497 N 0.00 0.56 -0.06 1.13 2.43 -1.22 -0.17 114.38 117.05 2gag h ARG 497 Ca -0.00 -0.41 -0.02 0.00 -0.81 0.00 0.00 59.98 58.74 2gag h ARG 497 Cb 0.36 0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.98 2gag h ARG 497 CO 0.02 1.03 -0.02 0.00 -1.51 0.00 0.00 179.97 179.49 2gag h ALA 498 N 0.86 0.08 -0.00 2.80 0.00 -1.22 -1.54 119.26 120.24 2gag h ALA 498 Ca -0.02 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 2gag h ALA 498 Cb 1.24 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 2gag h ALA 498 CO 0.12 -0.18 -0.36 1.79 0.00 0.00 0.00 179.25 180.62 2gag h THR 499 N -0.25 1.26 0.00 0.00 1.35 -1.22 -1.83 112.91 112.23 2gag h THR 499 Ca 0.01 -1.24 -0.04 0.00 -0.55 0.00 0.00 66.41 64.60 2gag h THR 499 Cb 0.45 1.66 -0.01 0.00 -1.73 0.00 0.00 68.15 68.52 2gag h THR 499 CO 0.01 0.35 -0.19 1.23 -0.25 0.00 0.00 175.52 176.67 2gag h GLY 500 N 1.08 0.00 2.00 5.82 0.00 -0.88 -2.31 103.07 108.78 2gag h GLY 500 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2gag h GLY 500 CO 0.05 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.59 2gag n ALA 501 N -2.21 2.23 0.00 3.60 0.00 -0.59 -4.89 120.51 118.65 2gag n ALA 501 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2gag n ALA 501 Cb 0.41 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.40 2gag n ALA 501 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gag n GLY 502 N 1.23 0.97 3.81 0.00 0.00 -0.87 -5.10 105.19 105.24 2gag n GLY 502 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 2gag n GLY 502 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2gag s MET 503 N -0.10 4.24 0.00 1.61 -1.94 -0.98 -4.97 119.30 117.16 2gag s MET 503 Ca 0.00 0.81 0.00 0.00 -1.71 0.00 0.00 55.69 54.79 2gag s MET 503 Cb 0.00 -3.03 0.00 0.00 2.01 0.00 0.00 34.83 33.81 2gag s MET 503 CO 0.00 0.50 0.00 1.63 -0.01 0.00 0.00 175.02 177.14 2gag n LYS 504 N 1.11 0.94 -1.96 2.03 5.02 -1.26 -4.07 118.16 119.98 2gag n LYS 504 Ca -0.05 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.83 2gag n LYS 504 Cb 0.51 -0.76 -0.01 0.00 -0.02 0.00 0.00 35.03 34.75 2gag n LYS 504 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2gag s SER 505 N -2.86 6.52 0.52 4.39 0.15 -1.26 -4.89 113.70 116.26 2gag s SER 505 Ca 0.00 2.87 0.25 0.00 0.70 0.00 0.00 55.95 59.76 2gag s SER 505 Cb 0.00 -2.66 1.43 0.00 -1.71 0.00 0.00 66.02 63.08 2gag s SER 505 CO 0.00 -0.73 2.10 1.62 1.20 0.00 0.00 173.24 177.43 2gag h VAL 506 N 2.95 0.70 -0.24 4.45 3.04 -1.91 -1.15 116.25 124.08 2gag h VAL 506 Ca -0.50 -0.42 -0.17 0.00 -1.01 0.00 0.00 66.70 64.61 2gag h VAL 506 Cb 1.23 1.25 -0.00 0.00 -2.01 0.00 0.00 31.29 31.76 2gag h VAL 506 CO 0.64 0.10 -0.53 -0.33 -1.01 0.00 0.00 177.57 176.44 2gag h GLU 507 N 0.00 0.71 -0.21 4.17 4.39 -1.93 -0.86 114.58 120.85 2gag h GLU 507 Ca -0.00 -0.44 -0.07 0.00 0.34 0.00 0.00 59.36 59.20 2gag h GLU 507 Cb 0.24 0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.94 2gag h GLU 507 CO 0.01 1.06 -0.13 0.45 -1.16 0.00 0.00 179.01 179.24 2gag h HIS 508 N 0.55 0.53 -0.78 4.33 3.86 -1.69 -2.20 115.15 119.74 2gag h HIS 508 Ca 0.02 -0.14 0.00 0.00 -1.16 0.00 0.00 60.37 59.09 2gag h HIS 508 Cb 1.10 -0.12 -0.04 0.00 1.06 0.00 0.00 27.41 29.42 2gag h HIS 508 CO 0.06 0.76 0.51 0.82 0.86 0.00 0.00 177.93 180.93 2gag h ILE 509 N 0.14 1.21 -0.19 2.45 1.08 -1.22 0.19 117.51 121.17 2gag h ILE 509 Ca 0.04 -0.40 0.03 0.00 -0.39 0.00 0.00 64.86 64.15 2gag h ILE 509 Cb 0.64 0.07 -0.03 0.00 -3.07 0.00 0.00 36.82 34.43 2gag h ILE 509 CO 0.04 0.20 -0.02 0.50 -0.69 0.00 0.00 178.15 178.18 2gag h LYS 510 N 1.06 0.04 -0.13 2.37 3.64 -1.09 -1.48 116.57 120.98 2gag h LYS 510 Ca 0.29 -0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.47 2gag h LYS 510 Cb -0.10 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 2gag h LYS 510 CO -0.06 0.02 -0.71 0.00 -2.27 0.00 0.00 179.45 176.43 2gag h ARG 511 N 0.04 0.58 -0.36 1.90 3.08 -0.87 0.63 114.38 119.38 2gag h ARG 511 Ca 0.09 -0.45 -0.03 0.00 0.07 0.00 0.00 59.98 59.66 2gag h ARG 511 Cb 0.12 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 2gag h ARG 511 CO -0.16 1.07 0.12 -0.92 -1.07 0.00 0.00 179.97 179.01 2gag h TYR 512 N 0.41 0.58 0.00 3.04 3.20 -0.55 -3.30 116.97 120.36 2gag h TYR 512 Ca -0.03 -0.06 -0.28 0.00 3.14 0.00 0.00 58.73 61.50 2gag h TYR 512 Cb 1.30 -0.17 -0.05 0.00 1.54 0.00 0.00 36.73 39.35 2gag h TYR 512 CO 0.06 0.56 -1.63 1.79 -1.64 0.00 0.00 178.16 177.29 2gag h THR 513 N 0.44 0.94 0.00 1.81 1.35 -1.29 -3.49 112.91 112.67 2gag h THR 513 Ca 0.12 -2.78 0.00 0.00 -0.55 0.00 0.00 66.41 63.20 2gag h THR 513 Cb 0.24 2.47 0.00 0.00 -1.73 0.00 0.00 68.15 69.13 2gag h THR 513 CO -0.00 0.54 0.00 -1.54 -0.25 0.00 0.00 175.52 174.27 2gag n SER 514 N -3.08 -1.77 -4.74 5.36 3.41 0.22 -4.94 113.62 108.07 2gag n SER 514 Ca -0.15 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.04 2gag n SER 514 Cb 1.04 -0.29 -0.01 0.00 -0.26 0.00 0.00 64.21 64.69 2gag n SER 514 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2gag n ILE 515 N -2.59 1.59 -1.00 -1.33 5.41 -1.17 -2.30 119.36 117.96 2gag n ILE 515 Ca 0.00 -0.40 -0.00 0.00 1.00 0.00 0.00 62.75 63.35 2gag n ILE 515 Cb 0.00 -1.84 -0.00 0.00 -0.71 0.00 0.00 39.64 37.09 2gag n ILE 515 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2gag n SER 516 N 1.22 -3.63 -0.77 4.38 3.41 -1.26 -4.75 113.62 112.22 2gag n SER 516 Ca 0.05 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.77 2gag n SER 516 Cb 0.37 -1.15 0.07 0.00 -0.26 0.00 0.00 64.21 63.24 2gag n SER 516 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2gag n THR 517 N -2.79 0.00 -1.36 6.66 -2.24 -0.97 -3.39 114.28 110.18 2gag n THR 517 Ca -0.00 -0.45 -0.26 0.00 -2.27 0.00 0.00 64.05 61.07 2gag n THR 517 Cb 0.11 1.40 0.20 0.00 -2.10 0.00 0.00 70.33 69.94 2gag n THR 517 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gag n ALA 518 N 0.91 -2.22 0.55 6.98 0.00 -1.26 -4.82 120.51 120.65 2gag n ALA 518 Ca 0.12 -1.46 0.06 0.00 0.00 0.00 0.00 53.44 52.16 2gag n ALA 518 Cb 0.52 -0.09 0.30 0.00 0.00 0.00 0.00 19.45 20.18 2gag n ALA 518 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2gag n ASN 519 N -4.22 0.00 -0.53 0.00 2.04 -1.26 -0.95 115.26 110.34 2gag n ASN 519 Ca 0.14 0.21 0.12 0.00 -0.44 0.00 0.00 54.58 54.61 2gag n ASN 519 Cb 0.51 -0.34 0.13 0.00 -2.53 0.00 0.00 39.78 37.54 2gag n ASN 519 CO 0.00 0.00 0.00 -0.90 -0.44 0.00 0.00 177.26 175.92 2gag n ASP 520 N -1.34 1.97 -4.03 0.53 5.75 -1.26 -4.77 116.55 113.40 2gag n ASP 520 Ca 0.05 -1.48 -0.28 0.00 -0.01 0.00 0.00 54.79 53.08 2gag n ASP 520 Cb 0.11 0.29 -0.03 0.00 -1.03 0.00 0.00 41.12 40.46 2gag n ASP 520 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2gag n GLN 521 N 0.11 -2.48 -1.28 0.11 1.13 -0.13 -2.29 117.38 112.56 2gag n GLN 521 Ca 0.11 0.32 -0.10 0.00 -1.94 0.00 0.00 57.00 55.40 2gag n GLN 521 Cb 0.46 -4.19 -0.04 0.00 0.11 0.00 0.00 30.24 26.58 2gag n GLN 521 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2gag n GLY 522 N -2.11 0.97 0.37 1.08 0.00 -1.22 -4.90 105.19 99.39 2gag n GLY 522 Ca -0.29 -0.09 0.13 0.00 0.00 0.00 0.00 46.02 45.76 2gag n GLY 522 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gag h LYS 523 N 0.07 0.62 0.00 1.61 1.57 -1.82 0.16 116.57 118.78 2gag h LYS 523 Ca -0.19 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 2gag h LYS 523 Cb 1.01 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.18 2gag h LYS 523 CO 0.29 0.41 -0.68 0.25 -0.57 0.00 0.00 179.45 179.15 2gag n THR 524 N -4.55 0.00 -0.02 -0.16 -2.24 -1.26 -4.75 114.28 101.30 2gag n THR 524 Ca 0.17 -0.26 0.04 0.00 -2.27 0.00 0.00 64.05 61.74 2gag n THR 524 Cb 0.48 0.85 -0.11 0.00 -2.10 0.00 0.00 70.33 69.46 2gag n THR 524 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2gag n SER 525 N -1.37 1.75 0.22 3.42 3.41 -0.99 -4.41 113.62 115.66 2gag n SER 525 Ca 0.01 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.46 2gag n SER 525 Cb 0.18 1.47 -0.08 0.00 -0.26 0.00 0.00 64.21 65.52 2gag n SER 525 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2gag h GLY 526 N 2.60 -1.00 2.00 5.00 0.00 -1.27 0.44 103.07 110.85 2gag h GLY 526 Ca -0.08 0.50 -0.11 0.00 0.00 0.00 0.00 47.33 47.65 2gag h GLY 526 CO 0.00 -0.32 -0.50 -2.08 0.00 0.00 0.00 176.54 173.64 2gag h VAL 527 N -0.82 1.33 -0.71 4.60 2.07 -1.85 -2.16 116.25 118.71 2gag h VAL 527 Ca -0.03 -1.73 -0.02 0.00 0.82 0.00 0.00 66.70 65.74 2gag h VAL 527 Cb 0.75 1.94 -0.03 0.00 -1.52 0.00 0.00 31.29 32.43 2gag h VAL 527 CO -0.11 0.49 0.37 0.00 0.02 0.00 0.00 177.57 178.34 2gag h ALA 528 N 1.50 0.91 -0.60 1.67 0.00 -1.69 -0.51 119.26 120.55 2gag h ALA 528 Ca -0.01 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2gag h ALA 528 Cb 0.90 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 2gag h ALA 528 CO 0.07 0.44 0.24 0.00 0.00 0.00 0.00 179.25 179.99 2gag h ALA 529 N 1.19 0.78 -0.85 0.00 0.00 -0.45 -1.27 119.26 118.65 2gag h ALA 529 Ca 0.25 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2gag h ALA 529 Cb 0.06 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 2gag h ALA 529 CO -0.04 0.39 0.48 0.82 0.00 0.00 0.00 179.25 180.90 2gag h ILE 530 N 0.83 1.24 -0.77 0.00 2.04 -0.87 -0.03 117.51 119.96 2gag h ILE 530 Ca 0.20 -0.59 -0.05 0.00 1.00 0.00 0.00 64.86 65.43 2gag h ILE 530 Cb 0.20 0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 36.34 2gag h ILE 530 CO -0.02 0.27 0.30 1.23 0.00 0.00 0.00 178.15 179.93 2gag h GLY 531 N 1.17 1.23 0.98 5.37 0.00 -0.64 -0.99 103.07 110.20 2gag h GLY 531 Ca 0.30 -0.67 -0.10 0.00 0.00 0.00 0.00 47.33 46.86 2gag h GLY 531 CO -0.05 0.63 -0.19 -2.08 0.00 0.00 0.00 176.54 174.85 2gag h VAL 532 N 1.12 1.29 -0.33 4.60 2.07 -0.67 -2.12 116.25 122.20 2gag h VAL 532 Ca 0.26 -1.31 0.02 0.00 0.82 0.00 0.00 66.70 66.48 2gag h VAL 532 Cb 0.22 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 2gag h VAL 532 CO -0.02 0.43 0.18 0.40 0.02 0.00 0.00 177.57 178.58 2gag h ILE 533 N 0.54 1.01 -0.86 4.57 2.04 -0.74 -0.06 117.51 124.02 2gag h ILE 533 Ca 0.08 -0.13 0.01 0.00 1.00 0.00 0.00 64.86 65.82 2gag h ILE 533 Cb 0.73 0.61 -0.04 0.00 -0.74 0.00 0.00 36.82 37.38 2gag h ILE 533 CO 0.05 0.07 0.57 0.00 0.00 0.00 0.00 178.15 178.84 2gag h ALA 534 N 1.16 1.10 -0.22 1.87 0.00 -1.12 0.18 119.26 122.22 2gag h ALA 534 Ca 0.13 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2gag h ALA 534 Cb 0.02 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 2gag h ALA 534 CO -0.07 0.47 -0.02 0.00 0.00 0.00 0.00 179.25 179.62 2gag h ALA 535 N 1.32 0.30 -0.03 0.00 0.00 -0.89 0.26 119.26 120.22 2gag h ALA 535 Ca 0.32 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 2gag h ALA 535 Cb -0.10 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2gag h ALA 535 CO -0.08 0.05 -0.68 -0.39 0.00 0.00 0.00 179.25 178.16 2gag h VAL 536 N 0.16 1.44 -0.17 0.00 -1.51 -0.80 -3.02 116.25 112.35 2gag h VAL 536 Ca 0.06 -2.22 0.00 0.00 -1.23 0.00 0.00 66.70 63.31 2gag h VAL 536 Cb 0.45 2.18 0.00 0.00 -2.13 0.00 0.00 31.29 31.79 2gag h VAL 536 CO 0.02 0.64 0.00 0.18 -1.23 0.00 0.00 177.57 177.18 2gag n LEU 537 N -3.78 2.21 -3.25 4.19 4.77 0.03 -4.94 117.00 116.23 2gag n LEU 537 Ca -0.02 -0.87 -0.20 0.00 -0.03 0.00 0.00 56.01 54.89 2gag n LEU 537 Cb 0.67 -0.10 0.07 0.00 -2.33 0.00 0.00 43.42 41.73 2gag n LEU 537 CO 0.44 0.44 0.19 0.61 -1.33 0.00 0.00 177.39 177.74 2gag n GLY 538 N 1.25 -0.36 3.68 -0.72 0.00 -0.47 -4.99 105.19 103.59 2gag n GLY 538 Ca 0.17 0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.97 2gag n GLY 538 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gag s ILE 539 N -3.30 5.20 0.03 -0.61 1.01 0.78 -5.01 121.20 119.32 2gag s ILE 539 Ca 0.39 0.12 -0.16 0.00 0.00 0.00 0.00 60.65 61.00 2gag s ILE 539 Cb -0.17 -3.38 -0.35 0.00 0.01 0.00 0.00 42.46 38.57 2gag s ILE 539 CO 0.65 0.43 1.01 -0.08 0.00 0.00 0.00 174.94 176.95 2gag h GLU 540 N 6.87 0.56 -4.53 2.79 4.81 -1.94 -3.41 114.58 119.72 2gag h GLU 540 Ca -0.39 -0.92 -0.71 0.00 -0.13 0.00 0.00 59.36 57.20 2gag h GLU 540 Cb 1.16 0.34 -0.24 0.00 0.63 0.00 0.00 28.75 30.64 2gag h GLU 540 CO 0.72 1.44 -0.48 1.21 -0.73 0.00 0.00 179.01 181.17 2gag s ASN 541 N -7.57 5.84 0.58 1.04 2.47 -1.26 -4.95 114.94 111.09 2gag s ASN 541 Ca -0.09 -1.06 0.29 0.00 0.42 0.00 0.00 52.86 52.42 2gag s ASN 541 Cb 0.04 -2.06 1.57 0.00 -1.45 0.00 0.00 41.25 39.35 2gag s ASN 541 CO 0.95 -0.44 1.87 -0.65 -3.72 0.00 0.00 177.10 175.10 2gag h PRO 542 N 8.50 0.00 0.00 0.43 0.11 -1.95 0.32 132.00 139.41 2gag h PRO 542 Ca -0.26 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.83 2gag h PRO 542 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 2gag h PRO 542 CO 0.71 0.00 -0.13 0.00 -0.21 0.00 0.00 178.00 178.36 2gag h ALA 543 N 1.46 1.06 0.00 -0.75 0.00 -1.94 -1.04 119.26 118.05 2gag h ALA 543 Ca 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2gag h ALA 543 Cb 0.50 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2gag h ALA 543 CO 0.00 0.17 -0.08 0.00 0.00 0.00 0.00 179.25 179.34 2gag h ALA 544 N 1.87 0.99 0.02 0.00 0.00 -0.77 -3.11 119.26 118.26 2gag h ALA 544 Ca -0.00 -0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.65 2gag h ALA 544 Cb 0.58 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2gag h ALA 544 CO 0.02 0.09 -1.03 0.82 0.00 0.00 0.00 179.25 179.15 2gag h ILE 545 N 0.00 1.12 -0.31 0.00 1.08 -1.40 -3.51 117.51 114.50 2gag h ILE 545 Ca -0.00 -2.26 0.04 0.00 -0.39 0.00 0.00 64.86 62.24 2gag h ILE 545 Cb 0.69 2.58 -0.01 0.00 -3.07 0.00 0.00 36.82 37.01 2gag h ILE 545 CO 0.01 0.47 -0.07 0.61 -0.69 0.00 0.00 178.15 178.48 2gag n GLY 546 N 1.55 -1.71 3.98 5.37 0.00 -0.50 -4.61 105.19 109.26 2gag n GLY 546 Ca -0.26 -1.48 -0.18 0.00 0.00 0.00 0.00 46.02 44.10 2gag n GLY 546 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2gag s THR 547 N -1.68 2.80 0.64 2.61 -4.23 -1.26 -4.92 115.64 109.59 2gag s THR 547 Ca 0.00 -1.09 -0.06 0.00 -1.18 0.00 0.00 61.69 59.36 2gag s THR 547 Cb 0.00 -2.90 0.03 0.00 1.34 0.00 0.00 72.50 70.98 2gag s THR 547 CO 0.00 0.00 0.94 0.42 -0.54 0.00 0.00 174.62 175.44 2gag s THR 548 N -2.42 3.00 0.29 3.99 -4.23 -1.26 -4.97 115.64 110.04 2gag s THR 548 Ca 0.54 -0.16 -0.30 0.00 -1.18 0.00 0.00 61.69 60.59 2gag s THR 548 Cb -0.08 -3.23 -0.11 0.00 1.34 0.00 0.00 72.50 70.43 2gag s THR 548 CO 0.32 -0.24 1.49 -0.89 -0.54 0.00 0.00 174.62 174.76 2gag s THR 549 N -3.09 2.37 -0.15 3.99 2.01 -1.26 -4.99 115.64 114.53 2gag s THR 549 Ca 0.57 0.32 -0.18 0.00 0.31 0.00 0.00 61.69 62.71 2gag s THR 549 Cb -0.11 -3.21 -0.04 0.00 0.01 0.00 0.00 72.50 69.16 2gag s THR 549 CO 0.44 0.06 0.49 -0.36 -0.69 0.00 0.00 174.62 174.56 2gag s PHE 550 N -0.27 3.47 0.06 4.92 0.08 -1.26 -5.07 117.98 119.91 2gag s PHE 550 Ca 0.59 0.85 0.05 0.00 0.12 0.00 0.00 56.93 58.54 2gag s PHE 550 Cb -0.44 -2.59 -0.03 0.00 -0.57 0.00 0.00 43.02 39.39 2gag s PHE 550 CO 0.49 0.08 -0.14 1.03 -0.10 0.00 0.00 175.22 176.57 2gag s ARG 551 N 0.96 0.85 0.60 0.44 1.81 -1.26 -4.43 118.95 117.91 2gag s ARG 551 Ca 0.25 -0.89 -0.16 0.00 -1.72 0.00 0.00 55.73 53.21 2gag s ARG 551 Cb -0.15 -0.86 -0.03 0.00 -0.45 0.00 0.00 34.95 33.46 2gag s ARG 551 CO 0.10 0.20 1.08 0.00 -0.68 0.00 0.00 175.30 176.00 2gag s ALA 552 N -1.13 2.66 0.33 2.13 0.00 -1.26 -4.38 121.76 120.10 2gag s ALA 552 Ca -0.01 0.52 -0.10 0.00 0.00 0.00 0.00 51.96 52.37 2gag s ALA 552 Cb -0.09 -3.28 -0.07 0.00 0.00 0.00 0.00 23.12 19.68 2gag s ALA 552 CO 0.02 -0.91 0.67 -1.25 0.00 0.00 0.00 175.76 174.29 2gag s PRO 553 N -3.89 3.80 0.15 0.00 0.04 -1.26 -5.08 135.00 128.75 2gag s PRO 553 Ca 0.66 0.37 -0.18 0.00 0.04 0.00 0.00 61.00 61.90 2gag s PRO 553 Cb -0.19 -2.51 0.04 0.00 0.04 0.00 0.00 34.50 31.89 2gag s PRO 553 CO 0.35 0.13 1.71 -0.92 0.04 0.00 0.00 177.00 178.31 2gag h TYR 554 N 1.82 -0.03 -3.68 0.56 -0.00 -1.34 -3.42 116.97 110.88 2gag h TYR 554 Ca -0.47 0.02 -0.36 0.00 -0.00 0.00 0.00 58.73 57.92 2gag h TYR 554 Cb 1.18 0.06 -0.18 0.00 -0.00 0.00 0.00 36.73 37.79 2gag h TYR 554 CO 0.60 -0.06 -0.74 0.95 -0.00 0.00 0.00 178.16 178.91 2gag s THR 555 N -6.19 1.10 0.45 1.81 -4.23 -1.26 -4.99 115.64 102.32 2gag s THR 555 Ca -0.13 -1.65 -0.24 0.00 -1.18 0.00 0.00 61.69 58.49 2gag s