#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ggu s GLY 9 N 0.00 0.49 0.00 7.13 0.00 -1.26 -5.00 107.32 108.68 1ggu s GLY 9 Ca 0.00 -1.56 0.20 0.00 0.00 0.00 0.00 44.72 43.36 1ggu s GLY 9 CO 0.00 2.40 1.67 0.61 0.00 0.00 0.00 173.10 177.78 1ggu n GLY 10 N 3.92 -0.52 0.06 0.20 0.00 -1.26 -4.19 105.19 103.40 1ggu n GLY 10 Ca 0.14 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 1ggu n GLY 10 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1ggu h ARG 11 N 0.85 0.01 -3.09 1.61 9.65 -2.02 -3.47 114.38 117.93 1ggu h ARG 11 Ca 0.00 -0.01 -0.15 0.00 -1.10 0.00 0.00 59.98 58.72 1ggu h ARG 11 Cb 0.19 0.00 -0.24 0.00 -1.39 0.00 0.00 29.97 28.53 1ggu h ARG 11 CO 0.00 0.72 -0.38 -0.98 2.80 0.00 0.00 179.97 182.13 1ggu s ARG 12 N -3.35 0.39 0.27 0.20 1.70 -1.26 -5.05 118.95 111.85 1ggu s ARG 12 Ca -0.17 0.24 -0.04 0.00 -0.47 0.00 0.00 55.73 55.29 1ggu s ARG 12 Cb -0.00 0.18 0.34 0.00 -0.57 0.00 0.00 34.95 34.90 1ggu s ARG 12 CO 0.68 -0.07 1.91 0.00 -1.08 0.00 0.00 175.30 176.74 1ggu h ALA 13 N 5.30 1.28 -3.65 7.88 0.00 -1.91 -3.41 119.26 124.76 1ggu h ALA 13 Ca -0.27 -0.11 -0.44 0.00 0.00 0.00 0.00 54.91 54.09 1ggu h ALA 13 Cb 1.19 -0.33 -0.32 0.00 0.00 0.00 0.00 17.79 18.33 1ggu h ALA 13 CO 0.35 0.60 -0.79 0.54 0.00 0.00 0.00 179.25 179.95 1ggu s VAL 14 N -5.80 0.81 0.82 0.00 0.11 -1.26 -5.11 120.40 109.97 1ggu s VAL 14 Ca -0.12 -0.34 -0.14 0.00 -2.93 0.00 0.00 61.98 58.45 1ggu s VAL 14 Cb 0.17 -0.75 0.01 0.00 -1.53 0.00 0.00 36.38 34.29 1ggu s VAL 14 CO 0.81 0.27 0.62 -2.65 -3.33 0.00 0.00 175.10 170.82 1ggu n PRO 15 N 3.57 0.07 -1.85 1.54 -0.02 -1.26 -4.91 135.00 132.15 1ggu n PRO 15 Ca -0.21 0.08 -0.42 0.00 -2.02 0.00 0.00 63.50 60.93 1ggu n PRO 15 Cb 0.53 -1.97 -0.03 0.00 -0.02 0.00 0.00 33.50 32.02 1ggu n PRO 15 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1ggu s PRO 16 N -3.35 4.17 -1.07 0.52 0.04 -1.26 -4.90 135.00 129.15 1ggu s PRO 16 Ca 0.64 2.48 -0.16 0.00 0.04 0.00 0.00 61.00 64.00 1ggu s PRO 16 Cb -0.29 -3.09 0.16 0.00 0.04 0.00 0.00 34.50 31.31 1ggu s PRO 16 CO 0.60 -0.63 1.28 1.21 0.04 0.00 0.00 177.00 179.49 1ggu s ASN 17 N 0.91 6.88 -0.09 6.66 2.47 -1.26 -4.73 114.94 125.78 1ggu s ASN 17 Ca 0.69 -2.58 0.12 0.00 0.42 0.00 0.00 52.86 51.51 1ggu s ASN 17 Cb -0.46 -2.39 0.23 0.00 -1.45 0.00 0.00 41.25 37.17 1ggu s ASN 17 CO 0.37 -0.87 1.11 -0.46 -3.72 0.00 0.00 177.10 173.53 1ggu n ASN 18 N 5.94 1.39 -3.94 -4.21 2.04 -1.26 -1.58 115.26 113.64 1ggu n ASN 18 Ca 0.30 -2.74 -0.19 0.00 -0.44 0.00 0.00 54.58 51.51 1ggu n ASN 18 Cb 0.46 -0.36 -0.16 0.00 -2.53 0.00 0.00 39.78 37.19 1ggu n ASN 18 CO 0.00 0.00 0.00 -0.55 -0.44 0.00 0.00 177.26 176.27 1ggu s SER 19 N -2.24 0.94 0.02 0.53 0.15 -1.26 -3.63 113.70 108.21 1ggu s SER 19 Ca 0.23 -0.14 -0.01 0.00 0.70 0.00 0.00 55.95 56.73 1ggu s SER 19 Cb 0.21 -0.34 -0.27 0.00 -1.71 0.00 0.00 66.02 63.91 1ggu s SER 19 CO -0.01 0.00 0.93 -1.13 1.20 0.00 0.00 173.24 174.24 1ggu h ASN 20 N 6.73 0.32 0.63 5.45 -0.00 -1.91 -3.32 115.58 123.48 1ggu h ASN 20 Ca -0.35 -0.43 -0.05 0.00 -0.00 0.00 0.00 56.30 55.47 1ggu h ASN 20 Cb 1.16 -0.11 -0.01 0.00 -0.00 0.00 0.00 38.32 39.37 1ggu h ASN 20 CO 0.48 1.35 -0.22 0.00 -0.00 0.00 0.00 177.43 179.05 1ggu h ALA 21 N 0.60 1.15 -2.15 1.57 0.00 -1.94 -3.36 119.26 115.13 1ggu h ALA 21 Ca -0.20 -0.20 -0.45 0.00 0.00 0.00 0.00 54.91 54.06 1ggu h ALA 21 Cb 1.98 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.72 1ggu h ALA 21 CO 0.16 0.27 0.34 0.00 0.00 0.00 0.00 179.25 180.02 1ggu s ALA 22 N -3.92 3.07 -0.09 0.00 0.00 -1.25 -5.02 121.76 114.55 1ggu s ALA 22 Ca -0.01 0.43 -0.11 0.00 0.00 0.00 0.00 51.96 52.27 1ggu s ALA 22 Cb 0.12 -3.16 0.03 0.00 0.00 0.00 0.00 23.12 20.10 1ggu s ALA 22 CO 0.63 0.12 0.29 -1.83 0.00 0.00 0.00 175.76 174.97 1ggu s GLU 23 N -2.96 0.41 0.40 0.00 -1.05 -1.26 -2.93 118.70 111.31 1ggu s GLU 23 Ca 0.60 0.26 -0.02 0.00 -0.15 0.00 0.00 54.97 55.66 1ggu s GLU 23 Cb -0.11 0.19 0.08 0.00 -0.44 0.00 0.00 34.13 33.85 1ggu s GLU 23 CO 0.15 -0.07 0.54 -0.40 0.95 0.00 0.00 175.26 176.44 1ggu n ASP 24 N 2.55 0.57 -4.20 0.83 5.75 -1.24 -4.77 116.55 116.05 1ggu n ASP 24 Ca -0.15 -1.52 -0.34 0.00 -0.01 0.00 0.00 54.79 52.77 1ggu n ASP 24 Cb 0.57 -0.37 -0.15 0.00 -1.03 0.00 0.00 41.12 40.15 1ggu n ASP 24 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1ggu s ASP 25 N -3.16 4.14 -0.01 -1.12 1.01 -1.26 -5.05 116.67 111.21 1ggu s ASP 25 Ca 0.35 -0.78 -0.25 0.00 0.71 0.00 0.00 52.55 52.57 1ggu s ASP 25 Cb -0.02 -1.64 -0.04 0.00 1.01 0.00 0.00 42.92 42.23 1ggu s ASP 25 CO 0.23 -0.09 0.79 -0.76 0.21 0.00 0.00 175.17 175.55 1ggu s LEU 26 N 1.34 4.37 0.45 1.23 1.43 -1.26 -5.03 118.68 121.21 1ggu s LEU 26 Ca 0.02 1.38 -0.24 0.00 -1.03 0.00 0.00 54.13 54.26 1ggu s LEU 26 Cb -0.16 -3.25 -0.08 0.00 0.03 0.00 0.00 46.19 42.74 1ggu s LEU 26 CO -0.06 -0.11 1.28 -2.16 0.23 0.00 0.00 176.35 175.53 1ggu s PRO 27 N 0.57 3.74 0.00 1.29 0.04 -1.26 -4.92 135.00 134.46 1ggu s PRO 27 Ca 0.41 2.07 0.29 0.00 0.04 0.00 0.00 61.00 63.81 1ggu s PRO 27 Cb -0.19 -2.56 1.26 0.00 0.04 0.00 0.00 34.50 33.05 1ggu s PRO 27 CO 0.22 -0.66 1.92 0.25 0.04 0.00 0.00 177.00 178.77 1ggu n THR 28 N -0.28 0.00 -3.66 1.26 -2.24 -1.26 -4.61 114.28 103.49 1ggu n THR 28 Ca 0.06 -0.01 -0.06 0.00 -2.27 0.00 0.00 64.05 61.78 1ggu n THR 28 Cb 0.45 -0.39 -0.07 0.00 -2.10 0.00 0.00 70.33 68.21 1ggu n THR 28 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1ggu s VAL 29 N -2.81 -0.71 -0.42 2.28 1.01 -1.26 -0.50 120.40 117.99 1ggu s VAL 29 Ca 0.20 0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.29 1ggu s VAL 29 Cb 0.19 -0.81 0.15 0.00 0.00 0.00 0.00 36.38 35.92 1ggu s VAL 29 CO 0.52 0.04 0.28 -1.83 0.00 0.00 0.00 175.10 174.11 1ggu s GLU 30 N 2.59 1.01 0.49 2.72 -1.05 -0.54 -4.99 118.70 118.92 1ggu s GLU 30 Ca -0.04 -1.92 0.09 0.00 -0.15 0.00 0.00 54.97 52.94 1ggu s GLU 30 Cb -0.11 -1.78 0.04 0.00 -0.44 0.00 0.00 34.13 31.84 1ggu s GLU 30 CO -0.16 -1.26 0.67 -0.51 0.95 0.00 0.00 175.26 174.95 1ggu s LEU 31 N 0.35 3.42 -0.30 1.83 1.43 -1.26 -1.85 118.68 122.31 1ggu s LEU 31 Ca 0.23 -0.59 -0.16 0.00 -1.03 0.00 0.00 54.13 52.58 1ggu s LEU 31 Cb -0.13 -2.24 0.17 0.00 0.03 0.00 0.00 46.19 44.02 1ggu s LEU 31 CO -0.07 -1.01 1.07 -1.58 0.23 0.00 0.00 176.35 174.98 1ggu s GLN 32 N -4.49 0.24 0.00 1.70 0.74 -1.26 -4.86 119.66 111.74 1ggu s GLN 32 Ca 0.58 0.53 0.00 0.00 0.05 0.00 0.00 55.36 56.52 1ggu s GLN 32 Cb -0.08 0.24 0.00 0.00 1.10 0.00 0.00 33.01 34.27 1ggu s GLN 32 CO 0.36 -0.07 0.00 0.41 -0.55 0.00 0.00 175.29 175.44 1ggu n GLY 33 N 4.39 0.24 0.00 2.59 0.00 -1.26 -4.68 105.19 106.46 1ggu n GLY 33 Ca -0.12 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.73 1ggu n GLY 33 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ggu n VAL 34 N 0.00 0.00 -3.70 1.61 0.24 -1.26 -5.22 118.33 110.00 1ggu n VAL 34 Ca 0.00 0.00 0.04 0.00 -2.04 0.00 0.00 64.34 62.34 1ggu n VAL 34 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1ggu n VAL 34 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 1ggu s VAL 35 N 3.93 0.00 0.00 3.34 -7.23 -1.26 -5.09 120.40 114.09 1ggu s VAL 35 Ca 0.00 -0.03 0.00 0.00 -1.81 0.00 0.00 61.98 60.14 1ggu s VAL 35 Cb 0.00 -2.29 0.00 0.00 0.56 0.00 0.00 36.38 34.65 1ggu s VAL 35 CO 