#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gko s VAL 3 N 0.00 4.13 -0.14 0.00 1.01 -1.26 -4.88 120.40 119.27 3gko s VAL 3 Ca 0.00 1.41 0.14 0.00 0.00 0.00 0.00 61.98 63.54 3gko s VAL 3 Cb 0.00 -3.91 -0.24 0.00 0.00 0.00 0.00 36.38 32.23 3gko s VAL 3 CO 0.00 -0.08 0.31 0.29 0.00 0.00 0.00 175.10 175.62 3gko n LYS 4 N 6.19 0.67 -3.60 2.72 4.76 -1.26 -4.98 118.16 122.65 3gko n LYS 4 Ca 0.13 0.13 -0.16 0.00 -2.87 0.00 0.00 58.31 55.54 3gko n LYS 4 Cb 0.45 -1.64 -0.07 0.00 -1.84 0.00 0.00 35.03 31.93 3gko n LYS 4 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3gko s ALA 5 N -2.54 -1.51 -0.27 7.82 0.00 -1.26 -5.18 121.76 118.83 3gko s ALA 5 Ca -0.09 1.18 -0.25 0.00 0.00 0.00 0.00 51.96 52.79 3gko s ALA 5 Cb 0.07 -0.17 0.10 0.00 0.00 0.00 0.00 23.12 23.13 3gko s ALA 5 CO 0.82 -0.33 0.92 0.00 0.00 0.00 0.00 175.76 177.17 3gko s ALA 6 N -0.95 -1.90 -0.03 0.00 0.00 -1.26 -5.16 121.76 112.45 3gko s ALA 6 Ca -0.10 1.91 -0.24 0.00 0.00 0.00 0.00 51.96 53.53 3gko s ALA 6 Cb -0.02 -1.30 0.05 0.00 0.00 0.00 0.00 23.12 21.85 3gko s ALA 6 CO 0.07 -0.28 0.51 -0.98 0.00 0.00 0.00 175.76 175.09 3gko s ARG 7 N 0.20 0.88 0.16 0.00 1.70 -1.26 -4.61 118.95 116.02 3gko s ARG 7 Ca 0.02 0.06 -0.18 0.00 -0.47 0.00 0.00 55.73 55.16 3gko s ARG 7 Cb -0.05 0.41 0.04 0.00 -0.57 0.00 0.00 34.95 34.78 3gko s ARG 7 CO -0.03 -0.26 0.48 1.52 -1.08 0.00 0.00 175.30 175.93 3gko s TYR 8 N -1.24 -0.23 -2.84 5.89 1.13 -0.85 -4.89 117.35 114.31 3gko s TYR 8 Ca -0.12 -0.08 0.00 0.00 -1.41 0.00 0.00 57.07 55.46 3gko s TYR 8 Cb -0.02 0.36 0.00 0.00 -1.10 0.00 0.00 41.96 41.20 3gko s TYR 8 CO 0.07 -0.81 0.00 0.41 -2.51 0.00 0.00 175.55 172.71 3gko n GLY 9 N -0.30 -0.59 3.35 5.49 0.00 -1.26 0.64 105.19 112.53 3gko n GLY 9 Ca -0.14 -0.69 -0.33 0.00 0.00 0.00 0.00 46.02 44.87 3gko n GLY 9 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3gko s LYS 10 N -1.14 3.06 0.31 1.61 2.47 -0.63 -4.84 119.74 120.58 3gko s LYS 10 Ca 0.00 -0.75 0.09 0.00 -1.56 0.00 0.00 55.97 53.75 3gko s LYS 10 Cb 0.00 -2.47 -0.05 0.00 -1.46 0.00 0.00 37.83 33.85 3gko s LYS 10 CO 0.00 0.31 0.04 0.34 0.16 0.00 0.00 175.35 176.19 3gko s ASP 11 N 0.08 4.47 -1.42 1.43 2.15 -1.26 -1.31 116.67 120.81 3gko s ASP 11 Ca -0.07 -0.77 -0.08 0.00 0.43 0.00 0.00 52.55 52.06 3gko s ASP 11 Cb -0.15 -0.72 0.04 0.00 -0.30 0.00 0.00 42.92 41.79 3gko s ASP 11 CO 0.05 -0.14 0.90 0.59 -0.17 0.00 0.00 175.17 176.40 3gko n ASN 12 N -0.98 -3.56 -4.51 -0.34 3.02 -1.17 -4.94 115.26 102.79 3gko n ASN 12 Ca -0.05 -0.76 -0.43 0.00 -0.03 0.00 0.00 54.58 53.31 3gko n ASN 12 Cb 0.60 -4.12 -0.06 0.00 -0.61 0.00 0.00 39.78 35.60 3gko n ASN 12 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3gko s VAL 13 N -3.44 4.72 0.12 2.41 1.01 -0.28 -4.87 120.40 120.08 3gko s VAL 13 Ca 0.39 0.09 -0.30 0.00 0.00 0.00 0.00 61.98 62.17 3gko s VAL 13 Cb -0.19 -4.31 -0.06 0.00 0.00 0.00 0.00 36.38 31.82 3gko s VAL 13 CO 0.81 -0.76 0.99 -0.13 0.00 0.00 0.00 175.10 176.01 3gko s ARG 14 N 3.08 4.68 -0.03 2.72 0.52 -1.26 -0.32 118.95 128.35 3gko s ARG 14 Ca 0.24 1.50 0.00 0.00 -0.52 0.00 0.00 55.73 56.96 3gko s ARG 14 Cb -0.14 -3.36 0.03 0.00 0.52 0.00 0.00 34.95 32.00 3gko s ARG 14 CO 0.18 0.19 0.01 0.08 0.02 0.00 0.00 175.30 175.78 3gko s VAL 15 N -0.05 0.11 0.01 3.52 1.01 0.06 -4.97 120.40 120.10 3gko s VAL 15 Ca 0.47 0.12 0.08 0.00 0.00 0.00 0.00 61.98 62.65 3gko s VAL 15 Cb -0.25 -0.22 -0.02 0.00 0.00 0.00 0.00 36.38 35.90 3gko s VAL 15 CO 0.31 0.13 -0.25 -0.47 0.00 0.00 0.00 175.10 174.82 3gko s TYR 16 N 1.00 2.19 -0.02 5.22 6.14 -1.26 -0.74 117.35 129.86 3gko s TYR 16 Ca -0.10 -0.41 -0.02 0.00 0.64 0.00 0.00 57.07 57.19 3gko s TYR 16 Cb -0.13 -1.36 0.01 0.00 0.42 0.00 0.00 41.96 40.90 3gko s TYR 16 CO -0.02 0.04 0.06 0.21 0.64 0.00 0.00 175.55 176.48 3gko s LYS 17 N -0.88 0.07 0.04 4.97 2.20 0.46 -4.99 119.74 121.60 3gko s LYS 17 Ca 0.10 0.10 0.09 0.00 -0.36 0.00 0.00 55.97 55.90 3gko s LYS 17 Cb -0.10 0.01 -0.03 0.00 -1.51 0.00 0.00 37.83 36.21 3gko s LYS 17 CO 0.00 -0.02 -0.25 0.54 -0.36 0.00 0.00 175.35 175.26 3gko s VAL 18 N 0.14 2.04 -0.11 4.02 0.11 -1.26 -0.54 120.40 124.80 3gko s VAL 18 Ca -0.01 -1.32 0.03 0.00 -2.93 0.00 0.00 61.98 57.75 3gko s VAL 18 Cb -0.02 -1.74 -0.00 0.00 -1.53 0.00 0.00 36.38 33.09 3gko s VAL 18 CO -0.00 0.36 -0.21 -2.28 -3.33 0.00 0.00 175.10 169.64 3gko s HIS 19 N -0.78 2.63 -0.20 1.54 2.46 0.05 -4.97 115.29 116.02 3gko s HIS 19 Ca 0.11 -0.93 0.02 0.00 0.47 0.00 0.00 55.06 54.73 3gko s HIS 19 Cb -0.10 -1.75 0.03 0.00 -0.13 0.00 0.00 32.58 30.64 3gko s HIS 19 CO 0.02 -0.36 -0.17 0.15 -2.47 0.00 0.00 174.74 171.91 3gko s LYS 20 N 0.33 2.77 -0.45 2.88 1.02 -1.26 -0.74 119.74 124.29 3gko s LYS 20 Ca -0.16 -0.98 -0.27 0.00 0.02 0.00 0.00 55.97 54.58 3gko s LYS 20 Cb -0.17 -2.67 0.03 0.00 -0.52 0.00 0.00 37.83 34.50 3gko s LYS 20 CO 0.08 -0.32 0.99 0.34 -0.92 0.00 0.00 175.35 175.52 3gko s ASP 21 N 1.23 6.57 0.48 2.83 3.68 -0.46 -4.89 116.67 126.11 3gko s ASP 21 Ca 0.01 0.30 0.22 0.00 2.13 0.00 0.00 52.55 55.21 3gko s ASP 21 Cb -0.15 -2.48 1.20 0.00 -1.45 0.00 0.00 42.92 40.04 3gko s ASP 21 CO -0.11 -1.07 2.00 -0.33 0.13 0.00 0.00 175.17 175.80 3gko h GLU 22 N 9.00 0.00 0.06 4.34 5.08 -1.94 0.56 114.58 131.69 3gko h GLU 22 Ca -0.24 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.12 3gko h GLU 22 Cb 1.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.32 3gko h GLU 22 CO 1.05 0.18 -0.03 0.87 -1.00 0.00 0.00 179.01 180.08 3gko h LYS 23 N 0.00 -0.08 0.00 2.33 1.79 -1.97 -3.38 116.57 115.26 3gko h LYS 23 Ca -0.00 0.01 -0.05 0.00 -2.18 0.00 0.00 60.65 58.42 3gko h LYS 23 Cb 0.40 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.06 3gko h LYS 23 CO 0.02 0.52 -1.55 0.25 -1.08 0.00 0.00 179.45 177.60 3gko n THR 24 N -4.80 0.52 -0.31 -0.16 -2.24 -1.21 -4.97 114.28 101.11 3gko n THR 24 Ca -0.08 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 61.13 3gko n THR 24 Cb 0.31 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.27 3gko n THR 24 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gko n GLY 25 N 1.28 1.52 3.72 3.38 0.00 0.20 -5.01 105.19 110.29 3gko n GLY 25 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 3gko n GLY 25 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gko s VAL 26 N -3.00 3.70 0.10 1.61 1.01 -1.25 -4.74 120.40 117.83 3gko s VAL 26 Ca 0.00 1.30 0.07 0.00 0.00 0.00 0.00 61.98 63.35 3gko s VAL 26 Cb 0.00 -3.83 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 3gko s VAL 26 CO 0.00 0.15 -0.10 -1.10 0.00 0.00 0.00 175.10 174.05 3gko s GLN 27 N 0.53 2.15 -0.04 2.72 -0.21 0.63 -1.35 119.66 124.09 3gko s GLN 27 Ca 0.57 -1.01 0.01 0.00 0.02 0.00 0.00 55.36 54.96 3gko s GLN 27 Cb -0.32 -2.32 0.02 0.00 1.00 0.00 0.00 33.01 31.39 3gko s GLN 27 CO 0.32 0.51 -0.06 0.99 -2.12 0.00 0.00 175.29 174.94 3gko s THR 28 N -1.20 0.63 0.13 -0.19 2.01 0.08 -4.58 115.64 112.51 3gko s THR 28 Ca 0.21 -0.19 0.06 0.00 0.31 0.00 0.00 61.69 62.08 3gko s THR 28 Cb -0.11 -0.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.73 3gko s THR 28 CO 0.13 0.24 -0.00 0.68 -0.69 0.00 0.00 174.62 174.98 3gko s VAL 29 N 0.78 3.86 -0.02 3.82 -7.23 -1.26 -0.77 120.40 119.58 3gko s VAL 29 Ca -0.11 -1.19 0.01 0.00 -1.81 0.00 0.00 61.98 58.87 3gko s VAL 29 Cb -0.14 -2.88 0.02 0.00 0.56 0.00 0.00 36.38 33.93 3gko s VAL 29 CO 0.01 0.02 -0.02 -0.31 -0.31 0.00 0.00 175.10 174.49 3gko s TYR 30 N -1.49 0.38 -0.01 2.82 2.02 0.29 -4.87 117.35 116.50 3gko s TYR 30 Ca 0.26 -0.05 0.01 0.00 -0.37 0.00 0.00 57.07 56.92 3gko s TYR 30 Cb -0.11 -0.37 0.00 0.00 -0.40 0.00 0.00 41.96 41.08 3gko s TYR 30 CO 0.18 -0.09 -0.03 -2.00 -1.57 0.00 0.00 175.55 172.04 3gko s GLU 31 N 0.62 0.27 0.28 -0.62 2.12 -1.26 -0.40 118.70 119.71 3gko s GLU 31 Ca -0.06 -0.09 -0.10 0.00 0.36 0.00 0.00 54.97 55.07 3gko s GLU 31 Cb -0.10 -0.29 -0.00 0.00 0.26 0.00 0.00 34.13 34.01 3gko s GLU 31 CO -0.01 0.04 0.48 0.00 -0.54 0.00 0.00 175.26 175.23 3gko s MET 32 N 0.06 1.66 -0.09 4.30 0.23 0.08 -1.30 119.30 124.24 3gko s MET 32 Ca -0.00 -1.40 0.01 0.00 -1.03 0.00 0.00 55.69 53.27 3gko s MET 32 Cb -0.03 0.46 0.02 0.00 -1.53 0.00 0.00 34.83 33.75 3gko s MET 32 CO -0.00 -0.69 -0.11 0.99 -2.03 0.00 0.00 175.02 173.18 3gko s THR 33 N -3.69 1.14 0.03 3.16 2.01 -0.18 -0.76 115.64 117.35 3gko s THR 33 Ca 0.25 -0.42 0.06 0.00 0.31 0.00 0.00 61.69 61.89 3gko s THR 33 Cb -0.01 -1.09 -0.03 0.00 0.01 0.00 0.00 72.50 71.39 3gko s THR 33 CO 0.12 0.37 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.57 3gko s VAL 34 N 1.15 2.96 -0.05 3.82 1.01 0.57 -1.13 120.40 128.74 3gko s VAL 34 Ca -0.05 -1.10 0.01 0.00 0.00 0.00 0.00 61.98 60.84 3gko s VAL 34 Cb -0.14 -2.26 0.02 0.00 0.00 0.00 0.00 36.38 34.00 3gko s VAL 34 CO -0.02 0.35 -0.05 0.00 0.00 0.00 0.00 175.10 175.37 3gko s VAL 36 N 0.88 1.07 -0.08 0.00 1.01 -0.43 -0.96 120.40 121.90 3gko s VAL 36 Ca -0.12 -0.32 0.05 0.00 0.00 0.00 0.00 61.98 61.59 3gko s VAL 36 Cb -0.14 -1.08 -0.01 0.00 0.00 0.00 0.00 36.38 35.15 3gko s VAL 36 CO 0.00 0.37 -0.24 -0.76 0.00 0.00 0.00 175.10 174.48 3gko s LEU 37 N 1.65 2.06 0.12 3.92 1.43 -0.53 -1.60 118.68 125.72 3gko s LEU 37 Ca 0.04 -0.52 0.05 0.00 -1.03 0.00 0.00 54.13 52.67 3gko s LEU 37 Cb -0.13 -1.36 -0.04 0.00 0.03 0.00 0.00 46.19 44.69 3gko s LEU 37 CO -0.08 0.20 0.04 -0.76 0.23 0.00 0.00 176.35 175.99 3gko s LEU 38 N 0.08 3.58 0.11 1.79 1.43 0.21 -0.49 118.68 125.38 3gko s LEU 38 Ca -0.10 -0.17 0.05 0.00 -1.03 0.00 0.00 54.13 52.88 3gko s LEU 38 Cb -0.16 -2.26 -0.04 0.00 0.03 0.00 0.00 46.19 43.77 3gko s LEU 38 CO 0.06 0.14 -0.14 -1.61 0.23 0.00 0.00 176.35 175.03 3gko s GLU 39 N -2.59 0.96 0.00 1.70 2.02 -0.27 -2.01 118.70 118.50 3gko s GLU 39 Ca 0.28 -1.17 0.00 0.00 0.02 0.00 0.00 54.97 54.10 3gko s GLU 39 Cb -0.11 -0.84 0.00 0.00 0.10 0.00 0.00 34.13 33.28 3gko s GLU 39 CO 0.20 0.16 0.00 0.41 0.02 0.00 0.00 175.26 176.06 3gko n GLY 40 N 0.69 -0.51 3.15 -1.39 0.00 -1.26 -0.96 105.19 104.91 3gko n GLY 40 Ca -0.17 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 44.50 3gko n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3gko n GLU 41 N 0.00 