THR 555 Cb 0.12 -1.41 -0.09 0.00 1.34 0.00 0.00 72.50 72.46 2gag s THR 555 CO 0.70 -0.49 1.06 -2.65 -0.54 0.00 0.00 174.62 172.70 2gag n PRO 556 N 0.58 1.41 -4.46 3.99 -0.02 -1.26 -4.98 135.00 130.26 2gag n PRO 556 Ca -0.16 0.51 -0.24 0.00 -2.02 0.00 0.00 63.50 61.58 2gag n PRO 556 Cb 0.57 -2.14 -0.17 0.00 -0.02 0.00 0.00 33.50 31.75 2gag n PRO 556 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2gag s VAL 557 N -1.30 1.06 0.25 -1.45 1.01 -1.26 -5.13 120.40 113.58 2gag s VAL 557 Ca 0.65 -0.42 -0.31 0.00 0.00 0.00 0.00 61.98 61.90 2gag s VAL 557 Cb -0.52 -0.99 -0.13 0.00 0.00 0.00 0.00 36.38 34.73 2gag s VAL 557 CO 0.56 0.34 1.37 0.00 0.00 0.00 0.00 175.10 177.37 2gag n ALA 558 N 3.97 0.98 -0.15 5.51 0.00 -1.26 -4.90 120.51 124.66 2gag n ALA 558 Ca -0.22 0.41 -0.04 0.00 0.00 0.00 0.00 53.44 53.60 2gag n ALA 558 Cb 0.51 -2.25 0.03 0.00 0.00 0.00 0.00 19.45 17.74 2gag n ALA 558 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2gag h PHE 559 N 3.96 -0.24 -0.64 0.00 -1.00 -2.00 -2.07 116.94 114.95 2gag h PHE 559 Ca -0.45 0.04 0.03 0.00 2.81 0.00 0.00 57.97 60.40 2gag h PHE 559 Cb 1.28 0.18 -0.04 0.00 3.61 0.00 0.00 35.95 40.99 2gag h PHE 559 CO 0.56 -0.20 0.42 0.00 -1.61 0.00 0.00 178.31 177.48 2gag h ALA 560 N 1.47 1.63 -0.56 2.45 0.00 -1.99 -1.17 119.26 121.09 2gag h ALA 560 Ca 0.23 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 2gag h ALA 560 Cb 0.34 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2gag h ALA 560 CO -0.48 0.31 0.04 0.00 0.00 0.00 0.00 179.25 179.12 2gag h ALA 561 N 1.62 0.75 -0.02 0.00 0.00 -1.76 -2.49 119.26 117.37 2gag h ALA 561 Ca 0.25 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2gag h ALA 561 Cb 0.04 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2gag h ALA 561 CO -0.07 0.55 -0.29 -0.07 0.00 0.00 0.00 179.25 179.37 2gag h LEU 562 N 0.85 0.03 -0.91 0.00 3.38 -0.86 -2.55 115.31 115.25 2gag h LEU 562 Ca 0.16 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 2gag h LEU 562 Cb 0.49 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2gag h LEU 562 CO 0.02 0.33 -0.21 0.00 0.09 0.00 0.00 178.44 178.67 2gag h ALA 563 N 1.68 0.97 -0.89 1.53 0.00 -0.85 -3.48 119.26 118.22 2gag h ALA 563 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2gag h ALA 563 Cb 0.53 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2gag h ALA 563 CO 0.04 0.26 0.00 0.41 0.00 0.00 0.00 179.25 179.96 2gag n GLY 564 N 0.36 3.14 0.80 0.00 0.00 -0.96 -1.95 105.19 106.57 2gag n GLY 564 Ca 0.01 -0.23 0.07 0.00 0.00 0.00 0.00 46.02 45.87 2gag n GLY 564 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gag n ARG 565 N 14.00 2.00 -2.12 1.61 5.12 -1.14 -4.58 116.66 131.55 2gag n ARG 565 Ca 0.00 -1.55 -0.42 0.00 -1.93 0.00 0.00 57.85 53.94 2gag n ARG 565 Cb 0.00 -1.34 0.00 0.00 -1.16 0.00 0.00 32.46 29.96 2gag n ARG 565 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2gag n ASN 566 N 0.76 4.40 -4.01 0.55 4.13 -0.82 -4.67 115.26 115.60 2gag n ASN 566 Ca 0.15 -2.90 -0.08 0.00 1.68 0.00 0.00 54.58 53.43 2gag n ASN 566 Cb 0.37 -1.66 -0.10 0.00 -1.54 0.00 0.00 39.78 36.85 2gag n ASN 566 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2gag s ARG 567 N 3.14 0.57 5.86 3.52 1.81 -1.26 -4.47 118.95 128.12 2gag s ARG 567 Ca 0.48 -0.97 0.00 0.00 -1.72 0.00 0.00 55.73 53.52 2gag s ARG 567 Cb 0.10 0.21 0.00 0.00 -0.45 0.00 0.00 34.95 34.81 2gag s ARG 567 CO -0.02 -0.12 0.00 0.41 -0.68 0.00 0.00 175.30 174.88 2gag n GLY 568 N 0.52 3.00 0.26 -3.53 0.00 -1.26 -1.67 105.19 102.50 2gag n GLY 568 Ca -0.17 -0.31 0.09 0.00 0.00 0.00 0.00 46.02 45.64 2gag n GLY 568 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2gag h ASP 569 N 7.55 0.00 -0.02 1.61 3.32 -1.96 -1.98 116.42 124.94 2gag h ASP 569 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2gag h ASP 569 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2gag h ASP 569 CO 0.00 0.03 0.00 0.00 -1.72 0.00 0.00 179.24 177.55 2gag n GLN 570 N -4.33 1.09 -0.21 3.56 1.13 -0.67 -3.69 117.38 114.25 2gag n GLN 570 Ca -0.03 -0.14 -0.03 0.00 -1.94 0.00 0.00 57.00 54.86 2gag n GLN 570 Cb 0.11 -1.29 0.15 0.00 0.11 0.00 0.00 30.24 29.33 2gag n GLN 570 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 2gag h LEU 571 N 0.27 0.92 -7.29 1.08 5.85 -1.34 -3.37 115.31 111.42 2gag h LEU 571 Ca 0.00 -0.13 -0.11 0.00 0.84 0.00 0.00 57.88 58.47 2gag h LEU 571 Cb 0.06 -0.24 -0.24 0.00 0.37 0.00 0.00 40.66 40.62 2gag h LEU 571 CO 0.00 0.82 -0.20 -0.62 -0.34 0.00 0.00 178.44 178.10 2gag s ASP 572 N -6.46 -0.45 0.44 1.25 2.15 -1.24 -4.88 116.67 107.47 2gag s ASP 572 Ca -0.11 0.84 -0.24 0.00 0.43 0.00 0.00 52.55 53.47 2gag s ASP 572 Cb 0.16 0.86 -0.10 0.00 -0.30 0.00 0.00 42.92 43.55 2gag s ASP 572 CO 0.81 -0.17 1.13 -2.65 -0.17 0.00 0.00 175.17 174.12 2gag n PRO 573 N 2.74 1.56 -4.00 4.34 -0.02 -1.26 -4.96 135.00 133.40 2gag n PRO 573 Ca -0.14 0.56 -0.33 0.00 -2.02 0.00 0.00 63.50 61.58 2gag n PRO 573 Cb 0.57 -2.21 -0.14 0.00 -0.02 0.00 0.00 33.50 31.70 2gag n PRO 573 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2gag s ALA 574 N -1.26 2.77 0.09 3.55 0.00 -1.26 -4.69 121.76 120.97 2gag s ALA 574 Ca 0.63 -2.09 -0.24 0.00 0.00 0.00 0.00 51.96 50.27 2gag s ALA 574 Cb -0.52 -1.85 -0.07 0.00 0.00 0.00 0.00 23.12 20.68 2gag s ALA 574 CO 0.56 -1.43 0.73 1.03 0.00 0.00 0.00 175.76 176.65 2gag s ARG 575 N 1.07 4.47 0.05 0.00 0.52 0.16 -4.92 118.95 120.30 2gag s ARG 575 Ca -0.00 1.03 0.05 0.00 -0.52 0.00 0.00 55.73 56.28 2gag s ARG 575 Cb -0.20 -3.31 -0.02 0.00 0.52 0.00 0.00 34.95 31.94 2gag s ARG 575 CO -0.05 0.45 -0.14 0.96 0.02 0.00 0.00 175.30 176.53 2gag s ILE 576 N -0.62 1.11 0.75 1.52 -4.36 -1.26 -0.70 121.20 117.65 2gag s ILE 576 Ca 0.35 -1.08 -0.07 0.00 -0.26 0.00 0.00 60.65 59.59 2gag s ILE 576 Cb -0.21 -1.02 0.10 0.00 1.25 0.00 0.00 42.46 42.57 2gag s ILE 576 CO 0.23 -0.06 1.07 0.42 0.24 0.00 0.00 174.94 176.84 2gag s THR 577 N -0.96 2.20 -0.42 8.37 -4.23 -1.26 -4.96 115.64 114.38 2gag s THR 577 Ca 0.01 -0.27 0.21 0.00 -1.18 0.00 0.00 61.69 60.45 2gag s THR 577 Cb -0.08 -2.93 0.21 0.00 1.34 0.00 0.00 72.50 71.04 2gag s THR 577 CO 0.02 0.00 1.63 0.00 -0.54 0.00 0.00 174.62 175.73 2gag n ALA 578 N -3.06 1.36 1.09 3.99 0.00 -1.26 -2.03 120.51 120.59 2gag n ALA 578 Ca 0.10 0.12 0.12 0.00 0.00 0.00 0.00 53.44 53.79 2gag n ALA 578 Cb 0.60 -1.32 0.15 0.00 0.00 0.00 0.00 19.45 18.88 2gag n ALA 578 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2gag n MET 579 N -2.16 1.77 -0.31 0.00 2.81 -1.26 -3.95 117.12 114.02 2gag n MET 579 Ca 0.01 -1.39 0.13 0.00 -1.81 0.00 0.00 57.70 54.64 2gag n MET 579 Cb 0.13 -1.47 0.31 0.00 -0.71 0.00 0.00 33.22 31.47 2gag n MET 579 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 2gag h HIS 580 N 3.39 0.69 -0.65 2.03 6.17 -1.78 -0.70 115.15 124.31 2gag h HIS 580 Ca 0.00 0.04 0.02 0.00 0.71 0.00 0.00 60.37 61.14 2gag h HIS 580 Cb 0.82 -0.16 -0.03 0.00 2.52 0.00 0.00 27.41 30.55 2gag h HIS 580 CO 0.00 -0.02 0.43 0.66 0.71 0.00 0.00 177.93 179.70 2gag h SER 581 N 0.43 0.69 -0.10 3.26 4.64 -1.84 -1.05 113.55 119.58 2gag h SER 581 Ca 0.56 -0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.84 2gag h SER 581 Cb 1.05 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.97 2gag h SER 581 CO -0.51 0.48 -0.06 -0.25 -0.87 0.00 0.00 176.83 175.63 2gag h TRP 582 N 0.81 0.25 -0.83 4.77 7.01 -1.48 -1.53 115.95 124.95 2gag h TRP 582 Ca 0.25 -0.06 0.06 0.00 2.11 0.00 0.00 58.89 61.25 2gag h TRP 582 Cb 0.01 -0.06 -0.06 0.00 -2.10 0.00 0.00 29.16 26.96 2gag h TRP 582 CO -0.00 0.58 0.51 0.45 -2.79 0.00 0.00 178.44 177.19 2gag h HIS 583 N -0.15 0.94 0.42 2.65 3.86 -1.16 0.36 115.15 122.06 2gag h HIS 583 Ca 0.02 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 2gag h HIS 583 Cb 0.52 -0.30 0.00 0.00 1.06 0.00 0.00 27.41 28.69 2gag h HIS 583 CO 0.07 0.47 -0.20 -0.07 0.86 0.00 0.00 177.93 179.06 2gag h LEU 584 N 0.93 -0.48 -1.70 2.43 3.38 -1.12 -1.31 115.31 117.44 2gag h LEU 584 Ca 0.36 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.26 2gag h LEU 584 Cb 0.17 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.04 2gag h LEU 584 CO -0.17 -0.21 0.00 0.77 0.09 0.00 0.00 178.44 178.92 2gag h SER 585 N -0.74 0.00 -0.55 -0.43 4.64 -0.98 -2.36 113.55 113.12 2gag h SER 585 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2gag h SER 585 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2gag h SER 585 CO 0.09 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.46 2gag n HIS 586 N -2.71 1.91 -1.21 4.77 8.25 0.09 -4.95 115.22 121.37 2gag n HIS 586 Ca -0.00 -0.73 -0.07 0.00 -0.26 0.00 0.00 57.72 56.65 2gag n HIS 586 Cb 0.17 -0.47 -0.03 0.00 1.12 0.00 0.00 29.99 30.78 2gag n HIS 586 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gag n GLY 587 N 0.56 0.92 3.75 -1.41 0.00 -0.89 -4.88 105.19 103.25 2gag n GLY 587 Ca 0.27 -0.64 -0.37 0.00 0.00 0.00 0.00 46.02 45.27 2gag n GLY 587 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gag s ALA 588 N -2.24 2.65 0.07 4.61 0.00 -0.51 -4.34 121.76 122.00 2gag s ALA 588 Ca 0.00 1.21 -0.02 0.00 0.00 0.00 0.00 51.96 53.15 2gag s ALA 588 Cb 0.00 -3.53 -0.04 0.00 0.00 0.00 0.00 23.12 19.55 2gag s ALA 588 CO 0.00 -1.34 0.25 -1.21 0.00 0.00 0.00 175.76 173.46 2gag s GLU 589 N -3.11 3.49 0.15 0.00 0.41 -0.59 -4.89 118.70 114.17 2gag s GLU 589 Ca 0.75 -0.32 0.09 0.00 -0.41 0.00 0.00 54.97 55.09 2gag s GLU 589 Cb -0.37 -3.00 -0.04 0.00 -1.78 0.00 0.00 34.13 28.94 2gag s GLU 589 CO 0.41 0.58 -0.16 -0.06 -0.49 0.00 0.00 175.26 175.55 2gag s PHE 590 N -1.52 2.52 -0.07 1.61 0.08 -1.26 -0.02 117.98 119.32 2gag s PHE 590 Ca 0.35 -0.27 0.03 0.00 0.12 0.00 0.00 56.93 57.17 2gag s PHE 590 Cb -0.13 -1.28 -0.02 0.00 -0.57 0.00 0.00 43.02 41.02 2gag s PHE 590 CO 0.26 0.45 -0.17 -2.00 -0.10 0.00 0.00 175.22 173.66 2gag s GLU 591 N -2.49 2.74 -0.33 0.44 2.12 0.60 -4.74 118.70 117.04 2gag s GLU 591 Ca 0.21 -0.75 -0.27 0.00 0.36 0.00 0.00 54.97 54.52 2gag s GLU 591 Cb -0.09 -2.38 0.01 0.00 0.26 0.00 0.00 34.13 31.92 2gag s GLU 591 CO 0.12 0.45 0.98 -0.51 -0.54 0.00 0.00 175.26 175.77 2gag s ASP 592 N -0.30 6.82 -0.43 -1.70 1.01 -1.26 -1.60 116.67 119.21 2gag s ASP 592 Ca 0.02 0.88 0.02 0.00 0.71 0.00 0.00 52.55 54.17 2gag s ASP 592 Cb -0.13 -2.50 0.12 0.00 1.01 0.00 0.00 42.92 41.42 2gag s ASP 592 CO 0.03 -0.82 0.18 -0.69 0.21 0.00 0.00 175.17 174.08 2gag s VAL 593 N 3.47 2.68 0.00 -1.27 1.01 -0.14 -4.97 120.40 121.18 2gag s VAL 593 Ca 0.41 -2.66 0.00 0.00 0.00 0.00 0.00 61.98 59.73 2gag s VAL 593 Cb -0.13 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 33.37 2gag s VAL 593 CO 0.15 -0.70 0.00 0.61 0.00 0.00 0.00 175.10 175.16 2gag n GLY 594 N 3.89 2.70 0.64 4.51 0.00 -1.26 -1.01 105.19 114.65 2gag n GLY 594 Ca 0.04 -0.30 0.13 0.00 0.00 0.00 0.00 46.02 45.88 2gag n GLY 594 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2gag n GLN 595 N 13.50 1.88 -2.93 1.61 6.02 -1.26 -4.91 117.38 131.29 2gag n GLN 595 Ca 0.00 -1.29 -0.36 0.00 -0.01 0.00 0.00 57.00 55.34 2gag n GLN 595 Cb 0.00 -1.46 -0.06 0.00 1.02 0.00 0.00 30.24 29.73 2gag n GLN 595 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2gag s TRP 596 N -1.93 3.64 -0.39 1.08 0.52 -0.18 0.39 118.94 122.06 2gag s TRP 596 Ca 0.35 1.59 -0.13 0.00 0.02 0.00 0.00 56.10 57.92 2gag s TRP 596 Cb 0.20 -2.78 0.02 0.00 -1.15 0.00 0.00 33.47 29.76 2gag s TRP 596 CO 0.31 0.24 0.26 0.15 0.02 0.00 0.00 176.95 177.93 2gag s LYS 597 N -2.13 2.97 0.03 4.98 -0.14 0.13 -0.96 119.74 124.62 2gag s LYS 597 Ca 0.48 -1.00 0.06 0.00 -1.36 0.00 0.00 55.97 54.14 2gag s LYS 597 Cb -0.17 -3.87 -0.03 0.00 -1.68 0.00 0.00 37.83 32.07 2gag s LYS 597 CO 0.22 -0.70 -0.13 1.03 -0.76 0.00 0.00 175.35 175.00 2gag s ARG 598 N 1.64 2.26 0.17 1.68 0.52 -0.63 -4.73 118.95 119.87 2gag s ARG 598 Ca 0.04 -0.88 -0.32 0.00 -0.52 0.00 0.00 55.73 54.05 2gag s ARG 598 Cb -0.19 -2.32 -0.11 0.00 0.52 0.00 0.00 34.95 32.86 2gag s ARG 598 CO 0.09 0.56 1.65 -2.14 0.02 0.00 0.00 175.30 175.48 2gag s PRO 599 N -1.48 4.18 -0.17 3.54 0.02 -1.26 -0.29 135.00 139.53 2gag s PRO 599 Ca 0.16 2.46 -0.20 0.00 0.02 0.00 0.00 61.00 63.45 2gag s PRO 599 Cb -0.11 -3.19 -0.22 0.00 0.02 0.00 0.00 34.50 31.00 2gag s PRO 599 CO 0.07 -0.69 0.37 2.35 -0.33 0.00 0.00 177.00 178.77 2gag h TRP 600 N 7.05 0.14 -2.02 6.54 7.01 -0.73 -0.28 115.95 133.65 2gag h TRP 600 Ca -0.43 -0.10 0.19 0.00 2.11 0.00 0.00 58.89 60.66 2gag h TRP 600 Cb 1.20 -0.01 -0.13 0.00 -2.10 0.00 0.00 29.16 28.12 2gag h TRP 600 CO 0.67 1.47 0.60 1.52 -2.79 0.00 0.00 178.44 179.91 2gag s TYR 601 N -2.39 -0.20 -0.49 2.65 -0.85 -1.22 -1.63 117.35 113.22 2gag s TYR 601 Ca -0.25 0.04 0.04 0.00 -0.52 0.00 0.00 57.07 56.37 2gag s TYR 601 Cb 0.05 0.56 0.13 0.00 0.38 0.00 0.00 41.96 43.07 2gag s TYR 601 CO 0.66 -0.52 0.23 0.71 -1.52 0.00 0.00 175.55 175.10 2gag s TYR 602 N -2.93 3.23 0.34 -3.49 2.02 -1.26 -1.54 117.35 113.71 2gag s TYR 602 Ca 0.09 -3.12 -0.27 0.00 -0.37 0.00 0.00 57.07 53.40 2gag s TYR 602 Cb -0.00 -2.81 -0.09 0.00 -0.40 0.00 0.00 41.96 38.66 2gag s TYR 602 CO -0.04 -0.77 1.05 -1.25 -1.57 0.00 0.00 175.55 172.96 2gag s PRO 603 N -0.08 4.43 0.29 -1.71 0.04 -1.26 -4.96 135.00 131.75 2gag s PRO 603 Ca 0.16 1.60 0.02 0.00 0.04 0.00 0.00 61.00 62.82 2gag s PRO 603 Cb -0.25 -2.86 -0.03 0.00 0.04 0.00 0.00 34.50 31.40 2gag s PRO 603 CO -0.01 0.08 0.46 -0.65 0.04 0.00 0.00 177.00 176.92 2gag s GLN 604 N -1.97 3.47 -0.31 4.56 -0.21 -1.26 -4.91 119.66 119.03 2gag s GLN 604 Ca 0.51 -0.49 -0.31 0.00 0.02 0.00 0.00 55.36 55.09 2gag s GLN 604 Cb -0.26 -2.76 -0.13 0.00 1.00 0.00 0.00 33.01 30.86 2gag s GLN 604 CO 0.32 0.28 1.04 0.00 -2.12 0.00 0.00 175.29 174.81 2gag n ALA 605 N -1.54 -1.04 -0.97 6.09 0.00 -1.26 -0.50 120.51 121.29 2gag n ALA 605 Ca -0.06 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.72 2gag n ALA 605 Cb 0.56 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.74 2gag n ALA 605 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gag n GLY 606 N 2.55 0.64 3.83 0.00 0.00 -1.26 -5.03 105.19 105.92 2gag n GLY 606 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 2gag n GLY 606 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gag s GLU 607 N -0.18 4.06 0.74 1.61 2.02 0.34 -5.08 118.70 122.22 2gag s GLU 607 Ca 0.00 0.58 -0.06 0.00 0.02 0.00 0.00 54.97 55.50 2gag s GLU 607 Cb 0.00 -3.19 0.10 0.00 0.10 0.00 0.00 34.13 31.14 2gag s GLU 607 CO 0.00 0.64 1.05 0.95 0.02 0.00 0.00 175.26 177.92 2gag s THR 608 N -1.15 2.22 0.14 3.63 -4.23 -1.26 -4.78 115.64 110.21 2gag s THR 608 Ca 0.28 -0.32 -0.17 0.00 -1.18 0.00 0.00 61.69 60.30 2gag s THR 608 Cb -0.18 -2.90 -0.02 0.00 1.34 0.00 0.00 72.50 70.74 2gag s THR 608 CO 0.17 0.00 1.78 -0.03 -0.54 0.00 0.00 174.62 176.00 2gag h MET 609 N -0.72 0.45 -0.99 3.99 4.05 -1.99 -1.58 114.93 118.14 2gag h MET 609 Ca -0.42 -0.04 0.05 0.00 -0.28 0.00 0.00 59.70 59.01 2gag h MET 609 Cb 1.29 -0.10 -0.06 0.00 -0.80 0.00 0.00 31.60 31.93 2gag h MET 609 CO 0.51 0.33 0.64 -0.44 0.23 0.00 0.00 176.91 178.19 2gag h ASP 610 N 0.44 1.05 -0.27 1.39 3.32 -1.99 -0.28 116.42 120.08 2gag h ASP 610 Ca 0.12 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.11 2gag h ASP 610 Cb -0.01 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 2gag h ASP 610 CO -0.02 0.69 -0.06 1.56 -1.72 0.00 0.00 179.24 179.68 2gag h GLN 611 N 1.20 0.52 -0.18 3.56 4.20 -1.84 -0.12 115.11 122.45 2gag h GLN 611 Ca 0.41 -0.20 0.01 0.00 0.06 0.00 0.00 58.65 58.94 2gag h GLN 611 Cb 0.10 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 2gag h GLN 611 CO -0.15 0.73 0.09 0.00 -0.67 0.00 0.00 178.83 178.82 2gag h ALA 612 N 0.78 0.21 -0.19 3.87 0.00 -0.87 -0.36 119.26 122.70 2gag h ALA 612 Ca 0.07 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 2gag h ALA 612 Cb 0.53 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2gag h ALA 612 CO 0.03 -0.34 -0.26 0.28 0.00 0.00 0.00 179.25 178.95 2gag h VAL 613 N 0.19 1.26 -0.48 0.00 2.07 -1.03 0.85 116.25 119.10 2gag h VAL 613 Ca 0.07 -1.23 -0.09 0.00 0.82 0.00 0.00 66.70 66.27 2gag h VAL 613 Cb 0.02 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 2gag h VAL 613 CO -0.05 0.38 -0.06 0.22 