0.00 0.00 0.42 0.00 -0.31 0.00 0.00 175.10 175.21 1ggu n GLN 42 N -0.64 0.00 -2.83 4.82 1.13 -1.26 -5.64 117.38 112.96 1ggu n GLN 42 Ca -0.05 0.00 -0.43 0.00 -1.94 0.00 0.00 57.00 54.58 1ggu n GLN 42 Cb 0.62 0.00 -0.04 0.00 0.11 0.00 0.00 30.24 30.94 1ggu n GLN 42 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1ggu s GLU 43 N 0.00 3.21 -0.01 -1.09 0.41 -1.26 -4.84 118.70 115.13 1ggu s GLU 43 Ca 0.00 -0.94 0.20 0.00 -0.41 0.00 0.00 54.97 53.82 1ggu s GLU 43 Cb 0.00 -4.39 -0.23 0.00 -1.78 0.00 0.00 34.13 27.73 1ggu s GLU 43 CO 0.00 -1.86 0.74 1.19 -0.49 0.00 0.00 175.26 174.84 1ggu n PHE 44 N 7.74 0.00 0.00 1.61 3.01 -1.26 -5.03 117.46 123.53 1ggu n PHE 44 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.49 1ggu n PHE 44 Cb 0.47 -0.10 0.00 0.00 -0.01 0.00 0.00 39.48 39.83 1ggu n PHE 44 CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66 1ggu n LEU 45 N -1.62 0.00 -4.12 4.37 7.94 -1.26 -4.92 117.00 117.39 1ggu n LEU 45 Ca 0.02 0.00 -0.25 0.00 -1.11 0.00 0.00 56.01 54.67 1ggu n LEU 45 Cb 0.35 0.00 -0.16 0.00 0.53 0.00 0.00 43.42 44.14 1ggu n LEU 45 CO 0.40 0.00 -0.49 0.21 -1.11 0.00 0.00 177.39 176.40 1ggu s ASN 46 N 0.00 2.00 0.05 1.96 2.47 -1.26 -4.91 114.94 115.25 1ggu s ASN 46 Ca 0.00 -0.32 -0.29 0.00 0.42 0.00 0.00 52.86 52.67 1ggu s ASN 46 Cb 0.00 -0.53 -0.05 0.00 -1.45 0.00 0.00 41.25 39.22 1ggu s ASN 46 CO 0.00 0.14 0.91 0.68 -3.72 0.00 0.00 177.10 175.12 1ggu s VAL 47 N 0.03 4.71 -0.10 -5.21 -7.23 -1.26 -0.38 120.40 110.96 1ggu s VAL 47 Ca -0.03 1.94 -0.11 0.00 -1.81 0.00 0.00 61.98 61.97 1ggu s VAL 47 Cb -0.11 -4.26 -0.27 0.00 0.56 0.00 0.00 36.38 32.30 1ggu s VAL 47 CO 0.02 0.26 0.49 0.71 -0.31 0.00 0.00 175.10 176.27 1ggu h THR 48 N 4.38 0.82 -2.36 5.32 1.35 -0.46 -3.46 112.91 118.49 1ggu h THR 48 Ca -0.42 -2.39 0.13 0.00 -0.55 0.00 0.00 66.41 63.18 1ggu h THR 48 Cb 1.21 2.61 -0.11 0.00 -1.73 0.00 0.00 68.15 70.13 1ggu h THR 48 CO 0.73 0.81 0.47 -0.94 -0.25 0.00 0.00 175.52 176.34 1ggu s SER 49 N -7.11 -0.29 -0.00 5.36 1.04 -1.11 -5.02 113.70 106.57 1ggu s SER 49 Ca -0.20 -0.20 0.06 0.00 0.48 0.00 0.00 55.95 56.08 1ggu s SER 49 Cb 0.06 0.45 -0.02 0.00 0.10 0.00 0.00 66.02 66.61 1ggu s SER 49 CO 0.78 -0.79 -0.18 -0.69 0.98 0.00 0.00 173.24 173.35 1ggu s VAL 50 N -3.25 1.42 -0.18 5.02 1.01 -1.26 -1.42 120.40 121.74 1ggu s VAL 50 Ca 0.08 -0.85 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 1ggu s VAL 50 Cb -0.01 -1.20 0.05 0.00 0.00 0.00 0.00 36.38 35.22 1ggu s VAL 50 CO -0.04 0.34 -0.02 -1.00 0.00 0.00 0.00 175.10 174.38 1ggu s HIS 51 N -0.51 1.53 0.19 5.22 3.76 0.11 -4.97 115.29 120.62 1ggu s HIS 51 Ca 0.07 -1.06 -0.05 0.00 -0.15 0.00 0.00 55.06 53.86 1ggu s HIS 51 Cb -0.07 -1.23 -0.06 0.00 1.11 0.00 0.00 32.58 32.33 1ggu s HIS 51 CO -0.00 -0.62 0.44 -0.51 -0.85 0.00 0.00 174.74 173.20 1ggu s LEU 52 N 1.69 4.21 -0.86 0.89 1.43 -1.26 0.21 118.68 124.98 1ggu s LEU 52 Ca -0.01 0.65 0.00 0.00 -1.03 0.00 0.00 54.13 53.75 1ggu s LEU 52 Cb -0.16 -3.41 0.24 0.00 0.03 0.00 0.00 46.19 42.89 1ggu s LEU 52 CO -0.07 -0.03 0.88 0.49 0.23 0.00 0.00 176.35 177.84 1ggu n PHE 53 N -0.23 3.71 -0.14 0.29 3.72 -1.23 -4.84 117.46 118.73 1ggu n PHE 53 Ca -0.02 -3.90 0.07 0.00 -0.05 0.00 0.00 57.45 53.55 1ggu n PHE 53 Cb 0.52 -0.99 0.28 0.00 -0.94 0.00 0.00 39.48 38.35 1ggu n PHE 53 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 1ggu n LYS 54 N 1.77 3.27 -2.37 -1.08 2.85 -1.26 -4.21 118.16 117.12 1ggu n LYS 54 Ca 0.24 -2.19 -0.36 0.00 -1.05 0.00 0.00 58.31 54.96 1ggu n LYS 54 Cb 0.37 -1.82 -0.02 0.00 -0.65 0.00 0.00 35.03 32.91 1ggu n LYS 54 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 1ggu s GLU 55 N -1.91 3.70 0.58 -1.58 0.41 -1.26 -4.74 118.70 113.89 1ggu s GLU 55 Ca 0.39 1.58 0.36 0.00 -0.41 0.00 0.00 54.97 56.88 1ggu s GLU 55 Cb 0.26 -2.21 1.67 0.00 -1.78 0.00 0.00 34.13 32.07 1ggu s GLU 55 CO 0.17 -0.56 2.10 0.00 -0.49 0.00 0.00 175.26 176.48 1ggu h ARG 56 N 1.71 0.00 0.00 1.61 3.08 -1.93 0.35 114.38 119.20 1ggu h ARG 56 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.56 1ggu h ARG 56 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.29 1ggu h ARG 56 CO 0.59 0.03 -0.68 -2.67 -1.07 0.00 0.00 179.97 176.17 1ggu n TRP 57 N -3.18 0.10 -1.97 3.04 4.27 -1.26 -4.48 117.44 113.96 1ggu n TRP 57 Ca -0.01 0.03 -0.29 0.00 -3.89 0.00 0.00 57.50 53.34 1ggu n TRP 57 Cb 0.23 -0.29 0.15 0.00 -1.36 0.00 0.00 31.31 30.04 1ggu n TRP 57 CO 0.00 0.00 0.00 0.34 -2.29 0.00 0.00 177.69 175.74 1ggu s ASP 58 N -3.29 3.68 0.46 -0.67 -1.08 0.11 -4.91 116.67 110.98 1ggu s ASP 58 Ca 0.09 0.40 0.25 0.00 -0.52 0.00 0.00 52.55 52.77 1ggu s ASP 58 Cb 0.16 -0.62 0.96 0.00 -1.46 0.00 0.00 42.92 41.96 1ggu s ASP 58 CO 0.74 -2.38 1.84 0.71 0.52 0.00 0.00 175.17 176.60 1ggu h THR 59 N -1.36 0.45 0.82 1.71 1.35 -1.85 -2.91 112.91 111.12 1ggu h THR 59 Ca -0.44 -1.03 -0.04 0.00 -0.55 0.00 0.00 66.41 64.34 1ggu h THR 59 Cb 1.27 1.74 0.01 0.00 -1.73 0.00 0.00 68.15 69.44 1ggu h THR 59 CO 0.48 0.18 -0.40 0.78 -0.25 0.00 0.00 175.52 176.31 1ggu h ASN 60 N 0.00 -0.94 -0.39 5.36 2.35 -1.88 -0.17 115.58 119.91 1ggu h ASN 60 Ca -0.00 0.03 -0.11 0.00 -0.55 0.00 0.00 56.30 55.67 1ggu h ASN 60 Cb 0.73 0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.33 1ggu h ASN 60 CO 0.02 -0.63 -0.17 0.11 -1.65 0.00 0.00 177.43 175.11 1ggu h LYS 61 N -1.18 0.81 -0.62 0.81 1.57 -1.81 -1.63 116.57 114.52 1ggu h LYS 61 Ca -0.11 -0.35 -0.04 0.00 -1.87 0.00 0.00 60.65 58.28 1ggu h LYS 61 Cb 0.85 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.10 1ggu h LYS 61 CO 0.19 0.97 0.24 0.28 -0.57 0.00 0.00 179.45 180.56 1ggu h VAL 62 N 0.61 1.24 0.00 0.50 2.07 -1.57 0.11 116.25 119.20 1ggu h VAL 62 Ca 0.09 -0.75 -0.05 0.00 0.82 0.00 0.00 66.70 66.81 1ggu h VAL 62 Cb 0.72 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1ggu h VAL 62 CO 0.05 0.29 -0.24 0.44 0.02 0.00 0.00 177.57 178.14 1ggu h ASP 63 N 0.88 0.00 -0.12 0.57 5.19 -0.92 -2.84 116.42 119.17 1ggu h ASP 63 Ca 0.21 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.62 1ggu h ASP 63 Cb 0.23 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.74 1ggu h ASP 63 CO -0.01 0.24 0.00 1.41 -3.12 0.00 0.00 179.24 177.75 1ggu n HIS 64 N -3.24 0.13 -3.87 4.55 8.25 -0.62 -4.96 115.22 115.46 1ggu n HIS 64 Ca 0.02 -0.07 -0.27 0.00 -0.26 0.00 0.00 57.72 57.14 1ggu n HIS 64 Cb 0.54 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.67 1ggu n HIS 64 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1ggu n HIS 65 N 0.75 -2.03 -0.06 4.41 -0.00 -0.15 -4.59 115.22 113.56 1ggu n HIS 65 Ca 0.17 0.85 0.00 0.00 -0.00 0.00 0.00 57.72 58.74 1ggu n HIS 65 Cb 0.46 -4.00 0.00 0.00 -0.00 0.00 0.00 29.99 26.45 1ggu n HIS 65 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 1ggu n THR 66 N -4.48 0.89 0.68 1.59 -2.24 -0.21 -4.71 114.28 105.79 1ggu n THR 66 Ca -0.12 -0.91 0.12 0.00 -2.27 0.00 0.00 64.05 60.86 1ggu n THR 66 Cb 0.60 0.56 0.47 0.00 -2.10 0.00 0.00 70.33 69.86 1ggu n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1ggu n ASP 67 N -0.44 0.37 0.21 3.42 5.75 -1.15 -2.81 116.55 121.89 1ggu n ASP 67 Ca 0.00 0.55 0.10 0.00 -0.01 0.00 0.00 54.79 55.44 1ggu n ASP 67 Cb 0.25 -0.65 0.17 0.00 -1.03 0.00 0.00 41.12 39.86 1ggu n ASP 67 