3.19 0.00 1.61 1.02 0.06 -4.42 120.64 122.11 3gko n GLU 41 Ca 0.00 -3.20 0.00 0.00 -0.02 0.00 0.00 57.16 53.94 3gko n GLU 41 Cb 0.00 -3.25 0.00 0.00 -0.02 0.00 0.00 31.44 28.17 3gko n GLU 41 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 3gko n ILE 42 N 5.10 0.46 -0.23 -3.67 -5.35 -1.26 -4.80 119.36 109.59 3gko n ILE 42 Ca 0.46 -0.63 0.16 0.00 -0.27 0.00 0.00 62.75 62.48 3gko n ILE 42 Cb 0.41 0.86 0.47 0.00 -1.74 0.00 0.00 39.64 39.64 3gko n ILE 42 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 3gko h GLU 43 N 0.00 0.47 0.00 6.28 3.07 -1.98 -1.12 114.58 121.30 3gko h GLU 43 Ca 0.00 -0.03 -0.00 0.00 -0.50 0.00 0.00 59.36 58.83 3gko h GLU 43 Cb 0.39 -0.11 -0.00 0.00 -0.84 0.00 0.00 28.75 28.19 3gko h GLU 43 CO 0.00 0.31 -0.02 1.79 -1.40 0.00 0.00 179.01 179.69 3gko h THR 44 N 0.49 0.11 0.00 1.13 1.35 -1.89 -0.40 112.91 113.69 3gko h THR 44 Ca 0.45 -0.26 -0.08 0.00 -0.55 0.00 0.00 66.41 65.97 3gko h THR 44 Cb 0.98 1.23 -0.01 0.00 -1.73 0.00 0.00 68.15 68.62 3gko h THR 44 CO -0.18 0.02 -0.36 0.77 -0.25 0.00 0.00 175.52 175.52 3gko h SER 45 N 0.00 0.00 0.17 5.36 4.64 -1.19 0.34 113.55 122.87 3gko h SER 45 Ca -0.00 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 60.96 3gko h SER 45 Cb 0.23 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.31 3gko h SER 45 CO 0.00 0.36 -1.85 1.88 -0.87 0.00 0.00 176.83 176.35 3gko h TYR 46 N 0.00 0.61 0.00 4.77 -1.99 -1.23 -3.31 116.97 115.81 3gko h TYR 46 Ca -0.00 -0.45 -0.15 0.00 2.00 0.00 0.00 58.73 60.14 3gko h TYR 46 Cb 0.68 -0.02 -0.03 0.00 2.00 0.00 0.00 36.73 39.36 3gko h TYR 46 CO 0.00 1.72 -1.51 0.25 -0.00 0.00 0.00 178.16 178.61 3gko n THR 47 N -3.54 1.00 -0.67 -2.88 -2.24 -0.62 -4.54 114.28 100.80 3gko n THR 47 Ca -0.28 -0.67 0.01 0.00 -2.27 0.00 0.00 64.05 60.85 3gko n THR 47 Cb 1.06 -0.58 0.02 0.00 -2.10 0.00 0.00 70.33 68.73 3gko n THR 47 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3gko n LYS 48 N -2.78 1.51 -3.09 -0.78 4.76 0.04 -4.99 118.16 112.84 3gko n LYS 48 Ca -0.10 -1.28 -0.23 0.00 -2.87 0.00 0.00 58.31 53.83 3gko n LYS 48 Cb 0.80 -0.86 0.04 0.00 -1.84 0.00 0.00 35.03 33.17 3gko n LYS 48 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3gko n ALA 49 N -0.42 -1.01 -3.09 7.82 0.00 -1.06 -4.92 120.51 117.83 3gko n ALA 49 Ca 0.02 0.28 -0.45 0.00 0.00 0.00 0.00 53.44 53.30 3gko n ALA 49 Cb 0.43 -3.95 -0.03 0.00 0.00 0.00 0.00 19.45 15.90 3gko n ALA 49 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3gko s ASP 50 N -2.75 6.54 0.00 0.00 2.15 -0.82 -4.88 116.67 116.92 3gko s ASP 50 Ca 0.33 -2.05 0.31 0.00 0.43 0.00 0.00 52.55 51.57 3gko s ASP 50 Cb -0.15 -2.32 1.60 0.00 -0.30 0.00 0.00 42.92 41.75 3gko s ASP 50 CO 0.41 -0.94 2.09 0.59 -0.17 0.00 0.00 175.17 177.15 3gko n ASN 51 N 5.76 0.04 0.30 -0.34 3.02 -1.26 -3.32 115.26 119.46 3gko n ASN 51 Ca 0.12 -0.39 0.17 0.00 -0.03 0.00 0.00 54.58 54.45 3gko n ASN 51 Cb 0.47 -0.20 0.94 0.00 -0.61 0.00 0.00 39.78 40.38 3gko n ASN 51 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3gko h SER 52 N 0.05 0.00 0.15 6.41 4.64 -1.98 -0.21 113.55 122.61 3gko h SER 52 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3gko h SER 52 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 3gko h SER 52 CO 0.00 0.03 -0.13 1.33 -0.87 0.00 0.00 176.83 177.19 3gko n VAL 53 N -3.50 0.00 -3.32 0.95 0.24 -1.24 -4.86 118.33 106.60 3gko n VAL 53 Ca -0.02 -0.16 -0.40 0.00 -2.04 0.00 0.00 64.34 61.72 3gko n VAL 53 Cb 0.14 0.34 -0.08 0.00 -1.47 0.00 0.00 33.84 32.76 3gko n VAL 53 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3gko s ILE 54 N -2.30 5.12 -0.48 1.34 1.01 -0.09 -4.87 121.20 120.93 3gko s ILE 54 Ca 0.31 0.64 -0.24 0.00 0.00 0.00 0.00 60.65 61.35 3gko s ILE 54 Cb 0.20 -3.78 0.03 0.00 0.01 0.00 0.00 42.46 38.92 3gko s ILE 54 CO 0.44 0.08 0.88 -0.69 0.00 0.00 0.00 174.94 175.66 3gko s VAL 55 N 2.19 4.51 0.22 2.92 1.01 -1.26 -4.97 120.40 125.01 3gko s VAL 55 Ca 0.17 0.54 -0.30 0.00 0.00 0.00 0.00 61.98 62.40 3gko s VAL 55 Cb -0.16 -4.42 -0.16 0.00 0.00 0.00 0.00 36.38 31.65 3gko s VAL 55 CO 0.10 -0.86 0.93 0.00 0.00 0.00 0.00 175.10 175.27 3gko n ALA 56 N 7.09 -1.24 0.25 5.51 0.00 -1.26 -4.74 120.51 126.12 3gko n ALA 56 Ca 0.04 0.43 0.09 0.00 0.00 0.00 0.00 53.44 54.00 3gko n ALA 56 Cb 0.48 -1.90 0.65 0.00 0.00 0.00 0.00 19.45 18.68 3gko n ALA 56 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3gko h THR 57 N 1.96 0.90 -0.45 0.00 1.35 -1.93 0.13 112.91 114.86 3gko h THR 57 Ca -0.38 -0.33 -0.07 0.00 -0.55 0.00 0.00 66.41 65.08 3gko h THR 57 Cb 1.37 1.19 -0.02 0.00 -1.73 0.00 0.00 68.15 68.96 3gko h THR 57 CO 0.62 0.09 -0.01 -0.78 -0.25 0.00 0.00 175.52 175.19 3gko h ASP 58 N 0.00 0.72 0.06 5.36 3.58 -1.94 -0.37 116.42 123.83 3gko h ASP 58 Ca -0.00 -0.17 -0.15 0.00 0.42 0.00 0.00 57.03 57.13 3gko h ASP 58 Cb 0.18 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 41.03 3gko h ASP 58 CO 0.01 0.80 -0.50 0.28 -2.88 0.00 0.00 179.24 176.96 3gko h SER 59 N 0.70 0.54 -0.77 2.28 0.02 -1.15 -1.69 113.55 113.48 3gko h SER 59 Ca 0.14 -0.27 -0.04 0.00 -0.84 0.00 0.00 61.79 60.78 3gko h SER 59 Cb 0.45 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.80 3gko h SER 59 CO 0.02 0.95 0.35 0.40 -1.14 0.00 0.00 176.83 177.40 3gko h ILE 60 N 0.39 1.25 -0.01 3.27 2.04 -0.48 -0.22 117.51 123.76 3gko h ILE 60 Ca 0.02 -0.75 -0.00 0.00 1.00 0.00 0.00 64.86 65.13 3gko h ILE 60 Cb 1.01 0.28 -0.00 0.00 -0.74 0.00 0.00 36.82 37.37 3gko h ILE 60 CO 0.09 0.31 0.01 0.50 0.00 0.00 0.00 178.15 179.06 3gko h LYS 61 N 1.13 0.01 -0.82 2.37 3.64 -0.67 -1.67 116.57 120.55 3gko h LYS 61 Ca 0.27 -0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.72 3gko h LYS 61 Cb 0.16 -0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 31.91 3gko h LYS 61 CO -0.03 0.06 0.48 -0.91 -2.27 0.00 0.00 179.45 176.79 3gko h ASN 62 N -0.04 0.72 -0.43 4.20 2.35 -0.90 -1.67 115.58 119.81 3gko h ASN 62 Ca 0.00 0.03 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 3gko h ASN 62 Cb 0.05 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 3gko h ASN 62 CO -0.00 0.44 0.20 0.74 -1.65 0.00 0.00 177.43 177.16 3gko h THR 63 N 0.84 1.17 -0.37 2.81 2.02 -0.67 -0.53 112.91 118.18 3gko h THR 63 Ca 0.38 -0.51 -0.03 0.00 0.77 0.00 0.00 66.41 67.02 3gko h THR 63 Cb 0.27 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 3gko h THR 63 CO -0.21 0.20 0.11 0.40 0.37 0.00 0.00 175.52 176.39 3gko h ILE 64 N 0.66 1.21 -0.32 3.11 2.04 -0.37 0.05 117.51 123.90 3gko h ILE 64 Ca 0.16 -0.70 -0.04 0.00 1.00 0.00 0.00 64.86 65.29 3gko h ILE 64 Cb 0.11 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 3gko h ILE 64 CO -0.02 0.24 0.05 1.88 0.00 0.00 0.00 178.15 180.31 3gko h TYR 65 N 0.44 0.56 -0.44 1.37 0.05 -1.09 -1.53 116.97 116.33 3gko h TYR 65 Ca 0.12 -0.08 0.00 0.00 0.05 0.00 0.00 58.73 58.82 3gko h TYR 65 Cb 0.26 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 37.82 3gko h TYR 65 CO 0.01 0.60 0.29 0.82 -1.05 0.00 0.00 178.16 178.83 3gko h ILE 66 N 0.36 1.12 -0.63 -2.88 2.04 -1.01 -0.78 117.51 115.72 3gko h ILE 66 Ca 0.10 -0.23 -0.06 0.00 1.00 0.00 0.00 64.86 65.67 3gko h ILE 66 Cb 0.34 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 36.88 3gko h ILE 66 CO 0.01 0.12 0.16 0.74 0.00 0.00 0.00 178.15 179.17 3gko h THR 67 N 0.59 1.25 -0.03 -0.27 2.02 -0.90 -1.61 112.91 113.96 3gko h THR 67 Ca 0.16 -0.89 -0.08 0.00 0.77 0.00 0.00 66.41 66.37 3gko h THR 67 Cb -0.05 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 66.94 3gko h THR 67 CO -0.03 0.34 -0.36 0.00 0.37 0.00 0.00 175.52 175.83 3gko h ALA 68 N 1.23 1.34 -0.08 6.16 0.00 -0.87 -1.63 119.26 125.41 3gko h ALA 68 Ca 0.20 -0.34 -0.19 0.00 0.00 0.00 0.00 54.91 54.58 3gko h ALA 68 Cb 0.33 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 3gko h ALA 68 CO -0.00 0.48 -0.73 -0.22 0.00 0.00 0.00 179.25 178.78 3gko h LYS 69 N 0.05 0.41 -0.35 0.00 1.63 -0.42 -3.31 116.57 114.58 3gko h LYS 69 Ca 0.00 -0.34 0.00 0.00 -0.85 0.00 0.00 60.65 59.47 3gko h LYS 69 Cb 0.67 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.37 3gko h LYS 69 CO 0.05 0.98 0.00 1.04 -3.45 0.00 0.00 179.45 178.07 3gko n GLN 70 N -3.84 2.42 -3.99 1.90 6.02 -0.67 -4.99 117.38 114.23 3gko n GLN 70 Ca -0.04 -2.21 -0.09 0.00 -0.01 0.00 0.00 57.00 54.65 3gko n GLN 70 Cb 0.71 -1.48 -0.08 0.00 1.02 0.00 0.00 30.24 30.40 3gko n GLN 70 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 3gko s ASN 71 N -1.45 0.19 0.41 1.08 0.01 -0.63 -5.07 114.94 109.49 3gko s ASN 71 Ca 0.36 -0.90 -0.25 0.00 -0.71 0.00 0.00 52.86 51.37 3gko s ASN 71 Cb 0.21 0.34 -0.08 0.00 0.41 0.00 0.00 41.25 42.13 3gko s ASN 71 CO 0.30 -0.76 1.19 -2.84 -1.51 0.00 0.00 177.10 173.47 3gko s PRO 72 N -3.94 4.00 0.00 -0.60 0.02 -1.26 -4.70 135.00 128.51 3gko s PRO 72 Ca 0.13 1.87 0.24 0.00 0.02 0.00 0.00 61.00 63.27 3gko s PRO 72 Cb 0.05 -2.65 0.45 0.00 0.02 0.00 0.00 34.50 32.37 3gko s PRO 72 CO -0.05 -0.38 1.40 1.33 -0.33 0.00 0.00 177.00 178.98 3gko n VAL 73 N -0.00 0.13 -4.07 3.83 0.24 -1.26 -4.42 118.33 112.77 3gko n VAL 73 Ca 0.05 -0.50 -0.13 0.00 -2.04 0.00 0.00 64.34 61.72 3gko n VAL 73 Cb 0.46 1.11 -0.12 0.00 -1.47 0.00 0.00 33.84 33.82 3gko n VAL 73 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3gko s THR 74 N -1.87 0.42 0.71 3.34 -4.23 -1.26 -3.88 115.64 108.86 3gko s THR 74 Ca 0.33 -0.73 -0.13 0.00 -1.18 0.00 0.00 61.69 59.98 3gko s THR 74 Cb 0.21 -0.45 0.03 0.00 1.34 0.00 0.00 72.50 73.62 3gko s THR 74 CO 0.31 -0.22 1.09 -2.16 -0.54 0.00 0.00 174.62 173.10 3gko s PRO 75 N -1.01 2.58 0.52 3.99 0.04 -1.26 -4.83 135.00 135.03 3gko s PRO 75 Ca -0.06 1.24 0.21 0.00 0.04 0.00 0.00 61.00 62.43 3gko s PRO 75 Cb -0.07 -1.93 1.33 0.00 0.04 0.00 0.00 34.50 33.87 3gko s PRO 75 CO 0.00 -1.40 2.06 -1.00 0.04 0.00 0.00 177.00 176.70 3gko h PRO 76 N -0.56 0.01 -0.95 0.56 0.13 -1.97 -1.06 132.00 128.17 3gko h PRO 76 Ca -0.45 -0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.71 3gko h PRO 76 Cb 1.23 -0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.31 3gko h PRO 76 CO 0.53 0.01 0.62 0.93 -0.23 0.00 0.00 178.00 179.86 3gko h GLU 77 N 0.01 1.18 0.05 0.86 