0.02 0.00 0.00 177.57 178.08 2gag h TYR 614 N 0.33 0.98 -0.02 1.57 3.20 -0.64 -0.53 116.97 121.85 2gag h TYR 614 Ca 0.05 -0.19 -0.00 0.00 3.14 0.00 0.00 58.73 61.72 2gag h TYR 614 Cb 0.64 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.66 2gag h TYR 614 CO 0.02 0.94 0.00 -0.09 -1.64 0.00 0.00 178.16 177.39 2gag h ARG 615 N 0.74 0.04 -0.28 1.82 2.43 -0.61 -3.05 114.38 115.46 2gag h ARG 615 Ca 0.13 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 2gag h ARG 615 Cb 0.59 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 2gag h ARG 615 CO 0.04 0.30 0.18 0.93 -1.51 0.00 0.00 179.97 179.91 2gag h GLU 616 N -0.23 0.37 -0.49 0.20 5.08 -0.77 0.42 114.58 119.15 2gag h GLU 616 Ca 0.01 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.38 2gag h GLU 616 Cb 0.29 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 2gag h GLU 616 CO 0.00 0.26 0.33 0.77 -1.00 0.00 0.00 179.01 179.37 2gag h SER 617 N 0.37 0.45 0.21 1.42 0.02 -1.16 -1.78 113.55 113.09 2gag h SER 617 Ca 0.10 -0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.76 2gag h SER 617 Cb -0.03 -0.10 0.03 0.00 0.14 0.00 0.00 62.40 62.44 2gag h SER 617 CO -0.02 0.31 -1.25 0.50 -1.14 0.00 0.00 176.83 175.23 2gag h LYS 618 N 0.52 0.45 -0.89 3.45 1.63 -1.36 -3.34 116.57 117.04 2gag h LYS 618 Ca 0.20 -0.78 0.05 0.00 -0.85 0.00 0.00 60.65 59.28 2gag h LYS 618 Cb 0.15 0.29 -0.06 0.00 -0.60 0.00 0.00 32.23 32.01 2gag h LYS 618 CO -0.05 1.37 0.56 0.00 -3.45 0.00 0.00 179.45 177.88 2gag h ALA 619 N 0.12 1.20 -0.53 5.00 0.00 -0.39 0.33 119.26 124.99 2gag h ALA 619 Ca -0.22 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2gag h ALA 619 Cb 1.98 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 19.47 2gag h ALA 619 CO 0.23 0.36 0.31 0.28 0.00 0.00 0.00 179.25 180.43 2gag h VAL 620 N 1.06 1.16 0.00 0.00 2.07 -1.47 -0.64 116.25 118.43 2gag h VAL 620 Ca 0.37 -0.38 -0.12 0.00 0.82 0.00 0.00 66.70 67.39 2gag h VAL 620 Cb 0.10 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 2gag h VAL 620 CO -0.15 0.17 -0.59 0.03 0.02 0.00 0.00 177.57 177.05 2gag h ARG 621 N 0.71 0.00 -0.19 1.57 3.08 -1.59 -3.26 114.38 114.70 2gag h ARG 621 Ca 0.19 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 60.06 2gag h ARG 621 Cb 0.00 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.06 2gag h ARG 621 CO -0.03 0.59 -0.59 -0.44 -1.07 0.00 0.00 179.97 178.42 2gag h ASP 622 N 0.00 0.85 0.00 7.04 3.32 -0.57 -3.41 116.42 123.65 2gag h ASP 622 Ca -0.01 -0.59 0.00 0.00 0.02 0.00 0.00 57.03 56.45 2gag h ASP 622 Cb 1.28 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.59 2gag h ASP 622 CO 0.08 1.29 0.00 -0.24 -1.72 0.00 0.00 179.24 178.65 2gag n SER 623 N -4.07 0.00 -3.57 6.45 2.88 -0.28 -4.82 113.62 110.21 2gag n SER 623 Ca -0.07 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.33 2gag n SER 623 Cb 0.65 0.01 -0.06 0.00 -0.75 0.00 0.00 64.21 64.06 2gag n SER 623 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2gag s VAL 624 N -0.09 0.00 0.21 2.46 0.11 -1.17 -0.94 120.40 120.99 2gag s VAL 624 Ca 0.00 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 59.06 2gag s VAL 624 Cb 0.00 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.80 2gag s VAL 624 CO 0.00 0.00 0.05 -0.83 -3.33 0.00 0.00 175.10 170.99 2gag s GLY 625 N -0.72 1.46 -0.00 6.54 0.00 0.13 -1.34 107.32 113.38 2gag s GLY 625 Ca -0.05 -1.72 0.01 0.00 0.00 0.00 0.00 44.72 42.96 2gag s GLY 625 CO 0.04 -1.55 -0.04 -3.16 0.00 0.00 0.00 173.10 168.39 2gag s MET 626 N -3.98 0.34 -0.00 2.90 0.23 -0.68 -0.93 119.30 117.18 2gag s MET 626 Ca 0.31 -0.14 0.01 0.00 -1.03 0.00 0.00 55.69 54.84 2gag s MET 626 Cb 0.07 -0.34 -0.00 0.00 -1.53 0.00 0.00 34.83 33.03 2gag s MET 626 CO 0.09 0.08 -0.04 -1.17 -2.03 0.00 0.00 175.02 171.94 2gag s LEU 627 N -0.03 1.97 -0.75 0.18 2.96 -0.62 -1.08 118.68 121.31 2gag s LEU 627 Ca 0.01 -0.08 -0.25 0.00 -0.22 0.00 0.00 54.13 53.58 2gag s LEU 627 Cb -0.02 -0.24 0.04 0.00 0.50 0.00 0.00 46.19 46.47 2gag s LEU 627 CO -0.00 0.05 1.21 -0.62 -1.32 0.00 0.00 176.35 175.67 2gag s ASP 628 N -0.06 6.20 -0.26 3.68 -1.08 -1.26 -1.24 116.67 122.65 2gag s ASP 628 Ca 0.01 -0.71 0.11 0.00 -0.52 0.00 0.00 52.55 51.44 2gag s ASP 628 Cb -0.02 -2.52 0.73 0.00 -1.46 0.00 0.00 42.92 39.65 2gag s ASP 628 CO -0.00 -1.69 1.71 0.00 0.52 0.00 0.00 175.17 175.70 2gag n ALA 629 N 8.84 4.15 -0.19 3.66 0.00 -0.43 -4.63 120.51 131.91 2gag n ALA 629 Ca 0.04 -1.98 0.05 0.00 0.00 0.00 0.00 53.44 51.55 2gag n ALA 629 Cb 0.48 -1.19 0.33 0.00 0.00 0.00 0.00 19.45 19.07 2gag n ALA 629 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2gag h THR 630 N 3.11 1.07 0.00 0.00 2.02 -1.87 -3.28 112.91 113.95 2gag h THR 630 Ca 0.13 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 67.03 2gag h THR 630 Cb 2.07 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 68.66 2gag h THR 630 CO 0.59 0.15 0.00 0.35 0.37 0.00 0.00 175.52 176.98 2gag n THR 631 N -4.47 0.80 -1.89 3.16 -2.24 -1.26 -4.74 114.28 103.64 2gag n THR 631 Ca 0.10 0.20 -0.38 0.00 -2.27 0.00 0.00 64.05 61.70 2gag n THR 631 Cb 0.17 -0.99 0.03 0.00 -2.10 0.00 0.00 70.33 67.44 2gag n THR 631 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2gag s LEU 632 N -2.69 3.86 0.41 3.22 1.02 -1.24 -4.42 118.68 118.86 2gag s LEU 632 Ca 0.10 2.65 -0.25 0.00 0.02 0.00 0.00 54.13 56.65 2gag s LEU 632 Cb 0.08 -4.30 -0.08 0.00 0.02 0.00 0.00 46.19 41.91 2gag s LEU 632 CO 0.20 -1.46 1.16 -0.83 0.02 0.00 0.00 176.35 175.44 2gag s GLY 633 N -1.09 2.84 -0.05 -3.19 0.00 -0.49 -4.80 107.32 100.55 2gag s GLY 633 Ca 0.71 0.94 -0.02 0.00 0.00 0.00 0.00 44.72 46.35 2gag s GLY 633 CO 0.44 1.44 0.09 0.54 0.00 0.00 0.00 173.10 175.60 2gag s LYS 634 N -2.38 -0.00 -0.09 2.90 1.02 -1.26 -1.03 119.74 118.90 2gag s LYS 634 Ca 0.58 0.34 0.00 0.00 0.02 0.00 0.00 55.97 56.92 2gag s LYS 634 Cb -0.30 -0.29 0.02 0.00 -0.52 0.00 0.00 37.83 36.74 2gag s LYS 634 CO 0.37 -0.23 -0.07 0.42 -0.92 0.00 0.00 175.35 174.92 2gag s ILE 635 N 1.55 0.90 -0.17 2.17 1.01 -0.00 -0.58 121.20 126.07 2gag s ILE 635 Ca -0.04 -0.25 -0.13 0.00 0.00 0.00 0.00 60.65 60.23 2gag s ILE 635 Cb -0.12 -0.91 -0.05 0.00 0.01 0.00 0.00 42.46 41.39 2gag s ILE 635 CO -0.04 0.33 0.26 -0.70 0.00 0.00 0.00 174.94 174.79 2gag s GLU 636 N 1.43 4.24 0.08 2.79 2.12 -0.00 -0.54 118.70 128.82 2gag s GLU 636 Ca -0.01 0.03 0.10 0.00 0.36 0.00 0.00 54.97 55.45 2gag s GLU 636 Cb -0.13 -3.43 -0.03 0.00 0.26 0.00 0.00 34.13 30.79 2gag s GLU 636 CO -0.04 0.23 -0.25 0.96 -0.54 0.00 0.00 175.26 175.62 2gag s ILE 637 N 0.50 2.09 -0.06 -3.70 -4.36 -0.25 -1.05 121.20 114.38 2gag s ILE 637 Ca 0.15 -1.52 -0.04 0.00 -0.26 0.00 0.00 60.65 58.97 2gag s ILE 637 Cb -0.13 -1.82 0.02 0.00 1.25 0.00 0.00 42.46 41.78 2gag s ILE 637 CO 0.03 0.20 0.14 -0.60 0.24 0.00 0.00 174.94 174.95 2gag s ARG 638 N -1.61 0.13 0.00 0.37 3.52 -0.15 -1.62 118.95 119.60 2gag s ARG 638 Ca 0.12 0.25 0.00 0.00 -0.13 0.00 0.00 55.73 55.97 2gag s ARG 638 Cb -0.10 -0.02 0.00 0.00 -1.56 0.00 0.00 34.95 33.27 2gag s ARG 638 CO 0.04 -0.07 0.00 0.41 -0.81 0.00 0.00 175.30 174.87 2gag n GLY 639 N 3.45 2.90 0.24 8.12 0.00 -0.35 -0.85 105.19 118.71 2gag n GLY 639 Ca -0.18 -0.92 0.10 0.00 0.00 0.00 0.00 46.02 45.02 2gag n GLY 639 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gag h LYS 640 N 0.00 0.00 -0.57 1.61 6.56 -1.81 -2.75 116.57 119.60 2gag h LYS 640 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2gag h LYS 640 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 2gag h LYS 640 CO 0.00 0.17 0.00 -0.25 -2.06 0.00 0.00 179.45 177.31 2gag n ASP 641 N -3.70 4.16 -0.08 0.86 8.00 -0.91 -4.63 116.55 120.26 2gag n ASP 641 Ca -0.02 -2.33 -0.07 0.00 0.71 0.00 0.00 54.79 53.09 2gag n ASP 641 Cb 0.29 -0.49 -0.00 0.00 -0.02 0.00 0.00 41.12 40.90 2gag n ASP 641 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2gag h ALA 642 N 3.50 0.26 -0.63 2.24 0.00 -1.60 0.63 119.26 123.66 2gag h ALA 642 Ca 0.00 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2gag h ALA 642 Cb 1.22 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 2gag h ALA 642 CO 0.14 -0.41 0.28 0.00 0.00 0.00 0.00 179.25 179.26 2gag h ALA 643 N 1.26 0.81 -0.69 0.00 0.00 -1.83 -1.04 119.26 117.76 2gag h ALA 643 Ca 0.14 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2gag h ALA 643 Cb 0.19 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2gag h ALA 643 CO -0.24 0.39 0.24 1.49 0.00 0.00 0.00 179.25 181.13 2gag h GLU 644 N 0.87 1.05 -0.54 0.00 4.22 -1.80 -1.90 114.58 116.47 2gag h GLU 644 Ca 0.21 -0.20 -0.03 0.00 0.08 0.00 0.00 59.36 59.43 2gag h GLU 644 Cb 0.15 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2gag h GLU 644 CO -0.02 0.88 0.23 0.35 -2.18 0.00 0.00 179.01 178.26 2gag h PHE 645 N 1.02 0.80 -0.36 0.92 3.57 -0.38 -2.09 116.94 120.42 2gag h PHE 645 Ca 0.23 -0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 2gag h PHE 645 Cb 0.25 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 2gag h PHE 645 CO 0.02 0.65 0.14 -0.07 -2.23 0.00 0.00 178.31 176.82 2gag h LEU 646 N 0.72 0.45 -1.50 0.59 3.38 -0.70 -1.71 115.31 116.53 2gag h LEU 646 Ca 0.18 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 2gag h LEU 646 Cb 0.17 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2gag h LEU 646 CO -0.02 0.41 -0.24 0.78 0.09 0.00 0.00 178.44 179.47 2gag h ASN 647 N 0.50 0.00 0.48 -0.43 -0.26 -0.67 0.40 115.58 115.60 2gag h ASN 647 Ca 0.12 0.00 -0.30 0.00 -0.56 0.00 0.00 56.30 55.56 2gag h ASN 647 Cb 0.11 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.35 2gag h ASN 647 CO -0.01 0.24 -1.54 0.03 -1.06 0.00 0.00 177.43 175.08 2gag h ARG 648 N 0.00 0.20 0.06 0.81 3.08 -1.03 -3.40 114.38 114.10 2gag h ARG 648 Ca -0.00 -0.34 -0.08 0.00 0.07 0.00 0.00 59.98 59.63 2gag h ARG 648 Cb 0.54 0.13 0.01 0.00 0.08 0.00 0.00 29.97 30.72 2gag h ARG 648 CO 0.03 1.03 -0.35 0.82 -1.07 0.00 0.00 179.97 180.43 2gag h ILE 649 N 0.05 1.67 -3.46 2.04 1.08 -1.18 0.14 117.51 117.86 2gag h ILE 649 Ca -0.24 -2.40 -0.50 0.00 -0.39 0.00 0.00 64.86 61.32 2gag h ILE 649 Cb 2.00 3.28 -0.00 0.00 -3.07 0.00 0.00 36.82 39.03 2gag h ILE 649 CO 0.14 0.65 -0.00 -0.31 -0.69 0.00 0.00 178.15 177.94 2gag s TYR 650 N -2.36 3.48 0.32 1.37 2.02 0.11 -4.20 117.35 118.09 2gag s TYR 650 Ca -0.17 0.85 0.11 0.00 -0.37 0.00 0.00 57.07 57.49 2gag s TYR 650 Cb -0.01 -2.28 0.52 0.00 -0.40 0.00 0.00 41.96 39.78 2gag s TYR 650 CO 0.75 0.02 1.71 1.79 -1.57 0.00 0.00 175.55 178.25 2gag h THR 651 N 1.19 1.36 -0.74 -0.71 1.35 -1.37 -3.44 112.91 110.56 2gag h THR 651 Ca -0.47 -1.73 -0.50 0.00 -0.55 0.00 0.00 66.41 63.16 2gag h THR 651 Cb 1.19 1.92 0.02 0.00 -1.73 0.00 0.00 68.15 69.55 2gag h THR 651 CO 0.65 0.49 -0.12 0.54 -0.25 0.00 0.00 175.52 176.83 2gag s ASN 652 N -6.89 5.02 0.12 5.36 4.22 -1.11 -1.44 114.94 120.23 2gag s ASN 652 Ca -0.02 -0.92 -0.06 0.00 -2.14 0.00 0.00 52.86 49.72 2gag s ASN 652 Cb 0.13 0.35 -0.06 0.00 1.28 0.00 0.00 41.25 42.96 2gag s ASN 652 CO 0.75 -1.33 0.38 -0.83 -2.04 0.00 0.00 177.10 174.03 2gag s GLY 653 N -4.62 2.26 0.00 0.45 0.00 -1.26 -4.58 107.32 99.56 2gag s GLY 653 Ca 0.58 -0.52 0.00 0.00 0.00 0.00 0.00 44.72 44.78 2gag s GLY 653 CO 0.37 -0.41 0.04 -1.72 0.00 0.00 0.00 173.10 171.38 2gag n TYR 654 N 0.29 0.00 0.06 1.90 4.01 -1.26 -4.82 117.16 117.34 2gag n TYR 654 Ca -0.04 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.77 2gag n TYR 654 Cb 0.52 0.00 0.50 0.00 -0.31 0.00 0.00 39.34 40.05 2gag n TYR 654 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 2gag h THR 655 N 0.09 1.03 -0.28 -0.72 1.35 -1.96 -2.33 112.91 110.09 2gag h THR 655 Ca 0.00 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 2gag h THR 655 Cb 0.05 0.63 0.00 0.00 -1.73 0.00 0.00 68.15 67.10 2gag h THR 655 CO 0.00 0.07 0.00 0.29 -0.25 0.00 0.00 175.52 175.63 2gag n LYS 656 N -4.49 2.31 -1.81 4.72 4.76 -1.26 -4.94 118.16 117.46 2gag n LYS 656 Ca 0.03 -1.97 -0.41 0.00 -2.87 0.00 0.00 58.31 53.09 2gag n LYS 656 Cb 0.14 -1.48 -0.02 0.00 -1.84 0.00 0.00 35.03 31.83 2gag n LYS 656 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2gag s LEU 657 N -1.60 4.35 0.25 -0.35 2.96 -0.88 -4.95 118.68 118.47 2gag s LEU 657 Ca 0.36 2.91 -0.22 0.00 -0.22 0.00 0.00 54.13 56.97 2gag s LEU 657 Cb 0.21 -3.63 -0.09 0.00 0.50 0.00 0.00 46.19 43.18 2gag s LEU 657 CO 0.30 -0.89 0.79 -0.54 -1.32 0.00 0.00 176.35 174.70 2gag s LYS 658 N -0.46 4.36 0.32 1.98 1.02 -1.26 -5.01 119.74 120.69 2gag s LYS 658 Ca 0.63 1.01 -0.29 0.00 0.02 0.00 0.00 55.97 57.34 2gag s LYS 658 Cb -0.47 -2.86 -0.11 0.00 -0.52 0.00 0.00 37.83 33.86 2gag s LYS 658 CO 0.47 0.36 1.56 0.08 -0.92 0.00 0.00 175.35 176.90 2gag s VAL 659 N -1.54 2.07 0.00 3.17 1.01 -1.26 -1.45 120.40 122.39 2gag s VAL 659 Ca 0.45 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.49 2gag s VAL 659 Cb -0.17 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.17 2gag s VAL 659 CO 0.22 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.94 2gag n GLY 660 N 1.60 0.56 3.46 4.51 0.00 -0.42 -5.03 105.19 109.87 2gag n GLY 660 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.82 2gag n GLY 660 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2gag s MET 661 N -0.82 1.63 0.30 1.61 1.00 -0.53 -1.09 119.30 121.41 2gag s MET 661 Ca 0.00 -1.63 0.11 0.00 0.00 0.00 0.00 55.69 54.16 2gag s MET 661 Cb 0.00 -1.83 -0.05 0.00 0.00 0.00 0.00 34.83 32.95 2gag s MET 661 CO 0.00 0.37 -0.13 0.20 0.00 0.00 0.00 175.02 175.46 2gag s GLY 662 N -3.10 1.98 -0.13 -0.03 0.00 0.88 -1.94 107.32 104.98 2gag s GLY 662 Ca 0.26 -1.94 -0.06 0.00 0.00 0.00 0.00 44.72 42.98 2gag s GLY 662 CO 0.13 -1.96 0.30 -1.60 0.00 0.00 0.00 173.10 169.96 2gag s ARG 663 N -3.58 0.26 0.34 2.90 3.52 0.04 -4.89 118.95 117.54 2gag s ARG 663 Ca 0.31 0.63 -0.27 0.00 -0.13 0.00 0.00 55.73 56.28 2gag s ARG 663 Cb -0.02 -0.08 -0.09 0.00 -1.56 0.00 0.00 34.95 33.20 2gag s ARG 663 CO 0.16 -0.17 1.07 -0.47 -0.81 0.00 0.00 175.30 175.08 2gag s TYR 664 N 1.42 3.45 0.15 5.12 5.04 -1.26 -0.88 117.35 130.39 2gag s TYR 664 Ca -0.08 1.69 -0.11 0.00 -2.44 0.00 0.00 57.07 56.12 2gag s TYR 664 Cb -0.10 -3.19 0.00 0.00 0.35 0.00 0.00 41.96 39.02 2gag s TYR 664 CO -0.10 -0.53 0.32 0.20 -1.34 0.00 0.00 175.55 174.10 2gag s GLY 665 N -1.23 0.22 -0.03 8.97 0.00 0.29 -4.95 107.32 110.59 2gag s GLY 665 Ca 0.51 -0.62 0.07 0.00 0.00 0.00 0.00 44.72 44.67 2gag s GLY 665 CO 0.34 -0.67 -0.23 0.14 0.00 0.00 0.00 173.10 172.68 2gag s VAL 666 N -3.91 1.86 -0.17 1.40 1.01 -1.26 -1.95 120.40 117.38 2gag s VAL 666 Ca 0.12 -0.99 -0.03 0.00 0.00 0.00 0.00 61.98 61.07 2gag s VAL 666 Cb 0.03 -1.55 -0.02 0.00 0.00 0.00 0.00 36.38 34.83 2gag s VAL 666 CO -0.04 0.52 -0.04 -0.32 0.00 0.00 0.00 175.10 175.22 2gag s MET 667 N -0.40 3.60 0.16 2.72 1.75 -0.22 -1.09 119.30 125.82 2gag s MET 667 Ca 0.05 -0.55 0.10 0.00 -1.25 0.00 0.00 55.69 54.04 2gag s MET 667 Cb -0.10 -2.92 -0.04 0.00 2.84 0.00 0.00 34.83 34.61 2gag s MET 667 CO 0.00 0.16 -0.23 0.00 -0.65 0.00 0.00 175.02 174.30 2gag s LYS 669 N -2.44 -0.33 0.57 0.00 -0.14 -1.11 -4.63 119.74 111.66 2gag s LYS 669 Ca 0.16 -0.39 0.38 0.00 -1.36 0.00 0.00 55.97 54.76 2gag s LYS 669 Cb -0.08 -1.73 1.93 0.00 -1.68 0.00 0.00 37.83 36.26 2gag s LYS 669 CO 0.08 -3.07 2.15 0.00 -0.76 0.00 0.00 175.35 173.75 2gag h ALA 670 N -2.11 1.00 0.00 5.17 0.00 -1.92 -1.78 119.26 119.62 2gag h ALA 670 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2gag h ALA 670 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2gag h ALA 670 CO 0.31 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.16 2gag n ASP 671 N -2.93 0.00 0.00 0.00 5.68 -1.26 -3.87 116.55 114.16 2gag n ASP 671 Ca -0.02 -0.62 0.00 0.00 -0.50 0.00 0.00 54.79 53.66 2gag n ASP 671 Cb 0.14 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.01 2gag n ASP 671 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2gag n GLY 672 N 0.88 0.85 3.80 6.12 0.00 -0.67 -4.79 105.19 111.38 2gag n GLY 672 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 2gag n GLY 672 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2gag s MET 673 N -0.15 4.37 0.17 1.61 -1.94 -1.26 -4.44 119.30 117.66 2gag s MET 673 Ca 0.00 0.94 -0.33 0.00 -1.71 0.00 0.00 55.69 54.59 2gag s MET 673 Cb 0.00 -3.19 -0.14 0.00 2.01 0.00 0.00 34.83 33.52 2gag s MET 673 CO 0.00 0.57 1.60 -0.89 -0.01 0.00 0.00 175.02 176.28 2gag n ILE 674 N 1.48 0.04 -0.04 2.53 5.41 -0.07 -2.76 119.36 125.95 2gag n ILE 674 Ca -0.07 -0.01 -0.07 0.00 1.00 0.00 0.00 62.75 63.61 2gag n ILE 674 Cb 0.50 -1.61 -0.03 0.00 -0.71 0.00 0.00 39.64 37.78 2gag n ILE 674 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 176.55 176.88 2gag n PHE 675 N 3.45 0.00 -3.83 1.39 7.35 0.56 -4.65 117.46 121.73 2gag n PHE 675 Ca 0.17 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.78 2gag n PHE 675 Cb 0.30 -0.30 -0.00 0.00 0.35 0.00 0.00 39.48 39.82 2gag n PHE 675 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2gag s ASP 676 N -5.05 -0.14 0.26 -2.13 2.15 -0.92 -4.97 116.67 105.87 2gag s ASP 676 Ca -0.11 -0.83 -0.21 0.00 0.43 0.00 0.00 52.55 51.83 2gag s ASP 676 Cb 0.03 0.77 0.04 0.00 -0.30 0.00 0.00 42.92 43.47 2gag s ASP 676 CO 0.17 -1.47 0.83 1.51 -0.17 0.00 0.00 175.17 176.04 2gag s ASP 677 N -3.00 -0.15 0.00 -0.34 -4.77 -1.26 -1.06 116.67 106.10 2gag s ASP 677 Ca 0.13 -0.69 0.00 0.00 -3.30 0.00 0.00 52.55 48.69 2gag s ASP 677 Cb -0.05 0.67 0.00 0.00 -1.09 0.00 0.00 42.92 42.45 2gag s ASP 677 CO 0.09 -1.28 0.00 0.61 0.70 0.00 0.00 175.17 175.29 2gag n GLY 678 N -0.50 -0.94 3.64 2.12 0.00 -0.82 -3.44 105.19 105.24 2gag n GLY 678 Ca -0.05 -1.49 -0.35 0.00 0.00 0.00 0.00 46.02 44.13 2gag n GLY 678 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gag s VAL 679 N -2.30 4.54 -0.16 1.61 1.01 -1.21 -0.55 120.40 123.34 2gag s VAL 679 Ca 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 61.98 61.80 2gag s VAL 679 Cb 0.00 -2.99 -0.03 0.00 0.00 0.00 0.00 36.38 33.36 2gag s VAL 679 CO 0.00 0.52 -0.03 -0.89 0.00 0.00 0.00 175.10 174.70 2gag s THR 680 N -0.10 3.93 -0.11 3.92 2.01 -0.06 -1.66 115.64 123.56 2gag s THR 680 Ca 0.05 -0.34 -0.07 0.00 0.31 0.00 0.00 61.69 61.65 2gag s THR 680 Cb -0.12 -2.73 -0.04 0.00 0.01 0.00 0.00 72.50 69.62 2gag s THR 680 CO 0.02 0.49 0.14 -0.76 -0.69 0.00 0.00 174.62 173.81 2gag s LEU 681 N 0.43 4.36 -0.43 4.42 1.43 0.14 -0.78 118.68 128.25 2gag s LEU 681 Ca -0.03 0.45 -0.16 0.00 -1.03 0.00 0.00 54.13 53.36 2gag s LEU 681 Cb -0.14 -2.10 0.03 0.00 0.03 0.00 0.00 46.19 44.01 2gag s LEU 681 CO 0.03 0.40 0.37 -0.60 0.23 0.00 0.00 176.35 176.78 2gag s ARG 682 N -1.09 3.02 0.22 1.70 3.52 -0.82 -0.38 118.95 125.12 2gag s ARG 682 Ca 0.16 -0.98 0.17 0.00 -0.13 0.00 0.00 55.73 54.95 2gag s ARG 682 Cb -0.12 -4.00 0.02 0.00 -1.56 0.00 0.00 34.95 29.29 2gag s ARG 682 CO 0.05 -0.84 1.23 -0.07 -0.81 0.00 0.00 175.30 174.86 2gag h LEU 683 N 8.83 0.00 -7.90 -0.88 3.38 -1.20 -1.11 115.31 116.42 2gag h LEU 683 Ca -0.27 0.00 0.11 0.00 0.09 0.00 0.00 57.88 57.81 2gag h LEU 683 Cb 1.11 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.83 2gag h LEU 683 CO 0.78 0.42 0.45 0.00 0.09 0.00 0.00 178.44 180.18 2gag s ALA 684 N -3.02 -1.34 0.39 1.53 0.00 -0.80 -4.81 121.76 113.72 2gag s ALA 684 Ca 0.02 -0.34 0.07 0.00 0.00 0.00 0.00 51.96 51.70 2gag s ALA 684 Cb 0.08 0.72 0.82 0.00 0.00 0.00 0.00 23.12 24.73 2gag s ALA 684 CO 0.76 -1.04 2.01 1.49 0.00 0.00 0.00 175.76 178.98 2gag h GLU 685 N 2.00 0.62 -0.24 0.00 4.22 -1.99 -2.90 114.58 116.28 2gag h GLU 685 Ca -0.27 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.13 2gag h GLU 685 Cb 1.23 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.34 2gag h GLU 685 CO 0.34 0.41 0.00 -0.40 -2.18 0.00 0.00 179.01 177.18 2gag n ASP 686 N -4.47 3.28 -3.85 1.04 5.75 -1.26 -4.84 116.55 112.20 2gag n ASP 686 Ca 0.07 -2.61 -0.13 0.00 -0.01 0.00 0.00 54.79 52.11 2gag n ASP 686 Cb 0.16 -0.39 -0.14 0.00 -1.03 0.00 0.00 41.12 39.71 2gag n ASP 686 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2gag s ARG 687 N -2.08 0.01 0.07 0.11 0.52 -1.10 -1.20 118.95 115.27 2gag s ARG 687 Ca 0.32 0.04 0.02 0.00 -0.52 0.00 0.00 55.73 55.58 2gag s ARG 687 Cb 0.24 -0.07 -0.03 0.00 0.52 0.00 0.00 34.95 35.60 2gag s ARG 687 CO 0.10 -0.04 -0.07 -0.06 0.02 0.00 0.00 175.30 175.26 2gag s PHE 688 N 0.26 0.76 -0.25 -0.53 0.08 -0.64 -0.62 117.98 117.04 2gag s PHE 688 Ca -0.02 -0.76 0.02 0.00 0.12 0.00 0.00 56.93 56.28 2gag s PHE 688 Cb -0.03 -0.45 0.06 0.00 -0.57 0.00 0.00 43.02 42.03 2gag s PHE 688 CO -0.01 -0.15 -0.06 -1.17 -0.10 0.00 0.00 175.22 173.74 2gag s LEU 689 N -2.45 2.98 -0.01 -0.37 2.96 0.49 -1.09 118.68 121.18 2gag s LEU 689 Ca 0.03 -1.33 -0.19 0.00 -0.22 0.00 0.00 54.13 52.41 2gag s LEU 689 Cb -0.01 -1.31 -0.05 0.00 0.50 0.00 0.00 46.19 45.32 2gag s LEU 689 CO -0.03 -0.24 0.54 -0.76 -1.32 0.00 0.00 176.35 174.54 2gag s LEU 690 N 1.28 4.42 -0.14 -0.68 1.02 0.30 -0.69 118.68 124.19 2gag s LEU 690 Ca -0.05 1.09 0.01 0.00 0.02 0.00 0.00 54.13 55.20 2gag s LEU 690 Cb -0.19 -2.83 -0.00 0.00 0.02 0.00 0.00 46.19 43.18 2gag s LEU 690 CO -0.07 0.14 -0.17 -1.00 0.02 0.00 0.00 176.35 175.28 2gag s HIS 691 N -0.30 2.74 0.40 0.29 3.76 -0.67 -0.82 115.29 120.69 2gag s HIS 691 Ca 0.29 -0.95 0.07 0.00 -0.15 0.00 0.00 55.06 54.32 2gag s HIS 691 Cb -0.18 -1.84 -0.08 0.00 1.11 0.00 0.00 32.58 31.60 2gag s HIS 691 CO 0.16 -0.40 0.00 0.95 -0.85 0.00 0.00 174.74 174.60 2gag s THR 692 N 0.60 1.97 0.71 1.30 -4.23 -0.20 -3.31 115.64 112.49 2gag s THR 692 Ca -0.10 -2.02 -0.16 0.00 -1.18 0.00 0.00 61.69 58.24 2gag s THR 692 Cb -0.16 -2.95 0.03 0.00 1.34 0.00 0.00 72.50 70.76 2gag s THR 692 CO 0.03 -0.02 1.23 0.42 -0.54 0.00 0.00 174.62 175.74 2gag s THR 693 N -2.74 2.21 0.16 3.99 -4.23 -1.22 -1.39 115.64 112.42 2gag s THR 693 Ca 0.35 0.11 -0.16 0.00 -1.18 0.00 0.00 61.69 60.80 2gag s THR 693 Cb 0.09 -2.78 0.06 0.00 1.34 0.00 0.00 72.50 71.21 2gag s THR 693 CO 0.18 -0.05 1.70 0.74 -0.54 0.00 0.00 174.62 176.65 2gag h THR 694 N -0.07 0.72 0.00 3.99 2.02 -1.91 -2.76 112.91 114.89 2gag h THR 694 Ca -0.49 -0.03 -0.08 0.00 0.77 0.00 0.00 66.41 66.58 2gag h THR 694 Cb 1.31 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 68.31 2gag h THR 694 CO 0.50 0.02 -0.37 1.23 0.37 0.00 0.00 175.52 177.27 2gag h GLY 695 N 0.10 0.00 -2.49 2.16 0.00 -1.91 -3.20 103.07 97.73 2gag h GLY 695 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 2gag h GLY 695 CO -0.31 0.00 0.00 0.61 0.00 0.00 0.00 176.54 176.84 2gag n GLY 696 N 0.21 2.15 0.42 4.60 0.00 -1.06 -4.67 105.19 106.85 2gag n GLY 696 Ca -0.00 -0.73 -0.13 0.00 0.00 0.00 0.00 46.02 45.16 2gag n GLY 696 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gag h ALA 697 N 4.20 -0.66 -0.82 4.61 0.00 -1.51 -0.27 119.26 124.81 2gag h ALA 697 Ca 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2gag h ALA 697 Cb 0.94 0.90 -0.04 0.00 0.00 0.00 0.00 17.79 19.59 2gag h ALA 697 CO 0.02 -0.97 0.35 0.00 0.00 0.00 0.00 179.25 178.66 2gag h ALA 698 N 0.06 1.07 -0.81 0.00 0.00 -1.88 -2.71 119.26 114.99 2gag h ALA 698 Ca 0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2gag h ALA 698 Cb 0.63 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 2gag h ALA 698 CO -0.46 0.67 0.44 -0.44 0.00 0.00 0.00 179.25 179.46 2gag h ASP 699 N 1.19 1.01 -0.10 0.00 3.32 -1.73 -1.47 116.42 118.63 2gag h ASP 699 Ca 0.28 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.22 2gag h ASP 699 Cb 0.18 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.47 2gag h ASP 699 CO -0.03 0.81 -0.04 0.58 -1.72 0.00 0.00 179.24 178.84 2gag h VAL 700 N 1.13 1.31 -0.70 -1.35 2.07 -0.89 0.30 116.25 118.12 2gag h VAL 700 Ca 0.29 -1.01 0.04 0.00 0.82 0.00 0.00 66.70 66.83 2gag h VAL 700 Cb 0.02 1.77 -0.05 0.00 -1.52 0.00 0.00 31.29 31.52 2gag h VAL 700 CO -0.05 0.29 0.43 0.25 0.02 0.00 0.00 177.57 178.51 2gag h LEU 701 N -0.14 0.69 -0.91 2.57 5.85 -1.33 -0.51 115.31 121.53 2gag h LEU 701 Ca 0.02 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 2gag h LEU 701 Cb 0.47 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 2gag h LEU 701 CO 0.01 0.47 0.24 0.44 -0.34 0.00 0.00 178.44 179.26 2gag h ASP 702 N 0.82 0.96 -0.24 1.25 3.32 -1.19 -1.29 116.42 120.06 2gag h ASP 702 Ca 0.29 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 2gag h ASP 702 Cb 0.06 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 2gag h ASP 702 CO -0.13 0.88 0.13 -0.25 -1.72 0.00 0.00 179.24 178.16 2gag h TRP 703 N 1.01 0.33 -0.48 4.55 2.91 0.04 0.23 115.95 124.52 2gag h TRP 703 Ca 0.23 -0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.23 2gag h TRP 703 Cb 0.25 -0.10 -0.02 0.00 -0.51 0.00 0.00 29.16 28.77 2gag h TRP 703 CO 0.02 0.28 0.25 -0.07 -1.03 0.00 0.00 178.44 177.89 2gag h LEU 704 N 0.28 0.62 -0.81 0.65 3.38 -0.85 -2.26 115.31 116.32 2gag h LEU 704 Ca 0.08 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 2gag h LEU 704 Cb 0.06 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2gag h LEU 704 CO -0.01 0.56 0.23 -0.33 0.09 0.00 0.00 178.44 178.97 2gag h GLU 705 N 0.64 1.11 -0.26 1.13 4.39 -1.01 -1.53 114.58 119.06 2gag h GLU 705 Ca 0.17 -0.23 0.03 0.00 0.34 0.00 0.00 59.36 59.67 2gag h GLU 705 Cb 0.09 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.54 2gag h GLU 705 CO -0.02 0.95 0.07 1.49 -1.16 0.00 0.00 179.01 180.33 2gag h GLU 706 N 1.07 0.17 -0.42 2.33 4.81 -0.19 0.98 114.58 123.33 2gag h GLU 706 Ca 0.23 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.39 2gag h GLU 706 Cb 0.30 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 2gag h GLU 706 CO -0.01 0.11 0.01 -1.49 -0.73 0.00 0.00 179.01 176.90 2gag h TRP 707 N 0.17 0.79 -0.22 0.92 4.06 -1.19 -0.31 115.95 120.18 2gag h TRP 707 Ca 0.12 -0.14 -0.03 0.00 2.06 0.00 0.00 58.89 60.90 2gag h TRP 707 Cb 0.10 -0.21 -0.01 0.00 -1.00 0.00 0.00 29.16 28.05 2gag h TRP 707 CO -0.14 0.79 0.00 -0.07 -3.56 0.00 0.00 178.44 175.46 2gag h LEU 708 N 0.57 0.38 -0.23 -4.49 3.38 -1.11 0.14 115.31 113.94 2gag h LEU 708 Ca 0.12 -0.31 -0.21 0.00 0.09 0.00 0.00 57.88 57.57 2gag h LEU 708 Cb 0.47 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.13 2gag h LEU 708 CO 0.02 0.59 -0.78 1.56 0.09 0.00 0.00 178.44 179.92 2gag h GLN 709 N 0.15 0.65 0.00 1.13 4.20 -0.78 -1.24 115.11 119.21 2gag h GLN 709 Ca 0.06 -0.54 -0.03 0.00 0.06 0.00 0.00 58.65 58.20 2gag h GLN 709 Cb 0.40 0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 2gag h GLN 709 CO 0.01 1.16 -1.98 0.25 -0.67 0.00 0.00 178.83 177.60 2gag n THR 710 N -3.89 0.11 -0.03 -0.54 -2.24 -0.13 -4.61 114.28 102.95 2gag n THR 710 Ca -0.07 -0.50 -0.06 0.00 -2.27 0.00 0.00 64.05 61.15 2gag n THR 710 Cb 0.75 -0.02 -0.02 0.00 -2.10 0.00 0.00 70.33 68.93 2gag n THR 710 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2gag n GLU 711 N -2.26 0.14 -2.79 -0.78 -0.58 -0.49 -4.90 120.64 108.97 2gag n GLU 711 Ca -0.06 0.05 -0.26 0.00 -0.42 0.00 0.00 57.16 56.47 2gag n GLU 711 Cb 0.59 -0.86 -0.02 0.00 -0.57 0.00 0.00 31.44 30.57 2gag n GLU 711 CO 0.00 0.00 0.00 0.91 -0.48 0.00 0.00 177.13 177.56 2gag n TRP 712 N -3.06 3.51 0.21 -0.32 8.01 0.39 -4.85 117.44 121.33 2gag n TRP 712 Ca -0.12 -3.65 0.08 0.00 -1.31 0.00 0.00 57.50 52.50 2gag n TRP 712 Cb 0.60 -0.34 0.37 0.00 -2.01 0.00 0.00 31.31 29.92 2gag n TRP 712 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.69 176.33 2gag n PRO 713 N -0.29 0.09 0.14 -0.99 -0.04 -0.47 -1.49 135.00 131.95 2gag n PRO 713 Ca 0.33 0.50 0.01 0.00 -0.04 0.00 0.00 63.50 64.30 2gag n PRO 713 Cb 0.51 -1.75 0.11 0.00 -0.04 0.00 0.00 33.50 32.33 2gag n PRO 713 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 2gag h ASP 714 N 0.00 0.00 -3.48 3.54 2.03 -1.89 -3.46 116.42 113.17 2gag h ASP 714 Ca 0.00 0.00 -0.53 0.00 -0.73 0.00 0.00 57.03 55.77 2gag h ASP 714 Cb 0.11 0.00 0.06 0.00 -0.83 0.00 0.00 39.33 38.66 2gag h ASP 714 CO 0.00 0.58 0.72 -0.76 -1.03 0.00 0.00 179.24 178.75 2gag s LEU 715 N -6.83 4.40 -0.97 0.15 1.43 -0.56 -4.94 118.68 111.36 2gag s LEU 715 Ca 0.02 2.63 -0.18 0.00 -1.03 0.00 0.00 54.13 55.57 2gag s LEU 715 Cb 0.10 -3.63 0.14 0.00 0.03 0.00 0.00 46.19 42.83 2gag s LEU 715 CO 0.74 -0.64 1.17 -0.62 0.23 0.00 0.00 176.35 177.23 2gag s ASP 716 N 0.20 6.71 -0.08 2.29 2.15 -1.26 -4.93 116.67 121.75 2gag s ASP 716 Ca 0.57 -2.22 -0.04 0.00 0.43 0.00 0.00 52.55 51.29 2gag s ASP 716 Cb -0.41 -2.40 0.04 0.00 -0.30 0.00 0.00 42.92 39.86 2gag s ASP 716 CO 0.44 -1.00 0.18 -0.69 -0.17 0.00 0.00 175.17 173.94 2gag s VAL 717 N 2.44 -0.04 -0.04 1.11 1.01 -1.26 -2.13 120.40 121.49 2gag s VAL 717 Ca 0.34 0.14 0.04 0.00 0.00 0.00 0.00 61.98 62.50 2gag s VAL 717 Cb -0.05 -0.28 -0.00 0.00 0.00 0.00 0.00 36.38 36.05 2gag s VAL 717 CO -0.08 0.06 -0.17 -0.89 0.00 0.00 0.00 175.10 174.02 2gag s THR 718 N 1.00 1.41 0.03 3.92 2.01 -0.03 -4.96 115.64 119.02 2gag s THR 718 Ca -0.07 -0.71 0.09 0.00 0.31 0.00 0.00 61.69 61.31 2gag s THR 718 Cb -0.09 -1.22 -0.03 0.00 0.01 0.00 0.00 72.50 71.17 2gag s THR 718 CO -0.06 0.41 -0.25 0.00 -0.69 0.00 0.00 174.62 174.03 2gag s THR 720 N -0.77 -0.06 0.08 0.00 2.01 -0.21 -5.00 115.64 111.70 2gag s THR 720 Ca 0.12 0.21 -0.30 0.00 0.31 0.00 0.00 61.69 62.02 2gag s THR 720 Cb -0.10 -0.14 -0.06 0.00 0.01 0.00 0.00 72.50 72.21 2gag s THR 720 CO 0.02 0.08 1.20 -0.55 -0.69 0.00 0.00 174.62 174.68 2gag s SER 721 N 1.13 7.09 -0.04 3.53 0.15 -1.26 -0.82 113.70 123.47 2gag s SER 721 Ca -0.09 2.05 0.06 0.00 0.70 0.00 0.00 55.95 58.67 2gag s SER 721 Cb -0.12 -2.58 0.09 0.00 -1.71 0.00 0.00 66.02 61.69 2gag s SER 721 CO -0.04 -0.45 0.95 1.33 1.20 0.00 0.00 173.24 176.24 2gag n VAL 722 N 3.69 0.93 -0.25 4.45 0.24 0.25 -4.85 118.33 122.78 2gag n VAL 722 Ca 0.08 -1.04 -0.04 0.00 -2.04 0.00 0.00 64.34 61.30 2gag n VAL 722 Cb 0.46 0.36 0.02 0.00 -1.47 0.00 0.00 33.84 33.21 2gag n VAL 722 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 2gag h THR 723 N 1.70 0.12 -0.00 3.34 2.02 -1.76 -1.56 112.91 116.77 2gag h THR 723 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2gag h THR 723 Cb 0.89 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 2gag h THR 723 CO 0.00 0.00 -0.18 -0.62 0.37 0.00 0.00 175.52 175.09 2gag n GLU 724 N -5.44 0.38 0.18 6.66 -0.58 -1.26 -3.59 120.64 116.99 2gag n GLU 724 Ca 0.06 -0.14 0.06 0.00 -0.42 0.00 0.00 57.16 56.72 2gag n GLU 724 Cb 0.37 -1.50 0.28 0.00 -0.57 0.00 0.00 31.44 30.02 2gag n GLU 724 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 2gag h GLN 725 N 0.34 0.00 -6.65 3.49 5.75 -1.63 -3.42 115.11 112.99 2gag h GLN 725 Ca 0.00 0.00 -0.69 0.00 -0.15 0.00 0.00 58.65 57.81 2gag h GLN 725 Cb 0.43 0.00 -0.26 0.00 1.07 0.00 0.00 27.48 28.72 2gag h GLN 725 CO 0.00 0.38 -0.86 -0.51 -2.65 0.00 0.00 178.83 175.19 2gag s LEU 726 N -6.85 2.28 0.03 -2.39 1.43 -1.20 0.18 118.68 112.16 2gag s LEU 726 Ca 0.01 -0.51 0.07 0.00 -1.03 0.00 0.00 54.13 52.68 2gag s LEU 726 Cb 0.10 -1.36 -0.03 0.00 0.03 0.00 0.00 46.19 44.93 2gag s LEU 726 CO 0.69 0.28 -0.20 0.00 0.23 0.00 0.00 176.35 177.35 2gag s ALA 727 N -0.79 2.50 -0.02 4.21 0.00 0.30 -4.68 121.76 123.28 2gag s ALA 727 Ca 0.12 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 50.91 2gag s ALA 727 Cb -0.10 -0.69 0.01 0.00 0.00 0.00 0.00 23.12 22.34 2gag s ALA 727 CO 0.02 0.56 -0.07 0.99 0.00 0.00 0.00 175.76 177.26 2gag s THR 728 N -0.87 0.60 -0.20 0.00 2.01 -1.26 -1.52 115.64 114.40 2gag s THR 728 Ca 0.13 -0.25 -0.02 0.00 0.31 0.00 0.00 61.69 61.86 2gag s THR 728 Cb -0.10 -0.55 0.00 0.00 0.01 0.00 0.00 72.50 71.86 2gag s THR 728 CO 0.04 0.20 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.37 2gag s VAL 729 N 0.27 2.86 -0.22 3.82 1.01 0.01 -1.32 120.40 126.82 2gag s VAL 729 Ca -0.04 -0.67 -0.15 0.00 0.00 0.00 0.00 61.98 61.13 2gag s VAL 729 Cb -0.08 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 2gag s VAL 729 CO 0.00 0.47 0.36 0.00 0.00 0.00 0.00 175.10 175.93 2gag s ALA 730 N 1.40 3.57 -0.30 5.51 0.00 -0.37 -0.02 121.76 131.55 2gag s ALA 730 Ca 0.05 -0.65 -0.06 0.00 0.00 0.00 0.00 51.96 51.30 2gag s ALA 730 Cb -0.14 -2.61 0.02 0.00 0.00 0.00 0.00 23.12 20.39 2gag s ALA 730 CO -0.07 -0.38 0.08 0.08 0.00 0.00 0.00 175.76 175.47 2gag s VAL 731 N 1.47 3.86 -0.03 0.00 1.01 0.85 -1.59 120.40 125.97 2gag s VAL 731 Ca 0.16 -0.80 0.05 0.00 0.00 0.00 0.00 61.98 61.39 2gag s VAL 731 Cb -0.15 -3.03 -0.01 0.00 0.00 0.00 0.00 36.38 33.20 2gag s VAL 731 CO 