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 1ggu h LYS 68 N 0.00 0.00 -6.37 0.11 1.57 -1.90 -3.45 116.57 106.52 1ggu h LYS 68 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 1ggu h LYS 68 Cb 0.49 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.82 1ggu h LYS 68 CO 0.00 0.11 1.18 0.71 -0.57 0.00 0.00 179.45 180.88 1ggu s TYR 69 N -3.19 1.57 -1.06 -1.35 2.02 -1.12 -4.81 117.35 109.41 1ggu s TYR 69 Ca 0.06 -0.26 -0.13 0.00 -0.37 0.00 0.00 57.07 56.36 1ggu s TYR 69 Cb 0.06 -4.18 -0.08 0.00 -0.40 0.00 0.00 41.96 37.36 1ggu s TYR 69 CO 0.68 -5.15 2.19 0.39 -1.57 0.00 0.00 175.55 172.09 1ggu n GLU 70 N 7.08 2.24 -3.70 -0.62 -0.58 -0.14 -4.72 120.64 120.21 1ggu n GLU 70 Ca 0.19 -1.89 -0.12 0.00 -0.42 0.00 0.00 57.16 54.91 1ggu n GLU 70 Cb 0.41 -2.81 -0.13 0.00 -0.57 0.00 0.00 31.44 28.34 1ggu n GLU 70 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1ggu s ASN 71 N 3.75 -0.09 -0.00 1.62 3.84 -1.26 -4.37 114.94 118.43 1ggu s ASN 71 Ca 0.51 0.62 0.05 0.00 0.21 0.00 0.00 52.86 54.25 1ggu s ASN 71 Cb 0.13 0.61 0.15 0.00 -0.55 0.00 0.00 41.25 41.59 1ggu s ASN 71 CO 0.00 -0.20 1.10 -0.46 -2.79 0.00 0.00 177.10 174.75 1ggu n ASN 72 N 4.68 0.95 -4.98 -4.21 2.04 -1.26 -4.86 115.26 107.61 1ggu n ASN 72 Ca -0.18 -2.01 -0.20 0.00 -0.44 0.00 0.00 54.58 51.75 1ggu n ASN 72 Cb 0.52 -0.14 -0.01 0.00 -2.53 0.00 0.00 39.78 37.62 1ggu n ASN 72 CO 0.00 0.00 0.00 -0.54 -0.44 0.00 0.00 177.26 176.28 1ggu s LYS 73 N -1.75 3.20 0.04 -3.83 -0.14 -1.26 -5.00 119.74 111.00 1ggu s LYS 73 Ca 0.11 -0.91 -0.31 0.00 -1.36 0.00 0.00 55.97 53.50 1ggu s LYS 73 Cb 0.06 -2.82 -0.06 0.00 -1.68 0.00 0.00 37.83 33.33 1ggu s LYS 73 CO 0.07 0.14 1.30 -1.17 -0.76 0.00 0.00 175.35 174.93 1ggu s LEU 74 N -4.15 4.34 -0.11 3.17 2.96 -1.26 -4.95 118.68 118.69 1ggu s LEU 74 Ca 0.42 2.09 0.01 0.00 -0.22 0.00 0.00 54.13 56.43 1ggu s LEU 74 Cb -0.09 -3.57 0.02 0.00 0.50 0.00 0.00 46.19 43.04 1ggu s LEU 74 CO 0.31 -0.59 -0.14 -0.63 -1.32 0.00 0.00 176.35 173.97 1ggu s ILE 75 N 1.56 1.46 0.15 6.68 1.01 -1.26 -0.75 121.20 130.06 1ggu s ILE 75 Ca 0.61 -0.61 0.05 0.00 0.00 0.00 0.00 60.65 60.70 1ggu s ILE 75 Cb -0.31 -1.35 -0.04 0.00 0.01 0.00 0.00 42.46 40.77 1ggu s ILE 75 CO 0.28 0.44 -0.12 0.54 0.00 0.00 0.00 174.94 176.07 1ggu s VAL 76 N 1.09 1.31 0.03 2.92 0.11 0.10 -4.64 120.40 121.34 1ggu s VAL 76 Ca -0.04 -2.00 0.03 0.00 -2.93 0.00 0.00 61.98 57.03 1ggu s VAL 76 Cb -0.14 -1.80 -0.04 0.00 -1.53 0.00 0.00 36.38 32.87 1ggu s VAL 76 CO -0.03 -0.64 0.00 -0.13 -3.33 0.00 0.00 175.10 170.97 1ggu s ARG 77 N -3.46 2.71 0.59 1.54 0.52 -1.26 -0.50 118.95 119.10 1ggu s ARG 77 Ca 0.16 -0.69 -0.18 0.00 -0.52 0.00 0.00 55.73 54.50 1ggu s ARG 77 Cb 0.00 -2.63 -0.03 0.00 0.52 0.00 0.00 34.95 32.81 1ggu s ARG 77 CO 0.02 0.59 1.15 -0.98 0.02 0.00 0.00 175.30 176.11 1ggu s ARG 78 N -1.85 3.06 0.00 3.54 1.70 0.18 -3.84 118.95 121.74 1ggu s ARG 78 Ca 0.22 1.63 0.00 0.00 -0.47 0.00 0.00 55.73 57.11 1ggu s ARG 78 Cb -0.12 -1.96 0.00 0.00 -0.57 0.00 0.00 34.95 32.30 1ggu s ARG 78 CO 0.13 -1.09 0.00 0.41 -1.08 0.00 0.00 175.30 173.67 1ggu n GLY 79 N 0.11 0.51 2.92 3.88 0.00 -0.99 -4.56 105.19 107.06 1ggu n GLY 79 Ca 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 1ggu n GLY 79 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ggu s GLN 80 N -0.06 0.66 0.55 1.61 0.74 -1.25 -4.83 119.66 117.08 1ggu s GLN 80 Ca 0.00 -0.15 -0.21 0.00 0.05 0.00 0.00 55.36 55.06 1ggu s GLN 80 Cb 0.00 -0.67 -0.05 0.00 1.10 0.00 0.00 33.01 33.39 1ggu s GLN 80 CO 0.00 0.01 1.26 -1.54 -0.55 0.00 0.00 175.29 174.47 1ggu s SER 81 N 0.46 5.41 0.05 6.67 1.04 -1.26 -4.42 113.70 121.66 1ggu s SER 81 Ca -0.06 2.52 -0.02 0.00 0.48 0.00 0.00 55.95 58.87 1ggu s SER 81 Cb -0.09 -2.61 -0.03 0.00 0.10 0.00 0.00 66.02 63.38 1ggu s SER 81 CO -0.00 -1.45 0.00 0.72 0.98 0.00 0.00 173.24 173.49 1ggu s PHE 82 N -1.46 0.44 -0.13 5.02 -0.71 0.16 -4.93 117.98 116.37 1ggu s PHE 82 Ca 0.72 -0.95 -0.05 0.00 -1.04 0.00 0.00 56.93 55.62 1ggu s PHE 82 Cb -0.34 -0.32 -0.04 0.00 -1.21 0.00 0.00 43.02 41.11 1ggu s PHE 82 CO 0.39 -0.39 0.05 0.71 -1.34 0.00 0.00 175.22 174.65 1ggu s TYR 83 N -3.70 3.29 0.05 3.49 2.02 -1.26 0.83 117.35 122.07 1ggu s TYR 83 Ca 0.05 0.22 0.01 0.00 -0.37 0.00 0.00 57.07 56.98 1ggu s TYR 83 Cb 0.06 -1.93 -0.03 0.00 -0.40 0.00 0.00 41.96 39.66 1ggu s TYR 83 CO -0.09 0.41 -0.06 0.14 -1.57 0.00 0.00 175.55 174.38 1ggu s VAL 84 N -0.46 0.41 -0.11 0.71 -7.23 0.19 -3.50 120.40 110.42 1ggu s VAL 84 Ca 0.10 -1.28 0.01 0.00 -1.81 0.00 0.00 61.98 59.00 1ggu s VAL 84 Cb -0.12 -0.82 0.02 0.00 0.56 0.00 0.00 36.38 36.02 1ggu s VAL 84 CO 0.02 -0.58 -0.14 -1.58 -0.31 0.00 0.00 175.10 172.51 1ggu s GLN 85 N -2.24 2.09 -0.31 4.82 0.74 0.13 0.74 119.66 125.62 1ggu s GLN 85 Ca -0.06 -0.51 -0.06 0.00 0.05 0.00 0.00 55.36 54.78 1ggu s GLN 85 Cb -0.05 -1.82 0.02 0.00 1.10 0.00 0.00 33.01 32.27 1ggu s GLN 85 CO -0.02 -0.09 0.09 0.42 -0.55 0.00 0.00 175.29 175.13 1ggu s ILE 86 N 1.07 3.84 -0.46 -2.34 1.01 -0.02 0.04 121.20 124.35 1ggu s ILE 86 Ca -0.05 -0.91 -0.25 0.00 0.00 0.00 0.00 60.65 59.44 1ggu s ILE 86 Cb -0.15 -3.07 0.03 0.00 0.01 0.00 0.00 42.46 39.28 1ggu s ILE 86 CO -0.03 -0.04 0.91 -1.81 0.00 0.00 0.00 174.94 173.98 1ggu s ASP 87 N 1.45 6.50 0.90 3.58 1.01 -0.51 -1.03 116.67 128.56 1ggu s ASP 87 Ca 0.01 0.11 -0.10 0.00 0.71 0.00 0.00 52.55 53.28 1ggu s ASP 87 Cb -0.18 -2.45 0.18 0.00 1.01 0.00 0.00 42.92 41.48 1ggu s ASP 87 CO 0.02 -1.03 1.10 0.49 0.21 0.00 0.00 175.17 175.96 1ggu n PHE 88 N 7.12 -3.65 0.17 4.23 3.72 -0.78 0.20 117.46 128.47 1ggu n PHE 88 Ca 0.06 -1.24 0.06 0.00 -0.05 0.00 0.00 57.45 56.28 1ggu n PHE 88 Cb 0.48 -0.83 0.11 0.00 -0.94 0.00 0.00 39.48 38.30 1ggu n PHE 88 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1ggu h SER 89 N -1.22 0.00 -4.18 4.37 4.64 -1.02 -3.40 113.55 112.75 1ggu h SER 89 Ca -0.36 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 60.99 1ggu h SER 89 Cb 1.08 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 62.95 1ggu h SER 89 CO 0.29 0.32 0.38 0.00 -0.87 0.00 0.00 176.83 176.94 1ggu s ARG 90 N -3.10 0.74 -0.12 4.77 1.04 -1.26 -5.01 118.95 116.02 1ggu s ARG 90 Ca 0.05 0.37 -0.31 0.00 -1.04 0.00 0.00 55.73 54.79 1ggu s ARG 90 Cb 0.07 0.35 -0.15 0.00 -2.04 0.00 0.00 34.95 33.18 1ggu s ARG 90 CO 0.71 -0.19 0.91 -0.35 -0.04 0.00 0.00 175.30 176.34 1ggu n PRO 91 N 1.30 0.00 -1.72 3.89 -0.04 -1.26 -4.81 135.00 132.37 1ggu n PRO 91 Ca -0.14 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.91 1ggu n PRO 91 Cb 0.57 -1.10 0.01 0.00 -0.04 0.00 0.00 33.50 32.93 1ggu n PRO 91 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 1ggu n TYR 92 N 1.69 2.31 -3.56 0.54 9.36 -1.26 -4.95 117.16 121.29 1ggu n TYR 92 Ca 0.17 0.50 -0.29 0.00 3.32 0.00 0.00 57.90 61.60 1ggu n TYR 92 Cb 0.03 -2.41 -0.13 0.00 -0.63 0.00 0.00 39.34 36.20 1ggu n TYR 92 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1ggu s ASP 93 N -0.45 3.25 0.58 2.98 -1.08 -1.26 -4.99 116.67 115.70 1ggu s ASP 93 Ca 0.59 -2.31 0.01 0.00 -0.52 0.00 0.00 52.55 50.33 1ggu s ASP 93 Cb -0.51 -0.64 0.06 0.00 -1.46 0.00 0.00 42.92 40.38 1ggu s ASP 93 CO 0.59 -0.30 0.98 -0.65 0.52 0.00 0.00 175.17 176.31 1ggu h PRO 94 N 6.97 0.00 0.00 4.34 0.11 -1.93 0.21 132.00 141.70 