3.07 -1.95 0.54 114.58 118.35 3gko h GLU 77 Ca 0.15 -0.07 -0.00 0.00 -0.50 0.00 0.00 59.36 58.94 3gko h GLU 77 Cb 0.58 -0.27 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 3gko h GLU 77 CO -0.00 0.78 -0.02 1.25 -1.40 0.00 0.00 179.01 179.62 3gko h LEU 78 N 1.22 -0.05 -0.64 1.33 5.85 -1.56 -2.44 115.31 119.01 3gko h LEU 78 Ca 0.37 -0.46 0.06 0.00 0.84 0.00 0.00 57.88 58.69 3gko h LEU 78 Cb -0.03 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 3gko h LEU 78 CO -0.11 0.45 0.35 0.15 -0.34 0.00 0.00 178.44 178.94 3gko h PHE 79 N -0.58 0.65 -0.83 1.25 3.57 -1.25 -0.35 116.94 119.40 3gko h PHE 79 Ca -0.01 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 3gko h PHE 79 Cb 0.51 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 39.02 3gko h PHE 79 CO 0.09 0.31 0.47 0.78 -2.23 0.00 0.00 178.31 177.74 3gko h GLY 80 N 0.66 1.22 0.97 2.40 0.00 -0.93 -0.67 103.07 106.72 3gko h GLY 80 Ca 0.29 -0.53 -0.08 0.00 0.00 0.00 0.00 47.33 47.00 3gko h GLY 80 CO -0.18 0.51 -0.06 1.76 0.00 0.00 0.00 176.54 178.57 3gko h SER 81 N 1.15 0.76 -0.19 0.19 0.02 -0.80 -0.27 113.55 114.41 3gko h SER 81 Ca 0.29 -0.35 -0.01 0.00 -0.84 0.00 0.00 61.79 60.89 3gko h SER 81 Cb -0.00 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.32 3gko h SER 81 CO -0.05 0.93 0.07 0.40 -1.14 0.00 0.00 176.83 177.03 3gko h ILE 82 N 0.58 1.17 -0.32 3.27 2.04 -0.81 -0.71 117.51 122.73 3gko h ILE 82 Ca 0.11 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 3gko h ILE 82 Cb 0.58 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 3gko h ILE 82 CO 0.03 0.17 0.16 0.25 0.00 0.00 0.00 178.15 178.76 3gko h LEU 83 N 0.14 0.41 -0.54 1.44 5.85 -1.07 -1.84 115.31 119.70 3gko h LEU 83 Ca 0.06 -0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.62 3gko h LEU 83 Cb 0.20 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 3gko h LEU 83 CO -0.00 0.40 0.12 1.23 -0.34 0.00 0.00 178.44 179.85 3gko h GLY 84 N 0.38 0.93 1.23 3.75 0.00 -0.99 -2.91 103.07 105.48 3gko h GLY 84 Ca 0.11 -0.59 -0.02 0.00 0.00 0.00 0.00 47.33 46.83 3gko h GLY 84 CO -0.02 0.55 0.37 -0.84 0.00 0.00 0.00 176.54 176.60 3gko h THR 85 N 0.76 1.22 -0.46 4.70 2.02 -0.99 -2.81 112.91 117.35 3gko h THR 85 Ca 0.17 -0.58 0.08 0.00 0.77 0.00 0.00 66.41 66.84 3gko h THR 85 Cb 0.35 0.28 -0.07 0.00 -1.74 0.00 0.00 68.15 66.97 3gko h THR 85 CO 0.00 0.25 0.08 -0.74 0.37 0.00 0.00 175.52 175.48 3gko h HIS 86 N 1.00 0.12 -0.55 3.16 6.17 -1.12 -1.33 115.15 122.59 3gko h HIS 86 Ca 0.25 0.03 -0.04 0.00 0.71 0.00 0.00 60.37 61.32 3gko h HIS 86 Cb 0.06 0.02 -0.02 0.00 2.52 0.00 0.00 27.41 29.98 3gko h HIS 86 CO 0.01 -0.02 0.21 0.74 0.71 0.00 0.00 177.93 179.58 3gko h PHE 87 N 0.21 0.86 0.00 5.26 0.04 -1.49 1.00 116.94 122.81 3gko h PHE 87 Ca 0.23 -0.07 0.00 0.00 2.80 0.00 0.00 57.97 60.93 3gko h PHE 87 Cb 0.31 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 38.20 3gko h PHE 87 CO -0.23 0.70 0.00 0.44 -0.60 0.00 0.00 178.31 178.62 3gko n ILE 88 N -4.49 0.59 -0.06 -0.55 -5.35 -1.08 -2.36 119.36 106.06 3gko n ILE 88 Ca 0.03 -0.12 -0.13 0.00 -0.27 0.00 0.00 62.75 62.26 3gko n ILE 88 Cb 0.17 -0.72 -0.14 0.00 -1.74 0.00 0.00 39.64 37.21 3gko n ILE 88 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 3gko n GLU 89 N -2.14 0.67 0.04 6.28 1.02 -0.52 -4.47 120.64 121.52 3gko n GLU 89 Ca 0.05 0.18 -0.19 0.00 -0.02 0.00 0.00 57.16 57.17 3gko n GLU 89 Cb 0.37 -1.66 -0.10 0.00 -0.02 0.00 0.00 31.44 30.03 3gko n GLU 89 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 3gko h LYS 90 N 0.01 0.69 -4.78 3.49 1.63 -0.82 -3.43 116.57 113.37 3gko h LYS 90 Ca -0.43 -0.72 -0.68 0.00 -0.85 0.00 0.00 60.65 57.96 3gko h LYS 90 Cb 2.08 0.20 -0.29 0.00 -0.60 0.00 0.00 32.23 33.62 3gko h LYS 90 CO 0.04 1.30 -0.65 0.71 -3.45 0.00 0.00 179.45 177.41 3gko s TYR 91 N -3.36 3.19 0.47 1.91 2.02 -1.00 -4.99 117.35 115.58 3gko s TYR 91 Ca -0.09 -1.36 0.19 0.00 -0.37 0.00 0.00 57.07 55.43 3gko s TYR 91 Cb 0.07 -2.20 1.18 0.00 -0.40 0.00 0.00 41.96 40.60 3gko s TYR 91 CO 0.92 -0.69 1.96 -0.91 -1.57 0.00 0.00 175.55 175.26 3gko h ASN 92 N 8.15 0.24 0.20 2.29 2.35 -1.85 -2.13 115.58 124.84 3gko h ASN 92 Ca -0.27 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.49 3gko h ASN 92 Cb 1.10 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.43 3gko h ASN 92 CO 0.59 0.13 -0.20 0.00 -1.65 0.00 0.00 177.43 176.30 3gko n HIS 93 N -4.44 0.00 -3.34 1.19 1.44 -1.26 -4.78 115.22 104.03 3gko n HIS 93 Ca 0.12 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.43 3gko n HIS 93 Cb 0.53 -0.10 -0.09 0.00 0.12 0.00 0.00 29.99 30.45 3gko n HIS 93 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3gko s ILE 94 N -2.40 5.13 -1.28 0.61 -1.09 -0.80 -0.76 121.20 120.60 3gko s ILE 94 Ca 0.27 0.49 0.14 0.00 -2.23 0.00 0.00 60.65 59.32 3gko s ILE 94 Cb 0.20 -3.79 -0.00 0.00 -1.58 0.00 0.00 42.46 37.29 3gko s ILE 94 CO 0.48 0.04 0.78 1.41 -1.23 0.00 0.00 174.94 176.41 3gko n HIS 95 N 5.45 0.00 -3.72 3.97 8.25 -0.13 -4.49 115.22 124.54 3gko n HIS 95 Ca -0.07 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.26 3gko n HIS 95 Cb 0.50 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.51 3gko n HIS 95 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3gko s ALA 96 N -1.70 -1.09 -0.10 -1.41 0.00 -1.00 -0.72 121.76 115.74 3gko s ALA 96 Ca 0.12 1.26 0.01 0.00 0.00 0.00 0.00 51.96 53.34 3gko s ALA 96 Cb 0.11 -0.73 0.02 0.00 0.00 0.00 0.00 23.12 22.52 3gko s ALA 96 CO 0.35 -0.21 -0.12 0.00 0.00 0.00 0.00 175.76 175.78 3gko s ALA 97 N 0.27 1.44 -0.34 0.00 0.00 0.00 -1.11 121.76 122.02 3gko s ALA 97 Ca -0.00 -0.57 -0.05 0.00 0.00 0.00 0.00 51.96 51.33 3gko s ALA 97 Cb -0.03 -0.78 0.05 0.00 0.00 0.00 0.00 23.12 22.36 3gko s ALA 97 CO 0.00 -0.13 0.09 -1.01 0.00 0.00 0.00 175.76 174.71 3gko s HIS 98 N 1.13 3.29 -0.23 0.00 3.76 0.36 -0.82 115.29 122.78 3gko s HIS 98 Ca -0.05 -1.65 -0.05 0.00 -0.15 0.00 0.00 55.06 53.16 3gko s HIS 98 Cb -0.14 -2.36 -0.01 0.00 1.11 0.00 0.00 32.58 31.17 3gko s HIS 98 CO -0.02 -0.78 -0.01 0.08 -0.85 0.00 0.00 174.74 173.16 3gko s VAL 99 N 1.34 3.62 -0.10 -0.90 1.01 0.37 -1.45 120.40 124.29 3gko s VAL 99 Ca -0.01 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.55 3gko s VAL 99 Cb -0.20 -2.67 -0.02 0.00 0.00 0.00 0.00 36.38 33.48 3gko s VAL 99 CO 0.01 0.39 -0.12 0.21 0.00 0.00 0.00 175.10 175.58 3gko s ASN 100 N 1.51 4.12 -0.05 3.32 3.84 -0.13 0.27 114.94 127.82 3gko s ASN 100 Ca 0.06 -0.24 0.01 0.00 0.21 0.00 0.00 52.86 52.90 3gko s ASN 100 Cb -0.15 -1.30 0.02 0.00 -0.55 0.00 0.00 41.25 39.27 3gko s ASN 100 CO -0.01 0.25 -0.06 -0.63 -2.79 0.00 0.00 177.10 173.85 3gko s ILE 101 N -0.14 0.67 -0.23 -5.21 1.01 -0.47 -1.13 121.20 115.70 3gko s ILE 101 Ca -0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 60.65 60.40 3gko s ILE 101 Cb -0.13 -0.67 -0.00 0.00 0.01 0.00 0.00 42.46 41.66 3gko s ILE 101 CO 0.03 0.25 -0.03 -0.69 0.00 0.00 0.00 174.94 174.50 3gko s VAL 102 N 0.84 3.40 -0.19 2.92 1.01 -0.28 -1.67 120.40 126.43 3gko s VAL 102 Ca -0.12 -0.55 -0.14 0.00 0.00 0.00 0.00 61.98 61.17 3gko s VAL 102 Cb -0.15 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.61 3gko s VAL 102 CO 0.01 0.37 0.30 0.00 0.00 0.00 0.00 175.10 175.79 3gko s HIS 104 N 0.81 3.52 -0.13 0.00 3.76 -0.42 -2.86 115.29 119.98 3gko s HIS 104 Ca 0.16 0.58 -0.25 0.00 -0.15 0.00 0.00 55.06 55.39 3gko s HIS 104 Cb -0.14 -2.01 -0.02 0.00 1.11 0.00 0.00 32.58 31.52 3gko s HIS 104 CO 0.05 0.50 0.82 1.03 -0.85 0.00 0.00 174.74 176.29 3gko s ARG 105 N -2.30 4.35 -0.47 1.40 0.52 -1.26 -4.46 118.95 116.73 3gko s ARG 105 Ca 0.36 1.02 0.03 0.00 -0.52 0.00 0.00 55.73 56.62 3gko s ARG 105 Cb -0.13 -3.53 0.16 0.00 0.52 0.00 0.00 34.95 31.96 3gko s ARG 105 CO 0.22 -0.21 0.33 -1.58 0.02 0.00 0.00 175.30 174.07 3gko s TRP 106 N 1.73 1.73 0.05 -0.53 0.23 -1.26 -4.20 118.94 116.68 3gko s TRP 106 Ca 0.39 -2.44 -0.26 0.00 -2.03 0.00 0.00 56.10 51.76 3gko s TRP 106 Cb -0.17 -1.49 -0.05 0.00 0.03 0.00 0.00 33.47 31.78 3gko s TRP 106 CO 0.15 -0.76 0.82 0.99 0.96 0.00 0.00 176.95 179.11 3gko s THR 107 N -0.01 4.72 0.26 2.01 2.01 -0.24 -4.76 115.64 119.64 3gko s THR 107 Ca 0.25 1.74 -0.31 0.00 0.31 0.00 0.00 61.69 63.69 3gko s THR 107 Cb -0.09 -4.17 -0.12 0.00 0.01 0.00 0.00 72.50 68.14 3gko s THR 107 CO -0.11 0.33 1.61 -1.14 -0.69 0.00 0.00 174.62 174.61 3gko n ARG 108 N 2.98 2.63 -2.55 4.92 0.63 -1.26 -0.29 116.66 123.72 3gko n ARG 108 Ca -0.01 0.94 -0.36 0.00 -0.92 0.00 0.00 57.85 57.50 3gko n ARG 108 Cb 0.50 -2.72 -0.04 0.00 0.45 0.00 0.00 32.46 30.65 3gko n ARG 108 CO 0.00 0.00 0.00 -1.64 -2.51 0.00 0.00 177.63 173.48 3gko s MET 109 N -0.05 4.16 -0.23 -0.14 -1.94 -0.18 -4.82 119.30 116.11 3gko s MET 109 Ca 0.68 1.50 -0.05 0.00 -1.71 0.00 0.00 55.69 56.11 3gko s MET 109 Cb -0.52 -2.53 -0.02 0.00 2.01 0.00 0.00 34.83 33.77 3gko s MET 109 CO 0.44 -0.14 -0.00 -0.51 -0.01 0.00 0.00 175.02 174.80 3gko s ASP 110 N -1.58 4.62 -0.18 3.03 1.01 -1.26 -0.10 116.67 122.22 3gko s ASP 110 Ca 0.58 -0.31 0.00 0.00 0.71 0.00 0.00 52.55 53.53 3gko s ASP 110 Cb -0.22 -1.81 0.01 0.00 1.01 0.00 0.00 42.92 41.92 3gko s ASP 110 CO 0.27 -0.01 -0.16 -0.63 0.21 0.00 0.00 175.17 174.85 3gko s ILE 111 N 1.45 2.44 -1.46 0.77 -1.09 0.34 -4.64 121.20 119.02 3gko s ILE 111 Ca 0.05 -0.82 -0.10 0.00 -2.23 0.00 0.00 60.65 57.55 3gko s ILE 111 Cb -0.15 -2.04 0.06 0.00 -1.58 0.00 0.00 42.46 38.75 3gko s ILE 111 CO -0.00 0.51 0.79 0.47 -1.23 0.00 0.00 174.94 175.48 3gko n ASP 112 N 4.48 -5.05 -0.00 3.58 8.00 -1.26 -1.31 116.55 125.00 3gko n ASP 112 Ca -0.20 -0.53 -0.00 0.00 0.71 0.00 0.00 54.79 54.77 3gko n ASP 112 Cb 0.51 -4.06 -0.00 0.00 -0.02 0.00 0.00 41.12 37.54 3gko n ASP 112 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gko n GLY 113 N -1.56 0.46 3.08 0.44 0.00 -1.26 -5.03 105.19 101.32 3gko n GLY 113 Ca -0.01 -0.04 -0.25 0.00 0.00 0.00 0.00 46.02 45.72 3gko n GLY 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gko s LYS 114 N -0.22 1.77 0.15 1.61 1.02 -0.42 -5.10 119.74 118.54 3gko s LYS 114 Ca 0.00 -0.51 -0.31 0.00 0.02 0.00 0.00 55.97 55.16 3gko s LYS 114 Cb 0.00 -1.48 -0.10 0.00 -0.52 