0.08 0.03 -0.17 -0.69 0.00 0.00 0.00 175.10 174.35 2gag s VAL 732 N 1.47 1.40 0.00 2.92 1.01 -0.11 -0.71 120.40 126.38 2gag s VAL 732 Ca 0.02 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.26 2gag s VAL 732 Cb -0.18 -1.18 0.00 0.00 0.00 0.00 0.00 36.38 35.02 2gag s VAL 732 CO 0.02 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.13 2gag n GLY 733 N 2.87 2.53 0.37 4.51 0.00 0.28 0.19 105.19 115.94 2gag n GLY 733 Ca -0.16 -2.07 0.17 0.00 0.00 0.00 0.00 46.02 43.96 2gag n GLY 733 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gag h PRO 734 N 0.00 0.18 -0.42 1.61 0.13 -1.61 -1.00 132.00 130.89 2gag h PRO 734 Ca 0.00 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 2gag h PRO 734 Cb 0.00 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.09 2gag h PRO 734 CO 0.00 0.12 0.00 0.54 -0.23 0.00 0.00 178.00 178.43 2gag n ARG 735 N -4.43 2.03 -0.10 0.86 5.12 -0.11 -4.32 116.66 115.70 2gag n ARG 735 Ca 0.10 -1.59 -0.02 0.00 -1.93 0.00 0.00 57.85 54.41 2gag n ARG 735 Cb 0.51 -1.36 0.22 0.00 -1.16 0.00 0.00 32.46 30.67 2gag n ARG 735 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 2gag h SER 736 N 2.67 0.70 -0.42 0.55 4.64 -1.36 -1.49 113.55 118.84 2gag h SER 736 Ca 0.00 -0.12 -0.02 0.00 -0.47 0.00 0.00 61.79 61.18 2gag h SER 736 Cb 0.61 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.49 2gag h SER 736 CO 0.00 0.70 0.19 -0.09 -0.87 0.00 0.00 176.83 176.76 2gag h ARG 737 N 0.73 0.61 -0.92 4.77 2.43 -1.79 -0.58 114.38 119.63 2gag h ARG 737 Ca 0.16 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 2gag h ARG 737 Cb 0.28 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.68 2gag h ARG 737 CO -0.00 0.54 0.53 -0.44 -1.51 0.00 0.00 179.97 179.08 2gag h ASP 738 N 0.53 1.13 -0.11 -3.80 3.32 -1.71 -1.21 116.42 114.56 2gag h ASP 738 Ca 0.14 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 2gag h ASP 738 Cb 0.14 -0.29 -0.00 0.00 0.22 0.00 0.00 39.33 39.40 2gag h ASP 738 CO -0.02 0.89 0.02 0.58 -1.72 0.00 0.00 179.24 179.00 2gag h VAL 739 N 1.28 1.20 -0.98 -1.35 2.07 -0.87 -2.62 116.25 114.99 2gag h VAL 739 Ca 0.33 -0.63 0.02 0.00 0.82 0.00 0.00 66.70 67.23 2gag h VAL 739 Cb -0.01 1.41 -0.05 0.00 -1.52 0.00 0.00 31.29 31.12 2gag h VAL 739 CO -0.06 0.18 0.65 0.40 0.02 0.00 0.00 177.57 178.76 2gag h ILE 740 N -0.03 1.23 -0.81 4.57 1.08 -0.86 -1.66 117.51 121.04 2gag h ILE 740 Ca 0.04 -0.45 0.02 0.00 -0.39 0.00 0.00 64.86 64.07 2gag h ILE 740 Cb 0.27 -0.19 -0.04 0.00 -3.07 0.00 0.00 36.82 33.79 2gag h ILE 740 CO 0.00 0.24 0.53 0.00 -0.69 0.00 0.00 178.15 178.23 2gag h ALA 741 N 1.40 1.45 0.00 1.87 0.00 -1.08 0.14 119.26 123.04 2gag h ALA 741 Ca 0.36 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 2gag h ALA 741 Cb -0.12 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.36 2gag h ALA 741 CO -0.09 0.49 -0.11 0.87 0.00 0.00 0.00 179.25 180.42 2gag h LYS 742 N 1.06 0.00 0.02 0.00 1.57 -0.94 -3.08 116.57 115.20 2gag h LYS 742 Ca 0.30 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.79 2gag h LYS 742 Cb -0.07 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 2gag h LYS 742 CO -0.07 0.11 -1.69 -0.07 -0.57 0.00 0.00 179.45 177.15 2gag h LEU 743 N 0.00 0.07 -6.36 2.94 3.38 -0.44 -3.42 115.31 111.48 2gag h LEU 743 Ca -0.00 -0.15 -0.59 0.00 0.09 0.00 0.00 57.88 57.23 2gag h LEU 743 Cb 0.70 -0.02 -0.39 0.00 0.09 0.00 0.00 40.66 41.04 2gag h LEU 743 CO 0.01 1.14 -0.91 0.00 0.09 0.00 0.00 178.44 178.77 2gag n ALA 744 N -2.61 2.96 0.20 1.53 0.00 0.30 -0.63 120.51 122.26 2gag n ALA 744 Ca -0.18 -3.59 0.12 0.00 0.00 0.00 0.00 53.44 49.78 2gag n ALA 744 Cb 1.04 -0.83 0.62 0.00 0.00 0.00 0.00 19.45 20.28 2gag n ALA 744 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2gag h SER 745 N 4.99 0.00 0.02 0.00 4.64 -1.79 -0.79 113.55 120.61 2gag h SER 745 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 2gag h SER 745 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 2gag h SER 745 CO 0.50 0.00 -0.08 1.07 -0.87 0.00 0.00 176.83 177.45 2gag n THR 746 N -2.35 0.00 -4.03 2.95 5.66 -1.26 -4.92 114.28 110.33 2gag n THR 746 Ca -0.02 -0.31 -0.36 0.00 -3.05 0.00 0.00 64.05 60.32 2gag n THR 746 Cb 0.16 0.85 -0.08 0.00 -1.55 0.00 0.00 70.33 69.71 2gag n THR 746 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2gag s VAL 747 N -2.11 5.06 -0.51 1.08 1.01 -0.30 -5.05 120.40 119.57 2gag s VAL 747 Ca 0.31 0.04 -0.26 0.00 0.00 0.00 0.00 61.98 62.08 2gag s VAL 747 Cb 0.20 -3.21 0.03 0.00 0.00 0.00 0.00 36.38 33.41 2gag s VAL 747 CO 0.37 0.58 1.01 -0.62 0.00 0.00 0.00 175.10 176.44 2gag s ASP 748 N -0.68 6.47 -0.08 3.32 2.15 -1.26 -4.85 116.67 121.74 2gag s ASP 748 Ca 0.12 0.04 0.16 0.00 0.43 0.00 0.00 52.55 53.30 2gag s ASP 748 Cb -0.12 -2.48 0.55 0.00 -0.30 0.00 0.00 42.92 40.58 2gag s ASP 748 CO 0.02 -1.20 1.47 1.33 -0.17 0.00 0.00 175.17 176.62 2gag n VAL 749 N 6.47 1.58 -1.68 1.11 0.24 -1.26 -4.23 118.33 120.55 2gag n VAL 749 Ca 0.06 -1.24 -0.34 0.00 -2.04 0.00 0.00 64.34 60.78 2gag n VAL 749 Cb 0.48 0.21 0.06 0.00 -1.47 0.00 0.00 33.84 33.13 2gag n VAL 749 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2gag s SER 750 N -1.14 4.82 0.43 -1.34 1.04 -1.26 -4.72 113.70 111.53 2gag s SER 750 Ca 0.41 2.16 0.11 0.00 0.48 0.00 0.00 55.95 59.11 2gag s SER 750 Cb 0.26 -2.57 0.98 0.00 0.10 0.00 0.00 66.02 64.79 2gag s SER 750 CO 0.20 -1.83 2.03 -1.13 0.98 0.00 0.00 173.24 173.48 2gag h ASN 751 N 0.02 0.38 0.18 7.02 -0.00 -1.92 0.37 115.58 121.63 2gag h ASN 751 Ca -0.47 -0.00 -0.25 0.00 -0.00 0.00 0.00 56.30 55.58 2gag h ASN 751 Cb 1.27 -0.08 0.01 0.00 -0.00 0.00 0.00 38.32 39.52 2gag h ASN 751 CO 0.53 0.26 -1.01 -0.08 -0.00 0.00 0.00 177.43 177.13 2gag h GLU 752 N 0.44 0.56 -0.00 6.67 4.81 -1.98 -3.28 114.58 121.79 2gag h GLU 752 Ca 0.20 -0.61 0.00 0.00 -0.13 0.00 0.00 59.36 58.83 2gag h GLU 752 Cb 0.25 0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.81 2gag h GLU 752 CO -0.05 1.22 -0.50 0.41 -0.73 0.00 0.00 179.01 179.36 2gag n GLY 753 N 1.03 -1.13 2.58 1.92 0.00 -0.92 -4.58 105.19 104.10 2gag n GLY 753 Ca -0.09 -0.38 -0.21 0.00 0.00 0.00 0.00 46.02 45.34 2gag n GLY 753 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2gag s PHE 754 N -2.93 0.23 0.80 1.61 5.99 0.13 -4.86 117.98 118.95 2gag s PHE 754 Ca 0.13 -1.45 -0.12 0.00 0.00 0.00 0.00 56.93 55.49 2gag s PHE 754 Cb 0.18 -0.60 0.07 0.00 0.00 0.00 0.00 43.02 42.66 2gag s PHE 754 CO 0.69 -0.93 1.11 0.15 -0.00 0.00 0.00 175.22 176.24 2gag s LYS 755 N 0.86 2.10 0.28 10.12 1.02 -1.24 -4.45 119.74 128.43 2gag s LYS 755 Ca 0.23 0.50 -0.30 0.00 0.02 0.00 0.00 55.97 56.42 2gag s LYS 755 Cb -0.10 -1.93 -0.12 0.00 -0.52 0.00 0.00 37.83 35.16 2gag s LYS 755 CO -0.07 -1.58 1.58 0.34 -0.92 0.00 0.00 175.35 174.71 2gag n PHE 756 N -3.38 2.75 -1.16 3.18 7.35 -1.26 -1.98 117.46 122.96 2gag n PHE 756 Ca 0.07 0.26 -0.05 0.00 -0.76 0.00 0.00 57.45 56.96 2gag n PHE 756 Cb 0.57 -2.59 -0.02 0.00 0.35 0.00 0.00 39.48 37.79 2gag n PHE 756 CO 0.00 0.00 0.00 -1.33 -0.76 0.00 0.00 176.76 174.67 2gag n MET 757 N 2.33 -1.05 -3.60 -4.13 2.81 -0.01 -4.97 117.12 108.50 2gag n MET 757 Ca 0.10 0.58 -0.20 0.00 -1.81 0.00 0.00 57.70 56.36 2gag n MET 757 Cb 0.36 -4.53 -0.01 0.00 -0.71 0.00 0.00 33.22 28.33 2gag n MET 757 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2gag s ALA 758 N -1.86 4.09 0.04 3.04 0.00 -0.84 -0.08 121.76 126.15 2gag s ALA 758 Ca 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 51.96 50.62 2gag s ALA 758 Cb 0.00 -1.74 -0.03 0.00 0.00 0.00 0.00 23.12 21.35 2gag s ALA 758 CO 0.00 0.04 -0.04 -0.59 0.00 0.00 0.00 175.76 175.17 2gag s PHE 759 N -2.14 0.47 -0.01 0.00 -0.12 -0.25 -1.08 117.98 114.86 2gag s PHE 759 Ca 0.41 -0.77 0.02 0.00 -0.05 0.00 0.00 56.93 56.54 2gag s PHE 759 Cb -0.09 -0.33 -0.00 0.00 -0.63 0.00 0.00 43.02 41.97 2gag s PHE 759 CO 0.31 -0.24 -0.06 0.15 -0.05 0.00 0.00 175.22 175.32 2gag s LYS 760 N -2.65 0.51 -0.24 1.99 1.02 0.37 -4.83 119.74 115.92 2gag s LYS 760 Ca -0.04 -0.21 -0.19 0.00 0.02 0.00 0.00 55.97 55.55 2gag s LYS 760 Cb -0.02 -0.50 -0.03 0.00 -0.52 0.00 0.00 37.83 36.77 2gag s LYS 760 CO -0.05 0.12 0.57 -0.51 -0.92 0.00 0.00 175.35 174.57 2gag s ASP 761 N -0.10 6.54 0.31 2.83 1.01 -1.26 -1.19 116.67 124.81 2gag s ASP 761 Ca 0.02 0.66 0.03 0.00 0.71 0.00 0.00 52.55 53.97 2gag s ASP 761 Cb -0.03 -2.31 -0.04 0.00 1.01 0.00 0.00 42.92 41.55 2gag s ASP 761 CO -0.00 -0.29 0.16 0.68 0.21 0.00 0.00 175.17 175.92 2gag s VAL 762 N 2.17 0.36 -0.18 -1.27 -7.23 0.16 -5.00 120.40 109.40 2gag s VAL 762 Ca 0.24 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.42 2gag s VAL 762 Cb -0.16 -2.51 0.01 0.00 0.56 0.00 0.00 36.38 34.28 2gag s VAL 762 CO 0.09 0.00 -0.17 -0.69 -0.31 0.00 0.00 175.10 174.02 2gag s VAL 763 N -3.59 2.34 0.74 1.32 1.01 -1.26 -0.86 120.40 120.09 2gag s VAL 763 Ca 0.35 -0.85 -0.11 0.00 0.00 0.00 0.00 61.98 61.37 2gag s VAL 763 Cb 0.05 -1.99 0.04 0.00 0.00 0.00 0.00 36.38 34.47 2gag s VAL 763 CO 0.17 0.52 1.08 -0.76 0.00 0.00 0.00 175.10 176.11 2gag s LEU 764 N 1.23 2.93 0.54 3.92 1.43 -0.01 -4.83 118.68 123.89 2gag s LEU 764 Ca 0.03 1.56 0.24 0.00 -1.03 0.00 0.00 54.13 54.92 2gag s LEU 764 Cb -0.14 -4.32 1.43 0.00 0.03 0.00 0.00 46.19 43.20 2gag s LEU 764 CO -0.09 -1.73 2.06 0.44 0.23 0.00 0.00 176.35 177.26 2gag h ASP 765 N -0.92 0.00 0.63 2.29 3.32 -1.20 0.13 116.42 120.67 2gag h ASP 765 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2gag h ASP 765 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 2gag h ASP 765 CO 0.57 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 176.55 2gag n SER 766 N -4.26 0.32 0.00 6.45 3.41 -1.26 -4.86 113.62 113.42 2gag n SER 766 Ca 0.04 0.58 0.00 0.00 -0.26 0.00 0.00 58.87 59.23 2gag n SER 766 Cb 0.40 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 2gag n SER 766 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gag n GLY 767 N 0.05 1.83 3.71 5.00 0.00 0.44 -5.06 105.19 111.15 2gag n GLY 767 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2gag n GLY 767 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gag s ILE 768 N -2.49 3.70 0.29 -0.61 1.01 -1.26 -4.70 121.20 117.13 2gag s ILE 768 Ca 0.00 1.19 -0.28 0.00 0.00 0.00 0.00 60.65 61.56 2gag s ILE 768 Cb 0.00 -3.77 -0.09 0.00 0.01 0.00 0.00 42.46 38.61 2gag s ILE 768 CO 0.00 0.07 0.96 -1.61 0.00 0.00 0.00 174.94 174.37 2gag s GLU 769 N 1.37 4.69 0.16 2.79 2.02 -1.26 -0.83 118.70 127.63 2gag s GLU 769 Ca 0.62 1.46 -0.17 0.00 0.02 0.00 0.00 54.97 56.90 2gag s GLU 769 Cb -0.32 -3.04 0.03 0.00 0.10 0.00 0.00 34.13 30.89 2gag s GLU 769 CO 0.29 0.36 0.46 0.00 0.02 0.00 0.00 175.26 176.38 2gag s ALA 770 N -1.37 -0.92 -0.18 5.21 0.00 -0.04 -4.61 121.76 119.84 2gag s ALA 770 Ca 0.46 -0.13 -0.02 0.00 0.00 0.00 0.00 51.96 52.27 2gag s ALA 770 Cb -0.24 0.78 -0.01 0.00 0.00 0.00 0.00 23.12 23.65 2gag s ALA 770 CO 0.30 -0.71 -0.08 0.50 0.00 0.00 0.00 175.76 175.76 2gag s ARG 771 N -3.84 3.39 -0.19 0.00 3.52 -0.18 -0.67 118.95 120.98 2gag s ARG 771 Ca 0.06 -0.64 -0.05 0.00 -0.13 0.00 0.00 55.73 54.97 2gag s ARG 771 Cb 0.01 -2.86 -0.03 0.00 -1.56 0.00 0.00 34.95 30.51 2gag s ARG 771 CO -0.08 -0.03 -0.00 0.42 -0.81 0.00 0.00 175.30 174.81 2gag s ILE 772 N 1.00 3.99 -0.05 4.11 1.01 -0.33 -0.68 121.20 130.25 2gag s ILE 772 Ca -0.00 -0.30 0.06 0.00 0.00 0.00 0.00 60.65 60.40 2gag s ILE 772 Cb -0.15 -2.80 -0.01 0.00 0.01 0.00 0.00 42.46 39.51 2gag s ILE 772 CO -0.00 0.44 -0.24 -0.44 0.00 0.00 0.00 174.94 174.69 2gag s SER 773 N 0.90 2.93 -1.18 3.58 0.01 -0.39 -0.47 113.70 119.09 2gag s SER 773 Ca 0.01 -0.48 -0.15 0.00 1.31 0.00 0.00 55.95 56.64 2gag s SER 773 Cb -0.14 -0.76 0.16 0.00 0.21 0.00 0.00 66.02 65.49 2gag s SER 773 CO 0.02 0.24 1.41 -0.13 0.41 0.00 0.00 173.24 175.19 2gag s ARG 774 N -0.18 4.03 -0.09 12.44 0.52 -0.24 -0.66 118.95 134.76 2gag s ARG 774 Ca -0.02 -2.45 0.04 0.00 -0.52 0.00 0.00 55.73 52.77 2gag s ARG 774 Cb -0.13 -5.07 -0.01 0.00 0.52 0.00 0.00 34.95 30.26 2gag s ARG 774 CO 0.03 -1.79 -0.21 0.42 0.02 0.00 0.00 175.30 173.76 2gag s ILE 775 N 1.86 2.34 -0.03 1.52 1.01 -1.24 -0.83 121.20 125.83 2gag s ILE 775 Ca 0.42 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 60.16 2gag s ILE 775 Cb -0.03 -1.91 0.01 0.00 0.01 0.00 0.00 42.46 40.54 2gag s ILE 775 CO -0.01 0.56 -0.09 -0.55 0.00 0.00 0.00 174.94 174.85 2gag s SER 776 N 0.13 1.31 -0.20 3.58 0.15 -1.26 -4.48 113.70 112.92 2gag s SER 776 Ca -0.11 -0.21 0.14 0.00 0.70 0.00 0.00 55.95 56.48 2gag s SER 776 Cb -0.16 -0.43 0.46 0.00 -1.71 0.00 0.00 66.02 64.18 2gag s SER 776 CO 0.06 0.05 1.35 0.33 1.20 0.00 0.00 173.24 176.24 2gag n PHE 777 N 3.46 0.68 0.00 3.44 7.35 -1.26 -4.60 117.46 126.53 2gag n PHE 777 Ca -0.20 -1.19 0.00 0.00 -0.76 0.00 0.00 57.45 55.31 2gag n PHE 777 Cb 0.53 -0.32 0.00 0.00 0.35 0.00 0.00 39.48 40.04 2gag n PHE 777 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 2gag n SER 778 N -0.97 0.56 0.00 -2.13 3.41 -1.26 -3.57 113.62 109.65 2gag n SER 778 Ca 0.24 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 2gag n SER 778 Cb 0.86 0.30 0.00 0.00 -0.26 0.00 0.00 64.21 65.11 2gag n SER 778 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gag n GLY 779 N 0.47 1.38 3.95 5.00 0.00 -1.26 -4.75 105.19 109.97 2gag n GLY 779 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2gag n GLY 779 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gag s GLU 780 N -0.50 3.36 0.43 1.61 0.41 -1.26 -3.72 118.70 119.03 2gag s GLU 780 Ca 0.00 -0.40 -0.26 0.00 -0.41 0.00 0.00 54.97 53.90 2gag s GLU 780 Cb 0.00 -2.64 -0.09 0.00 -1.78 0.00 0.00 34.13 29.62 2gag s GLU 780 CO 0.00 0.03 1.45 -0.11 -0.49 0.00 0.00 175.26 176.15 2gag n LEU 781 N -1.86 5.02 -3.59 1.80 7.94 -1.21 -4.75 117.00 120.35 2gag n LEU 781 Ca -0.03 1.16 -0.16 0.00 -1.11 0.00 0.00 56.01 55.87 2gag n LEU 781 Cb 0.57 -1.61 -0.07 0.00 0.53 0.00 0.00 43.42 42.84 2gag n LEU 781 CO 0.48 -0.05 0.36 0.00 -1.11 0.00 0.00 177.39 177.08 2gag s ALA 782 N -1.17 -1.61 -0.08 1.96 0.00 -1.26 -0.56 121.76 119.04 2gag s ALA 782 Ca 0.58 1.37 0.01 0.00 0.00 0.00 0.00 51.96 53.92 2gag s ALA 782 Cb -0.46 -0.33 0.02 0.00 0.00 0.00 0.00 23.12 22.35 2gag s ALA 782 CO 0.60 -0.34 -0.08 -0.06 0.00 0.00 0.00 175.76 175.88 2gag s PHE 783 N -0.72 1.23 -0.25 0.00 0.08 0.11 -3.63 117.98 114.80 2gag s PHE 783 Ca -0.08 -0.50 -0.08 0.00 0.12 0.00 0.00 56.93 56.39 2gag s PHE 783 Cb -0.02 -1.02 -0.03 0.00 -0.57 0.00 0.00 43.02 41.38 2gag s PHE 783 CO 0.06 -0.35 0.09 -1.21 -0.10 0.00 0.00 175.22 173.71 2gag s GLU 784 N 1.25 3.74 -0.35 0.44 2.02 0.16 -0.10 118.70 125.86 2gag s GLU 784 Ca -0.04 -0.44 -0.14 0.00 0.02 0.00 0.00 54.97 54.37 2gag s GLU 784 Cb -0.14 -3.36 -0.01 0.00 0.10 0.00 0.00 34.13 30.72 2gag s GLU 784 CO -0.02 -0.13 0.31 0.42 0.02 0.00 0.00 175.26 175.86 2gag s ILE 785 N 1.47 5.22 -0.18 -1.63 1.01 0.98 -1.26 121.20 126.81 2gag s ILE 785 Ca 0.06 -0.09 -0.03 0.00 0.00 0.00 0.00 60.65 60.59 2gag s ILE 785 Cb -0.15 -3.79 -0.02 0.00 0.01 0.00 0.00 42.46 38.52 2gag s ILE 785 CO 0.05 -0.07 -0.05 0.00 0.00 0.00 0.00 174.94 174.86 2gag s ALA 786 N 1.89 2.86 0.13 9.38 0.00 0.15 -0.81 121.76 135.36 2gag s ALA 786 Ca 0.09 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 51.07 2gag s ALA 786 Cb -0.17 -1.58 -0.04 0.00 0.00 0.00 0.00 23.12 21.33 2gag s ALA 786 CO 0.11 -0.08 -0.01 0.14 0.00 0.00 0.00 175.76 175.92 2gag s VAL 787 N 0.89 0.55 0.32 0.00 -7.23 -0.58 -1.01 120.40 113.35 2gag s VAL 787 Ca -0.01 -1.94 -0.27 0.00 -1.81 0.00 0.00 61.98 57.95 2gag s VAL 787 Cb -0.15 -1.93 -0.13 0.00 0.56 0.00 0.00 36.38 34.73 2gag s VAL 787 CO 0.01 -0.63 1.05 -2.65 -0.31 0.00 0.00 175.10 172.57 2gag n PRO 788 N -0.13 1.48 -0.22 4.82 -0.02 -1.26 -0.54 135.00 139.14 2gag n PRO 788 Ca -0.09 0.52 0.13 0.00 -2.02 0.00 0.00 63.50 62.05 2gag n PRO 788 Cb 0.62 -1.96 0.44 0.00 -0.02 0.00 0.00 33.50 32.58 2gag n PRO 788 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2gag h ALA 789 N 2.00 1.96 0.00 3.55 0.00 -0.52 -0.80 119.26 125.46 2gag h ALA 789 Ca -0.41 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2gag h ALA 789 Cb 1.33 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2gag h ALA 789 