1ggu h PRO 94 Ca 0.02 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.99 1ggu h PRO 94 Cb 0.96 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 1ggu h PRO 94 CO 0.35 0.00 -0.68 0.00 -0.21 0.00 0.00 178.00 177.46 1ggu h ARG 95 N 0.00 0.00 0.00 1.05 3.08 -2.01 -3.42 114.38 113.08 1ggu h ARG 95 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1ggu h ARG 95 Cb 1.83 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.88 1ggu h ARG 95 CO 0.00 0.68 -0.31 2.89 -1.07 0.00 0.00 179.97 182.15 1ggu n ARG 96 N -3.34 1.40 -2.71 0.04 1.85 0.69 -5.08 116.66 109.51 1ggu n ARG 96 Ca 0.01 0.00 -0.43 0.00 -1.00 0.00 0.00 57.85 56.43 1ggu n ARG 96 Cb 0.78 -0.66 -0.02 0.00 -1.05 0.00 0.00 32.46 31.50 1ggu n ARG 96 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1ggu s ASP 97 N -1.57 7.05 -0.15 2.89 1.01 -0.96 -5.05 116.67 119.89 1ggu s ASP 97 Ca 0.00 1.32 -0.03 0.00 0.71 0.00 0.00 52.55 54.55 1ggu s ASP 97 Cb 0.00 -2.52 -0.02 0.00 1.01 0.00 0.00 42.92 41.39 1ggu s ASP 97 CO 0.00 -0.62 -0.07 -0.22 0.21 0.00 0.00 175.17 174.47 1ggu s LEU 98 N 3.05 3.05 0.19 1.23 0.20 -1.26 -4.75 118.68 120.39 1ggu s LEU 98 Ca 0.42 -0.22 -0.21 0.00 0.69 0.00 0.00 54.13 54.82 1ggu s LEU 98 Cb -0.15 -1.72 0.05 0.00 -0.43 0.00 0.00 46.19 43.93 1ggu s LEU 98 CO 0.07 0.15 0.60 0.72 -0.29 0.00 0.00 176.35 177.60 1ggu s PHE 99 N 0.45 -0.37 -0.17 5.38 -0.12 -1.26 -2.26 117.98 119.63 1ggu s PHE 99 Ca -0.06 0.08 -0.31 0.00 -0.05 0.00 0.00 56.93 56.59 1ggu s PHE 99 Cb -0.15 0.55 0.14 0.00 -0.63 0.00 0.00 43.02 42.93 1ggu s PHE 99 CO 0.03 -0.94 1.11 -0.98 -0.05 0.00 0.00 175.22 174.39 1ggu s ARG 100 N -3.81 0.45 0.47 1.99 1.70 -0.89 -4.40 118.95 114.46 1ggu s ARG 100 Ca 0.05 -0.01 -0.20 0.00 -0.47 0.00 0.00 55.73 55.10 1ggu s ARG 100 Cb -0.02 0.21 -0.09 0.00 -0.57 0.00 0.00 34.95 34.48 1ggu s ARG 100 CO -0.07 -0.16 1.00 0.08 -1.08 0.00 0.00 175.30 175.07 1ggu s VAL 101 N -1.68 4.11 0.01 4.99 1.01 -1.23 -1.95 120.40 125.66 1ggu s VAL 101 Ca 0.04 1.26 0.03 0.00 0.00 0.00 0.00 61.98 63.31 1ggu s VAL 101 Cb -0.01 -3.53 -0.01 0.00 0.00 0.00 0.00 36.38 32.83 1ggu s VAL 101 CO -0.03 -0.34 -0.09 -1.61 0.00 0.00 0.00 175.10 173.03 1ggu s GLU 102 N -3.35 0.68 -0.12 2.72 2.02 -0.29 -0.46 118.70 119.90 1ggu s GLU 102 Ca 0.64 -0.44 0.01 0.00 0.02 0.00 0.00 54.97 55.20 1ggu s GLU 102 Cb -0.13 -0.64 0.02 0.00 0.10 0.00 0.00 34.13 33.48 1ggu s GLU 102 CO 0.19 0.17 -0.15 0.71 0.02 0.00 0.00 175.26 176.20 1ggu s TYR 103 N -0.48 2.00 0.03 1.61 2.02 -0.22 -1.36 117.35 120.95 1ggu s TYR 103 Ca 0.01 -0.99 0.05 0.00 -0.37 0.00 0.00 57.07 55.77 1ggu s TYR 103 Cb -0.05 -1.46 -0.02 0.00 -0.40 0.00 0.00 41.96 40.03 1ggu s TYR 103 CO 0.00 -0.53 -0.15 0.14 -1.57 0.00 0.00 175.55 173.45 1ggu s VAL 104 N 1.13 1.18 -0.02 0.71 -7.23 -0.64 0.84 120.40 116.36 1ggu s VAL 104 Ca -0.03 -0.95 -0.01 0.00 -1.81 0.00 0.00 61.98 59.18 1ggu s VAL 104 Cb -0.14 -1.05 0.01 0.00 0.56 0.00 0.00 36.38 35.76 1ggu s VAL 104 CO -0.04 0.09 0.04 -0.51 -0.31 0.00 0.00 175.10 174.36 1ggu s ILE 105 N -0.75 -0.02 0.00 -0.62 2.07 0.06 -1.32 121.20 120.63 1ggu s ILE 105 Ca 0.03 0.06 0.00 0.00 -1.41 0.00 0.00 60.65 59.33 1ggu s ILE 105 Cb -0.07 -0.07 0.00 0.00 0.13 0.00 0.00 42.46 42.45 1ggu s ILE 105 CO 0.01 0.02 0.00 0.61 -1.91 0.00 0.00 174.94 173.67 1ggu n GLY 106 N 3.38 -1.32 0.18 1.50 0.00 -1.20 -4.30 105.19 103.44 1ggu n GLY 106 Ca -0.16 -1.59 0.09 0.00 0.00 0.00 0.00 46.02 44.36 1ggu n GLY 106 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1ggu h ARG 107 N 0.00 0.00 -2.14 1.61 2.43 -1.72 -3.30 114.38 111.27 1ggu h ARG 107 Ca 0.00 0.00 -0.57 0.00 -0.81 0.00 0.00 59.98 58.60 1ggu h ARG 107 Cb 0.00 0.00 -0.41 0.00 -0.42 0.00 0.00 29.97 29.14 1ggu h ARG 107 CO 0.00 0.12 -0.80 0.66 -1.51 0.00 0.00 179.97 178.44 1ggu n TYR 108 N -3.07 2.28 -2.15 2.20 4.01 -1.26 -4.14 117.16 115.04 1ggu n TYR 108 Ca 0.03 -3.93 -0.37 0.00 -0.16 0.00 0.00 57.90 53.46 1ggu n TYR 108 Cb 0.59 -0.48 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 1ggu n TYR 108 CO 0.00 0.00 0.00 -2.14 -0.46 0.00 0.00 176.86 174.26 1ggu s PRO 109 N -2.31 3.55 -0.15 -0.72 0.02 -1.26 -4.80 135.00 129.33 1ggu s PRO 109 Ca 0.40 1.84 -0.14 0.00 0.02 0.00 0.00 61.00 63.12 1ggu s PRO 109 Cb 0.20 -2.30 0.04 0.00 0.02 0.00 0.00 34.50 32.46 1ggu s PRO 109 CO -0.07 -0.75 0.41 -0.65 -0.33 0.00 0.00 177.00 175.61 1ggu s GLN 110 N -2.84 0.49 0.20 5.54 -0.21 -1.26 -4.77 119.66 116.80 1ggu s GLN 110 Ca 0.67 0.54 -0.11 0.00 0.02 0.00 0.00 55.36 56.48 1ggu s GLN 110 Cb -0.30 0.24 0.14 0.00 1.00 0.00 0.00 33.01 34.09 1ggu s GLN 110 CO 0.36 -0.06 1.86 1.49 -2.12 0.00 0.00 175.29 176.82 1ggu h GLU 111 N 5.43 0.96 -0.94 2.91 4.81 -1.94 -1.94 114.58 123.86 1ggu h GLU 111 Ca -0.27 -0.07 0.27 0.00 -0.13 0.00 0.00 59.36 59.16 1ggu h GLU 111 Cb 1.18 -0.21 -0.17 0.00 0.63 0.00 0.00 28.75 30.18 1ggu h GLU 111 CO 0.26 0.65 0.11 -0.91 -0.73 0.00 0.00 179.01 178.38 1ggu h ASN 112 N 0.98 -0.31 -0.19 1.04 -0.26 -1.96 -0.54 115.58 114.35 1ggu h ASN 112 Ca 0.26 0.25 0.00 0.00 -0.56 0.00 0.00 56.30 56.26 1ggu h ASN 112 Cb -0.09 0.41 0.00 0.00 -1.06 0.00 0.00 38.32 37.59 1ggu h ASN 112 CO -0.05 -0.30 0.00 0.29 -1.06 0.00 0.00 177.43 176.30 1ggu n LYS 113 N -5.41 2.35 -1.11 0.81 4.76 -1.07 -4.98 118.16 113.53 1ggu n LYS 113 Ca 0.23 -2.00 -0.04 0.00 -2.87 0.00 0.00 58.31 53.63 1ggu n LYS 113 Cb 0.76 -1.48 -0.02 0.00 -1.84 0.00 0.00 35.03 32.45 1ggu n LYS 113 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ggu n GLY 114 N 1.40 0.66 0.00 0.72 0.00 -0.21 -4.62 105.19 103.15 1ggu n GLY 114 Ca 0.17 -0.73 0.08 0.00 0.00 0.00 0.00 46.02 45.54 1ggu n GLY 114 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ggu n THR 115 N -2.86 0.00 -4.48 2.61 -2.24 -0.75 -4.76 114.28 101.79 1ggu n THR 115 Ca -0.04 -0.17 -0.32 0.00 -2.27 0.00 0.00 64.05 61.26 1ggu n THR 115 Cb 0.14 0.77 -0.16 0.00 -2.10 0.00 0.00 70.33 68.98 1ggu n THR 115 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1ggu s TYR 116 N -2.80 2.51 -0.29 4.78 5.04 -1.15 -0.76 117.35 124.67 1ggu s TYR 116 Ca 0.03 -1.30 0.00 0.00 -2.44 0.00 0.00 57.07 53.36 1ggu s TYR 116 Cb 0.13 -1.74 0.09 0.00 0.35 0.00 0.00 41.96 40.79 1ggu s TYR 116 CO 0.73 -0.62 0.05 0.42 -1.34 0.00 0.00 175.55 174.78 1ggu s ILE 117 N 0.99 1.27 -0.40 3.14 1.01 0.25 -3.96 121.20 123.49 1ggu s ILE 117 Ca -0.04 -1.48 -0.24 0.00 0.00 0.00 0.00 60.65 58.89 1ggu s ILE 117 Cb -0.15 -1.85 0.02 0.00 0.01 0.00 0.00 42.46 40.49 1ggu s ILE 117 CO -0.04 -0.50 0.86 -2.16 0.00 0.00 0.00 174.94 173.10 1ggu s PRO 118 N 1.45 3.67 -0.48 2.79 0.04 -1.26 -1.06 135.00 140.14 1ggu s PRO 118 Ca 0.06 0.28 -0.22 0.00 0.04 0.00 0.00 61.00 61.16 1ggu s PRO 118 Cb -0.18 -3.86 0.04 0.00 0.04 0.00 0.00 34.50 30.54 1ggu s PRO 118 CO -0.16 -1.01 0.73 0.08 0.04 0.00 0.00 177.00 176.68 1ggu s VAL 119 N 3.39 4.71 0.13 -0.36 1.01 0.40 -4.96 120.40 124.72 1ggu s VAL 119 Ca 0.34 0.06 -0.30 0.00 0.00 0.00 0.00 61.98 62.08 1ggu s VAL 119 Cb -0.12 -4.32 -0.07 0.00 0.00 0.00 0.00 36.38 31.87 1ggu s VAL 119 CO 0.21 -0.78 1.26 -2.16 0.00 0.00 0.00 175.10 173.63 1ggu s PRO 120 N 3.10 4.41 0.19 2.72 0.04 -1.26 -3.51 135.00 140.69 1ggu s PRO 120 Ca 0.24 1.92 -0.31 0.00 0.04 0.00 0.00 61.00 62.88 1ggu s PRO 120 Cb -0.15 -3.27 -0.10 0.00 0.04 