0.00 0.00 37.83 35.72 3gko s LYS 114 CO 0.00 0.13 1.71 -2.14 -0.92 0.00 0.00 175.35 174.14 3gko s PRO 115 N 0.35 4.16 0.20 -1.68 0.02 -1.26 -0.50 135.00 136.29 3gko s PRO 115 Ca -0.10 2.50 -0.30 0.00 0.02 0.00 0.00 61.00 63.13 3gko s PRO 115 Cb -0.14 -3.36 -0.08 0.00 0.02 0.00 0.00 34.50 30.95 3gko s PRO 115 CO 0.03 -0.75 0.95 -1.58 -0.33 0.00 0.00 177.00 175.32 3gko s HIS 116 N 1.95 3.94 0.41 6.54 2.46 0.86 -4.89 115.29 126.56 3gko s HIS 116 Ca 0.76 1.89 0.35 0.00 0.47 0.00 0.00 55.06 58.52 3gko s HIS 116 Cb -0.45 -3.00 1.76 0.00 -0.13 0.00 0.00 32.58 30.76 3gko s HIS 116 CO 0.33 0.39 2.15 -1.00 -2.47 0.00 0.00 174.74 174.14 3gko h PRO 117 N 4.55 0.00 0.00 2.88 0.13 -1.92 -3.37 132.00 134.27 3gko h PRO 117 Ca -0.44 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.59 3gko h PRO 117 Cb 1.20 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.17 3gko h PRO 117 CO 0.69 0.04 -0.48 -2.39 -0.23 0.00 0.00 178.00 175.63 3gko n HIS 118 N -3.30 0.00 -5.13 1.56 1.44 -1.26 -0.27 115.22 108.26 3gko n HIS 118 Ca -0.02 -0.33 -0.30 0.00 -2.01 0.00 0.00 57.72 55.07 3gko n HIS 118 Cb 0.20 0.18 -0.16 0.00 0.12 0.00 0.00 29.99 30.33 3gko n HIS 118 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 3gko s SER 119 N -1.09 2.79 0.14 4.39 0.15 -1.26 -5.04 113.70 113.77 3gko s SER 119 Ca 0.10 -0.46 0.04 0.00 0.70 0.00 0.00 55.95 56.32 3gko s SER 119 Cb 0.11 -0.77 -0.04 0.00 -1.71 0.00 0.00 66.02 63.61 3gko s SER 119 CO -0.05 0.22 -0.09 -0.36 1.20 0.00 0.00 173.24 174.16 3gko s PHE 120 N -0.10 1.17 0.01 3.44 0.40 -1.26 -1.01 117.98 120.63 3gko s PHE 120 Ca -0.04 -0.80 0.04 0.00 -0.60 0.00 0.00 56.93 55.52 3gko s PHE 120 Cb -0.13 -0.61 -0.01 0.00 0.51 0.00 0.00 43.02 42.77 3gko s PHE 120 CO 0.03 0.02 -0.11 -1.50 0.70 0.00 0.00 175.22 174.36 3gko s ILE 121 N -3.41 0.88 -0.99 0.64 2.07 0.60 -4.84 121.20 116.14 3gko s ILE 121 Ca 0.16 -0.61 -0.20 0.00 -1.41 0.00 0.00 60.65 58.58 3gko s ILE 121 Cb 0.03 -0.76 0.09 0.00 0.13 0.00 0.00 42.46 41.96 3gko s ILE 121 CO -0.01 0.15 1.30 -0.60 -1.91 0.00 0.00 174.94 173.87 3gko s ARG 122 N -0.52 3.62 -0.87 3.50 6.06 -1.26 -1.08 118.95 128.40 3gko s ARG 122 Ca 0.03 -1.50 -0.18 0.00 -2.50 0.00 0.00 55.73 51.57 3gko s ARG 122 Cb -0.05 -5.14 0.14 0.00 0.06 0.00 0.00 34.95 29.96 3gko s ARG 122 CO 0.00 -1.98 1.02 0.16 -2.50 0.00 0.00 175.30 172.00 3gko s ASP 123 N 4.23 6.59 0.00 -2.12 -4.77 -1.26 -4.87 116.67 114.47 3gko s ASP 123 Ca 0.40 -2.05 0.00 0.00 -3.30 0.00 0.00 52.55 47.60 3gko s ASP 123 Cb -0.02 -2.36 0.00 0.00 -1.09 0.00 0.00 42.92 39.45 3gko s ASP 123 CO -0.09 -1.01 0.00 -0.24 0.70 0.00 0.00 175.17 174.54 3gko n SER 124 N 6.15 -0.00 -0.58 2.11 2.88 -1.26 -4.76 113.62 118.16 3gko n SER 124 Ca 0.18 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.83 3gko n SER 124 Cb 0.48 0.30 0.37 0.00 -0.75 0.00 0.00 64.21 64.61 3gko n SER 124 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 3gko n GLU 125 N 0.94 1.77 -1.75 -1.46 4.07 -1.26 -4.71 120.64 118.25 3gko n GLU 125 Ca 0.00 -1.16 -0.42 0.00 -0.06 0.00 0.00 57.16 55.53 3gko n GLU 125 Cb 0.00 -1.40 -0.00 0.00 -0.06 0.00 0.00 31.44 29.98 3gko n GLU 125 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 3gko n GLU 126 N 0.38 2.51 -4.41 5.31 2.13 -1.23 -4.79 120.64 120.54 3gko n GLU 126 Ca 0.16 0.88 -0.23 0.00 0.66 0.00 0.00 57.16 58.63 3gko n GLU 126 Cb 0.34 -2.57 -0.11 0.00 0.27 0.00 0.00 31.44 29.38 3gko n GLU 126 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 3gko s LYS 127 N -1.87 1.49 -0.13 5.31 -0.14 0.42 -4.43 119.74 120.39 3gko s LYS 127 Ca 0.55 -1.61 0.03 0.00 -1.36 0.00 0.00 55.97 53.58 3gko s LYS 127 Cb -0.51 -1.56 0.01 0.00 -1.68 0.00 0.00 37.83 34.09 3gko s LYS 127 CO 0.62 0.30 -0.22 0.50 -0.76 0.00 0.00 175.35 175.79 3gko s ARG 128 N -3.22 3.03 0.30 1.68 3.52 -1.13 -1.44 118.95 121.69 3gko s ARG 128 Ca 0.24 -0.86 0.05 0.00 -0.13 0.00 0.00 55.73 55.03 3gko s ARG 128 Cb -0.05 -2.42 -0.06 0.00 -1.56 0.00 0.00 34.95 30.86 3gko s ARG 128 CO 0.11 0.02 0.01 -0.80 -0.81 0.00 0.00 175.30 173.82 3gko s ASN 129 N 0.73 2.56 -0.04 -2.12 0.01 0.37 -0.30 114.94 116.16 3gko s ASN 129 Ca -0.09 -1.29 -0.13 0.00 -0.71 0.00 0.00 52.86 50.64 3gko s ASN 129 Cb -0.16 -0.13 0.02 0.00 0.41 0.00 0.00 41.25 41.40 3gko s ASN 129 CO -0.00 -0.49 0.29 0.68 -1.51 0.00 0.00 177.10 176.07 3gko s VAL 130 N -3.16 0.05 -0.20 1.60 -7.23 -0.67 -1.33 120.40 109.45 3gko s VAL 130 Ca 0.33 -0.38 0.00 0.00 -1.81 0.00 0.00 61.98 60.12 3gko s VAL 130 Cb 0.07 -0.54 0.05 0.00 0.56 0.00 0.00 36.38 36.51 3gko s VAL 130 CO 0.14 -0.21 -0.06 -1.58 -0.31 0.00 0.00 175.10 173.08 3gko s GLN 131 N -0.96 1.59 -0.25 4.82 2.00 -0.16 -1.36 119.66 125.33 3gko s GLN 131 Ca -0.10 -0.76 -0.01 0.00 -2.00 0.00 0.00 55.36 52.48 3gko s GLN 131 Cb -0.05 -2.33 0.03 0.00 0.80 0.00 0.00 33.01 31.46 3gko s GLN 131 CO 0.03 -0.51 -0.06 0.08 -0.50 0.00 0.00 175.29 174.33 3gko s VAL 132 N 1.51 2.83 -0.35 1.34 1.01 0.14 -1.37 120.40 125.50 3gko s VAL 132 Ca -0.02 -1.08 -0.08 0.00 0.00 0.00 0.00 61.98 60.80 3gko s VAL 132 Cb -0.17 -2.46 0.04 0.00 0.00 0.00 0.00 36.38 33.79 3gko s VAL 132 CO -0.07 0.17 0.15 -1.81 0.00 0.00 0.00 175.10 173.54 3gko s ASP 133 N 1.31 5.49 -0.41 3.32 1.01 0.02 -0.48 116.67 126.93 3gko s ASP 133 Ca -0.01 -1.09 -0.15 0.00 0.71 0.00 0.00 52.55 52.01 3gko s ASP 133 Cb -0.17 -1.93 0.02 0.00 1.01 0.00 0.00 42.92 41.85 3gko s ASP 133 CO -0.04 -0.35 0.32 -0.69 0.21 0.00 0.00 175.17 174.61 3gko s VAL 134 N 1.46 5.23 -0.20 -1.27 1.01 -0.00 -1.28 120.40 125.35 3gko s VAL 134 Ca -0.00 -0.56 -0.02 0.00 0.00 0.00 0.00 61.98 61.40 3gko s VAL 134 Cb -0.19 -3.93 -0.00 0.00 0.00 0.00 0.00 36.38 32.25 3gko s VAL 134 CO 0.04 -0.31 -0.10 -0.69 0.00 0.00 0.00 175.10 174.05 3gko s VAL 135 N 1.77 2.99 0.07 2.92 1.01 -0.89 -0.82 120.40 127.46 3gko s VAL 135 Ca 0.06 -0.63 -0.34 0.00 0.00 0.00 0.00 61.98 61.07 3gko s VAL 135 Cb -0.18 -2.33 -0.13 0.00 0.00 0.00 0.00 36.38 33.74 3gko s VAL 135 CO 0.11 0.47 1.68 1.21 0.00 0.00 0.00 175.10 178.57 3gko n GLU 136 N 4.57 2.13 -0.26 2.72 2.13 0.10 -0.59 120.64 131.45 3gko n GLU 136 Ca -0.19 0.77 0.00 0.00 0.66 0.00 0.00 57.16 58.40 3gko n GLU 136 Cb 0.51 -2.57 0.00 0.00 0.27 0.00 0.00 31.44 29.65 3gko n GLU 136 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3gko n GLY 137 N 3.75 2.21 0.46 8.31 0.00 -1.26 -4.82 105.19 113.84 3gko n GLY 137 Ca 0.19 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.27 3gko n GLY 137 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gko n LYS 138 N -2.00 0.95 0.00 1.61 5.02 0.25 -5.12 118.16 118.86 3gko n LYS 138 Ca 0.00 -2.37 0.00 0.00 -2.02 0.00 0.00 58.31 53.92 3gko n LYS 138 Cb 0.00 -1.15 0.00 0.00 -0.02 0.00 0.00 35.03 33.86 3gko n LYS 138 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3gko n GLY 139 N -0.84 0.84 2.89 0.72 0.00 -1.09 -4.71 105.19 103.00 3gko n GLY 139 Ca 0.12 -0.72 -0.26 0.00 0.00 0.00 0.00 46.02 45.16 3gko n GLY 139 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gko s ILE 140 N 0.00 0.94 -0.23 -0.61 1.01 0.13 -2.09 121.20 120.35 3gko s ILE 140 Ca 0.00 -0.24 -0.09 0.00 0.00 0.00 0.00 60.65 60.32 3gko s ILE 140 Cb 0.00 -0.97 -0.04 0.00 0.01 0.00 0.00 42.46 41.46 3gko s ILE 140 CO 0.00 0.35 0.11 -1.81 0.00 0.00 0.00 174.94 173.59 3gko s ASP 141 N 1.68 5.66 -0.09 3.58 1.01 -0.40 -1.44 116.67 126.67 3gko s ASP 141 Ca 0.04 -0.01 0.03 0.00 0.71 0.00 0.00 52.55 53.32 3gko s ASP 141 Cb -0.13 -2.01 0.00 0.00 1.01 0.00 0.00 42.92 41.80 3gko s ASP 141 CO -0.07 0.05 -0.20 -0.63 0.21 0.00 0.00 175.17 174.54 3gko s ILE 142 N 1.11 1.71 -0.21 0.77 1.01 -1.26 -0.80 121.20 123.52 3gko s ILE 142 Ca 0.05 -0.82 0.00 0.00 0.00 0.00 0.00 60.65 59.89 3gko s ILE 142 Cb -0.14 -1.50 0.03 0.00 0.01 0.00 0.00 42.46 40.86 3gko s ILE 142 CO 0.04 0.48 -0.14 -0.54 0.00 0.00 0.00 174.94 174.78 3gko s LYS 143 N 0.45 2.85 0.07 2.79 1.02 -0.47 -1.25 119.74 125.20 3gko s LYS 143 Ca -0.17 -0.94 0.02 0.00 0.02 0.00 0.00 55.97 54.90 3gko s LYS 143 Cb -0.17 -2.75 -0.04 0.00 -0.52 0.00 0.00 37.83 34.35 3gko s LYS 143 CO 0.07 -0.31 0.12 -1.12 -0.92 0.00 0.00 175.35 173.19 3gko s SER 144 N 1.28 5.81 0.20 2.83 0.01 -0.54 -0.99 113.70 122.31 3gko s SER 144 Ca 0.01 0.09 -0.20 0.00 1.31 0.00 0.00 55.95 57.17 3gko s SER 144 Cb -0.15 -1.65 0.04 0.00 0.21 0.00 0.00 66.02 64.47 3gko s SER 144 CO -0.09 0.18 0.59 -0.94 0.41 0.00 0.00 173.24 173.39 3gko s SER 145 N -2.38 -0.36 -0.01 2.44 1.04 -0.44 -0.49 113.70 113.49 3gko s SER 145 Ca 0.31 -0.35 0.05 0.00 0.48 0.00 0.00 55.95 56.44 3gko s SER 145 Cb -0.12 0.62 -0.01 0.00 0.10 0.00 0.00 66.02 66.60 3gko s SER 145 CO 0.23 -1.10 -0.16 -1.48 0.98 0.00 0.00 173.24 171.72 3gko s LEU 146 N -2.84 2.05 0.14 2.42 0.05 -0.52 -0.48 118.68 119.49 3gko s LEU 146 Ca 0.07 -0.32 -0.09 0.00 0.05 0.00 0.00 54.13 53.85 3gko s LEU 146 Cb -0.02 -0.83 -0.01 0.00 -2.05 0.00 0.00 46.19 43.29 3gko s LEU 146 CO -0.04 0.19 0.25 -0.94 -0.55 0.00 0.00 176.35 175.25 3gko s SER 147 N -0.47 0.07 -0.91 1.48 1.04 -0.52 -1.34 113.70 113.05 3gko s SER 147 Ca 0.06 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 55.70 3gko s SER 147 Cb -0.06 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.45 3gko s SER 147 CO -0.00 -0.83 0.00 0.61 0.98 0.00 0.00 173.24 174.00 3gko n GLY 148 N -0.16 0.84 3.42 7.32 0.00 -1.08 -0.44 105.19 115.09 3gko n GLY 148 Ca -0.10 -0.61 -0.44 0.00 0.00 0.00 0.00 46.02 44.87 3gko n GLY 148 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3gko s LEU 149 N -2.15 4.93 -0.24 0.99 2.96 -1.22 -3.50 118.68 120.45 3gko s LEU 149 Ca 0.00 -1.32 -0.16 0.00 -0.22 0.00 0.00 54.13 52.43 3gko s LEU 149 Cb 0.00 -2.36 -0.04 0.00 0.50 0.00 0.00 46.19 44.29 3gko s LEU 149 CO 0.00 -1.25 0.42 -0.89 -1.32 0.00 0.00 176.35 173.31 3gko s THR 150 N 3.26 5.16 0.19 3.68 2.01 -1.26 -0.14 115.64 128.54 3gko s THR 150 Ca 0.19 0.70 0.02 0.00 0.31 0.00 0.00 61.69 62.91 3gko s THR 150 Cb -0.19 -3.74 -0.05 0.00 0.01 0.00 0.00 72.50 68.53 3gko s THR 150 CO 0.06 0.18 0.01 0.68 -0.69 0.00 0.00 174.62 174.86 3gko s VAL 151 N 1.83 0.73 -0.20 3.82 -7.23 -0.60 -5.01 120.40 113.74 3gko s VAL 151 Ca 0.18 -1.99 -0.18 0.00 -1.81 