CO 0.60 -0.18 0.00 -2.67 0.00 0.00 0.00 179.25 177.00 2gag n TRP 790 N -4.52 0.00 0.99 0.00 2.14 -1.26 -1.39 117.44 113.40 2gag n TRP 790 Ca 0.16 0.00 0.11 0.00 2.07 0.00 0.00 57.50 59.84 2gag n TRP 790 Cb 0.49 -0.05 0.05 0.00 -0.81 0.00 0.00 31.31 30.99 2gag n TRP 790 CO 0.00 0.00 0.00 0.72 2.07 0.00 0.00 177.69 180.48 2gag n HIS 791 N -1.05 0.00 -0.03 -2.67 8.25 -0.30 -4.66 115.22 114.76 2gag n HIS 791 Ca 0.11 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.49 2gag n HIS 791 Cb 0.07 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.15 2gag n HIS 791 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2gag h GLY 792 N 4.74 -0.04 0.98 -1.41 0.00 -1.33 -2.18 103.07 103.83 2gag h GLY 792 Ca 0.00 0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.53 2gag h GLY 792 CO 0.00 -0.16 0.19 -2.00 0.00 0.00 0.00 176.54 174.56 2gag h LEU 793 N -0.17 0.36 -0.85 3.11 5.85 -1.82 -1.48 115.31 120.30 2gag h LEU 793 Ca 0.12 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.82 2gag h LEU 793 Cb 0.35 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 2gag h LEU 793 CO -0.30 0.30 0.56 -0.09 -0.34 0.00 0.00 178.44 178.57 2gag h ARG 794 N 0.39 1.08 -0.20 1.25 9.65 -1.83 -0.58 114.38 124.14 2gag h ARG 794 Ca 0.11 -0.07 -0.12 0.00 -1.10 0.00 0.00 59.98 58.81 2gag h ARG 794 Cb -0.00 -0.24 -0.01 0.00 -1.39 0.00 0.00 29.97 28.32 2gag h ARG 794 CO -0.02 0.72 -0.37 0.28 2.80 0.00 0.00 179.97 183.38 2gag h VAL 795 N 1.11 1.29 -0.11 0.20 2.07 -1.22 -0.75 116.25 118.84 2gag h VAL 795 Ca 0.32 -1.48 -0.01 0.00 0.82 0.00 0.00 66.70 66.36 2gag h VAL 795 Cb -0.07 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 31.24 2gag h VAL 795 CO -0.09 0.46 0.05 -0.25 0.02 0.00 0.00 177.57 177.76 2gag h TRP 796 N 0.37 0.16 -0.71 1.57 2.91 -0.51 -0.06 115.95 119.68 2gag h TRP 796 Ca 0.04 -0.01 0.02 0.00 1.13 0.00 0.00 58.89 60.06 2gag h TRP 796 Cb 0.82 -0.05 -0.04 0.00 -0.51 0.00 0.00 29.16 29.38 2gag h TRP 796 CO 0.03 0.25 0.46 0.93 -1.03 0.00 0.00 178.44 179.08 2gag h GLU 797 N 0.03 0.90 -0.40 2.65 5.08 -0.94 -0.30 114.58 121.61 2gag h GLU 797 Ca 0.04 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.25 2gag h GLU 797 Cb 0.16 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 2gag h GLU 797 CO -0.00 0.60 -0.14 -0.44 -1.00 0.00 0.00 179.01 178.02 2gag h ASP 798 N 0.93 0.73 -0.39 1.42 3.32 -0.89 -0.78 116.42 120.76 2gag h ASP 798 Ca 0.27 -0.23 -0.11 0.00 0.02 0.00 0.00 57.03 56.98 2gag h ASP 798 Cb -0.06 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.28 2gag h ASP 798 CO -0.08 0.88 -0.20 0.58 -1.72 0.00 0.00 179.24 178.71 2gag h VAL 799 N 0.66 1.28 -0.43 -1.35 2.07 -0.54 -0.24 116.25 117.70 2gag h VAL 799 Ca 0.11 -1.34 0.02 0.00 0.82 0.00 0.00 66.70 66.31 2gag h VAL 799 Cb 0.62 1.31 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 2gag h VAL 799 CO 0.04 0.45 0.25 0.22 0.02 0.00 0.00 177.57 178.54 2gag h TYR 800 N 0.62 0.46 -0.25 1.57 3.20 -0.79 -0.57 116.97 121.21 2gag h TYR 800 Ca 0.08 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.93 2gag h TYR 800 Cb 0.76 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.87 2gag h TYR 800 CO 0.06 0.26 -0.01 0.00 -1.64 0.00 0.00 178.16 176.83 2gag h ALA 801 N 1.19 0.34 0.00 1.82 0.00 -1.02 -2.48 119.26 119.11 2gag h ALA 801 Ca 0.17 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2gag h ALA 801 Cb 0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2gag h ALA 801 CO -0.08 0.09 -0.17 0.00 0.00 0.00 0.00 179.25 179.08 2gag h ALA 802 N 0.80 1.59 -0.01 0.00 0.00 -0.79 -2.59 119.26 118.25 2gag h ALA 802 Ca 0.07 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2gag h ALA 802 Cb 0.44 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2gag h ALA 802 CO 0.02 0.21 -0.26 0.41 0.00 0.00 0.00 179.25 179.63 2gag n GLY 803 N -0.93 -0.30 0.31 0.00 0.00 -0.24 -4.43 105.19 99.60 2gag n GLY 803 Ca -0.02 -0.48 0.10 0.00 0.00 0.00 0.00 46.02 45.62 2gag n GLY 803 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2gag h GLU 804 N 1.82 0.48 0.00 1.61 4.81 -1.03 0.32 114.58 122.60 2gag h GLU 804 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2gag h GLU 804 Cb 0.59 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.86 2gag h GLU 804 CO 0.00 0.32 0.00 -0.85 -0.73 0.00 0.00 179.01 177.75 2gag n GLU 805 N -4.97 0.14 -0.38 1.92 0.28 -1.26 -1.80 120.64 114.56 2gag n GLU 805 Ca 0.20 0.46 0.09 0.00 -0.16 0.00 0.00 57.16 57.74 2gag n GLU 805 Cb 0.55 -1.82 0.24 0.00 1.43 0.00 0.00 31.44 31.84 2gag n GLU 805 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 2gag n PHE 806 N -2.09 0.78 -3.76 -1.84 3.72 0.04 -4.96 117.46 109.34 2gag n PHE 806 Ca 0.01 -0.91 -0.27 0.00 -0.05 0.00 0.00 57.45 56.23 2gag n PHE 806 Cb 0.16 -0.29 0.05 0.00 -0.94 0.00 0.00 39.48 38.46 2gag n PHE 806 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2gag n ASN 807 N -0.69 -5.24 -4.66 4.37 5.15 -0.75 -4.25 115.26 109.19 2gag n ASN 807 Ca 0.21 -0.68 -0.50 0.00 -0.60 0.00 0.00 54.58 53.01 2gag n ASN 807 Cb 0.85 -4.41 -0.05 0.00 -0.53 0.00 0.00 39.78 35.64 2gag n ASN 807 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2gag n ILE 808 N -4.79 0.23 -3.90 -1.44 3.06 -0.79 -4.74 119.36 106.98 2gag n ILE 808 Ca 0.00 -0.04 -0.35 0.00 -2.50 0.00 0.00 62.75 59.86 2gag n ILE 808 Cb 0.55 -1.45 -0.14 0.00 0.54 0.00 0.00 39.64 39.14 2gag n ILE 808 CO 0.00 0.00 0.00 -0.89 -2.50 0.00 0.00 176.55 173.16 2gag s THR 809 N 2.21 3.40 0.37 9.51 2.01 -0.45 -4.90 115.64 127.79 2gag s THR 809 Ca 0.87 -0.53 -0.26 0.00 0.31 0.00 0.00 61.69 62.08 2gag s THR 809 Cb -0.80 -2.57 -0.09 0.00 0.01 0.00 0.00 72.50 69.05 2gag s THR 809 CO 0.48 0.39 1.19 -2.16 -0.69 0.00 0.00 174.62 173.83 2gag s PRO 810 N 1.47 4.17 0.11 4.92 0.04 -1.26 -1.68 135.00 142.77 2gag s PRO 810 Ca 0.05 1.90 -0.01 0.00 0.04 0.00 0.00 61.00 62.98 2gag s PRO 810 Cb -0.15 -2.80 -0.04 0.00 0.04 0.00 0.00 34.50 31.55 2gag s PRO 810 CO -0.03 -0.24 0.04 1.52 0.04 0.00 0.00 177.00 178.34 2gag s TYR 811 N -1.34 0.77 0.00 0.56 -0.85 -0.24 -4.69 117.35 111.56 2gag s TYR 811 Ca 0.54 -1.18 0.00 0.00 -0.52 0.00 0.00 57.07 55.91 2gag s TYR 811 Cb -0.32 -0.44 0.00 0.00 0.38 0.00 0.00 41.96 41.57 2gag s TYR 811 CO 0.41 -0.49 0.00 0.41 -1.52 0.00 0.00 175.55 174.36 2gag n GLY 812 N -0.05 5.17 0.33 5.49 0.00 -1.25 -4.40 105.19 110.48 2gag n GLY 812 Ca -0.08 -1.61 -0.00 0.00 0.00 0.00 0.00 46.02 44.34 2gag n GLY 812 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2gag h THR 813 N 0.00 1.20 -0.08 2.61 1.35 -0.83 -1.39 112.91 115.76 2gag h THR 813 Ca 0.00 -0.47 -0.01 0.00 -0.55 0.00 0.00 66.41 65.38 2gag h THR 813 Cb 0.00 0.29 -0.00 0.00 -1.73 0.00 0.00 68.15 66.71 2gag h THR 813 CO 0.00 0.21 0.01 -0.08 -0.25 0.00 0.00 175.52 175.42 2gag h GLU 814 N 0.92 0.14 -0.41 4.72 4.57 -1.58 0.34 114.58 123.27 2gag h GLU 814 Ca 0.24 -0.04 -0.10 0.00 -1.18 0.00 0.00 59.36 58.28 2gag h GLU 814 Cb 0.01 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 2gag h GLU 814 CO -0.04 0.36 -0.16 1.15 -1.18 0.00 0.00 179.01 179.14 2gag h THR 815 N -0.11 1.26 -0.59 0.32 2.02 -1.74 -0.48 112.91 113.59 2gag h THR 815 Ca 0.02 -1.24 0.06 0.00 0.77 0.00 0.00 66.41 66.03 2gag h THR 815 Cb 0.29 1.12 -0.05 0.00 -1.74 0.00 0.00 68.15 67.77 2gag h THR 815 CO 0.00 0.42 0.30 -0.03 0.37 0.00 0.00 175.52 176.58 2gag h MET 816 N 0.68 0.55 -0.67 6.66 1.85 -1.07 -0.24 114.93 122.69 2gag h MET 816 Ca 0.11 -0.03 -0.01 0.00 -0.61 0.00 0.00 59.70 59.15 2gag h MET 816 Cb 0.65 -0.12 -0.03 0.00 0.43 0.00 0.00 31.60 32.52 2gag h MET 816 CO 0.05 0.36 0.37 0.45 -0.40 0.00 0.00 176.91 177.74 2gag h HIS 817 N 0.56 0.91 0.05 1.39 -0.00 -0.15 -2.09 115.15 115.83 2gag h HIS 817 Ca 0.27 -0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.62 2gag h HIS 817 Cb 0.20 -0.29 0.00 0.00 -0.00 0.00 0.00 27.41 27.31 2gag h HIS 817 CO -0.10 0.64 -0.03 0.28 -0.00 0.00 0.00 177.93 178.73 2gag h VAL 818 N 0.91 1.00 -0.66 2.45 2.07 -0.27 -2.10 116.25 119.65 2gag h VAL 818 Ca 0.24 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 67.57 2gag h VAL 818 Cb 0.03 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 2gag h VAL 818 CO -0.04 0.04 0.35 -0.07 0.02 0.00 0.00 177.57 177.87 2gag h LEU 819 N -0.15 0.84 -0.83 2.57 3.38 -0.96 -1.52 115.31 118.65 2gag h LEU 819 Ca -0.01 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 2gag h LEU 819 Cb 0.12 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2gag h LEU 819 CO 0.01 0.71 -0.52 0.08 0.09 0.00 0.00 178.44 178.81 2gag h ARG 820 N 0.91 0.17 -0.13 1.13 -0.00 -1.40 -2.92 114.38 112.13 2gag h ARG 820 Ca 0.23 -0.10 -0.12 0.00 -0.00 0.00 0.00 59.98 60.00 2gag h ARG 820 Cb 0.07 0.01 -0.01 0.00 -0.00 0.00 0.00 29.97 30.04 2gag h ARG 820 CO -0.03 0.65 -0.43 0.00 -0.00 0.00 0.00 179.97 180.15 2gag h ALA 821 N 1.33 1.02 0.00 0.08 0.00 -0.83 -1.61 119.26 119.26 2gag h ALA 821 Ca 0.00 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 2gag h ALA 821 Cb 0.96 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 2gag h ALA 821 CO 0.08 0.62 -0.03 0.93 0.00 0.00 0.00 179.25 180.84 2gag h GLU 822 N 0.26 0.00 -0.32 0.00 5.08 -1.10 -1.17 114.58 117.34 2gag h GLU 822 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2gag h GLU 822 Cb 0.87 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.12 2gag h GLU 822 CO 0.07 0.03 0.00 1.63 -1.00 0.00 0.00 179.01 179.74 2gag n LYS 823 N -3.33 2.22 -1.22 2.33 4.76 -0.83 -0.56 118.16 121.54 2gag n LYS 823 Ca -0.02 -2.04 -0.07 0.00 -2.87 0.00 0.00 58.31 53.30 2gag n LYS 823 Cb 0.16 -1.41 -0.03 0.00 -1.84 0.00 0.00 35.03 31.90 2gag n LYS 823 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2gag n GLY 824 N 1.15 0.92 3.74 0.72 0.00 -0.44 -4.64 105.19 106.64 2gag n GLY 824 Ca 0.15 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 2gag n GLY 824 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gag s PHE 825 N -2.14 3.83 0.55 1.61 0.08 -0.67 -4.92 117.98 116.33 2gag s PHE 825 Ca 0.00 1.81 -0.16 0.00 0.12 0.00 0.00 56.93 58.70 2gag s PHE 825 Cb 0.00 -3.08 -0.06 0.00 -0.57 0.00 0.00 43.02 39.31 2gag s PHE 825 CO 0.00 0.13 1.01 0.96 -0.10 0.00 0.00 175.22 177.22 2gag s ILE 826 N -0.54 4.32 -0.23 0.64 -4.36 -1.26 -4.53 121.20 115.24 2gag s ILE 826 Ca 0.45 1.07 0.02 0.00 -0.26 0.00 0.00 60.65 61.93 2gag s ILE 826 Cb -0.26 -3.62 0.05 0.00 1.25 0.00 0.00 42.46 39.88 2gag s ILE 826 CO 0.32 -0.67 -0.12 -0.63 0.24 0.00 0.00 174.94 174.08 2gag s ILE 827 N -2.62 1.96 0.20 8.37 1.09 -1.26 -5.01 121.20 123.93 2gag s ILE 827 Ca 0.60 -1.33 -0.32 0.00 -1.10 0.00 0.00 60.65 58.50 2gag s ILE 827 Cb -0.12 -2.02 -0.13 0.00 -1.06 0.00 0.00 42.46 39.12 2gag s ILE 827 CO 0.35 0.11 1.54 0.52 -0.10 0.00 0.00 174.94 177.36 2gag n VAL 828 N 4.55 0.40 0.00 2.92 0.31 -1.26 -1.16 118.33 124.08 2gag n VAL 828 Ca -0.15 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 2gag n VAL 828 Cb 0.45 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.78 2gag n VAL 828 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2gag n GLY 829 N 2.94 3.35 0.39 2.92 0.00 -1.01 -4.80 105.19 108.98 2gag n GLY 829 Ca 0.14 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.06 2gag n GLY 829 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2gag n GLN 830 N -2.00 0.38 0.00 1.61 7.27 -0.31 -4.61 117.38 119.72 2gag n GLN 830 Ca 0.00 0.16 0.13 0.00 0.07 0.00 0.00 57.00 57.36 2gag n GLN 830 Cb 0.00 -1.16 0.41 0.00 2.41 0.00 0.00 30.24 31.90 2gag n GLN 830 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 2gag n ASP 831 N -4.08 1.68 -4.14 1.69 8.00 -0.37 -4.80 116.55 114.53 2gag n ASP 831 Ca -0.18 -1.48 -0.20 0.00 0.71 0.00 0.00 54.79 53.64 2gag n ASP 831 Cb 0.48 0.04 -0.14 0.00 -0.02 0.00 0.00 41.12 41.48 2gag n ASP 831 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2gag s THR 832 N -2.11 1.11 -0.02 -3.53 -4.23 -1.25 -4.96 115.64 100.65 2gag s THR 832 Ca 0.33 -0.92 0.03 0.00 -1.18 0.00 0.00 61.69 59.95 2gag s THR 832 Cb 0.20 -0.99 0.04 0.00 1.34 0.00 0.00 72.50 73.09 2gag s THR 832 CO 0.37 0.06 0.85 -0.90 -0.54 0.00 0.00 174.62 174.46 2gag n ASP 833 N 2.06 0.61 0.00 3.99 5.68 -1.26 -2.40 116.55 125.23 2gag n ASP 833 Ca -0.17 -1.80 0.00 0.00 -0.50 0.00 0.00 54.79 52.31 2gag n ASP 833 Cb 0.55 -0.14 0.00 0.00 -1.14 0.00 0.00 41.12 40.39 2gag n ASP 833 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2gag n GLY 834 N -0.28 0.33 0.16 6.12 0.00 -1.26 -4.86 105.19 105.40 2gag n GLY 834 Ca 0.02 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.06 2gag n GLY 834 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gag n THR 835 N -2.00 0.85 -3.93 2.61 -2.24 -1.26 -4.84 114.28 103.47 2gag n THR 835 Ca 0.00 -0.93 -0.35 0.00 -2.27 0.00 0.00 64.05 60.50 2gag n THR 835 Cb 0.00 0.58 -0.11 0.00 -2.10 0.00 0.00 70.33 68.70 2gag n THR 835 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2gag s VAL 836 N -0.89 4.49 0.41 2.28 1.01 -1.26 -5.02 120.40 121.42 2gag s VAL 836 Ca 0.06 -0.13 0.02 0.00 0.00 0.00 0.00 61.98 61.93 2gag s VAL 836 Cb 0.03 -3.05 -0.01 0.00 0.00 0.00 0.00 36.38 33.35 2gag s VAL 836 CO 0.04 0.40 0.61 0.42 0.00 0.00 0.00 175.10 176.57 2gag s THR 837 N 0.98 4.11 0.34 3.92 -4.23 -1.26 -0.89 115.64 118.61 2gag s THR 837 Ca 0.04 -0.61 0.05 0.00 -1.18 0.00 0.00 61.69 59.98 2gag s THR 837 Cb -0.14 -3.49 0.29 0.00 1.34 0.00 0.00 72.50 70.50 2gag s THR 837 CO 0.03 -0.31 1.92 -0.65 -0.54 0.00 0.00 174.62 175.07 2gag h PRO 838 N 0.54 0.82 -0.32 3.99 0.11 -1.91 -1.52 132.00 133.71 2gag h PRO 838 Ca -0.46 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 2gag h PRO 838 Cb 1.25 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 2gag h PRO 838 CO 0.57 0.54 0.05 1.96 -0.21 0.00 0.00 178.00 180.90 2gag h GLN 839 N 0.84 0.54 -0.79 1.05 7.50 -1.94 0.11 115.11 122.42 2gag h GLN 839 Ca 0.37 -0.15 0.09 0.00 0.50 0.00 0.00 58.65 59.46 2gag h GLN 839 Cb 0.34 -0.06 -0.05 0.00 0.05 0.00 0.00 27.48 27.76 2gag h GLN 839 CO -0.14 0.63 0.52 -0.44 -1.50 0.00 0.00 178.83 177.89 2gag h ASP 840 N 0.36 0.67 0.00 1.46 3.32 -1.63 -0.50 116.42 120.11 2gag h ASP 840 Ca 0.10 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2gag h ASP 840 Cb 0.36 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.78 2gag h ASP 840 CO 0.01 0.41 0.00 0.00 -1.72 0.00 0.00 179.24 177.94 2gag n ALA 841 N -2.44 2.57 -0.82 3.45 0.00 -0.66 -0.64 120.51 121.96 2gag n ALA 841 Ca 0.13 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2gag n ALA 841 Cb 0.30 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.53 2gag n ALA 841 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gag n GLY 842 N 0.70 0.52 2.35 0.00 0.00 -0.19 -4.74 105.19 103.83 2gag n GLY 842 Ca 0.10 -0.62 -0.29 0.00 0.00 0.00 0.00 46.02 45.22 2gag n GLY 842 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2gag n MET 843 N -2.82 3.29 -0.27 1.61 2.81 0.34 -4.76 117.12 117.32 2gag n MET 843 Ca 0.00 -4.07 0.17 0.00 -1.81 0.00 0.00 57.70 51.99 2gag n MET 843 Cb 0.00 -2.27 0.45 0.00 -0.71 0.00 0.00 33.22 30.69 2gag n MET 843 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 2gag h GLU 844 N 2.41 0.51 -0.01 0.03 4.57 -1.80 -0.63 114.58 119.66 2gag h GLU 844 Ca 0.41 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.56 2gag h GLU 844 Cb 1.00 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.48 2gag h GLU 844 CO 1.01 0.34 0.02 0.11 -1.18 0.00 0.00 179.01 179.31 2gag h TRP 845 N 0.53 0.00 -0.00 0.92 5.08 -1.94 -1.91 115.95 118.63 2gag h TRP 845 Ca 0.49 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.46 2gag h TRP 845 Cb 1.05 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.21 2gag h TRP 845 CO -0.00 0.00 -0.27 1.55 -1.28 0.00 0.00 178.44 178.43 2gag n VAL 846 N -3.65 0.00 -3.20 0.12 3.14 -0.24 -4.77 118.33 109.74 2gag n VAL 846 Ca -0.03 -0.07 -0.43 0.00 -2.96 0.00 0.00 64.34 60.85 2gag n VAL 846 Cb 0.10 0.21 -0.08 0.00 -1.06 0.00 0.00 33.84 33.01 2gag n VAL 846 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 2gag s VAL 847 N -2.65 4.94 0.36 1.55 1.01 -0.72 -2.73 120.40 122.17 2gag s VAL 847 Ca 0.21 0.03 -0.28 0.00 0.00 0.00 0.00 61.98 61.94 2gag s VAL 847 Cb 0.19 -4.11 -0.11 0.00 0.00 0.00 0.00 36.38 32.35 2gag s VAL 847 CO 