0.00 0.00 34.50 31.02 1ggu s PRO 120 CO 0.18 -0.26 1.57 0.42 0.04 0.00 0.00 177.00 178.95 1ggu s ILE 121 N 0.63 2.51 0.08 0.56 -1.09 -1.26 -2.18 121.20 120.45 1ggu s ILE 121 Ca 0.58 0.38 0.03 0.00 -2.23 0.00 0.00 60.65 59.41 1ggu s ILE 121 Cb -0.33 -3.24 -0.03 0.00 -1.58 0.00 0.00 42.46 37.27 1ggu s ILE 121 CO 0.33 0.04 -0.09 0.54 -1.23 0.00 0.00 174.94 174.53 1ggu s VAL 122 N 0.89 0.75 0.13 2.92 0.11 0.71 -4.89 120.40 121.02 1ggu s VAL 122 Ca 0.69 -1.51 -0.13 0.00 -2.93 0.00 0.00 61.98 58.10 1ggu s VAL 122 Cb -0.45 -1.17 -0.02 0.00 -1.53 0.00 0.00 36.38 33.21 1ggu s VAL 122 CO 0.34 -0.57 1.53 0.77 -3.33 0.00 0.00 175.10 173.85 1ggu h SER 123 N 3.76 0.85 -3.50 3.54 4.64 -1.93 -3.38 113.55 117.52 1ggu h SER 123 Ca -0.36 -0.38 -0.22 0.00 -0.47 0.00 0.00 61.79 60.35 1ggu h SER 123 Cb 1.19 -0.23 -0.30 0.00 -0.31 0.00 0.00 62.40 62.74 1ggu h SER 123 CO 0.51 1.03 -0.57 -0.70 -0.87 0.00 0.00 176.83 176.23 1ggu s GLU 124 N -4.74 0.13 0.42 4.77 2.56 -1.26 -4.94 118.70 115.64 1ggu s GLU 124 Ca -0.12 0.36 -0.24 0.00 0.00 0.00 0.00 54.97 54.97 1ggu s GLU 124 Cb 0.11 -0.11 -0.11 0.00 2.00 0.00 0.00 34.13 36.02 1ggu s GLU 124 CO 0.83 -0.13 0.87 1.28 -0.56 0.00 0.00 175.26 177.56 1ggu n LEU 125 N 3.93 1.87 -4.71 2.70 4.77 -1.26 -4.96 117.00 119.34 1ggu n LEU 125 Ca -0.23 1.00 -0.27 0.00 -0.03 0.00 0.00 56.01 56.48 1ggu n LEU 125 Cb 0.53 -1.28 -0.07 0.00 -2.33 0.00 0.00 43.42 40.27 1ggu n LEU 125 CO 0.18 -1.90 -0.29 -1.10 -1.33 0.00 0.00 177.39 172.95 1ggu s GLN 126 N -1.90 2.59 -0.28 3.23 -1.52 -1.26 -5.08 119.66 115.43 1ggu s GLN 126 Ca 0.64 -1.00 -0.29 0.00 -1.95 0.00 0.00 55.36 52.76 1ggu s GLN 126 Cb -0.57 -2.47 -0.01 0.00 -0.22 0.00 0.00 33.01 29.74 1ggu s GLN 126 CO 0.57 0.47 1.38 -1.54 -0.25 0.00 0.00 175.29 175.92 1ggu s SER 127 N -2.95 6.59 -1.26 5.90 1.04 -1.26 -3.75 113.70 118.01 1ggu s SER 127 Ca 0.29 1.30 0.00 0.00 0.48 0.00 0.00 55.95 58.01 1ggu s SER 127 Cb -0.10 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.48 1ggu s SER 127 CO 0.20 -1.14 0.00 0.61 0.98 0.00 0.00 173.24 173.90 1ggu n GLY 128 N 4.42 0.84 3.16 7.32 0.00 -1.26 -5.02 105.19 114.65 1ggu n GLY 128 Ca 0.16 -0.40 -0.16 0.00 0.00 0.00 0.00 46.02 45.61 1ggu n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ggu s LYS 129 N -3.61 0.79 0.10 1.61 1.02 -1.25 -4.36 119.74 114.04 1ggu s LYS 129 Ca 0.00 -1.00 -0.30 0.00 0.02 0.00 0.00 55.97 54.68 1ggu s LYS 129 Cb 0.00 -0.65 -0.06 0.00 -0.52 0.00 0.00 37.83 36.60 1ggu s LYS 129 CO 0.00 0.13 1.14 -1.58 -0.92 0.00 0.00 175.35 174.12 1ggu s TRP 130 N -1.72 3.51 -0.06 3.18 0.52 -1.26 -4.35 118.94 118.77 1ggu s TRP 130 Ca -0.00 1.45 -0.31 0.00 0.02 0.00 0.00 56.10 57.25 1ggu s TRP 130 Cb -0.07 -3.34 0.11 0.00 -1.15 0.00 0.00 33.47 29.02 1ggu s TRP 130 CO 0.01 -0.93 1.01 0.20 0.02 0.00 0.00 176.95 177.27 1ggu s GLY 131 N 0.62 -0.40 -0.05 0.98 0.00 -0.79 -4.45 107.32 103.24 1ggu s GLY 131 Ca 0.55 1.16 0.01 0.00 0.00 0.00 0.00 44.72 46.44 1ggu s GLY 131 CO 0.31 0.38 -0.06 0.00 0.00 0.00 0.00 173.10 173.74 1ggu s ALA 132 N -2.87 0.80 -0.21 3.20 0.00 -0.93 -0.78 121.76 120.97 1ggu s ALA 132 Ca 0.07 -0.14 -0.06 0.00 0.00 0.00 0.00 51.96 51.84 1ggu s ALA 132 Cb -0.01 -0.48 -0.03 0.00 0.00 0.00 0.00 23.12 22.61 1ggu s ALA 132 CO -0.07 -0.03 0.02 0.21 0.00 0.00 0.00 175.76 175.89 1ggu s LYS 133 N 0.95 3.66 -0.44 0.00 2.20 0.38 -0.21 119.74 126.28 1ggu s LYS 133 Ca -0.10 -0.49 -0.27 0.00 -0.36 0.00 0.00 55.97 54.74 1ggu s LYS 133 Cb -0.14 -3.14 -0.03 0.00 -1.51 0.00 0.00 37.83 33.01 1ggu s LYS 133 CO 0.00 0.00 1.98 0.42 -0.36 0.00 0.00 175.35 177.39 1ggu s ILE 134 N 1.04 3.30 -2.36 5.43 1.01 -1.26 -1.14 121.20 127.22 1ggu s ILE 134 Ca 0.03 0.25 0.25 0.00 0.00 0.00 0.00 60.65 61.17 1ggu s ILE 134 Cb -0.14 -3.56 0.20 0.00 0.01 0.00 0.00 42.46 38.96 1ggu s ILE 134 CO 0.02 -0.47 1.34 0.55 0.00 0.00 0.00 174.94 176.39 1ggu n VAL 135 N 7.49 0.00 -3.48 2.92 3.14 0.89 -4.97 118.33 124.32 1ggu n VAL 135 Ca 0.25 -0.31 -0.13 0.00 -2.96 0.00 0.00 64.34 61.19 1ggu n VAL 135 Cb 0.50 1.04 -0.04 0.00 -1.06 0.00 0.00 33.84 34.28 1ggu n VAL 135 CO 0.00 0.00 0.00 -0.32 -6.46 0.00 0.00 176.83 170.05 1ggu s MET 136 N -2.25 1.10 -0.15 1.45 -2.45 -1.05 -4.93 119.30 111.01 1ggu s MET 136 Ca 0.26 -0.16 -0.05 0.00 -1.25 0.00 0.00 55.69 54.49 1ggu s MET 136 Cb 0.19 0.51 0.08 0.00 1.25 0.00 0.00 34.83 36.86 1ggu s MET 136 CO 0.44 -0.43 0.28 1.03 1.05 0.00 0.00 175.02 177.39 1ggu s ARG 137 N -2.62 0.18 -0.29 4.11 0.52 -1.26 -1.52 118.95 118.08 1ggu s ARG 137 Ca -0.03 0.67 0.02 0.00 -0.52 0.00 0.00 55.73 55.88 1ggu s ARG 137 Cb -0.01 -0.21 0.17 0.00 0.52 0.00 0.00 34.95 35.42 1ggu s ARG 137 CO -0.04 -0.37 0.44 -2.00 0.02 0.00 0.00 175.30 173.36 1ggu s GLU 138 N 2.43 0.44 -0.38 3.54 2.12 -0.29 -5.01 118.70 121.55 1ggu s GLU 138 Ca 0.03 0.24 -0.21 0.00 0.36 0.00 0.00 54.97 55.39 1ggu s GLU 138 Cb -0.13 -0.20 0.03 0.00 0.26 0.00 0.00 34.13 34.09 1ggu s GLU 138 CO -0.10 -1.01 0.50 -0.25 -0.54 0.00 0.00 175.26 173.87 1ggu n ASP 139 N 5.37 -6.99 0.00 -1.70 8.00 -1.26 -2.92 116.55 117.05 1ggu n ASP 139 Ca 0.01 0.39 0.00 0.00 0.71 0.00 0.00 54.79 55.90 1ggu n ASP 139 Cb 0.50 -3.74 0.00 0.00 -0.02 0.00 0.00 41.12 37.86 1ggu n ASP 139 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1ggu n ARG 140 N -0.00 0.00 -2.33 -1.24 3.00 -1.26 -4.89 116.66 109.94 1ggu n ARG 140 Ca 0.02 0.00 -0.37 0.00 -0.01 0.00 0.00 57.85 57.49 1ggu n ARG 140 Cb 0.49 -0.04 -0.02 0.00 0.00 0.00 0.00 32.46 32.89 1ggu n ARG 140 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1ggu s SER 141 N 0.00 6.43 0.06 0.55 0.01 -1.15 -1.87 113.70 117.74 1ggu s SER 141 Ca 0.00 2.27 0.04 0.00 1.31 0.00 0.00 55.95 59.58 1ggu s SER 141 Cb 0.00 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.60 1ggu s SER 141 CO 0.00 -0.73 -0.12 0.68 0.41 0.00 0.00 173.24 173.48 1ggu s VAL 142 N -1.51 0.95 -0.05 3.43 -7.23 -0.20 -1.13 120.40 114.66 1ggu s VAL 142 Ca 0.60 -1.18 0.06 0.00 -1.81 0.00 0.00 61.98 59.64 1ggu s VAL 142 Cb -0.28 -0.93 -0.02 0.00 0.56 0.00 0.00 36.38 35.71 1ggu s VAL 142 CO 0.35 -0.23 -0.21 -0.60 -0.31 0.00 0.00 175.10 174.10 1ggu s ARG 143 N -1.58 2.42 0.05 4.82 3.52 -0.58 -0.84 118.95 126.76 1ggu s ARG 143 Ca -0.03 -0.83 0.08 0.00 -0.13 0.00 0.00 55.73 54.81 1ggu s ARG 143 Cb -0.10 -2.22 -0.03 0.00 -1.56 0.00 0.00 34.95 31.05 1ggu s ARG 143 CO 0.02 0.52 -0.22 -0.51 -0.81 0.00 0.00 175.30 174.30 1ggu s LEU 144 N -0.49 2.17 -0.38 -0.88 1.43 0.23 -0.08 118.68 120.68 1ggu s LEU 144 Ca 0.06 -0.54 -0.03 0.00 -1.03 0.00 0.00 54.13 52.59 1ggu s LEU 144 Cb -0.11 -1.05 0.09 0.00 0.03 0.00 0.00 46.19 45.14 1ggu s LEU 144 CO 0.01 0.18 0.15 -0.55 0.23 0.00 0.00 176.35 176.37 1ggu s SER 145 N -1.21 5.18 -0.12 2.29 0.15 -0.30 -0.63 113.70 119.06 1ggu s SER 145 Ca 0.09 -1.75 -0.12 0.00 0.70 0.00 0.00 55.95 54.86 1ggu s SER 145 Cb -0.09 -1.81 -0.05 0.00 -1.71 0.00 0.00 66.02 62.37 1ggu s SER 145 CO 0.02 -0.45 0.26 -0.63 1.20 0.00 0.00 173.24 173.63 1ggu s ILE 146 N 1.20 5.31 -0.09 6.45 1.01 0.24 -0.47 121.20 134.85 1ggu s ILE 146 Ca 0.04 0.48 0.04 0.00 0.00 0.00 0.00 60.65 61.20 1ggu s ILE 146 Cb -0.22 -3.57 0.00 0.00 0.01 0.00 0.00 42.46 38.68 1ggu s ILE 146 CO -0.03 0.49 -0.21 -1.58 0.00 0.00 0.00 174.94 173.61 1ggu s GLN 147 N -0.22 2.74 0.21 