0.00 0.00 61.98 58.18 3gko s VAL 151 Cb -0.15 -2.22 0.05 0.00 0.56 0.00 0.00 36.38 34.62 3gko s VAL 151 CO 0.09 -0.39 0.54 -0.22 -0.31 0.00 0.00 175.10 174.80 3gko s LEU 152 N -3.21 -0.10 -0.04 1.32 0.20 -1.26 -1.93 118.68 113.66 3gko s LEU 152 Ca 0.26 1.09 0.05 0.00 0.69 0.00 0.00 54.13 56.22 3gko s LEU 152 Cb 0.06 1.84 -0.01 0.00 -0.43 0.00 0.00 46.19 47.65 3gko s LEU 152 CO 0.06 -0.19 -0.19 -1.59 -0.29 0.00 0.00 176.35 174.15 3gko s LYS 153 N 0.42 1.87 0.00 1.98 -2.85 -0.01 -5.00 119.74 116.16 3gko s LYS 153 Ca -0.01 -0.68 0.27 0.00 -1.00 0.00 0.00 55.97 54.55 3gko s LYS 153 Cb -0.04 -1.66 0.92 0.00 -2.06 0.00 0.00 37.83 34.99 3gko s LYS 153 CO -0.01 0.31 1.70 -1.13 0.10 0.00 0.00 175.35 176.32 3gko n SER 154 N 2.97 0.29 -1.90 0.03 3.41 -1.26 -1.91 113.62 115.26 3gko n SER 154 Ca -0.17 0.01 -0.04 0.00 -0.26 0.00 0.00 58.87 58.40 3gko n SER 154 Cb 0.53 -0.11 0.01 0.00 -0.26 0.00 0.00 64.21 64.38 3gko n SER 154 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 3gko n THR 155 N -1.41 0.00 -3.43 6.66 5.66 -1.26 -4.48 114.28 116.02 3gko n THR 155 Ca 0.07 -0.48 -0.20 0.00 -3.05 0.00 0.00 64.05 60.39 3gko n THR 155 Cb 0.33 0.49 0.07 0.00 -1.55 0.00 0.00 70.33 69.67 3gko n THR 155 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 3gko n ASN 156 N -1.25 -5.18 -3.79 1.09 4.13 -1.26 -4.89 115.26 104.12 3gko n ASN 156 Ca -0.04 -0.49 -0.14 0.00 1.68 0.00 0.00 54.58 55.59 3gko n ASN 156 Cb 0.30 -4.52 -0.15 0.00 -1.54 0.00 0.00 39.78 33.87 3gko n ASN 156 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 3gko s SER 157 N -3.45 0.00 0.13 6.41 0.15 -1.25 -2.51 113.70 113.18 3gko s SER 157 Ca 0.42 0.11 0.01 0.00 0.70 0.00 0.00 55.95 57.19 3gko s SER 157 Cb -0.19 0.03 -0.04 0.00 -1.71 0.00 0.00 66.02 64.11 3gko s SER 157 CO 0.64 -0.11 -0.01 -1.10 1.20 0.00 0.00 173.24 173.87 3gko s GLN 158 N 0.84 0.96 -0.32 5.44 -0.21 0.65 -0.92 119.66 126.09 3gko s GLN 158 Ca -0.07 -1.44 0.05 0.00 0.02 0.00 0.00 55.36 53.92 3gko s GLN 158 Cb -0.10 -0.09 0.19 0.00 1.00 0.00 0.00 33.01 34.01 3gko s GLN 158 CO -0.03 -0.13 0.65 0.12 -2.12 0.00 0.00 175.29 173.78 3gko s PHE 159 N -3.76 -1.68 0.20 0.91 5.36 -0.34 -3.68 117.98 114.98 3gko s PHE 159 Ca 0.19 0.79 -0.05 0.00 -0.96 0.00 0.00 56.93 56.90 3gko s PHE 159 Cb 0.06 0.29 -0.03 0.00 -0.34 0.00 0.00 43.02 43.01 3gko s PHE 159 CO 0.00 -1.02 0.22 1.67 -1.46 0.00 0.00 175.22 174.63 3gko s TRP 160 N 2.57 0.82 0.00 10.12 1.48 -1.26 -1.92 118.94 130.75 3gko s TRP 160 Ca 0.13 -1.12 0.00 0.00 -1.06 0.00 0.00 56.10 54.05 3gko s TRP 160 Cb -0.07 -0.30 0.00 0.00 -1.16 0.00 0.00 33.47 31.93 3gko s TRP 160 CO -0.21 -0.72 0.00 0.41 -4.06 0.00 0.00 176.95 172.38 3gko n GLY 161 N -0.26 0.51 3.89 3.67 0.00 -1.26 -5.04 105.19 106.69 3gko n GLY 161 Ca -0.01 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 3gko n GLY 161 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3gko s PHE 162 N -2.00 3.41 0.26 1.61 -0.71 -1.26 -4.99 117.98 114.29 3gko s PHE 162 Ca 0.00 1.02 -0.31 0.00 -1.04 0.00 0.00 56.93 56.60 3gko s PHE 162 Cb 0.00 -2.86 -0.12 0.00 -1.21 0.00 0.00 43.02 38.82 3gko s PHE 162 CO 0.00 -0.92 1.58 -0.11 -1.34 0.00 0.00 175.22 174.43 3gko n LEU 163 N -2.81 3.95 -4.02 -1.99 0.00 -1.26 -5.00 117.00 105.87 3gko n LEU 163 Ca 0.06 1.12 -0.30 0.00 0.00 0.00 0.00 56.01 56.89 3gko n LEU 163 Cb 0.56 -1.54 -0.16 0.00 0.00 0.00 0.00 43.42 42.27 3gko n LEU 163 CO 0.56 -0.00 -0.48 -0.13 0.00 0.00 0.00 177.39 177.34 3gko s ARG 164 N -0.04 2.28 0.00 1.96 0.52 -1.26 -4.95 118.95 117.46 3gko s ARG 164 Ca 0.68 -0.60 0.00 0.00 -0.52 0.00 0.00 55.73 55.29 3gko s ARG 164 Cb -0.54 -2.16 0.00 0.00 0.52 0.00 0.00 34.95 32.77 3gko s ARG 164 CO 0.45 -0.26 0.00 -0.40 0.02 0.00 0.00 175.30 175.10 3gko n ASP 165 N 4.76 0.00 0.00 0.23 5.68 -1.26 -5.00 116.55 120.95 3gko n ASP 165 Ca -0.17 -0.29 0.04 0.00 -0.50 0.00 0.00 54.79 53.88 3gko n ASP 165 Cb 0.50 0.00 0.21 0.00 -1.14 0.00 0.00 41.12 40.68 3gko n ASP 165 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 3gko n GLU 166 N 0.00 0.12 0.00 0.11 0.00 -1.26 -1.60 120.64 118.01 3gko n GLU 166 Ca 0.00 0.20 0.09 0.00 0.00 0.00 0.00 57.16 57.45 3gko n GLU 166 Cb 0.00 -1.50 0.06 0.00 0.00 0.00 0.00 31.44 30.00 3gko n GLU 166 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 3gko n TYR 167 N -1.28 0.00 -3.50 -1.84 4.01 -1.26 -4.98 117.16 108.31 3gko n TYR 167 Ca 0.04 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.41 3gko n TYR 167 Cb 0.06 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.03 3gko n TYR 167 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 3gko s THR 168 N -1.57 5.28 0.00 -0.72 2.01 -0.63 -4.92 115.64 115.10 3gko s THR 168 Ca 0.20 0.62 0.00 0.00 0.31 0.00 0.00 61.69 62.81 3gko s THR 168 Cb 0.15 -3.66 0.00 0.00 0.01 0.00 0.00 72.50 69.00 3gko s THR 168 CO 0.26 0.38 0.00 0.35 -0.69 0.00 0.00 174.62 174.92 3gko n THR 169 N 3.56 0.00 -1.69 -0.82 -2.24 -1.26 -4.84 114.28 106.98 3gko n THR 169 Ca -0.11 0.00 -0.44 0.00 -2.27 0.00 0.00 64.05 61.23 3gko n THR 169 Cb 0.52 0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.92 3gko n THR 169 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3gko n LEU 170 N -0.86 3.72 -4.79 3.22 7.94 -1.26 -4.97 117.00 120.00 3gko n LEU 170 Ca 0.00 1.04 -0.38 0.00 -1.11 0.00 0.00 56.01 55.56 3gko n LEU 170 Cb 0.02 -1.51 -0.06 0.00 0.53 0.00 0.00 43.42 42.40 3gko n LEU 170 CO 0.00 0.03 0.49 -0.54 -1.11 0.00 0.00 177.39 176.26 3gko s LYS 171 N 1.79 4.47 0.54 1.96 1.02 -1.26 -5.03 119.74 123.22 3gko s LYS 171 Ca 0.79 1.09 -0.20 0.00 0.02 0.00 0.00 55.97 57.67 3gko s LYS 171 Cb -0.56 -3.06 -0.05 0.00 -0.52 0.00 0.00 37.83 33.64 3gko s LYS 171 CO 0.37 0.47 1.19 -1.21 -0.92 0.00 0.00 175.35 175.25 3gko s GLU 172 N -1.57 3.29 0.00 1.68 2.02 -1.26 -5.00 118.70 117.85 3gko s GLU 172 Ca 0.40 1.80 -0.02 0.00 0.02 0.00 0.00 54.97 57.17 3gko s GLU 172 Cb -0.20 -2.10 -0.01 0.00 0.10 0.00 0.00 34.13 31.92 3gko s GLU 172 CO 0.24 -0.95 0.04 -0.08 0.02 0.00 0.00 175.26 174.53 3gko s THR 173 N -1.60 0.06 -0.69 3.63 -1.32 -0.81 -5.00 115.64 109.92 3gko s THR 173 Ca 0.72 -0.51 0.07 0.00 -1.21 0.00 0.00 61.69 60.76 3gko s THR 173 Cb -0.29 -0.23 0.15 0.00 -1.51 0.00 0.00 72.50 70.62 3gko s THR 173 CO 0.33 -0.28 1.03 0.79 -2.21 0.00 0.00 174.62 174.28 3gko n TRP 174 N 2.14 0.21 -3.15 9.09 8.01 -1.26 -1.20 117.44 131.27 3gko n TRP 174 Ca -0.19 -0.35 0.04 0.00 -1.31 0.00 0.00 57.50 55.70 3gko n TRP 174 Cb 0.57 -0.02 -0.00 0.00 -2.01 0.00 0.00 31.31 29.84 3gko n TRP 174 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.69 177.02 3gko s ASP 175 N -0.88 -1.40 0.23 -0.99 -1.08 -1.23 -4.69 116.67 106.62 3gko s ASP 175 Ca 0.13 0.31 0.00 0.00 -0.52 0.00 0.00 52.55 52.48 3gko s ASP 175 Cb 0.07 1.95 -0.04 0.00 -1.46 0.00 0.00 42.92 43.44 3gko s ASP 175 CO 0.10 -0.26 0.15 0.00 0.52 0.00 0.00 175.17 175.68 3gko s ARG 176 N 2.86 1.30 0.20 4.34 1.70 -0.10 -5.01 118.95 124.24 3gko s ARG 176 Ca 0.14 -1.70 -0.17 0.00 -0.47 0.00 0.00 55.73 53.52 3gko s ARG 176 Cb -0.10 0.24 -0.08 0.00 -0.57 0.00 0.00 34.95 34.44 3gko s ARG 176 CO -0.24 -0.43 0.65 0.42 -1.08 0.00 0.00 175.30 174.63 3gko s ILE 177 N -4.02 4.69 -0.09 4.99 1.01 -1.26 -3.97 121.20 122.55 3gko s ILE 177 Ca 0.39 1.07 -0.01 0.00 0.00 0.00 0.00 60.65 62.11 3gko s ILE 177 Cb 0.06 -3.79 0.03 0.00 0.01 0.00 0.00 42.46 38.77 3gko s ILE 177 CO 0.15 0.19 -0.04 -0.22 0.00 0.00 0.00 174.94 175.02 3gko s LEU 178 N -2.04 0.92 0.01 2.97 2.96 -0.80 -4.81 118.68 117.88 3gko s LEU 178 Ca 0.42 -0.19 0.01 0.00 -0.22 0.00 0.00 54.13 54.15 3gko s LEU 178 Cb -0.16 -0.64 -0.01 0.00 0.50 0.00 0.00 46.19 45.89 3gko s LEU 178 CO 0.20 -0.15 -0.05 -0.55 -1.32 0.00 0.00 176.35 174.48 3gko s SER 179 N 1.77 0.56 0.28 3.68 0.15 -1.26 -0.83 113.70 118.05 3gko s SER 179 Ca 0.04 -0.21 -0.17 0.00 0.70 0.00 0.00 55.95 56.31 3gko s SER 179 Cb -0.13 -0.02 0.01 0.00 -1.71 0.00 0.00 66.02 64.17 3gko s SER 179 CO -0.06 -0.03 0.62 0.28 1.20 0.00 0.00 173.24 175.25 3gko s THR 180 N -0.47 0.00 -0.29 6.45 -1.32 -0.81 -1.58 115.64 117.61 3gko s THR 180 Ca -0.02 -1.18 0.01 0.00 -1.21 0.00 0.00 61.69 59.29 3gko s THR 180 Cb -0.04 -2.19 0.06 0.00 -1.51 0.00 0.00 72.50 68.83 3gko s THR 180 CO -0.00 0.00 -0.04 -1.81 -2.21 0.00 0.00 174.62 170.56 3gko s ASP 181 N -2.99 4.66 -0.02 8.08 1.01 -1.26 -1.55 116.67 124.60 3gko s ASP 181 Ca 0.17 -1.48 -0.30 0.00 0.71 0.00 0.00 52.55 51.64 3gko s ASP 181 Cb -0.04 -1.62 -0.04 0.00 1.01 0.00 0.00 42.92 42.23 3gko s ASP 181 CO 0.09 -0.25 1.19 -0.69 0.21 0.00 0.00 175.17 175.71 3gko s VAL 182 N 1.12 4.23 -0.30 -1.27 1.01 0.81 -4.36 120.40 121.64 3gko s VAL 182 Ca -0.05 1.57 0.01 0.00 0.00 0.00 0.00 61.98 63.52 3gko s VAL 182 Cb -0.20 -4.01 0.09 0.00 0.00 0.00 0.00 36.38 32.26 3gko s VAL 182 CO -0.04 0.04 0.04 -0.62 0.00 0.00 0.00 175.10 174.52 3gko s ASP 183 N 1.34 4.23 -0.07 3.32 -1.08 -1.20 -2.64 116.67 120.58 3gko s ASP 183 Ca 0.56 -1.70 0.05 0.00 -0.52 0.00 0.00 52.55 50.95 3gko s ASP 183 Cb -0.26 -1.21 -0.01 0.00 -1.46 0.00 0.00 42.92 39.99 3gko s ASP 183 CO 0.24 -0.36 -0.23 0.00 0.52 0.00 0.00 175.17 175.34 3gko s ALA 184 N 1.31 2.06 -0.06 3.66 0.00 -0.45 -1.50 121.76 126.79 3gko s ALA 184 Ca 0.06 -0.96 0.03 0.00 0.00 0.00 0.00 51.96 51.09 3gko s ALA 184 Cb -0.18 -0.70 0.01 0.00 0.00 0.00 0.00 23.12 22.25 3gko s ALA 184 CO -0.14 0.35 -0.14 0.99 0.00 0.00 0.00 175.76 176.81 3gko s THR 185 N 0.06 1.25 -0.15 0.00 2.01 0.42 -1.44 115.64 117.78 3gko s THR 185 Ca -0.09 -0.58 0.01 0.00 0.31 0.00 0.00 61.69 61.34 3gko s THR 185 Cb -0.15 -1.11 0.00 0.00 0.01 0.00 0.00 72.50 71.26 3gko s THR 185 CO 0.05 0.37 -0.18 -1.66 -0.69 0.00 0.00 174.62 172.52 3gko s TRP 186 N 0.38 2.75 -0.24 4.92 -2.14 0.35 0.08 118.94 125.05 3gko s TRP 186 Ca -0.10 -1.21 -0.15 0.00 2.66 0.00 0.00 56.10 57.30 3gko s TRP 186 Cb -0.14 -1.87 -0.04 0.00 -3.10 0.00 0.00 33.47 28.32 3gko s TRP 186 CO 0.03 -0.56 0.39 -1.14 -2.66 0.00 0.00 176.95 173.01 3gko s GLN 187 N 0.89 4.10 0.53 3.25 0.74 -0.52 -1.47 119.66 127.19 3gko s GLN 187 Ca -0.04 0.12 -0.14 0.00 0.05 0.00 0.00 55.36 55.35 3gko s GLN 187 Cb -0.15 -3.59 -0.06 0.00 1.10 0.00 0.00 