0.56 -0.47 1.46 -0.55 0.00 0.00 0.00 175.10 176.10 2gag s SER 848 N 1.90 6.41 0.00 3.32 0.15 -0.52 -4.91 113.70 120.05 2gag s SER 848 Ca 0.19 2.99 0.06 0.00 0.70 0.00 0.00 55.95 59.89 2gag s SER 848 Cb -0.15 -2.66 0.13 0.00 -1.71 0.00 0.00 66.02 61.63 2gag s SER 848 CO 0.16 -0.82 0.98 0.29 1.20 0.00 0.00 173.24 175.06 2gag n LYS 849 N 0.60 1.79 -0.00 5.44 4.76 -1.26 -4.63 118.16 124.85 2gag n LYS 849 Ca 0.01 -1.47 0.03 0.00 -2.87 0.00 0.00 58.31 54.01 2gag n LYS 849 Cb 0.40 -1.15 -0.05 0.00 -1.84 0.00 0.00 35.03 32.39 2gag n LYS 849 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2gag n LEU 850 N 0.20 0.06 -4.07 -0.35 4.77 -1.26 -5.04 117.00 111.32 2gag n LEU 850 Ca 0.06 -0.11 -0.10 0.00 -0.03 0.00 0.00 56.01 55.83 2gag n LEU 850 Cb 0.28 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.27 2gag n LEU 850 CO 0.04 0.02 -0.37 -1.59 -1.33 0.00 0.00 177.39 174.16 2gag s LYS 851 N -2.28 0.56 0.46 3.23 0.00 -1.26 -5.15 119.74 115.30 2gag s LYS 851 Ca -0.01 -0.99 -0.08 0.00 0.00 0.00 0.00 55.97 54.89 2gag s LYS 851 Cb 0.04 -0.02 -0.05 0.00 0.00 0.00 0.00 37.83 37.81 2gag s LYS 851 CO 0.27 -0.04 0.79 0.34 0.00 0.00 0.00 175.35 176.72 2gag s ASP 852 N -2.28 6.37 0.24 0.03 2.15 -1.26 -4.81 116.67 117.11 2gag s ASP 852 Ca -0.02 1.05 -0.18 0.00 0.43 0.00 0.00 52.55 53.83 2gag s ASP 852 Cb -0.01 -2.29 0.02 0.00 -0.30 0.00 0.00 42.92 40.33 2gag s ASP 852 CO -0.04 -0.52 0.60 0.72 -0.17 0.00 0.00 175.17 175.76 2gag s PHE 853 N -2.61 -0.07 0.03 -5.34 -0.12 -1.26 -4.50 117.98 104.10 2gag s PHE 853 Ca 0.49 -0.32 -0.30 0.00 -0.05 0.00 0.00 56.93 56.75 2gag s PHE 853 Cb -0.10 0.49 -0.08 0.00 -0.63 0.00 0.00 43.02 42.70 2gag s PHE 853 CO 0.40 -1.07 1.83 0.42 -0.05 0.00 0.00 175.22 176.75 2gag s ILE 854 N -3.92 3.12 0.00 -4.49 -1.09 0.50 -1.95 121.20 113.38 2gag s ILE 854 Ca 0.12 0.26 0.00 0.00 -2.23 0.00 0.00 60.65 58.81 2gag s ILE 854 Cb -0.03 -3.17 0.00 0.00 -1.58 0.00 0.00 42.46 37.68 2gag s ILE 854 CO 0.03 -0.02 0.00 0.61 -1.23 0.00 0.00 174.94 174.34 2gag n GLY 855 N 4.34 2.10 0.22 6.18 0.00 -1.24 -4.47 105.19 112.32 2gag n GLY 855 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.18 2gag n GLY 855 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2gag h ASN 856 N 0.70 -0.54 -0.85 1.61 -1.24 -1.67 -1.45 115.58 112.12 2gag h ASN 856 Ca 0.00 0.17 0.17 0.00 0.71 0.00 0.00 56.30 57.34 2gag h ASN 856 Cb 0.00 0.35 -0.06 0.00 0.73 0.00 0.00 38.32 39.34 2gag h ASN 856 CO 0.00 -0.19 0.56 -0.09 -1.29 0.00 0.00 177.43 176.42 2gag h ARG 857 N -0.01 0.49 0.00 6.67 9.65 -1.88 -1.96 114.38 127.33 2gag h ARG 857 Ca 0.26 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.12 2gag h ARG 857 Cb 0.41 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.88 2gag h ARG 857 CO -0.58 0.33 0.00 0.77 2.80 0.00 0.00 179.97 183.29 2gag h SER 858 N 0.51 0.00 0.34 -3.80 0.02 -1.47 -2.69 113.55 106.46 2gag h SER 858 Ca 0.43 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.38 2gag h SER 858 Cb 0.91 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.45 2gag h SER 858 CO -0.17 0.00 0.00 -1.22 -1.14 0.00 0.00 176.83 174.30 2gag n TYR 859 N -2.95 0.00 0.94 3.45 4.01 -0.74 -2.61 117.16 119.26 2gag n TYR 859 Ca -0.01 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.85 2gag n TYR 859 Cb 0.19 -0.27 0.16 0.00 -0.31 0.00 0.00 39.34 39.10 2gag n TYR 859 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2gag n SER 860 N -1.27 0.61 -4.74 7.72 7.64 -1.01 -4.71 113.62 117.85 2gag n SER 860 Ca 0.09 -0.37 -0.31 0.00 1.01 0.00 0.00 58.87 59.29 2gag n SER 860 Cb 0.15 0.43 0.11 0.00 -1.01 0.00 0.00 64.21 63.89 2gag n SER 860 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2gag s ARG 861 N -3.02 1.92 0.19 1.43 0.52 -1.07 -4.93 118.95 113.99 2gag s ARG 861 Ca 0.10 1.24 -0.12 0.00 -0.52 0.00 0.00 55.73 56.42 2gag s ARG 861 Cb 0.17 -1.85 0.21 0.00 0.52 0.00 0.00 34.95 34.00 2gag s ARG 861 CO 0.74 -1.90 1.71 0.00 0.02 0.00 0.00 175.30 175.87 2gag h ALA 862 N -1.32 0.59 -0.47 2.13 0.00 -1.93 -2.46 119.26 115.81 2gag h ALA 862 Ca -0.44 0.11 0.10 0.00 0.00 0.00 0.00 54.91 54.68 2gag h ALA 862 Cb 1.24 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.16 2gag h ALA 862 CO 0.49 -0.31 0.32 0.22 0.00 0.00 0.00 179.25 179.97 2gag h ASP 863 N 0.23 0.18 1.64 0.00 3.58 -1.94 -0.52 116.42 119.59 2gag h ASP 863 Ca 0.26 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.69 2gag h ASP 863 Cb 0.37 -0.04 -0.00 0.00 1.72 0.00 0.00 39.33 41.38 2gag h ASP 863 CO -0.35 0.11 -0.11 -1.13 -2.88 0.00 0.00 179.24 174.88 2gag h ASN 864 N 0.21 0.00 1.45 2.28 -0.73 -1.74 -3.10 115.58 113.95 2gag h ASN 864 Ca 0.22 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.39 2gag h ASN 864 Cb 0.59 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.18 2gag h ASN 864 CO -0.04 0.11 0.00 0.00 -0.37 0.00 0.00 177.43 177.13 2gag h ALA 865 N 1.89 1.00 -2.18 1.57 0.00 -1.05 -3.47 119.26 117.02 2gag h ALA 865 Ca -0.00 0.00 -0.60 0.00 0.00 0.00 0.00 54.91 54.31 2gag h ALA 865 Cb 0.96 0.00 0.17 0.00 0.00 0.00 0.00 17.79 18.92 2gag h ALA 865 CO 0.01 0.00 -0.71 0.54 0.00 0.00 0.00 179.25 179.10 2gag n ARG 866 N -2.68 0.30 0.05 0.00 1.74 -1.17 -4.90 116.66 110.00 2gag n ARG 866 Ca 0.04 0.11 0.12 0.00 -0.77 0.00 0.00 57.85 57.35 2gag n ARG 866 Cb 0.41 -1.36 0.11 0.00 -1.02 0.00 0.00 32.46 30.60 2gag n ARG 866 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2gag n GLU 867 N 0.72 0.30 -0.84 5.56 -0.58 -1.26 -4.24 120.64 120.30 2gag n GLU 867 Ca 0.10 0.06 -0.06 0.00 -0.42 0.00 0.00 57.16 56.84 2gag n GLU 867 Cb 0.45 -1.66 0.20 0.00 -0.57 0.00 0.00 31.44 29.87 2gag n GLU 867 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 2gag n ASP 868 N -2.08 2.78 -4.77 1.62 5.75 -1.26 -4.39 116.55 114.20 2gag n ASP 868 Ca 0.03 -3.69 -0.39 0.00 -0.01 0.00 0.00 54.79 50.72 2gag n ASP 868 Cb 0.44 -0.66 0.00 0.00 -1.03 0.00 0.00 41.12 39.88 2gag n ASP 868 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2gag s ARG 869 N -3.22 3.81 0.07 0.11 0.52 -1.26 -4.09 118.95 114.89 2gag s ARG 869 Ca 0.46 2.12 -0.31 0.00 -0.52 0.00 0.00 55.73 57.48 2gag s ARG 869 Cb 0.41 -2.63 -0.07 0.00 0.52 0.00 0.00 34.95 33.18 2gag s ARG 869 CO 0.02 -0.61 1.39 0.15 0.02 0.00 0.00 175.30 176.27 2gag s LYS 870 N -2.41 4.31 0.07 3.54 1.02 -1.26 -0.96 119.74 124.05 2gag s LYS 870 Ca 0.60 2.03 0.08 0.00 0.02 0.00 0.00 55.97 58.70 2gag s LYS 870 Cb -0.37 -3.40 -0.03 0.00 -0.52 0.00 0.00 37.83 33.51 2gag s LYS 870 CO 0.47 -0.49 -0.23 -0.65 -0.92 0.00 0.00 175.35 173.53 2gag s GLN 871 N 1.66 1.44 -0.33 1.68 -0.21 0.18 -4.76 119.66 119.33 2gag s GLN 871 Ca 0.64 -1.08 -0.29 0.00 0.02 0.00 0.00 55.36 54.65 2gag s GLN 871 Cb -0.34 -1.66 0.02 0.00 1.00 0.00 0.00 33.01 32.02 2gag s GLN 871 CO 0.29 0.41 1.06 -1.17 -2.12 0.00 0.00 175.29 173.77 2gag s LEU 872 N -1.46 3.92 0.00 2.90 2.96 0.18 -1.43 118.68 125.75 2gag s LEU 872 Ca 0.09 0.98 0.01 0.00 -0.22 0.00 0.00 54.13 55.00 2gag s LEU 872 Cb -0.09 -3.52 -0.00 0.00 0.50 0.00 0.00 46.19 43.07 2gag s LEU 872 CO 0.03 -0.89 0.07 1.33 -1.32 0.00 0.00 176.35 175.56 2gag n VAL 873 N 5.92 0.00 -4.22 1.68 0.24 -0.43 -4.66 118.33 116.86 2gag n VAL 873 Ca 0.12 -0.50 -0.25 0.00 -2.04 0.00 0.00 64.34 61.67 2gag n VAL 873 Cb 0.47 0.26 -0.08 0.00 -1.47 0.00 0.00 33.84 33.02 2gag n VAL 873 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2gag s SER 874 N -1.49 4.32 -0.02 -1.34 1.04 -0.62 0.11 113.70 115.70 2gag s SER 874 Ca 0.08 -1.12 0.01 0.00 0.48 0.00 0.00 55.95 55.40 2gag s SER 874 Cb 0.00 -0.47 0.01 0.00 0.10 0.00 0.00 66.02 65.66 2gag s SER 874 CO 0.06 -0.51 -0.04 0.68 0.98 0.00 0.00 173.24 174.40 2gag s VAL 875 N -2.61 0.43 -0.26 5.02 -7.23 -0.07 -0.65 120.40 115.03 2gag s VAL 875 Ca 0.40 -0.15 0.00 0.00 -1.81 0.00 0.00 61.98 60.42 2gag s VAL 875 Cb 0.05 -0.43 0.04 0.00 0.56 0.00 0.00 36.38 36.61 2gag s VAL 875 CO 0.22 0.16 -0.07 -0.76 -0.31 0.00 0.00 175.10 174.34 2gag s LEU 876 N 0.42 3.39 0.23 1.32 1.43 -0.09 -1.77 118.68 123.61 2gag s LEU 876 Ca -0.05 -1.15 -0.30 0.00 -1.03 0.00 0.00 54.13 51.60 2gag s LEU 876 Cb -0.09 -1.62 -0.10 0.00 0.03 0.00 0.00 46.19 44.41 2gag s LEU 876 CO -0.00 -0.18 1.44 -2.84 0.23 0.00 0.00 176.35 175.01 2gag s PRO 877 N 1.23 4.27 0.28 1.29 0.02 -1.26 0.10 135.00 140.93 2gag s PRO 877 Ca -0.04 2.28 0.01 0.00 0.02 0.00 0.00 61.00 63.27 2gag s PRO 877 Cb -0.18 -3.13 0.57 0.00 0.02 0.00 0.00 34.50 31.78 2gag s PRO 877 CO -0.04 -0.43 1.82 0.28 -0.33 0.00 0.00 177.00 178.29 2gag h VAL 878 N 3.65 0.87 -2.87 3.83 2.07 -1.66 -3.27 116.25 118.87 2gag h VAL 878 Ca -0.45 -0.31 -0.59 0.00 0.82 0.00 0.00 66.70 66.17 2gag h VAL 878 Cb 1.22 -0.13 -0.11 0.00 -1.52 0.00 0.00 31.29 30.75 2gag h VAL 878 CO 0.80 0.17 0.76 -0.62 0.02 0.00 0.00 177.57 178.69 2gag s ASP 879 N -5.61 6.28 0.00 0.57 -1.08 -1.26 -4.88 116.67 110.68 2gag s ASP 879 Ca -0.12 -0.44 0.00 0.00 -0.52 0.00 0.00 52.55 51.47 2gag s ASP 879 Cb 0.22 -2.48 0.00 0.00 -1.46 0.00 0.00 42.92 39.20 2gag s ASP 879 CO 0.80 -1.47 0.73 0.29 0.52 0.00 0.00 175.17 176.04 2gag n LYS 880 N 8.17 0.00 0.00 4.34 5.02 -1.23 -1.04 118.16 133.41 2gag n LYS 880 Ca 0.02 0.23 0.06 0.00 -2.02 0.00 0.00 58.31 56.60 2gag n LYS 880 Cb 0.48 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.97 2gag n LYS 880 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2gag n SER 881 N -1.23 1.24 -4.60 4.39 3.41 -1.26 -1.62 113.62 113.96 2gag n SER 881 Ca 0.00 -1.12 -0.42 0.00 -0.26 0.00 0.00 58.87 57.07 2gag n SER 881 Cb 0.00 0.55 -0.05 0.00 -0.26 0.00 0.00 64.21 64.46 2gag n SER 881 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2gag s LEU 882 N -1.90 4.08 -0.25 1.04 0.20 -0.21 -4.94 118.68 116.71 2gag s LEU 882 Ca 0.09 0.49 -0.14 0.00 0.69 0.00 0.00 54.13 55.26 2gag s LEU 882 Cb 0.10 -3.12 -0.04 0.00 -0.43 0.00 0.00 46.19 42.70 2gag s LEU 882 CO 0.34 -0.76 0.32 -0.60 -0.29 0.00 0.00 176.35 175.36 2gag s ARG 883 N 3.21 4.06 0.43 1.98 3.52 -1.26 -4.76 118.95 126.13 2gag s ARG 883 Ca 0.34 -0.02 -0.23 0.00 -0.13 0.00 0.00 55.73 55.69 2gag s ARG 883 Cb -0.13 -3.61 -0.09 0.00 -1.56 0.00 0.00 34.95 29.57 2gag s ARG 883 CO 0.17 -0.15 1.05 -0.51 -0.81 0.00 0.00 175.30 175.06 2gag s LEU 884 N 1.67 4.03 0.31 -0.88 1.43 -1.26 -5.02 118.68 118.96 2gag s LEU 884 Ca 0.14 2.02 -0.24 0.00 -1.03 0.00 0.00 54.13 55.02 2gag s LEU 884 Cb -0.15 -4.32 -0.10 0.00 0.03 0.00 0.00 46.19 41.65 2gag s LEU 884 CO 0.09 -0.63 0.89 -2.16 0.23 0.00 0.00 176.35 174.77 2gag s PRO 885 N -2.77 4.47 0.18 1.29 0.04 -1.26 -4.78 135.00 132.18 2gag s PRO 885 Ca 0.62 1.20 -0.30 0.00 0.04 0.00 0.00 61.00 62.55 2gag s PRO 885 Cb -0.21 -2.76 -0.09 0.00 0.04 0.00 0.00 34.50 31.49 2gag s PRO 885 CO 0.25 0.28 1.36 -1.21 0.04 0.00 0.00 177.00 177.72 2gag s GLU 886 N -2.14 4.34 0.00 4.56 2.02 -1.26 -1.75 118.70 124.47 2gag s GLU 886 Ca 0.50 2.11 0.00 0.00 0.02 0.00 0.00 54.97 57.60 2gag s GLU 886 Cb -0.17 -3.19 0.00 0.00 0.10 0.00 0.00 34.13 30.87 2gag s GLU 886 CO 0.22 -0.34 0.00 0.41 0.02 0.00 0.00 175.26 175.57 2gag n GLY 887 N 2.68 0.43 3.63 -1.39 0.00 0.17 -5.03 105.19 105.68 2gag n GLY 887 Ca 0.08 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.64 2gag n GLY 887 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gag n ALA 888 N -1.45 0.28 -2.28 4.61 0.00 -0.72 -4.61 120.51 116.34 2gag n ALA 888 Ca 0.00 0.41 -0.36 0.00 0.00 0.00 0.00 53.44 53.50 2gag n ALA 888 Cb 0.00 -2.14 -0.06 0.00 0.00 0.00 0.00 19.45 17.25 2gag n ALA 888 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gag s ALA 889 N -0.46 3.53 -0.08 0.00 0.00 -1.26 -1.23 121.76 122.26 2gag s ALA 889 Ca 0.66 -0.04 0.04 0.00 0.00 0.00 0.00 51.96 52.61 2gag s ALA 889 Cb -0.71 -2.61 -0.01 0.00 0.00 0.00 0.00 23.12 19.79 2gag s ALA 889 CO 0.54 0.42 -0.19 -0.51 0.00 0.00 0.00 175.76 176.02 2gag s LEU 890 N -1.92 2.39 0.15 0.00 1.43 -0.35 -4.24 118.68 116.14 2gag s LEU 890 Ca 0.39 -0.40 0.06 0.00 -1.03 0.00 0.00 54.13 53.15 2gag s LEU 890 Cb -0.16 -1.48 -0.04 0.00 0.03 0.00 0.00 46.19 44.54 2gag s LEU 890 CO 0.20 0.23 -0.13 0.68 0.23 0.00 0.00 176.35 177.56 2gag s VAL 891 N -0.07 1.39 0.75 -1.59 -7.23 0.31 0.64 120.40 114.61 2gag s VAL 891 Ca -0.05 -1.96 -0.15 0.00 -1.81 0.00 0.00 61.98 58.01 2gag s VAL 891 Cb -0.14 -1.77 0.05 0.00 0.56 0.00 0.00 36.38 35.08 2gag s VAL 891 CO 0.04 -0.57 1.21 0.00 -0.31 0.00 0.00 175.10 175.47 2gag n ALA 892 N 0.05 0.31 0.30 1.32 0.00 -1.26 -0.69 120.51 120.55 2gag n ALA 892 Ca -0.12 -0.22 0.17 0.00 0.00 0.00 0.00 53.44 53.28 2gag n ALA 892 Cb 0.59 -2.26 0.79 0.00 0.00 0.00 0.00 19.45 18.57 2gag n ALA 892 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2gag h SER 893 N -0.43 0.00 -0.12 0.00 4.64 -1.89 -2.29 113.55 113.47 2gag h SER 893 Ca -0.48 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.82 2gag h SER 893 Cb 1.31 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.39 2gag h SER 893 CO 0.48 0.00 -0.06 -0.90 -0.87 0.00 0.00 176.83 175.48 2gag n ASP 894 N -2.88 2.77 -4.77 4.97 5.75 -1.26 -5.00 116.55 116.11 2gag n ASP 894 Ca -0.00 -3.23 -0.40 0.00 -0.01 0.00 0.00 54.79 51.14 2gag n ASP 894 Cb 0.21 -0.50 0.01 0.00 -1.03 0.00 0.00 41.12 39.82 2gag n ASP 894 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2gag s ALA 895 N -2.94 3.37 -0.12 2.12 0.00 -0.86 -5.01 121.76 118.32 2gag s ALA 895 Ca 0.37 1.53 0.02 0.00 0.00 0.00 0.00 51.96 53.89 2gag s ALA 895 Cb 0.32 -3.61 -0.00 0.00 0.00 0.00 0.00 23.12 19.83 2gag s ALA 895 CO 0.03 -1.18 -0.19 -1.17 0.00 0.00 0.00 175.76 173.25 2gag s LEU 896 N -2.50 2.33 -0.20 0.00 2.96 -1.26 -4.99 118.68 115.02 2gag s LEU 896 Ca 0.58 -0.48 -0.20 0.00 -0.22 0.00 0.00 54.13 53.81 2gag s LEU 896 Cb -0.45 -1.49 -0.03 0.00 0.50 0.00 0.00 46.19 44.71 2gag s LEU 896 CO 0.60 0.14 0.59 0.00 -1.32 0.00 0.00 176.35 176.37 2gag s ALA 897 N 0.46 3.55 -0.10 5.97 0.00 -1.26 -4.42 121.76 125.96 2gag s ALA 897 Ca -0.13 -0.32 -0.00 0.00 0.00 0.00 0.00 51.96 51.50 2gag s ALA 897 Cb -0.17 -2.92 0.02 0.00 0.00 0.00 0.00 23.12 20.05 2gag s ALA 897 CO 0.06 -0.53 -0.06 -1.54 0.00 0.00 0.00 175.76 173.68 2gag s SER 898 N 1.20 1.95 -1.09 0.00 1.04 -0.65 -4.68 113.70 111.47 2gag s SER 898 Ca 0.27 -0.24 0.00 0.00 0.48 0.00 0.00 55.95 56.46 2gag s SER 898 Cb -0.16 -0.73 0.00 0.00 0.10 0.00 0.00 66.02 65.24 2gag s SER 898 CO 0.10 -0.12 0.00 -0.62 0.98 0.00 0.00 173.24 173.58 2gag n GLU 899 N 4.86 -0.77 -0.77 4.02 -0.58 -1.26 -2.14 120.64 124.01 2gag n GLU 899 Ca -0.13 0.80 0.00 0.00 -0.42 0.00 0.00 57.16 57.41 2gag n GLU 899 Cb 0.50 -4.78 0.00 0.00 -0.57 0.00 0.00 31.44 26.59 2gag n GLU 899 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2gag n GLY 900 N -1.53 0.71 3.36 0.62 0.00 -1.26 -5.04 105.19 102.06 2gag n GLY 900 Ca -0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 2gag n GLY 900 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gag s ILE 901 N -2.55 3.61 -0.16 -0.61 1.01 -0.91 -5.07 121.20 116.51 2gag s ILE 901 Ca 0.00 -0.42 -0.00 0.00 0.00 0.00 0.00 60.65 60.23 2gag s ILE 901 Cb 0.00 -2.64 0.00 0.00 0.01 0.00 0.00 42.46 39.83 2gag s ILE 901 CO 0.00 0.42 -0.15 -0.89 0.00 0.00 0.00 174.94 174.32 2gag s THR 902 N 1.35 2.66 0.37 2.92 2.01 -1.26 -1.64 115.64 122.04 2gag s THR 902 Ca 0.04 -0.76 -0.28 0.00 0.31 0.00 0.00 61.69 61.00 2gag s THR 902 Cb -0.14 -2.13 -0.11 0.00 0.01 0.00 0.00 72.50 70.13 2gag s THR 902 CO -0.01 0.51 1.44 -2.16 -0.69 0.00 0.00 174.62 173.71 2gag s PRO 903 N 0.94 4.13 0.07 4.92 0.04 -1.26 -5.00 135.00 138.85 2gag s PRO 903 Ca -0.03 2.48 0.04 0.00 0.04 0.00 0.00 61.00 63.53 2gag s PRO 903 Cb -0.15 -2.97 -0.04 0.00 0.04 0.00 0.00 34.50 31.38 2gag s PRO 903 CO -0.02 -0.48 0.03 -1.64 0.04 0.00 0.00 177.00 174.93 2gag s MET 904 N -2.06 2.71 0.02 4.56 -1.94 -1.26 -4.52 119.30 116.81 2gag s MET 904 Ca 0.52 -0.75 0.22 0.00 -1.71 0.00 0.00 55.69 53.98 2gag s MET 904 Cb -0.45 -2.63 -0.18 0.00 2.01 0.00 0.00 34.83 33.58 2gag s MET 904 CO 0.60 0.56 0.77 0.39 -0.01 0.00 0.00 175.02 177.33 2gag n GLU 905 N 0.66 0.42 -3.56 2.03 -0.58 0.21 -4.97 120.64 114.85 2gag n GLU 905 Ca -0.11 -0.08 0.00 0.00 -0.42 0.00 0.00 57.16 56.56 2gag n GLU 905 Cb 0.52 -1.56 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 2gag n GLU 905 