2.79 0.74 0.04 0.39 119.66 126.35 1ggu s GLN 147 Ca 0.17 -0.77 -0.06 0.00 0.05 0.00 0.00 55.36 54.74 1ggu s GLN 147 Cb -0.13 -2.09 -0.06 0.00 1.10 0.00 0.00 33.01 31.82 1ggu s GLN 147 CO 0.05 0.14 0.48 -1.54 -0.55 0.00 0.00 175.29 173.87 1ggu s SER 148 N 0.42 6.53 0.38 6.67 1.04 -1.26 -1.88 113.70 125.60 1ggu s SER 148 Ca -0.18 0.73 -0.27 0.00 0.48 0.00 0.00 55.95 56.71 1ggu s SER 148 Cb -0.17 -2.15 -0.09 0.00 0.10 0.00 0.00 66.02 63.70 1ggu s SER 148 CO 0.08 -0.05 1.32 -0.55 0.98 0.00 0.00 173.24 175.03 1ggu s SER 149 N -2.58 6.43 0.00 7.02 0.15 -1.26 -2.36 113.70 121.11 1ggu s SER 149 Ca 0.44 2.71 0.10 0.00 0.70 0.00 0.00 55.95 59.90 1ggu s SER 149 Cb -0.11 -2.64 0.62 0.00 -1.71 0.00 0.00 66.02 62.17 1ggu s SER 149 CO 0.24 -0.77 1.20 -0.81 1.20 0.00 0.00 173.24 174.30 1ggu n PRO 150 N 0.33 0.74 -0.15 5.44 -0.04 -1.26 -2.07 135.00 138.00 1ggu n PRO 150 Ca 0.02 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.54 1ggu n PRO 150 Cb 0.43 -1.22 0.12 0.00 -0.04 0.00 0.00 33.50 32.79 1ggu n PRO 150 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1ggu n LYS 151 N -0.72 2.57 -1.70 0.54 5.02 -1.26 -4.55 118.16 118.06 1ggu n LYS 151 Ca 0.08 -2.15 -0.38 0.00 -2.02 0.00 0.00 58.31 53.84 1ggu n LYS 151 Cb 0.04 -1.35 0.05 0.00 -0.02 0.00 0.00 35.03 33.75 1ggu n LYS 151 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ggu s ILE 153 N -1.36 2.35 -0.12 0.00 1.01 -1.26 -4.37 121.20 117.45 1ggu s ILE 153 Ca 0.74 0.35 -0.15 0.00 0.00 0.00 0.00 60.65 61.58 1ggu s ILE 153 Cb -0.42 -3.22 -0.05 0.00 0.01 0.00 0.00 42.46 38.78 1ggu s ILE 153 CO 0.48 0.08 0.37 -0.69 0.00 0.00 0.00 174.94 175.17 1ggu s VAL 154 N -1.00 5.23 -3.96 2.92 1.01 -1.03 -4.81 120.40 118.76 1ggu s VAL 154 Ca 0.52 0.71 0.00 0.00 0.00 0.00 0.00 61.98 63.22 1ggu s VAL 154 Cb -0.44 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.25 1ggu s VAL 154 CO 0.57 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.69 1ggu n GLY 155 N 3.03 -1.04 3.43 4.51 0.00 -0.99 -4.76 105.19 109.37 1ggu n GLY 155 Ca -0.11 -1.09 -0.37 0.00 0.00 0.00 0.00 46.02 44.45 1ggu n GLY 155 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ggu s LYS 156 N -1.58 3.58 0.21 1.61 2.20 -1.26 -0.79 119.74 123.70 1ggu s LYS 156 Ca 0.00 -0.53 0.05 0.00 -0.36 0.00 0.00 55.97 55.13 1ggu s LYS 156 Cb 0.00 -3.34 -0.03 0.00 -1.51 0.00 0.00 37.83 32.94 1ggu s LYS 156 CO 0.00 -0.23 0.29 -0.06 -0.36 0.00 0.00 175.35 174.99 1ggu s PHE 157 N 1.60 3.37 -0.11 4.03 0.40 0.10 -4.89 117.98 122.48 1ggu s PHE 157 Ca 0.06 0.00 -0.09 0.00 -0.60 0.00 0.00 56.93 56.30 1ggu s PHE 157 Cb -0.15 -1.56 -0.04 0.00 0.51 0.00 0.00 43.02 41.77 1ggu s PHE 157 CO 0.04 0.48 0.19 1.03 0.70 0.00 0.00 175.22 177.67 1ggu s ARG 158 N -3.65 3.65 -0.09 0.44 0.52 -0.43 -0.84 118.95 118.55 1ggu s ARG 158 Ca 0.34 -0.03 -0.01 0.00 -0.52 0.00 0.00 55.73 55.51 1ggu s ARG 158 Cb -0.10 -3.23 -0.03 0.00 0.52 0.00 0.00 34.95 32.11 1ggu s ARG 158 CO 0.28 0.69 -0.03 1.41 0.02 0.00 0.00 175.30 177.66 1ggu s MET 159 N -0.81 2.96 0.18 3.54 1.75 -1.26 -1.63 119.30 124.03 1ggu s MET 159 Ca 0.16 -0.47 -0.00 0.00 -1.25 0.00 0.00 55.69 54.13 1ggu s MET 159 Cb -0.13 -2.73 -0.04 0.00 2.84 0.00 0.00 34.83 34.77 1ggu s MET 159 CO 0.05 0.64 0.07 0.71 -0.65 0.00 0.00 175.02 175.84 1ggu s TYR 160 N -0.72 1.12 -0.04 4.11 2.02 -0.46 -4.73 117.35 118.64 1ggu s TYR 160 Ca 0.11 -1.21 0.00 0.00 -0.37 0.00 0.00 57.07 55.60 1ggu s TYR 160 Cb -0.11 -0.62 0.02 0.00 -0.40 0.00 0.00 41.96 40.86 1ggu s TYR 160 CO 0.02 -0.45 -0.02 0.08 -1.57 0.00 0.00 175.55 173.61 1ggu s VAL 161 N -3.94 0.38 0.04 0.71 1.01 -1.26 -1.14 120.40 116.20 1ggu s VAL 161 Ca 0.30 0.00 0.08 0.00 0.00 0.00 0.00 61.98 62.36 1ggu s VAL 161 Cb 0.07 -0.45 -0.03 0.00 0.00 0.00 0.00 36.38 35.97 1ggu s VAL 161 CO 0.07 0.20 -0.21 0.00 0.00 0.00 0.00 175.10 175.16 1ggu s ALA 162 N 1.17 1.83 -0.21 5.51 0.00 -0.82 -1.18 121.76 128.05 1ggu s ALA 162 Ca -0.07 -1.09 -0.03 0.00 0.00 0.00 0.00 51.96 50.77 1ggu s ALA 162 Cb -0.14 -0.36 -0.00 0.00 0.00 0.00 0.00 23.12 22.62 1ggu s ALA 162 CO -0.02 0.41 -0.08 0.08 0.00 0.00 0.00 175.76 176.16 1ggu s VAL 163 N -0.81 3.09 -0.06 0.00 1.01 0.21 -2.09 120.40 121.75 1ggu s VAL 163 Ca 0.08 -0.59 -0.28 0.00 0.00 0.00 0.00 61.98 61.19 1ggu s VAL 163 Cb -0.09 -2.38 -0.02 0.00 0.00 0.00 0.00 36.38 33.88 1ggu s VAL 163 CO 0.02 0.45 0.92 0.26 0.00 0.00 0.00 175.10 176.75 1ggu s TRP 164 N 1.36 3.58 0.25 5.22 0.51 -0.96 -0.88 118.94 128.01 1ggu s TRP 164 Ca 0.05 1.53 0.11 0.00 -2.12 0.00 0.00 56.10 55.67 1ggu s TRP 164 Cb -0.14 -3.07 -0.05 0.00 -0.81 0.00 0.00 33.47 29.41 1ggu s TRP 164 CO -0.05 -0.08 -0.16 0.95 -0.51 0.00 0.00 176.95 177.11 1ggu s THR 165 N 1.37 2.72 -0.37 2.01 -4.23 -0.95 -4.50 115.64 111.70 1ggu s THR 165 Ca 0.47 -2.14 0.19 0.00 -1.18 0.00 0.00 61.69 59.02 1ggu s THR 165 Cb -0.19 -2.40 0.19 0.00 1.34 0.00 0.00 72.50 71.44 1ggu s THR 165 CO 0.22 -0.30 1.57 -0.81 -0.54 0.00 0.00 174.62 174.76 1ggu n PRO 166 N -0.40 0.12 -3.90 3.99 -0.04 -1.26 -3.66 135.00 129.85 1ggu n PRO 166 Ca -0.08 0.58 -0.28 0.00 -0.04 0.00 0.00 63.50 63.68 1ggu n PRO 166 Cb 0.58 -1.87 -0.12 0.00 -0.04 0.00 0.00 33.50 32.05 1ggu n PRO 166 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1ggu s TYR 167 N -3.43 3.47 0.00 0.54 1.51 -1.26 -5.03 117.35 113.15 1ggu s TYR 167 Ca -0.01 -3.30 0.00 0.00 -1.01 0.00 0.00 57.07 52.75 1ggu s TYR 167 Cb 0.06 -2.70 0.00 0.00 -0.11 0.00 0.00 41.96 39.21 1ggu s TYR 167 CO 0.20 -0.58 0.00 0.41 -1.11 0.00 0.00 175.55 174.47 1ggu n GLY 168 N 2.17 -1.96 3.38 0.71 0.00 -1.24 -4.12 105.19 104.12 1ggu n GLY 168 Ca 0.17 -1.38 -0.19 0.00 0.00 0.00 0.00 46.02 44.62 1ggu n GLY 168 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ggu s VAL 169 N -0.10 1.67 0.03 1.61 -7.23 -0.77 -2.24 120.40 113.36 1ggu s VAL 169 Ca 0.00 -2.17 0.08 0.00 -1.81 0.00 0.00 61.98 58.08 1ggu s VAL 169 Cb 0.00 -2.21 -0.03 0.00 0.56 0.00 0.00 36.38 34.70 1ggu s VAL 169 CO 0.00 -0.47 -0.24 -0.76 -0.31 0.00 0.00 175.10 173.32 1ggu s LEU 170 N -3.36 2.30 0.13 1.32 1.43 -0.06 -1.47 118.68 118.96 1ggu s LEU 170 Ca 0.25 -0.52 -0.18 0.00 -1.03 0.00 0.00 54.13 52.66 1ggu s LEU 170 Cb 0.01 -1.37 0.04 0.00 0.03 0.00 0.00 46.19 44.91 1ggu s LEU 170 CO 0.09 0.27 0.45 0.00 0.23 0.00 0.00 176.35 177.39 1ggu s ARG 171 N -1.21 1.11 0.82 1.70 1.70 0.35 0.66 118.95 124.08 1ggu s ARG 171 Ca 0.12 -0.62 -0.13 0.00 -0.47 0.00 0.00 55.73 54.64 1ggu s ARG 171 Cb -0.10 0.49 0.09 0.00 -0.57 0.00 0.00 34.95 34.86 1ggu s ARG 171 CO 0.03 -0.44 1.20 0.95 -1.08 0.00 0.00 175.30 175.95 1ggu s THR 172 N -3.68 2.06 0.49 4.99 -4.23 -0.33 -4.52 115.64 110.43 1ggu s THR 172 Ca 0.02 0.02 0.01 0.00 -1.18 0.00 0.00 61.69 60.56 1ggu s THR 172 Cb 0.01 -2.37 0.01 0.00 1.34 0.00 0.00 72.50 71.49 1ggu s THR 172 CO -0.11 -0.02 0.71 -0.94 -0.54 0.00 0.00 174.62 173.72 1ggu s SER 173 N -2.24 5.57 0.07 3.99 1.04 -1.26 -4.78 113.70 116.08 1ggu s SER 173 Ca 0.72 0.11 -0.35 0.00 0.48 0.00 0.00 55.95 56.91 1ggu s SER 173 Cb -0.28 -1.19 -0.14 0.00 0.10 0.00 0.00 66.02 64.51 1ggu s SER 173 CO 0.52 -0.91 1.57 -1.14 0.98 0.00 0.00 173.24 174.26 1ggu n ARG 174 N -2.19 1.80 -3.55 4.02 3.00 -1.26 -4.96 116.66 113.51 1ggu n ARG 174 Ca 0.05 0.65 -0.29 0.00 -0.00 0.00 0.00 57.85 58.26 1ggu n ARG 