33.01 30.30 3gko s GLN 187 CO -0.02 -0.16 0.97 -1.58 -0.55 0.00 0.00 175.29 173.95 3gko s TRP 188 N 1.69 3.51 0.57 1.67 0.52 -0.38 -0.35 118.94 126.17 3gko s TRP 188 Ca 0.17 1.35 -0.21 0.00 0.02 0.00 0.00 56.10 57.43 3gko s TRP 188 Cb -0.15 -2.72 -0.04 0.00 -1.15 0.00 0.00 33.47 29.41 3gko s TRP 188 CO 0.09 -0.44 1.32 0.21 0.02 0.00 0.00 176.95 178.15 3gko s LYS 189 N -4.41 3.01 0.34 4.98 2.20 -0.33 -4.59 119.74 120.95 3gko s LYS 189 Ca 0.57 2.13 -0.29 0.00 -0.36 0.00 0.00 55.97 58.02 3gko s LYS 189 Cb -0.10 -2.13 -0.12 0.00 -1.51 0.00 0.00 37.83 33.97 3gko s LYS 189 CO 0.39 -1.26 1.48 -1.71 -0.36 0.00 0.00 175.35 173.88 3gko n ASN 190 N -1.27 3.59 -4.74 1.43 2.85 -1.26 -4.78 115.26 111.07 3gko n ASN 190 Ca 0.12 1.20 -0.35 0.00 -0.11 0.00 0.00 54.58 55.44 3gko n ASN 190 Cb 0.46 -1.58 -0.08 0.00 1.24 0.00 0.00 39.78 39.82 3gko n ASN 190 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 3gko s PHE 191 N -0.80 3.27 0.23 1.20 0.08 -0.52 -4.95 117.98 116.50 3gko s PHE 191 Ca 0.57 0.26 0.28 0.00 0.12 0.00 0.00 56.93 58.16 3gko s PHE 191 Cb -0.50 -1.80 1.23 0.00 -0.57 0.00 0.00 43.02 41.38 3gko s PHE 191 CO 0.59 0.54 1.95 0.66 -0.10 0.00 0.00 175.22 178.87 3gko h SER 192 N 4.84 0.00 0.00 1.36 4.64 -1.94 0.38 113.55 122.83 3gko h SER 192 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3gko h SER 192 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3gko h SER 192 CO 0.57 0.14 0.00 0.61 -0.87 0.00 0.00 176.83 177.28 3gko n GLY 193 N -0.16 -0.99 0.36 -0.77 0.00 -1.26 -4.32 105.19 98.06 3gko n GLY 193 Ca -0.00 -0.93 -0.03 0.00 0.00 0.00 0.00 46.02 45.06 3gko n GLY 193 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3gko h LEU 194 N 0.00 1.11 -0.54 0.99 3.38 -1.93 -2.60 115.31 115.72 3gko h LEU 194 Ca 0.00 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 57.93 3gko h LEU 194 Cb 0.00 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.43 3gko h LEU 194 CO 0.00 0.86 0.32 -0.61 0.09 0.00 0.00 178.44 179.10 3gko h GLN 195 N 1.26 0.60 -0.52 1.13 4.15 -1.99 0.30 115.11 120.05 3gko h GLN 195 Ca 0.33 -0.04 -0.12 0.00 0.77 0.00 0.00 58.65 59.59 3gko h GLN 195 Cb -0.03 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.51 3gko h GLN 195 CO -0.06 0.40 -0.14 1.49 -1.93 0.00 0.00 178.83 178.59 3gko h GLU 196 N 0.62 1.01 -0.27 1.69 4.81 -1.91 -0.85 114.58 119.68 3gko h GLU 196 Ca 0.22 -0.39 0.01 0.00 -0.13 0.00 0.00 59.36 59.07 3gko h GLU 196 Cb 0.05 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 3gko h GLU 196 CO -0.11 1.08 0.16 0.28 -0.73 0.00 0.00 179.01 179.69 3gko h VAL 197 N 0.88 1.04 -0.44 0.32 2.07 -1.07 -2.04 116.25 117.00 3gko h VAL 197 Ca 0.13 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 3gko h VAL 197 Cb 0.71 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 3gko h VAL 197 CO 0.05 0.06 0.25 0.03 0.02 0.00 0.00 177.57 177.99 3gko h ARG 198 N 0.34 0.60 0.00 1.57 3.08 -0.73 -1.73 114.38 117.51 3gko h ARG 198 Ca 0.10 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.10 3gko h ARG 198 Cb -0.02 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 29.91 3gko h ARG 198 CO -0.04 0.44 0.00 0.66 -1.07 0.00 0.00 179.97 179.96 3gko h SER 199 N 0.61 0.00 -0.20 7.04 4.64 -0.42 -2.82 113.55 122.41 3gko h SER 199 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 3gko h SER 199 Cb -0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3gko h SER 199 CO -0.03 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.34 3gko n HIS 200 N -2.67 0.26 -0.34 4.77 8.25 -0.68 -4.83 115.22 119.99 3gko n HIS 200 Ca 0.00 -0.47 0.08 0.00 -0.26 0.00 0.00 57.72 57.07 3gko n HIS 200 Cb 0.19 -0.03 0.18 0.00 1.12 0.00 0.00 29.99 31.45 3gko n HIS 200 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3gko h VAL 201 N 1.22 0.05 -0.26 1.59 2.07 -1.22 0.21 116.25 119.91 3gko h VAL 201 Ca 0.00 -0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.59 3gko h VAL 201 Cb 0.62 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 3gko h VAL 201 CO 0.00 0.00 0.19 -0.65 0.02 0.00 0.00 177.57 177.13 3gko h PRO 202 N 0.01 0.00 0.00 1.57 0.11 -1.88 -2.30 132.00 129.51 3gko h PRO 202 Ca 0.50 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.58 3gko h PRO 202 Cb 0.86 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.96 3gko h PRO 202 CO -0.95 0.00 -0.15 0.87 -0.21 0.00 0.00 178.00 177.56 3gko h LYS 203 N 0.00 0.00 0.37 1.05 1.57 -1.34 -2.97 116.57 115.25 3gko h LYS 203 Ca 0.12 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.89 3gko h LYS 203 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 3gko h LYS 203 CO -0.00 0.15 -0.18 0.74 -0.57 0.00 0.00 179.45 179.59 3gko h PHE 204 N 0.00 -0.46 -0.66 -1.35 0.04 -1.50 0.51 116.94 113.53 3gko h PHE 204 Ca -0.00 -0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.70 3gko h PHE 204 Cb 0.46 0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.73 3gko h PHE 204 CO 0.00 -0.14 0.18 -0.44 -0.60 0.00 0.00 178.31 177.31 3gko h ASP 205 N -0.79 0.97 -0.79 2.17 3.32 -1.72 -1.87 116.42 117.70 3gko h ASP 205 Ca -0.05 -0.19 -0.04 0.00 0.02 0.00 0.00 57.03 56.78 3gko h ASP 205 Cb 0.52 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.78 3gko h ASP 205 CO 0.08 0.92 0.35 0.00 -1.72 0.00 0.00 179.24 178.88 3gko h ALA 206 N 1.20 1.02 -0.05 3.45 0.00 -1.48 -1.38 119.26 122.03 3gko h ALA 206 Ca 0.21 -0.17 -0.19 0.00 0.00 0.00 0.00 54.91 54.76 3gko h ALA 206 Cb 0.32 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3gko h ALA 206 CO -0.00 0.61 -0.79 1.15 0.00 0.00 0.00 179.25 180.22 3gko h THR 207 N 1.13 1.41 -0.49 0.00 2.02 -0.71 -1.29 112.91 114.99 3gko h THR 207 Ca 0.27 -2.28 -0.03 0.00 0.77 0.00 0.00 66.41 65.14 3gko h THR 207 Cb 0.16 2.23 -0.02 0.00 -1.74 0.00 0.00 68.15 68.78 3gko h THR 207 CO -0.03 0.68 0.20 -0.25 0.37 0.00 0.00 175.52 176.49 3gko h TRP 208 N 0.22 0.74 -0.49 3.16 7.01 -1.14 0.26 115.95 125.71 3gko h TRP 208 Ca -0.04 -0.05 -0.01 0.00 2.11 0.00 0.00 58.89 60.90 3gko h TRP 208 Cb 1.38 -0.22 -0.02 0.00 -2.10 0.00 0.00 29.16 28.19 3gko h TRP 208 CO 0.04 0.61 0.28 0.00 -2.79 0.00 0.00 178.44 176.59 3gko h ALA 209 N 1.05 0.62 -0.27 2.65 0.00 -1.13 -0.85 119.26 121.32 3gko h ALA 209 Ca 0.16 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.01 3gko h ALA 209 Cb 0.18 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3gko h ALA 209 CO -0.01 0.13 0.15 1.15 0.00 0.00 0.00 179.25 180.67 3gko h THR 210 N 0.65 1.02 -0.40 0.00 2.02 -0.88 0.59 112.91 115.91 3gko h THR 210 Ca 0.17 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.25 3gko h THR 210 Cb 0.02 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 3gko h THR 210 CO -0.03 0.06 0.26 0.00 0.37 0.00 0.00 175.52 176.18 3gko h ALA 211 N 1.12 0.51 -0.46 6.16 0.00 -0.64 0.80 119.26 126.75 3gko h ALA 211 Ca 0.11 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 3gko h ALA 211 Cb 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3gko h ALA 211 CO -0.05 -0.03 0.04 -0.09 0.00 0.00 0.00 179.25 179.12 3gko h ARG 212 N 0.54 0.78 -0.43 0.00 2.43 -0.94 -1.05 114.38 115.72 3gko h ARG 212 Ca 0.15 -0.23 -0.05 0.00 -0.81 0.00 0.00 59.98 59.03 3gko h ARG 212 Cb -0.05 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 3gko h ARG 212 CO -0.03 0.82 0.06 0.93 -1.51 0.00 0.00 179.97 180.24 3gko h GLU 213 N 0.64 0.72 -0.66 0.20 5.08 -0.64 -1.21 114.58 118.71 3gko h GLU 213 Ca 0.13 -0.20 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 3gko h GLU 213 Cb 0.44 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 3gko h GLU 213 CO 0.02 0.76 0.15 0.28 -1.00 0.00 0.00 179.01 179.22 3gko h VAL 214 N 0.57 1.26 0.23 3.13 2.07 -0.80 -1.10 116.25 121.60 3gko h VAL 214 Ca 0.13 -0.96 -0.00 0.00 0.82 0.00 0.00 66.70 66.69 3gko h VAL 214 Cb 0.40 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 3gko h VAL 214 CO 0.01 0.36 -0.17 0.74 0.02 0.00 0.00 177.57 178.54 3gko h THR 215 N 0.99 0.64 -0.24 2.57 2.02 -0.96 -0.79 112.91 117.13 3gko h THR 215 Ca 0.21 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.36 3gko h THR 215 Cb 0.38 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 3gko h THR 215 CO 0.00 0.00 0.06 -0.07 0.37 0.00 0.00 175.52 175.88 3gko h LEU 216 N -0.40 0.37 -0.40 2.58 3.38 -1.13 -1.48 115.31 118.23 3gko h LEU 216 Ca -0.01 -0.23 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 3gko h LEU 216 Cb 0.35 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3gko h LEU 216 CO -0.00 0.50 0.04 0.50 0.09 0.00 0.00 178.44 179.57 3gko h LYS 217 N 0.22 0.69 -0.61 1.13 3.64 -1.19 -1.50 116.57 118.94 3gko h LYS 217 Ca 0.08 -0.20 -0.09 0.00 -1.27 0.00 0.00 60.65 59.17 3gko h LYS 217 Cb 0.28 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 3gko h LYS 217 CO 0.00 0.75 0.04 1.15 -2.27 0.00 0.00 179.45 179.12 3gko h THR 218 N 0.53 1.26 -0.35 1.00 2.02 -1.15 0.14 112.91 116.36 3gko h THR 218 Ca 0.12 -1.09 -0.01 0.00 0.77 0.00 0.00 66.41 66.19 3gko h THR 218 Cb 0.41 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.57 3gko h THR 218 CO 0.01 0.40 0.16 0.15 0.37 0.00 0.00 175.52 176.62 3gko h PHE 219 N 0.95 0.50 -0.17 3.16 3.57 -1.17 -0.65 116.94 123.13 3gko h PHE 219 Ca 0.18 -0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.51 3gko h PHE 219 Cb 0.51 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 3gko h PHE 219 CO 0.04 0.43 -0.51 0.00 -2.23 0.00 0.00 178.31 176.04 3gko h ALA 220 N 1.02 0.80 0.00 2.41 0.00 -1.08 -3.35 119.26 119.05 3gko h ALA 220 Ca 0.12 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 3gko h ALA 220 Cb 0.12 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3gko h ALA 220 CO -0.01 0.68 -1.91 0.39 0.00 0.00 0.00 179.25 178.39 3gko n GLU 221 N -3.97 0.66 -2.46 0.00 1.02 0.02 -4.93 120.64 110.98 3gko n GLU 221 Ca -0.02 -0.16 -0.43 0.00 -0.02 0.00 0.00 57.16 56.53 3gko n GLU 221 Cb 0.57 -1.55 -0.02 0.00 -0.02 0.00 0.00 31.44 30.41 3gko n GLU 221 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3gko s ASP 222 N -4.66 7.01 -1.15 1.62 2.15 -0.26 -4.90 116.67 116.49 3gko s ASP 222 Ca -0.07 1.73 -0.20 0.00 0.43 0.00 0.00 52.55 54.43 3gko s ASP 222 Cb 0.13 -2.55 0.06 0.00 -0.30 0.00 