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2gag n GLY 906 N 1.33 -0.42 3.23 0.62 0.00 -1.21 -0.48 105.19 108.27 2gag n GLY 906 Ca -0.00 -1.22 -0.10 0.00 0.00 0.00 0.00 46.02 44.70 2gag n GLY 906 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2gag s TRP 907 N -2.99 0.01 -0.35 1.61 1.48 -0.61 -1.22 118.94 116.88 2gag s TRP 907 Ca 0.00 -0.33 -0.23 0.00 -1.06 0.00 0.00 56.10 54.49 2gag s TRP 907 Cb 0.00 0.04 0.01 0.00 -1.16 0.00 0.00 33.47 32.36 2gag s TRP 907 CO 0.00 -0.55 0.75 0.08 -4.06 0.00 0.00 176.95 173.17 2gag s VAL 908 N -3.38 4.78 -0.03 -0.66 1.01 -0.37 -0.95 120.40 120.80 2gag s VAL 908 Ca 0.01 0.87 -0.04 0.00 0.00 0.00 0.00 61.98 62.82 2gag s VAL 908 Cb 0.02 -4.17 -0.28 0.00 0.00 0.00 0.00 36.38 31.96 2gag s VAL 908 CO -0.08 -0.37 0.72 0.71 0.00 0.00 0.00 175.10 176.07 2gag h THR 909 N 5.71 0.99 -3.69 3.92 1.35 -1.46 0.49 112.91 120.22 2gag h THR 909 Ca -0.25 -2.64 -0.25 0.00 -0.55 0.00 0.00 66.41 62.71 2gag h THR 909 Cb 1.10 2.70 -0.29 0.00 -1.73 0.00 0.00 68.15 69.92 2gag h THR 909 CO 0.89 0.81 -0.72 -0.44 -0.25 0.00 0.00 175.52 175.81 2gag s SER 910 N -7.00 0.06 -0.07 5.36 0.01 -1.18 -4.73 113.70 106.14 2gag s SER 910 Ca -0.12 0.00 -0.03 0.00 1.31 0.00 0.00 55.95 57.11 2gag s SER 910 Cb 0.06 -0.02 0.04 0.00 0.21 0.00 0.00 66.02 66.31 2gag s SER 910 CO 0.84 -0.03 0.16 -0.55 0.41 0.00 0.00 173.24 174.07 2gag s SER 911 N 0.25 -0.07 0.18 2.44 0.15 -1.26 0.02 113.70 115.40 2gag s SER 911 Ca -0.02 0.33 -0.05 0.00 0.70 0.00 0.00 55.95 56.91 2gag s SER 911 Cb -0.03 0.22 -0.03 0.00 -1.71 0.00 0.00 66.02 64.47 2gag s SER 911 CO -0.01 -0.16 0.20 -0.31 1.20 0.00 0.00 173.24 174.16 2gag s TYR 912 N 1.26 0.77 -0.50 3.44 2.02 -0.12 -4.94 117.35 119.29 2gag s TYR 912 Ca -0.08 -1.09 -0.07 0.00 -0.37 0.00 0.00 57.07 55.45 2gag s TYR 912 Cb -0.11 -0.30 0.13 0.00 -0.40 0.00 0.00 41.96 41.27 2gag s TYR 912 CO -0.06 -0.68 0.35 0.34 -1.57 0.00 0.00 175.55 173.93 2gag s ASP 913 N -3.06 5.62 -0.31 2.29 2.15 -1.26 -1.03 116.67 121.07 2gag s ASP 913 Ca 0.27 -2.10 -0.27 0.00 0.43 0.00 0.00 52.55 50.88 2gag s ASP 913 Cb 0.05 -1.97 0.01 0.00 -0.30 0.00 0.00 42.92 40.71 2gag s ASP 913 CO 0.06 -0.62 0.98 -0.55 -0.17 0.00 0.00 175.17 174.87 2gag s SER 914 N 2.23 6.85 0.29 -0.34 0.15 -1.00 -4.86 113.70 117.02 2gag s SER 914 Ca 0.08 0.94 0.26 0.00 0.70 0.00 0.00 55.95 57.93 2gag s SER 914 Cb -0.24 -2.50 0.82 0.00 -1.71 0.00 0.00 66.02 62.39 2gag s SER 914 CO -0.02 -0.78 1.75 1.55 1.20 0.00 0.00 173.24 176.94 2gag h PRO 915 N 8.05 0.00 0.17 5.44 0.13 -1.86 0.69 132.00 144.62 2gag h PRO 915 Ca -0.22 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.61 2gag h PRO 915 Cb 1.07 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.21 2gag h PRO 915 CO 0.98 0.00 -1.44 -0.91 -0.23 0.00 0.00 178.00 176.40 2gag h ASN 916 N 0.00 0.55 0.46 1.44 -0.26 -1.91 -3.26 115.58 112.60 2gag h ASN 916 Ca 0.00 -0.65 0.00 0.00 -0.56 0.00 0.00 56.30 55.09 2gag h ASN 916 Cb 0.68 -0.18 0.00 0.00 -1.06 0.00 0.00 38.32 37.76 2gag h ASN 916 CO 0.00 1.52 -0.72 0.18 -1.06 0.00 0.00 177.43 177.35 2gag n LEU 917 N -3.56 0.62 -1.05 1.61 4.77 -1.20 -4.96 117.00 113.23 2gag n LEU 917 Ca -0.14 -0.04 -0.12 0.00 -0.03 0.00 0.00 56.01 55.67 2gag n LEU 917 Cb 1.06 -0.17 -0.04 0.00 -2.33 0.00 0.00 43.42 41.94 2gag n LEU 917 CO 0.55 0.10 -0.13 0.61 -1.33 0.00 0.00 177.39 177.19 2gag n GLY 918 N 1.45 0.90 3.55 -0.72 0.00 0.19 -4.98 105.19 105.58 2gag n GLY 918 Ca 0.04 -0.45 -0.08 0.00 0.00 0.00 0.00 46.02 45.53 2gag n GLY 918 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2gag s ARG 919 N -3.46 1.06 0.65 1.61 1.70 -0.90 -5.00 118.95 114.61 2gag s ARG 919 Ca 0.00 -0.45 -0.14 0.00 -0.47 0.00 0.00 55.73 54.67 2gag s ARG 919 Cb 0.00 0.45 -0.01 0.00 -0.57 0.00 0.00 34.95 34.82 2gag s ARG 919 CO 0.00 -0.47 1.08 0.95 -1.08 0.00 0.00 175.30 175.78 2gag s THR 920 N -3.35 3.61 0.15 4.99 -4.23 -0.64 -2.37 115.64 113.80 2gag s THR 920 Ca 0.06 0.69 -0.25 0.00 -1.18 0.00 0.00 61.69 61.01 2gag s THR 920 Cb -0.01 -3.24 0.06 0.00 1.34 0.00 0.00 72.50 70.65 2gag s THR 920 CO -0.07 -0.52 0.90 0.72 -0.54 0.00 0.00 174.62 175.12 2gag s PHE 921 N -2.55 -0.19 0.17 3.99 -0.12 -0.20 -4.46 117.98 114.62 2gag s PHE 921 Ca 0.64 -0.11 -0.14 0.00 -0.05 0.00 0.00 56.93 57.26 2gag s PHE 921 Cb -0.17 0.63 0.02 0.00 -0.63 0.00 0.00 43.02 42.86 2gag s PHE 921 CO 0.43 -0.84 0.41 0.20 -0.05 0.00 0.00 175.22 175.36 2gag s GLY 922 N -2.87 0.06 0.05 1.99 0.00 -0.73 -0.95 107.32 104.87 2gag s GLY 922 Ca 0.11 -0.41 0.01 0.00 0.00 0.00 0.00 44.72 44.42 2gag s GLY 922 CO 0.01 -0.48 0.11 1.08 0.00 0.00 0.00 173.10 173.81 2gag s LEU 923 N -2.89 3.95 -0.01 0.66 1.43 0.10 -0.89 118.68 121.03 2gag s LEU 923 Ca 0.10 0.10 -0.15 0.00 -1.03 0.00 0.00 54.13 53.15 2gag s LEU 923 Cb 0.01 -2.51 0.02 0.00 0.03 0.00 0.00 46.19 43.74 2gag s LEU 923 CO -0.04 0.20 0.32 0.00 0.23 0.00 0.00 176.35 177.06 2gag s ALA 924 N -1.35 -0.80 -0.38 4.21 0.00 0.12 -1.15 121.76 122.40 2gag s ALA 924 Ca 0.28 0.31 -0.13 0.00 0.00 0.00 0.00 51.96 52.43 2gag s ALA 924 Cb -0.12 0.11 0.02 0.00 0.00 0.00 0.00 23.12 23.13 2gag s ALA 924 CO 0.21 -0.29 0.24 -0.51 0.00 0.00 0.00 175.76 175.41 2gag s LEU 925 N -1.43 4.81 -0.04 0.00 1.43 -0.13 -1.32 118.68 122.00 2gag s LEU 925 Ca -0.12 -0.86 0.04 0.00 -1.03 0.00 0.00 54.13 52.16 2gag s LEU 925 Cb -0.04 -2.09 -0.00 0.00 0.03 0.00 0.00 46.19 44.09 2gag s LEU 925 CO 0.03 -0.38 -0.17 -0.63 0.23 0.00 0.00 176.35 175.44 2gag s ILE 926 N 1.63 1.39 -0.04 -0.59 1.01 -0.52 -1.57 121.20 122.51 2gag s ILE 926 Ca 0.04 -0.69 -0.36 0.00 0.00 0.00 0.00 60.65 59.64 2gag s ILE 926 Cb -0.19 -1.20 -0.14 0.00 0.01 0.00 0.00 42.46 40.94 2gag s ILE 926 CO 0.08 0.40 1.69 0.29 0.00 0.00 0.00 174.94 177.40 2gag n LYS 927 N 3.18 1.76 -2.06 2.79 5.02 0.37 -0.41 118.16 128.82 2gag n LYS 927 Ca -0.18 0.64 -0.14 0.00 -2.02 0.00 0.00 58.31 56.61 2gag n LYS 927 Cb 0.53 -2.40 -0.03 0.00 -0.02 0.00 0.00 35.03 33.11 2gag n LYS 927 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2gag n ASN 928 N 4.90 -4.16 -0.34 4.39 5.15 -0.13 -4.85 115.26 120.21 2gag n ASN 928 Ca 0.21 0.22 0.20 0.00 -0.60 0.00 0.00 54.58 54.62 2gag n ASN 928 Cb 0.24 -3.62 0.44 0.00 -0.53 0.00 0.00 39.78 36.30 2gag n ASN 928 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 2gag h GLY 929 N 0.00 1.77 2.00 8.20 0.00 -0.95 -0.96 103.07 113.13 2gag h GLY 929 Ca -0.32 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 46.74 2gag h GLY 929 CO 0.41 -0.27 0.00 3.21 0.00 0.00 0.00 176.54 179.89 2gag h ARG 930 N 0.48 0.00 -0.55 4.80 3.08 -1.86 -1.69 114.38 118.64 2gag h ARG 930 Ca 0.66 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.71 2gag h ARG 930 Cb 1.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.46 2gag h ARG 930 CO -0.46 0.00 0.00 0.09 -1.07 0.00 0.00 179.97 178.53 2gag n ASN 931 N -2.94 4.39 -0.52 7.04 3.02 -0.37 -4.41 115.26 121.47 2gag n ASN 931 Ca -0.02 -2.47 0.06 0.00 -0.03 0.00 0.00 54.58 52.12 2gag n ASN 931 Cb 0.12 -0.52 0.12 0.00 -0.61 0.00 0.00 39.78 38.89 2gag n ASN 931 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2gag n ARG 932 N 0.79 1.00 -1.70 3.52 1.74 -0.63 -5.05 116.66 116.33 2gag n ARG 932 Ca 0.23 -2.50 -0.43 0.00 -0.77 0.00 0.00 57.85 54.38 2gag n ARG 932 Cb 0.83 -1.17 -0.03 0.00 -1.02 0.00 0.00 32.46 31.07 2gag n ARG 932 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2gag n ILE 933 N -0.83 0.11 0.00 0.55 2.08 -1.25 -1.53 119.36 118.49 2gag n ILE 933 Ca 0.13 -0.02 0.00 0.00 0.56 0.00 0.00 62.75 63.42 2gag n ILE 933 Cb 0.74 -1.91 0.00 0.00 -0.75 0.00 0.00 39.64 37.72 2gag n ILE 933 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2gag n GLY 934 N 3.92 2.21 3.77 7.39 0.00 0.59 -4.99 105.19 118.07 2gag n GLY 934 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 2gag n GLY 934 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2gag s GLU 935 N -0.83 4.02 -0.24 1.61 2.12 -0.58 -4.72 118.70 120.07 2gag s GLU 935 Ca 0.00 1.82 -0.14 0.00 0.36 0.00 0.00 54.97 57.00 2gag s GLU 935 Cb 0.00 -2.63 -0.04 0.00 0.26 0.00 0.00 34.13 31.72 2gag s GLU 935 CO 0.00 -0.34 0.34 0.08 -0.54 0.00 0.00 175.26 174.80 2gag s VAL 936 N -1.44 5.22 0.39 3.70 1.01 -1.26 -1.27 120.40 126.74 2gag s VAL 936 Ca 0.58 0.54 0.08 0.00 0.00 0.00 0.00 61.98 63.17 2gag s VAL 936 Cb -0.30 -3.67 -0.05 0.00 0.00 0.00 0.00 36.38 32.36 2gag s VAL 936 CO 0.37 0.22 0.19 -0.76 0.00 0.00 0.00 175.10 175.12 2gag s LEU 937 N 1.67 3.18 0.13 3.92 1.43 0.31 -3.61 118.68 125.70 2gag s LEU 937 Ca 0.15 -0.96 0.06 0.00 -1.03 0.00 0.00 54.13 52.35 2gag s LEU 937 Cb -0.15 -1.58 -0.04 0.00 0.03 0.00 0.00 46.19 44.45 2gag s LEU 937 CO 0.09 -0.48 -0.15 -0.54 0.23 0.00 0.00 176.35 175.49 2gag s LYS 938 N -3.91 1.06 -0.09 1.70 1.02 0.13 -1.45 119.74 118.21 2gag s LYS 938 Ca 0.41 -1.25 -0.05 0.00 0.02 0.00 0.00 55.97 55.10 2gag s LYS 938 Cb 0.01 -1.02 0.04 0.00 -0.52 0.00 0.00 37.83 36.35 2gag s LYS 938 CO 0.23 0.20 0.22 -0.08 -0.92 0.00 0.00 175.35 175.00 2gag s THR 939 N -1.99 -0.03 0.13 2.17 -1.32 -0.88 -0.53 115.64 113.18 2gag s THR 939 Ca 0.09 0.12 -0.31 0.00 -1.21 0.00 0.00 61.69 60.38 2gag s THR 939 Cb -0.06 -0.33 -0.10 0.00 -1.51 0.00 0.00 72.50 70.50 2gag s THR 939 CO 0.04 0.05 1.65 -2.16 -2.21 0.00 0.00 174.62 171.99 2gag s PRO 940 N 1.00 4.19 -0.05 7.08 0.04 -1.26 -2.47 135.00 143.53 2gag s PRO 940 Ca -0.07 2.41 -0.02 0.00 0.04 0.00 0.00 61.00 63.36 2gag s PRO 940 Cb -0.09 -3.36 0.03 0.00 0.04 0.00 0.00 34.50 31.12 2gag s PRO 940 CO -0.06 -0.70 0.05 0.54 0.04 0.00 0.00 177.00 176.87 2gag s VAL 941 N 1.90 -0.02 0.00 -0.36 0.11 0.10 -4.90 120.40 117.24 2gag s VAL 941 Ca 0.74 0.34 0.00 0.00 -2.93 0.00 0.00 61.98 60.12 2gag s VAL 941 Cb -0.43 -0.25 0.00 0.00 -1.53 0.00 0.00 36.38 34.17 2gag s VAL 941 CO 0.32 0.17 0.00 0.61 -3.33 0.00 0.00 175.10 172.87 2gag n GLY 942 N 5.27 1.79 0.97 6.54 0.00 -1.26 -2.19 105.19 116.30 2gag n GLY 942 Ca -0.04 -0.44 -0.01 0.00 0.00 0.00 0.00 46.02 45.53 2gag n GLY 942 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2gag n ASP 943 N 5.88 2.41 -4.15 1.61 9.92 -1.26 -5.01 116.55 125.95 2gag n ASP 943 Ca 0.00 -3.86 -0.10 0.00 -0.53 0.00 0.00 54.79 50.30 2gag n ASP 943 Cb 0.00 -0.55 -0.10 0.00 -0.64 0.00 0.00 41.12 39.83 2gag n ASP 943 CO 0.00 0.00 0.00 -1.58 0.13 0.00 0.00 177.20 175.75 2gag s GLN 944 N -3.30 0.92 -0.17 -1.24 0.74 -0.93 -5.16 119.66 110.51 2gag s GLN 944 Ca 0.42 -1.43 -0.06 0.00 0.05 0.00 0.00 55.36 54.34 2gag s GLN 944 Cb 0.39 0.20 -0.04 0.00 1.10 0.00 0.00 33.01 34.66 2gag s GLN 944 CO -0.04 -0.24 0.02 -0.51 -0.55 0.00 0.00 175.29 173.98 2gag s LEU 945 N -3.05 3.59 0.11 3.68 1.43 -1.26 -0.73 118.68 122.46 2gag s LEU 945 Ca 0.23 -0.00 0.08 0.00 -1.03 0.00 0.00 54.13 53.41 2gag s LEU 945 Cb 0.07 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 2gag s LEU 945 CO 0.01 0.17 -0.15 0.68 0.23 0.00 0.00 176.35 177.29 2gag s VAL 946 N 0.38 3.04 0.18 -1.59 -7.23 -1.03 -4.91 120.40 109.24 2gag s VAL 946 Ca 0.00 -1.43 -0.23 0.00 -1.81 0.00 0.00 61.98 58.51 2gag s VAL 946 Cb -0.13 -2.41 -0.08 0.00 0.56 0.00 0.00 36.38 34.32 2gag s VAL 946 CO 0.01 0.10 0.75 -1.81 -0.31 0.00 0.00 175.10 173.84 2gag s ASP 947 N -2.19 7.27 -0.00 4.85 1.01 -1.26 -2.08 116.67 124.26 2gag s ASP 947 Ca 0.19 1.55 -0.03 0.00 0.71 0.00 0.00 52.55 54.98 2gag s ASP 947 Cb -0.11 -2.47 -0.00 0.00 1.01 0.00 0.00 42.92 41.35 2gag s ASP 947 CO 0.12 0.16 0.06 0.68 0.21 0.00 0.00 175.17 176.39 2gag s VAL 948 N -1.26 0.06 -0.19 -1.27 -7.23 -0.53 -1.61 120.40 108.37 2gag s VAL 948 Ca 0.37 -0.49 -0.05 0.00 -1.81 0.00 0.00 61.98 60.01 2gag s VAL 948 Cb -0.21 -0.25 -0.03 0.00 0.56 0.00 0.00 36.38 36.45 2gag s VAL 948 CO 0.24 -0.27 -0.00 -0.69 -0.31 0.00 0.00 175.10 174.07 2gag s VAL 949 N -0.85 4.01 0.20 1.32 1.01 0.12 -0.53 120.40 125.68 2gag s VAL 949 Ca -0.09 -0.30 -0.32 0.00 0.00 0.00 0.00 61.98 61.27 2gag s VAL 949 Cb -0.06 -2.80 -0.11 0.00 0.00 0.00 0.00 36.38 33.41 2gag s VAL 949 CO 0.00 0.44 1.62 -0.69 0.00 0.00 0.00 175.10 176.48 2gag s VAL 950 N 0.82 2.35 0.32 2.92 1.01 -0.39 -0.92 120.40 126.51 2gag s VAL 950 Ca 0.00 0.26 0.05 0.00 0.00 0.00 0.00 61.98 62.30 2gag s VAL 950 Cb -0.14 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.04 2gag s VAL 950 CO 0.02 0.02 0.22 -0.44 0.00 0.00 0.00 175.10 174.92 2gag s SER 951 N 1.06 1.66 0.43 3.32 0.01 0.18 -0.30 113.70 120.06 2gag s SER 951 Ca 0.71 -1.68 -0.25 0.00 1.31 0.00 0.00 55.95 56.04 2gag s SER 951 Cb -0.46 0.51 -0.09 0.00 0.21 0.00 0.00 66.02 66.18 2gag s SER 951 CO 0.33 -0.99 1.23 -0.62 0.41 0.00 0.00 173.24 173.60 2gag n GLU 952 N -0.62 1.80 -0.36 12.44 -0.58 -1.26 -1.59 120.64 130.47 2gag n GLU 952 Ca 0.04 0.64 0.03 0.00 -0.42 0.00 0.00 57.16 57.45 2gag n GLU 952 Cb 0.63 -2.34 0.18 0.00 -0.57 0.00 0.00 31.44 29.34 2gag n GLU 952 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 2gag h THR 953 N 1.92 1.06 -3.27 2.62 2.02 -1.87 -3.30 112.91 112.09 2gag h THR 953 Ca -0.48 -0.39 -0.74 0.00 0.77 0.00 0.00 66.41 65.58 2gag h THR 953 Cb 1.30 -0.16 -0.26 0.00 -1.74 0.00 0.00 68.15 67.29 2gag h THR 953 CO 0.59 0.20 -0.35 -0.69 0.37 0.00 0.00 175.52 175.65 2gag s VAL 954 N -6.03 4.66 -0.07 3.16 1.01 -1.26 -3.59 120.40 118.28 2gag s VAL 954 Ca -0.12 -1.51 -0.07 0.00 0.00 0.00 0.00 61.98 60.27 2gag s VAL 954 Cb 0.20 -3.95 -0.29 0.00 0.00 0.00 0.00 36.38 32.34 2gag s VAL 954 CO 0.81 -0.72 0.59 -0.07 0.00 0.00 0.00 175.10 175.71 2gag h LEU 955 N 8.61 0.50 -9.22 3.92 3.38 -1.67 -3.42 115.31 117.42 2gag h LEU 955 Ca -0.25 -0.85 -0.60 0.00 0.09 0.00 0.00 57.88 56.27 2gag h LEU 955 Cb 1.09 -0.16 -0.12 0.00 0.09 0.00 0.00 40.66 41.56 2gag h LEU 955 CO 0.89 1.74 -0.37 -0.47 0.09 0.00 0.00 178.44 180.32 2gag s TYR 956 N -2.58 3.40 -1.37 1.13 5.04 0.28 -4.48 117.35 118.77 2gag s TYR 956 Ca -0.17 0.47 -0.15 0.00 -2.44 0.00 0.00 57.07 54.78 2gag s TYR 956 Cb 0.06 -2.33 0.02 0.00 0.35 0.00 0.00 41.96 40.06 2gag s TYR 956 CO 0.82 0.16 0.38 -3.47 -1.34 0.00 0.00 175.55 172.11 2gag n ASP 957 N 3.90 -1.64 0.18 4.32 2.03 -1.26 -4.72 116.55 119.36 2gag n ASP 957 Ca -0.13 -1.22 0.18 0.00 0.52 0.00 0.00 54.79 54.14 2gag n ASP 957 Cb 0.52 -2.00 0.76 0.00 -0.72 0.00 0.00 41.12 39.68 2gag n ASP 957 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2gag h PRO 958 N -2.12 0.00 -0.17 -0.67 0.13 -1.81 0.19 132.00 127.54 2gag h PRO 958 Ca -0.68 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 2gag h PRO 958 Cb 1.40 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.53 2gag h PRO 958 CO 0.61 0.00 0.00 -1.91 -0.23 0.00 0.00 178.00 176.47 2gag n GLU 959 N -3.40 1.92 -3.17 0.86 4.07 -1.26 -4.95 120.64 114.70 2gag n GLU 959 Ca 0.04 -1.37 -0.23 0.00 -0.06 0.00 0.00 57.16 55.54 2gag n GLU 959 Cb 0.54 -1.44 0.04 0.00 -0.06 0.00 0.00 31.44 30.52 2gag n GLU 959 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2gag n GLY 960 N 1.23 -0.52 0.07 8.31 0.00 0.67 -4.86 105.19 110.08 2gag n GLY 960 Ca 0.17 0.15 0.10 0.00 0.00 0.00 0.00 46.02 46.44 2gag n GLY 960 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gag n SER 961 N -2.59 0.37 -1.02 1.61 3.41 -1.26 -2.15 113.62 111.98 2gag n SER 961 Ca -0.08 0.59 0.12 0.00 -0.26 0.00 0.00 58.87 59.24 2gag n SER 961 Cb 0.60 -0.67 0.19 0.00 -0.26 0.00 0.00 64.21 64.07 2gag n SER 961 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2gag n ARG 962 N -1.91 2.37 -0.28 4.33 1.74 -1.26 -4.56 116.66 117.08 2gag n ARG 962 Ca 0.03 -2.04 0.08 0.00 -0.77 0.00 0.00 57.85 55.15 2gag n ARG 962 Cb 0.20 -1.49 0.23 0.00 -1.02 0.00 0.00 32.46 30.38 2gag n ARG 962 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 2gag h ARG 963 N 4.40 0.50 -0.69 5.56 2.43 -1.51 -2.49 114.38 122.58 2gag h ARG 963 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2gag h ARG 963 Cb 0.95 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.39 2gag h ARG 963 CO 0.00 0.33 0.00 -0.25 -1.51 0.00 0.00 179.97 178.54 2gag n ASP 964 N -4.95 4.04 0.00 -3.80 8.00 -1.26 -3.66 116.55 114.92 2gag n ASP 964 Ca 0.17 -2.09 0.00 0.00 0.71 0.00 0.00 54.79 53.58 2gag n ASP 964 Cb 0.47 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 41.08 2gag n ASP 964 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42