0.00 42.92 40.27 3gko s ASP 222 CO 0.89 -0.67 1.57 0.21 -0.17 0.00 0.00 175.17 177.00 3gko s ASN 223 N 1.69 6.67 0.05 -0.34 3.84 -1.26 -4.81 114.94 120.77 3gko s ASN 223 Ca 0.55 -1.95 -0.35 0.00 0.21 0.00 0.00 52.86 51.32 3gko s ASN 223 Cb -0.23 -2.56 -0.14 0.00 -0.55 0.00 0.00 41.25 37.77 3gko s ASN 223 CO 0.18 -1.33 1.65 -0.24 -2.79 0.00 0.00 177.10 174.57 3gko n SER 224 N 8.52 2.98 0.11 -4.21 2.88 -1.04 -4.87 113.62 117.98 3gko n SER 224 Ca 0.40 1.05 0.12 0.00 -1.33 0.00 0.00 58.87 59.11 3gko n SER 224 Cb 0.49 -1.36 0.07 0.00 -0.75 0.00 0.00 64.21 62.65 3gko n SER 224 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3gko h ALA 225 N 6.83 0.58 0.00 -1.46 0.00 -1.92 0.19 119.26 123.48 3gko h ALA 225 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3gko h ALA 225 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3gko h ALA 225 CO 0.90 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 179.02 3gko n SER 226 N -2.59 0.00 -0.24 0.00 3.41 -1.24 -4.28 113.62 108.69 3gko n SER 226 Ca 0.01 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.55 3gko n SER 226 Cb 0.52 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.51 3gko n SER 226 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3gko h VAL 227 N 0.15 1.25 -0.22 -3.33 2.07 -1.93 -2.44 116.25 111.80 3gko h VAL 227 Ca 0.00 -0.87 0.05 0.00 0.82 0.00 0.00 66.70 66.70 3gko h VAL 227 Cb 0.00 0.57 -0.06 0.00 -1.52 0.00 0.00 31.29 30.28 3gko h VAL 227 CO 0.00 0.34 -0.14 1.56 0.02 0.00 0.00 177.57 179.34 3gko h GLN 228 N 0.96 -0.13 -0.67 1.57 7.50 -1.97 -0.18 115.11 122.20 3gko h GLN 228 Ca 0.21 0.01 -0.08 0.00 0.50 0.00 0.00 58.65 59.29 3gko h GLN 228 Cb 0.30 0.03 -0.03 0.00 0.05 0.00 0.00 27.48 27.84 3gko h GLN 228 CO -0.01 -0.09 0.11 0.00 -1.50 0.00 0.00 178.83 177.35 3gko h ALA 229 N 1.02 0.93 -0.26 3.87 0.00 -1.90 -2.59 119.26 120.33 3gko h ALA 229 Ca 0.12 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.64 3gko h ALA 229 Cb 0.32 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 3gko h ALA 229 CO -0.30 0.67 -0.32 1.15 0.00 0.00 0.00 179.25 180.45 3gko h THR 230 N 1.03 1.31 -0.12 0.00 2.02 -1.14 -3.00 112.91 113.01 3gko h THR 230 Ca 0.20 -1.50 -0.07 0.00 0.77 0.00 0.00 66.41 65.81 3gko h THR 230 Cb 0.44 1.67 -0.01 0.00 -1.74 0.00 0.00 68.15 68.51 3gko h THR 230 CO 0.01 0.48 -0.24 0.00 0.37 0.00 0.00 175.52 176.13 3gko h MET 231 N 0.39 0.21 -0.60 6.66 -0.00 -1.01 -2.59 114.93 118.00 3gko h MET 231 Ca 0.03 -0.07 -0.06 0.00 -0.00 0.00 0.00 59.70 59.60 3gko h MET 231 Cb 0.90 -0.02 -0.02 0.00 -0.00 0.00 0.00 31.60 32.45 3gko h MET 231 CO 0.08 0.45 0.13 -0.92 -0.00 0.00 0.00 176.91 176.65 3gko h TYR 232 N 0.19 1.02 -0.79 -0.10 3.20 -1.42 -2.01 116.97 117.06 3gko h TYR 232 Ca 0.03 -0.13 0.00 0.00 3.14 0.00 0.00 58.73 61.78 3gko h TYR 232 Cb 0.54 -0.29 -0.04 0.00 1.54 0.00 0.00 36.73 38.49 3gko h TYR 232 CO 0.01 0.87 0.50 0.87 -1.64 0.00 0.00 178.16 178.76 3gko h LYS 233 N 0.88 1.05 -0.00 1.82 1.57 -1.33 -0.95 116.57 119.61 3gko h LYS 233 Ca 0.19 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 3gko h LYS 233 Cb 0.37 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.45 3gko h LYS 233 CO 0.00 0.72 0.00 0.52 -0.57 0.00 0.00 179.45 180.12 3gko h MET 234 N 1.08 0.00 -0.21 3.15 2.86 -1.21 -2.69 114.93 117.92 3gko h MET 234 Ca 0.29 -0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.94 3gko h MET 234 Cb -0.08 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 3gko h MET 234 CO -0.06 0.17 0.08 0.00 1.06 0.00 0.00 176.91 178.16 3gko h ALA 235 N 0.83 0.23 -0.38 6.32 0.00 -0.92 -2.15 119.26 123.20 3gko h ALA 235 Ca 0.00 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3gko h ALA 235 Cb 0.17 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3gko h ALA 235 CO -0.00 -0.34 0.07 1.05 0.00 0.00 0.00 179.25 180.03 3gko h GLU 236 N 0.18 0.56 -0.43 0.00 4.11 -1.20 -1.78 114.58 116.02 3gko h GLU 236 Ca 0.09 -0.10 -0.13 0.00 0.07 0.00 0.00 59.36 59.29 3gko h GLU 236 Cb 0.05 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 3gko h GLU 236 CO -0.08 0.53 -0.23 1.96 0.07 0.00 0.00 179.01 181.26 3gko h GLN 237 N 0.55 0.92 -0.49 1.06 4.20 -1.18 -2.21 115.11 117.95 3gko h GLN 237 Ca 0.13 -0.41 -0.05 0.00 0.06 0.00 0.00 58.65 58.38 3gko h GLN 237 Cb 0.24 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 3gko h GLN 237 CO -0.00 1.07 0.12 0.82 -0.67 0.00 0.00 178.83 180.16 3gko h ILE 238 N 0.75 1.24 -0.27 2.54 2.04 -1.00 -2.33 117.51 120.48 3gko h ILE 238 Ca 0.09 -0.84 -0.03 0.00 1.00 0.00 0.00 64.86 65.09 3gko h ILE 238 Cb 0.80 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 3gko h ILE 238 CO 0.07 0.30 0.05 -0.07 0.00 0.00 0.00 178.15 178.50 3gko h LEU 239 N 0.67 0.35 -0.43 1.44 3.38 -1.28 -1.83 115.31 117.61 3gko h LEU 239 Ca 0.15 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3gko h LEU 239 Cb 0.33 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3gko h LEU 239 CO 0.00 0.38 0.00 0.00 0.09 0.00 0.00 178.44 178.91 3gko h ALA 240 N 1.67 1.00 -0.26 1.53 0.00 -0.95 -3.25 119.26 119.00 3gko h ALA 240 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3gko h ALA 240 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3gko h ALA 240 CO -0.00 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.79 3gko n ARG 241 N -2.57 2.01 -3.26 0.00 1.74 -0.71 -4.83 116.66 109.04 3gko n ARG 241 Ca 0.04 -1.86 -0.05 0.00 -0.77 0.00 0.00 57.85 55.20 3gko n ARG 241 Cb 0.38 -1.34 -0.04 0.00 -1.02 0.00 0.00 32.46 30.43 3gko n ARG 241 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 3gko s GLN 242 N -1.16 0.46 0.54 5.56 2.00 -1.08 -5.03 119.66 120.95 3gko s GLN 242 Ca 0.26 0.23 0.29 0.00 -2.00 0.00 0.00 55.36 54.15 3gko s GLN 242 Cb 0.15 -0.15 1.56 0.00 0.80 0.00 0.00 33.01 35.37 3gko s GLN 242 CO 0.21 -1.04 2.11 1.96 -0.50 0.00 0.00 175.29 178.03 3gko h GLN 243 N 8.11 0.00 -0.00 1.67 7.50 -1.88 -2.78 115.11 127.73 3gko h GLN 243 Ca -0.06 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.09 3gko h GLN 243 Cb 1.14 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.67 3gko h GLN 243 CO 0.23 0.09 -0.00 1.28 -1.50 0.00 0.00 178.83 178.93 3gko n LEU 244 N -3.58 0.02 -4.84 1.46 4.77 -1.26 -4.76 117.00 108.82 3gko n LEU 244 Ca -0.02 0.09 -0.37 0.00 -0.03 0.00 0.00 56.01 55.67 3gko n LEU 244 Cb 0.21 -0.09 -0.06 0.00 -2.33 0.00 0.00 43.42 41.15 3gko n LEU 244 CO 0.29 0.00 -0.02 -0.63 -1.33 0.00 0.00 177.39 175.70 3gko s ILE 245 N -2.19 5.25 -0.21 -0.08 -1.09 -1.05 -1.19 121.20 120.64 3gko s ILE 245 Ca 0.41 0.56 0.01 0.00 -2.23 0.00 0.00 60.65 59.40 3gko s ILE 245 Cb 0.21 -3.58 -0.20 0.00 -1.58 0.00 0.00 42.46 37.31 3gko s ILE 245 CO 0.40 0.57 -0.02 -0.62 -1.23 0.00 0.00 174.94 174.04 3gko n GLU 246 N 2.13 0.68 -3.95 2.79 1.02 0.52 -4.89 120.64 118.95 3gko n GLU 246 Ca -0.16 0.17 -0.08 0.00 -0.02 0.00 0.00 57.16 57.07 3gko n GLU 246 Cb 0.53 -1.58 -0.09 0.00 -0.02 0.00 0.00 31.44 30.29 3gko n GLU 246 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3gko s THR 247 N -2.53 0.16 -0.07 2.62 -4.23 -1.22 -3.98 115.64 106.39 3gko s THR 247 Ca -0.29 -1.35 0.01 0.00 -1.18 0.00 0.00 61.69 58.88 3gko s THR 247 Cb 0.08 -1.29 0.02 0.00 1.34 0.00 0.00 72.50 72.65 3gko s THR 247 CO 0.67 -0.75 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.23 3gko s VAL 248 N -3.57 0.91 -0.04 2.29 1.01 -0.29 -1.44 120.40 119.27 3gko s VAL 248 Ca 0.03 -0.31 0.07 0.00 0.00 0.00 0.00 61.98 61.77 3gko s VAL 248 Cb 0.04 -0.89 -0.01 0.00 0.00 0.00 0.00 36.38 35.52 3gko s VAL 248 CO -0.09 0.32 -0.25 -0.70 0.00 0.00 0.00 175.10 174.38 3gko s GLU 249 N 1.03 2.32 -0.01 2.72 2.12 0.11 -0.62 118.70 126.37 3gko s GLU 249 Ca -0.08 -0.90 0.06 0.00 0.36 0.00 0.00 54.97 54.41 3gko s GLU 249 Cb -0.15 -2.08 -0.02 0.00 0.26 0.00 0.00 34.13 32.15 3gko s GLU 249 CO -0.00 0.45 -0.21 0.71 -0.54 0.00 0.00 175.26 175.68 3gko s TYR 250 N -0.36 1.84 -0.20 5.30 2.02 -0.41 -0.44 117.35 125.10 3gko s TYR 250 Ca 0.02 -0.35 -0.02 0.00 -0.37 0.00 0.00 57.07 56.35 3gko s TYR 250 Cb -0.12 -1.17 0.06 0.00 -0.40 0.00 0.00 41.96 40.33 3gko s TYR 250 CO 0.02 -0.02 0.01 0.45 -1.57 0.00 0.00 175.55 174.44 3gko s SER 251 N -0.57 3.08 -0.11 2.29 0.15 -0.56 -1.88 113.70 116.10 3gko s SER 251 Ca 0.08 -0.87 0.01 0.00 0.70 0.00 0.00 55.95 55.86 3gko s SER 251 Cb -0.08 -0.73 0.02 0.00 -1.71 0.00 0.00 66.02 63.52 3gko s SER 251 CO -0.00 -0.28 -0.12 -0.76 1.20 0.00 0.00 173.24 173.27 3gko s LEU 252 N 1.75 1.52 0.28 3.45 1.43 0.27 -3.22 118.68 124.15 3gko s LEU 252 Ca -0.02 -0.37 -0.19 0.00 -1.03 0.00 0.00 54.13 52.52 3gko s LEU 252 Cb -0.17 -0.97 -0.09 0.00 0.03 0.00 0.00 46.19 44.99 3gko s LEU 252 CO -0.07 -0.04 0.77 -2.16 0.23 0.00 0.00 176.35 175.08 3gko s PRO 253 N 1.27 4.22 -0.52 1.29 0.04 -1.26 -0.99 135.00 139.06 3gko s PRO 253 Ca -0.02 0.89 -0.15 0.00 0.04 0.00 0.00 61.00 61.76 3gko s PRO 253 Cb -0.14 -2.69 0.12 0.00 0.04 0.00 0.00 34.50 31.84 3gko s PRO 253 CO -0.05 0.28 0.46 1.21 0.04 0.00 0.00 177.00 178.94 3gko s ASN 254 N -1.87 6.09 -0.82 6.66 3.84 0.11 -4.32 114.94 124.64 3gko s ASN 254 Ca 0.49 -1.78 -0.24 0.00 0.21 0.00 0.00 52.86 51.54 3gko s ASN 254 Cb -0.14 -2.17 0.06 0.00 -0.55 0.00 0.00 41.25 38.45 3gko s ASN 254 CO 0.20 -0.81 1.22 -0.54 -2.79 0.00 0.00 177.10 174.37 3gko s LYS 255 N 1.56 3.33 0.33 0.43 1.02 -0.62 -2.69 119.74 123.10 3gko s LYS 255 Ca 0.04 -0.83 -0.29 0.00 0.02 0.00 0.00 55.97 54.91 3gko s LYS 255 Cb -0.29 -4.59 -0.10 0.00 -0.52 0.00 0.00 37.83 32.32 3gko s LYS 255 CO 0.03 -2.03 1.38 -1.01 -0.92 0.00 0.00 175.35 172.80 3gko s HIS 256 N 4.69 2.90 -0.25 3.18 3.76 -1.26 -4.24 115.29 124.07 3gko s HIS 256 Ca 0.34 1.28 0.02 0.00 -0.15 0.00 0.00 55.06 56.55 3gko s HIS 256 Cb -0.08 -3.81 0.06 0.00 1.11 0.00 0.00 32.58 29.87 3gko s HIS 256 CO 0.04 -2.32 -0.07 0.71 -0.85 0.00 0.00 174.74 172.25 3gko s TYR 257 N -0.97 2.72 0.14 1.40 1.51 -1.26 -0.53 117.35 120.35 3gko s TYR 257 Ca 0.52 -1.98 -0.18 0.00 -1.01 0.00 0.00 57.07 54.42 3gko s TYR 257 Cb -0.42 -1.73 -0.07 0.00 -0.11 0.00 0.00 41.96 39.63 3gko s TYR 257 CO 0.55 -0.82 0.61 -0.06 -1.11 0.00 0.00 175.55 174.72 3gko s PHE 258 N 1.28 3.71 0.68 2.71 0.08 -0.59 -4.83 117.98 121.03 3gko s PHE 258 Ca -0.07 1.25 -0.13 0.00 0.12 0.00 0.00 56.93 58.10 3gko s PHE 258 Cb -0.19 -2.49 0.01 0.00 -0.57 0.00 0.00 43.02 39.77 3gko s PHE 258 CO -0.06 0.48 1.08 -1.21 -0.10 0.00 0.00 175.22 175.41 3gko s GLU 259 N -1.59 2.83 -0.24 0.44 2.02 -1.26 -0.76 118.70 120.15 3gko s GLU 259 Ca 0.35 1.20 0.02 0.00 0.02 0.00 0.00 54.97 56.57 3gko s GLU 259 Cb -0.18 -1.97 0.05 0.00 0.10 0.00 0.00 34.13 32.14 3gko s GLU 259 CO 0.20 -1.20 -0.09 0.42 0.02 0.00 0.00 175.26 174.61 3gko s ILE 260 N -2.64 1.85 -0.25 -1.63 1.01 -1.25 -4.77 121.20 113.52 3gko s ILE 260 Ca 0.63 -1.34 -0.29 0.00 0.00 0.00 0.00 60.65 59.64 3gko s ILE 260 Cb -0.17 -1.99 -0.01 0.00 0.01 0.00 0.00 42.46 40.30 3gko s ILE 260 CO 0.46 0.01 1.31 -0.62 0.00 0.00 0.00 174.94 176.10 3gko s ASP 261 N 1.26 6.75 -0.06 3.58 -1.08 -1.26 -4.60 116.67 121.27 3gko s ASP 261 Ca -0.06 1.41 0.10 0.00 -0.52 0.00 0.00 52.55 53.48 3gko s ASP 261 Cb -0.19 -2.54 0.24 0.00 -1.46 0.00 0.00 42.92 38.98 3gko s ASP 261 CO -0.06 -0.97 1.18 0.18 0.52 0.00 0.00 175.17 176.01 3gko n LEU 262 N 7.30 2.67 0.30 -1.34 4.77 -1.26 -4.68 117.00 124.76 3gko n LEU 262 Ca 0.15 -2.42 0.20 0.00 -0.03 0.00 0.00 56.01 53.91 3gko n LEU 262 Cb 0.46 -0.25 1.02 0.00 -2.33 0.00 0.00 43.42 42.31 3gko n LEU 262 CO 0.60 0.64 1.10 0.77 -1.33 0.00 0.00 177.39 179.18 3gko h SER 263 N 0.87 0.00 0.90 -1.43 4.64 -1.65 -0.89 113.55 115.99 3gko h SER 263 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3gko h SER 263 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 3gko h SER 263 CO 0.04 0.00 0.00 4.11 -0.87 0.00 0.00 176.83 180.11 3gko h TRP 264 N 0.00 0.00 -3.40 4.77 5.08 -1.84 -2.69 115.95 117.87 3gko h TRP 264 Ca 0.00 0.00 -0.72 0.00 1.08 0.00 0.00 58.89 59.25 3gko h TRP 264 Cb 0.14 0.00 -0.31 0.00 -3.00 0.00 0.00 29.16 26.00 3gko h TRP 264 CO 0.00 0.00 -0.38 -1.58 -1.28 0.00 0.00 178.44 175.20 3gko s HIS 265 N -3.44 3.47 -1.39 0.12 5.04 -0.34 -4.66 115.29 114.09 3gko s HIS 265 Ca 0.03 -2.09 -0.03 0.00 -1.54 0.00 0.00 55.06 51.44 3gko s HIS 265 Cb 0.09 -3.44 0.02 0.00 0.04 0.00 0.00 32.58 29.29 3gko s HIS 265 CO 0.47 -0.97 0.26 1.63 -2.34 0.00 0.00 174.74 173.78 3gko n LYS 266 N 4.60 -3.04 -2.06 2.88 5.02 -1.26 -1.60 118.16 122.70 3gko n LYS 266 Ca -0.03 0.75 -0.20 0.00 -2.02 0.00 0.00 58.31 56.80 3gko n LYS 266 Cb 0.41 -5.45 -0.04 0.00 -0.02 0.00 0.00 35.03 29.92 3gko n LYS 266 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3gko n GLY 267 N -1.11 0.52 3.71 0.72 0.00 -1.02 -4.91 105.19 103.10 3gko n GLY 267 Ca -0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 3gko n GLY 267 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3gko n LEU 268 N -2.72 4.00 -4.50 0.99 7.94 -0.63 -4.80 117.00 117.28 3gko n LEU 268 Ca -0.22 1.03 -0.42 0.00 -1.11 0.00 0.00 56.01 55.29 3gko n LEU 268 Cb 0.67 -1.56 -0.10 0.00 0.53 0.00 0.00 43.42 42.96 3gko n LEU 268 CO 0.29 0.17 -0.06 -1.10 -1.11 0.00 0.00 177.39 175.58 3gko s GLN 269 N 1.74 3.25 -0.03 1.96 -1.52 -1.26 -1.74 119.66 122.06 3gko s GLN 269 Ca 0.78 -0.79 0.13 0.00 -1.95 0.00 0.00 55.36 53.53 3gko s GLN 269 Cb -0.50 -3.89 0.24 0.00 -0.22 0.00 0.00 33.01 28.63 3gko s GLN 269 CO 0.34 -0.62 1.10 -1.71 -0.25 0.00 0.00 175.29 174.15 3gko n ASN 270 N 5.21 0.76 -4.47 5.90 5.15 -1.26 -4.74 115.26 121.81 3gko n ASN 270 Ca -0.11 -2.25 -0.23 0.00 -0.60 0.00 0.00 54.58 51.39 3gko n ASN 270 Cb 0.48 -0.29 -0.10 0.00 -0.53 0.00 0.00 39.78 39.34 3gko n ASN 270 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 3gko s THR 271 N -0.51 1.77 0.00 -0.44 -4.23 -1.26 -3.72 115.64 107.25 3gko s THR 271 Ca 0.20 -2.13 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 3gko s THR 271 Cb 0.22 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.51 3gko s THR 271 CO -0.07 -0.24 0.00 0.61 -0.54 0.00 0.00 174.62 174.38 3gko n GLY 272 N -0.66 3.38 0.11 3.99 0.00 -1.26 -1.17 105.19 109.58 3gko n GLY 272 Ca -0.05 -0.16 0.10 0.00 0.00 0.00 0.00 46.02 45.90 3gko n GLY 272 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gko n LYS 273 N 14.00 0.13 0.00 1.61 5.02 -1.26 -1.81 118.16 135.85 3gko n LYS 273 Ca 0.00 0.47 0.12 0.00 -2.02 0.00 0.00 58.31 56.88 3gko n LYS 273 Cb 0.00 -1.80 0.20 0.00 -0.02 0.00 0.00 35.03 33.41 3gko n LYS 273 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3gko n ASN 274 N -2.05 1.98 -4.65 4.39 5.03 -0.31 -4.95 115.26 114.70 3gko n ASN 274 Ca 0.01 -1.51 -0.42 0.00 0.87 0.00 0.00 54.58 53.53 3gko n ASN 274 Cb 0.14 0.19 -0.03 0.00 -1.02 0.00 0.00 39.78 39.06 3gko n ASN 274 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3gko s ALA 275 N -2.27 3.42 0.00 5.41 0.00 -0.75 -4.28 121.76 123.29 3gko s ALA 275 Ca 0.26 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.29 3gko s ALA 275 Cb 0.19 -3.87 0.00 0.00 0.00 0.00 0.00 23.12 19.45 3gko s ALA 275 CO 0.45 -1.78 0.00 0.39 0.00 0.00 0.00 175.76 174.82 3gko n GLU 276 N 7.68 0.00 -3.75 0.00 1.02 -1.26 -4.97 120.64 119.36 3gko n GLU 276 Ca 0.21 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.99 3gko n GLU 276 Cb 0.42 -0.66 -0.11 0.00 -0.02 0.00 0.00 31.44 31.08 3gko n GLU 276 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3gko s VAL 277 N -1.86 4.93 0.29 2.62 1.01 -1.26 -5.09 120.40 121.03 3gko s VAL 277 Ca 0.00 0.03 0.11 0.00 0.00 0.00 0.00 61.98 62.12 3gko s VAL 277 Cb 0.00 -3.29 -0.05 0.00 0.00 0.00 0.00 36.38 33.03 3gko s VAL 277 CO 0.00 0.35 -0.17 -0.36 0.00 0.00 0.00 175.10 174.92 3gko s PHE 278 N 1.21 2.32 -0.40 5.22 0.40 -1.26 -3.95 117.98 121.52 3gko s PHE 278 Ca 0.06 -0.37 -0.08 0.00 -0.60 0.00 0.00 56.93 55.95 3gko s PHE 278 Cb -0.14 -1.08 0.08 0.00 0.51 0.00 0.00 43.02 42.38 3gko s PHE 278 CO 0.05 0.69 0.22 0.00 0.70 0.00 0.00 175.22 176.87 3gko s ALA 279 N -2.53 3.22 0.24 5.36 0.00 0.07 -4.94 121.76 123.17 3gko s ALA 279 Ca 0.31 -2.12 -0.30 0.00 0.00 0.00 0.00 51.96 49.84 3gko s ALA 279 Cb -0.03 -2.53 -0.10 0.00 0.00 0.00 0.00 23.12 20.45 3gko s ALA 279 CO 0.15 -1.61 1.45 -2.14 0.00 0.00 0.00 175.76 173.62 3gko s PRO 280 N 1.38 4.27 -0.26 0.00 0.02 -1.26 -1.54 135.00 137.60 3gko s PRO 280 Ca 0.03 2.30 -0.10 0.00 0.02 0.00 0.00 61.00 63.24 3gko s PRO 280 Cb -0.22 -3.12 -0.05 0.00 0.02 0.00 0.00 34.50 31.13 3gko s PRO 280 CO 0.01 -0.43 0.17 -0.65 -0.33 0.00 0.00 177.00 175.77 3gko s GLN 281 N -0.21 3.96 0.21 5.54 -1.52 0.30 -4.93 119.66 123.02 3gko s GLN 281 Ca 0.60 -0.32 -0.01 0.00 -1.95 0.00 0.00 55.36 53.68 3gko s GLN 281 Cb -0.42 -3.59 0.18 0.00 -0.22 0.00 0.00 33.01 28.96 3gko s GLN 281 CO 0.42 -0.10 1.55 0.77 -0.25 0.00 0.00 175.29 177.68 3gko h SER 282 N 8.06 0.55 -4.67 5.90 0.02 -1.93 -3.40 113.55 118.07 3gko h SER 282 Ca -0.36 -0.28 0.04 0.00 -0.84 0.00 0.00 61.79 60.35 3gko h SER 282 Cb 1.18 -0.16 -0.17 0.00 0.14 0.00 0.00 62.40 63.40 3gko h SER 282 CO 0.59 0.96 0.38 1.51 -1.14 0.00 0.00 176.83 179.13 3gko s ASP 283 N -6.90 -0.47 1.02 3.07 1.47 -1.26 -4.78 116.67 108.82 3gko s ASP 283 Ca -0.07 0.24 -0.09 0.00 1.18 0.00 0.00 52.55 53.81 3gko s ASP 283 Cb 0.12 0.44 0.12 0.00 -0.34 0.00 0.00 42.92 43.26 3gko s ASP 283 CO 0.83 -0.63 0.68 -0.81 0.68 0.00 0.00 175.17 175.92 3gko n PRO 284 N 0.18 -0.85 -3.82 2.11 -0.04 -1.26 -5.13 135.00 126.19 3gko n PRO 284 Ca -0.13 -1.05 -0.12 0.00 -0.04 0.00 0.00 63.50 62.16 3gko n PRO 284 Cb 0.61 -0.73 -0.11 0.00 -0.04 0.00 0.00 33.50 33.23 3gko n PRO 284 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3gko s ASN 285 N -3.47 -0.14 0.60 3.54 4.22 -1.26 -4.73 114.94 113.69 3gko s ASN 285 Ca 0.39 0.19 -0.17 0.00 -2.14 0.00 0.00 52.86 51.13 3gko s ASN 285 Cb -0.01 0.35 -0.03 0.00 1.28 0.00 0.00 41.25 42.84 3gko s ASN 285 CO 0.28 -0.22 1.11 -0.83 -2.04 0.00 0.00 177.10 175.39 3gko s GLY 286 N -0.55 2.34 -0.13 0.45 0.00 -1.09 -4.79 107.32 103.54 3gko s GLY 286 Ca -0.06 0.63 -0.02 0.00 0.00 0.00 0.00 44.72 45.27 3gko s GLY 286 CO 0.01 0.98 0.01 -2.27 0.00 0.00 0.00 173.10 171.82 3gko s LEU 287 N -4.37 0.95 -0.14 0.66 2.96 -1.26 0.09 118.68 117.57 3gko s LEU 287 Ca 0.69 -0.45 0.00 0.00 -0.22 0.00 0.00 54.13 54.15 3gko s LEU 287 Cb -0.21 -0.57 -0.01 0.00 0.50 0.00 0.00 46.19 45.90 3gko s LEU 287 CO 0.35 -0.23 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.36 3gko s ILE 288 N 1.88 2.77 0.09 6.68 -1.09 -0.16 -4.98 121.20 126.40 3gko s ILE 288 Ca 0.02 -0.74 0.07 0.00 -2.23 0.00 0.00 60.65 57.76 3gko s ILE 288 Cb -0.14 -2.16 -0.03 0.00 -1.58 0.00 0.00 42.46 38.54 3gko s ILE 288 CO -0.07 0.52 -0.17 -0.54 -1.23 0.00 0.00 174.94 173.45 3gko s LYS 289 N 0.64 0.97 -0.27 2.79 1.02 -1.26 -0.57 119.74 123.06 3gko s LYS 289 Ca -0.08 -1.08 -0.24 0.00 0.02 0.00 0.00 55.97 54.60 3gko s LYS 289 Cb -0.16 -1.08 0.08 0.00 -0.52 0.00 0.00 37.83 36.15 3gko s LYS 289 CO 0.03 0.24 0.77 0.00 -0.92 0.00 0.00 175.35 175.47 3gko s THR 291 N 0.51 2.19 -0.13 0.00 2.01 -1.26 -1.29 115.64 117.67 3gko s THR 291 Ca -0.01 -0.96 -0.02 0.00 0.31 0.00 0.00 61.69 61.02 3gko s THR 291 Cb -0.05 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.48 3gko s THR 291 CO -0.03 0.48 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.63 3gko s VAL 292 N 1.29 3.67 0.31 3.82 1.01 0.20 -4.96 120.40 125.75 3gko s VAL 292 Ca 0.04 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 61.58 3gko s VAL 292 Cb -0.14 -2.57 -0.01 0.00 0.00 0.00 0.00 36.38 33.67 3gko s VAL 292 CO -0.12 0.53 0.07 0.61 0.00 0.00 0.00 175.10 176.19 3gko n GLY 293 N 3.16 3.59 3.79 4.51 0.00 -1.26 -1.14 105.19 117.84 3gko n GLY 293 Ca -0.18 -2.15 -0.39 0.00 0.00 0.00 0.00 46.02 43.30 3gko n GLY 293 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gko s ARG 294 N -3.16 4.43 0.44 1.61 0.52 -1.26 -5.04 118.95 116.50 3gko s ARG 294 Ca 0.09 1.00 -0.21 0.00 -0.52 0.00 0.00 55.73 56.09 3gko s ARG 294 Cb 0.00 -3.26 -0.10 0.00 0.52 0.00 0.00 34.95 32.11 3gko s ARG 294 CO 0.07 0.58 0.98 -1.54 0.02 0.00 0.00 175.30 175.40 3gko s SER 295 N -1.06 6.76 0.00 0.23 1.04 -1.26 -5.17 113.70 114.23 3gko s SER 295 Ca 0.33 1.78 0.29 0.00 0.48 0.00 0.00 55.95 58.83 3gko s SER 295 Cb -0.22 -2.55 1.17 0.00 0.10 0.00 0.00 66.02 64.52 3gko s SER 295 CO 0.23 -0.49 1.81 -1.20 0.98 0.00 0.00 173.24 174.58