174 Cb 0.59 -2.39 -0.15 0.00 0.00 0.00 0.00 32.46 30.50 1ggu n ARG 174 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 1ggu s ASN 175 N 1.48 3.39 0.59 6.15 2.47 -1.26 -5.02 114.94 122.75 1ggu s ASN 175 Ca 0.84 -1.21 0.29 0.00 0.42 0.00 0.00 52.86 53.20 1ggu s ASN 175 Cb -0.79 -0.35 1.72 0.00 -1.45 0.00 0.00 41.25 40.38 1ggu s ASN 175 CO 0.45 -0.43 2.15 -0.65 -3.72 0.00 0.00 177.10 174.90 1ggu h PRO 176 N 8.40 0.00 0.00 0.43 0.11 -1.97 -2.52 132.00 136.45 1ggu h PRO 176 Ca -0.19 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.90 1ggu h PRO 176 Cb 1.03 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 1ggu h PRO 176 CO 0.42 0.00 -0.11 0.93 -0.21 0.00 0.00 178.00 179.03 1ggu h GLU 177 N 0.00 0.00 -0.05 1.05 4.39 -2.01 -2.79 114.58 115.17 1ggu h GLU 177 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1ggu h GLU 177 Cb 0.34 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.99 1ggu h GLU 177 CO -0.00 0.11 0.00 0.25 -1.16 0.00 0.00 179.01 178.21 1ggu n THR 178 N -3.23 0.04 -1.68 1.13 -2.24 -0.95 -4.79 114.28 102.56 1ggu n THR 178 Ca 0.01 -0.35 -0.46 0.00 -2.27 0.00 0.00 64.05 60.97 1ggu n THR 178 Cb 0.38 0.79 -0.04 0.00 -2.10 0.00 0.00 70.33 69.36 1ggu n THR 178 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1ggu n ASP 179 N 0.58 3.33 -4.24 3.42 8.00 -1.06 -4.34 116.55 122.24 1ggu n ASP 179 Ca 0.17 1.03 -0.33 0.00 0.71 0.00 0.00 54.79 56.37 1ggu n ASP 179 Cb 0.43 -1.42 -0.15 0.00 -0.02 0.00 0.00 41.12 39.96 1ggu n ASP 179 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ggu s THR 180 N 2.29 2.58 0.12 -3.53 2.01 -0.02 -4.00 115.64 115.08 1ggu s THR 180 Ca 0.84 -0.79 -0.21 0.00 0.31 0.00 0.00 61.69 61.84 1ggu s THR 180 Cb -0.66 -2.09 -0.07 0.00 0.01 0.00 0.00 72.50 69.68 1ggu s THR 180 CO 0.43 0.51 0.64 -0.31 -0.69 0.00 0.00 174.62 175.21 1ggu s TYR 181 N 0.96 3.81 -0.18 4.92 1.51 0.07 0.01 117.35 128.44 1ggu s TYR 181 Ca -0.03 1.38 0.00 0.00 -1.01 0.00 0.00 57.07 57.41 1ggu s TYR 181 Cb -0.15 -2.58 0.04 0.00 -0.11 0.00 0.00 41.96 39.16 1ggu s TYR 181 CO -0.03 0.53 -0.10 0.42 -1.11 0.00 0.00 175.55 175.27 1ggu s ILE 182 N -1.19 1.51 0.52 2.71 1.01 0.03 -0.72 121.20 125.06 1ggu s ILE 182 Ca 0.33 -0.86 0.06 0.00 0.00 0.00 0.00 60.65 60.18 1ggu s ILE 182 Cb -0.20 -1.58 0.02 0.00 0.01 0.00 0.00 42.46 40.71 1ggu s ILE 182 CO 0.21 0.21 0.35 -0.76 0.00 0.00 0.00 174.94 174.95 1ggu s LEU 183 N 1.47 2.78 0.67 2.97 1.43 0.35 -2.35 118.68 125.99 1ggu s LEU 183 Ca 0.00 -1.21 -0.16 0.00 -1.03 0.00 0.00 54.13 51.73 1ggu s LEU 183 Cb -0.15 -1.26 0.01 0.00 0.03 0.00 0.00 46.19 44.81 1ggu s LEU 183 CO -0.08 -0.99 1.15 -0.36 0.23 0.00 0.00 176.35 176.30 1ggu s PHE 184 N -2.73 2.43 -0.49 0.29 0.08 -0.42 -0.65 117.98 116.49 1ggu s PHE 184 Ca 0.34 1.57 0.03 0.00 0.12 0.00 0.00 56.93 58.99 1ggu s PHE 184 Cb -0.01 -3.29 0.14 0.00 -0.57 0.00 0.00 43.02 39.29 1ggu s PHE 184 CO 0.21 -2.00 0.30 1.21 -0.10 0.00 0.00 175.22 174.83 1ggu s ASN 185 N -2.27 3.69 0.38 1.36 3.84 -1.26 -4.59 114.94 116.08 1ggu s ASN 185 Ca 0.70 -2.93 0.24 0.00 0.21 0.00 0.00 52.86 51.09 1ggu s ASN 185 Cb -0.24 -1.15 1.33 0.00 -0.55 0.00 0.00 41.25 40.64 1ggu s ASN 185 CO 0.41 -0.22 1.74 -0.65 -2.79 0.00 0.00 177.10 175.59 1ggu h PRO 186 N 6.36 0.00 -0.00 0.43 0.11 -1.79 -2.57 132.00 134.53 1ggu h PRO 186 Ca 0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1ggu h PRO 186 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1ggu h PRO 186 CO 0.54 0.00 -0.52 0.91 -0.21 0.00 0.00 178.00 178.72 1ggu n TRP 187 N -2.37 0.00 -3.39 0.65 8.01 -1.26 -1.31 117.44 117.77 1ggu n TRP 187 Ca -0.02 0.00 -0.40 0.00 -1.31 0.00 0.00 57.50 55.77 1ggu n TRP 187 Cb 0.07 -0.13 -0.09 0.00 -2.01 0.00 0.00 31.31 29.15 1ggu n TRP 187 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1ggu h GLU 189 N 8.32 0.00 -0.27 0.00 4.11 -1.89 -1.40 114.58 123.44 1ggu h GLU 189 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.12 1ggu h GLU 189 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1ggu h GLU 189 CO 0.67 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 179.50 1ggu n ASP 190 N -3.37 3.30 -4.75 3.06 8.00 -1.26 -4.89 116.55 116.64 1ggu n ASP 190 Ca 0.01 -1.99 -0.39 0.00 0.71 0.00 0.00 54.79 53.12 1ggu n ASP 190 Cb 0.36 -0.17 -0.05 0.00 -0.02 0.00 0.00 41.12 41.24 1ggu n ASP 190 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1ggu s ASP 191 N -1.66 7.04 0.65 -2.24 -1.08 -0.53 -4.84 116.67 114.02 1ggu s ASP 191 Ca 0.36 1.24 0.29 0.00 -0.52 0.00 0.00 52.55 53.91 1ggu s ASP 191 Cb 0.22 -2.40 1.55 0.00 -1.46 0.00 0.00 42.92 40.83 1ggu s ASP 191 CO 0.31 0.04 1.89 0.00 0.52 0.00 0.00 175.17 177.94 1ggu h ALA 192 N 5.84 1.54 -0.02 3.66 0.00 -1.88 0.20 119.26 128.61 1ggu h ALA 192 Ca -0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1ggu h ALA 192 Cb 1.20 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1ggu h ALA 192 CO 0.71 -0.43 -0.01 0.28 0.00 0.00 0.00 179.25 179.79 1ggu n VAL 193 N -3.07 0.00 -1.59 0.00 0.31 -1.26 -0.66 118.33 112.05 1ggu n VAL 193 Ca 0.00 -0.34 -0.54 0.00 -0.01 0.00 0.00 64.34 63.45 1ggu n VAL 193 Cb 0.46 0.88 -0.07 0.00 -0.91 0.00 0.00 33.84 34.20 1ggu n VAL 193 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ggu n TYR 194 N 0.58 1.45 -4.14 3.52 9.36 0.06 -4.50 117.16 123.49 1ggu n TYR 194 Ca 0.17 0.70 -0.28 0.00 3.32 0.00 0.00 57.90 61.81 1ggu n TYR 194 Cb 0.45 -2.31 -0.17 0.00 -0.63 0.00 0.00 39.34 36.68 1ggu n TYR 194 CO 0.00 0.00 0.00 -1.17 0.22 0.00 0.00 176.86 175.91 1ggu s LEU 195 N 0.84 1.51 0.19 2.98 0.20 -0.43 -4.95 118.68 119.02 1ggu s LEU 195 Ca 0.88 -0.38 -0.25 0.00 0.69 0.00 0.00 54.13 55.06 1ggu s LEU 195 Cb -1.03 -1.00 0.07 0.00 -0.43 0.00 0.00 46.19 43.80 1ggu s LEU 195 CO 0.52 -0.05 1.54 0.47 -0.29 0.00 0.00 176.35 178.53 1ggu n ASP 196 N 4.60 -0.88 -4.55 3.68 8.00 -1.26 -4.72 116.55 121.42 1ggu n ASP 196 Ca -0.16 1.76 -0.24 0.00 0.71 0.00 0.00 54.79 56.86 1ggu n ASP 196 Cb 0.50 -0.30 -0.09 0.00 -0.02 0.00 0.00 41.12 41.21 1ggu n ASP 196 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1ggu s ASN 197 N -5.44 4.04 0.27 -2.24 2.20 -1.26 -5.05 114.94 107.45 1ggu s ASN 197 Ca -0.13 -0.83 0.01 0.00 -0.94 0.00 0.00 52.86 50.97 1ggu s ASN 197 Cb 0.15 -0.56 0.36 0.00 -2.00 0.00 0.00 41.25 39.20 1ggu s ASN 197 CO 0.66 0.03 1.70 -0.08 -2.94 0.00 0.00 177.10 176.47 1ggu h GLU 198 N 2.19 0.56 -0.67 3.55 4.57 -1.99 -2.69 114.58 120.09 1ggu h GLU 198 Ca -0.43 -0.21 0.05 0.00 -1.18 0.00 0.00 59.36 57.59 1ggu h GLU 198 Cb 1.25 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 29.76 1ggu h GLU 198 CO 0.59 0.75 0.39 0.87 -1.18 0.00 0.00 179.01 180.43 1ggu h LYS 199 N 0.49 0.71 -0.20 1.92 1.57 -1.99 0.78 116.57 119.87 1ggu h LYS 199 Ca 0.07 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.70 1ggu h LYS 199 Cb 0.67 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 1ggu h LYS 199 CO 0.05 0.47 -0.32 0.93 -0.57 0.00 0.00 179.45 180.01 1ggu h GLU 200 N 0.74 0.57 -0.29 3.15 5.08 -1.93 -2.13 114.58 119.76 1ggu h GLU 200 Ca 0.29 -0.35 0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1ggu h GLU 200 Cb 0.13 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1ggu h GLU 200 CO -0.15 0.95 0.18 0.00 -1.00 0.00 0.00 179.01 178.98 1ggu h ARG 201 N 0.23 0.35 -0.51 2.33 3.08 -1.23 0.14 114.38 118.78 1ggu h ARG 201 Ca 0.02 -0.02 0.10 0.00 0.07 0.00 0.00 59.98 60.14 1ggu h ARG 201 Cb 0.91 -0.08 -0.09 0.00 0.08 0.00 0.00 29.97 30.79 1ggu h ARG 201 CO 0.07 0.23 -0.02 1.49 -1.07 0.00 0.00 179.97 180.68 1ggu h GLU 202 N 0.36 0.09 0.56 0.04 4.57 -0.80 0.91 114.58 120.31 1ggu h GLU 202 Ca 0.11 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.26 1ggu h GLU 202 Cb -0.02 -0.02 0.01 0.00 -0.16 0.00 0.00 28.75 28.55 1ggu h GLU 202 CO -0.04 0.06 -0.27 1.49 -1.18 0.00 0.00 179.01 179.08 1ggu h GLU 203 N 0.10 -0.72 0.00 1.92 4.57 -0.68 -0.60 114.58 119.16 1ggu h GLU 203 Ca 0.25 0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.48 1ggu h GLU 203 Cb 0.39 0.16 0.00 0.00 -0.16 0.00 0.00 28.75 29.14 1ggu h GLU 203 CO -0.44 -0.46 0.00 0.66 -1.18 0.00 0.00 179.01 177.59 1ggu n TYR 204 N -5.27 0.00 0.01 0.92 4.01 0.42 -3.57 117.16 113.67 1ggu n TYR 204 Ca -0.10 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.64 1ggu n TYR 204 Cb 0.30 -0.46 -0.00 0.00 -0.31 0.00 0.00 39.34 38.87 1ggu n TYR 204 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1ggu n VAL 205 N -1.46 0.20 0.10 -0.72 0.31 0.29 -1.82 118.33 115.23 1ggu n VAL 205 Ca 0.07 0.06 0.08 0.00 -0.01 0.00 0.00 64.34 64.54 1ggu n VAL 205 Cb 0.28 -1.52 -0.01 0.00 -0.91 0.00 0.00 33.84 31.68 1ggu n VAL 205 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1ggu h LEU 206 N -0.01 0.00 -9.46 7.52 4.07 -1.11 -3.45 115.31 112.87 1ggu h LEU 206 Ca -0.01 0.00 -0.54 0.00 0.08 0.00 0.00 57.88 57.42 1ggu h LEU 206 Cb 0.86 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.59 1ggu h LEU 206 CO -0.00 0.19 0.51 0.21 -1.08 0.00 0.00 178.44 178.26 1ggu s ASN 207 N -5.60 7.16 -0.08 -0.43 3.84 -0.30 -4.90 114.94 114.62 1ggu s ASN 207 Ca -0.00 1.91 0.14 0.00 0.21 0.00 0.00 52.86 55.12 1ggu s ASN 207 Cb 0.09 -2.58 0.44 0.00 -0.55 0.00 0.00 41.25 38.65 1ggu s ASN 207 CO 0.78 -0.42 1.36 -0.90 -2.79 0.00 0.00 177.10 175.14 1ggu n ASP 208 N 3.97 3.49 -4.02 -4.21 5.75 -1.26 -4.90 116.55 115.37 1ggu n ASP 208 Ca 0.08 -2.43 -0.25 0.00 -0.01 0.00 0.00 54.79 52.18 1ggu n ASP 208 Cb 0.48 -0.39 -0.17 0.00 -1.03 0.00 0.00 41.12 40.01 1ggu n ASP 208 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1ggu s ILE 209 N -1.78 1.17 0.17 2.12 1.01 -1.26 -1.33 121.20 121.30 1ggu s ILE 209 Ca 0.33 -0.49 0.01 0.00 0.00 0.00 0.00 60.65 60.50 1ggu s ILE 209 Cb 0.23 -1.08 0.01 0.00 0.01 0.00 0.00 42.46 41.63 1ggu s ILE 209 CO 0.14 0.37 0.07 0.61 0.00 0.00 0.00 174.94 176.13 1ggu n GLY 210 N 3.90 3.45 2.83 6.18 0.00 0.13 -4.93 105.19 116.75 1ggu n GLY 210 Ca -0.22 -2.24 -0.14 0.00 0.00 0.00 0.00 46.02 43.43 1ggu n GLY 210 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ggu s VAL 211 N -1.21 -0.04 -0.09 1.61 1.01 -1.26 -1.77 120.40 118.65 1ggu s VAL 211 Ca 0.05 0.14 0.01 0.00 0.00 0.00 0.00 61.98 62.19 1ggu s VAL 211 Cb -0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 36.38 36.27 1ggu s VAL 211 CO 0.03 0.06 -0.10 -0.63 0.00 0.00 0.00 175.10 174.46 1ggu s ILE 212 N 0.74 3.35 -0.17 2.22 1.01 0.72 -4.64 121.20 124.43 1ggu s ILE 212 Ca -0.06 -0.59 -0.07 0.00 0.00 0.00 0.00 60.65 59.93 1ggu s ILE 212 Cb -0.09 -2.37 -0.04 0.00 0.01 0.00 0.00 42.46 39.97 1ggu s ILE 212 CO -0.02 0.57 0.06 -0.36 0.00 0.00 0.00 174.94 175.18 1ggu s PHE 213 N -0.38 3.26 0.00 3.97 0.08 -1.26 -2.10 117.98 121.55 1ggu s PHE 213 Ca 0.05 0.11 0.00 0.00 0.12 0.00 0.00 56.93 57.20 1ggu s PHE 213 Cb -0.12 -2.04 0.00 0.00 -0.57 0.00 0.00 43.02 40.29 1ggu s PHE 213 CO 0.02 0.22 0.00 2.48 -0.10 0.00 0.00 175.22 177.84 1ggu n TYR 214 N 3.30 0.00 -0.06 0.36 4.11 0.62 -4.82 117.16 120.67 1ggu n TYR 214 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.73 1ggu n TYR 214 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.87 1ggu n TYR 214 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1ggu n GLY 215 N 0.05 0.60 3.24 -7.48 0.00 -1.26 -0.82 105.19 99.53 1ggu n GLY 215 Ca 0.00 -1.02 -0.09 0.00 0.00 0.00 0.00 46.02 44.91 1ggu n GLY 215 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ggu s GLU 216 N 0.00 0.91 0.53 1.61 4.04 -0.69 -4.50 118.70 120.59 1ggu s GLU 216 Ca 0.00 -0.87 0.31 0.00 0.04 0.00 0.00 54.97 54.45 1ggu s GLU 216 Cb 0.00 0.38 1.45 0.00 0.02 0.00 0.00 34.13 35.98 1ggu s GLU 216 CO 0.00 -0.31 1.87 -0.24 -1.84 0.00 0.00 175.26 174.75 1ggu h VAL 217 N 2.66 0.54 -0.55 1.83 3.04 -1.91 0.18 116.25 122.04 1ggu h VAL 217 Ca -0.34 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.34 1ggu h VAL 217 Cb 1.22 0.50 0.00 0.00 -2.01 0.00 0.00 31.29 30.99 1ggu h VAL 217 CO 0.53 0.01 0.00 0.59 -1.01 0.00 0.00 177.57 177.69 1ggu n ASN 218 N -4.29 3.08 -2.72 3.17 5.03 -1.26 -4.53 115.26 113.73 1ggu n ASN 218 Ca 0.20 -2.04 -0.06 0.00 0.87 0.00 0.00 54.58 53.55 1ggu n ASN 218 Cb 0.97 -0.39 0.05 0.00 -1.02 0.00 0.00 39.78 39.39 1ggu n ASN 218 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 1ggu n ASP 219 N 1.09 -2.47 -4.64 6.41 2.03 0.59 -5.01 116.55 114.55 1ggu n ASP 219 Ca 0.19 -2.57 -0.43 0.00 0.52 0.00 0.00 54.79 52.50 1ggu n ASP 219 Cb 0.50 1.42 -0.03 0.00 -0.72 0.00 0.00 41.12 42.29 1ggu n ASP 219 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1ggu s ILE 220 N 0.63 3.78 0.15 5.18 -1.09 -1.06 -1.70 121.20 127.09 1ggu s ILE 220 Ca 0.29 0.91 0.03 0.00 -2.23 0.00 0.00 60.65 59.66 1ggu s ILE 220 Cb 0.16 -3.69 -0.04 0.00 -1.58 0.00 0.00 42.46 37.32 1ggu s ILE 220 CO -0.15 -0.20 0.22 -0.54 -1.23 0.00 0.00 174.94 173.05 1ggu s LYS 221 N 4.24 3.22 0.08 2.79 -0.14 0.00 -4.93 119.74 125.00 1ggu s LYS 221 Ca 0.69 -0.70 0.03 0.00 -1.36 0.00 0.00 55.97 54.62 1ggu s LYS 221 Cb -0.27 -2.84 -0.03 0.00 -1.68 0.00 0.00 37.83 33.01 1ggu s LYS 221 CO 0.26 0.51 -0.08 0.95 -0.76 0.00 0.00 175.35 176.23 1ggu s THR 222 N -1.73 0.74 -0.00 2.17 -4.23 -1.26 -0.28 115.64 111.04 1ggu s THR 222 Ca 0.33 -1.57 -0.27 0.00 -1.18 0.00 0.00 61.69 59.00 1ggu s THR 222 Cb -0.11 -1.24 0.06 0.00 1.34 0.00 0.00 72.50 72.55 1ggu s THR 222 CO 0.26 -0.61 0.60 -0.60 -0.54 0.00 0.00 174.62 173.73 1ggu s ARG 223 N -2.77 1.04 0.27 3.99 3.00 -0.89 -4.97 118.95 118.61 1ggu s ARG 223 Ca 0.03 0.03 -0.13 0.00 -1.00 0.00 0.00 55.73 54.66 1ggu s ARG 223 Cb -0.02 0.48 -0.08 0.00 0.00 0.00 0.00 34.95 35.33 1ggu s ARG 223 CO -0.01 -0.35 0.65 -1.12 0.00 0.00 0.00 175.30 174.47 1ggu s SER 224 N -1.53 6.74 -0.03 -2.12 0.01 -1.26 -0.20 113.70 115.31 1ggu s SER 224 Ca -0.09 1.14 0.02 0.00 1.31 0.00 0.00 55.95 58.33 1ggu s SER 224 Cb -0.01 -2.32 0.01 0.00 0.21 0.00 0.00 66.02 63.92 1ggu s SER 224 CO 0.05 -0.12 -0.07 0.86 0.41 0.00 0.00 173.24 174.37 1ggu s TRP 225 N -1.85 0.83 -0.45 2.43 -0.11 -0.73 -4.88 118.94 114.19 1ggu s TRP 225 Ca 0.50 -0.22 -0.24 0.00 1.22 0.00 0.00 56.10 57.36 1ggu s TRP 225 Cb -0.11 -0.64 0.03 0.00 -1.50 0.00 0.00 33.47 31.24 1ggu s TRP 225 CO 0.19 -0.13 0.83 0.45 -4.62 0.00 0.00 176.95 173.67 1ggu s SER 226 N 0.46 6.45 0.01 5.86 0.15 -0.70 0.22 113.70 126.15 1ggu s SER 226 Ca -0.07 -0.02 -0.20 0.00 0.70 0.00 0.00 55.95 56.36 1ggu s SER 226 Cb -0.11 -2.41 -0.20 0.00 -1.71 0.00 0.00 66.02 61.60 1ggu s SER 226 CO 0.01 -0.95 1.17 1.88 1.20 0.00 0.00 173.24 176.55 1ggu h TYR 227 N 8.99 0.52 -6.55 3.44 0.05 -1.56 -1.42 116.97 120.44 1ggu h TYR 227 Ca -0.24 -0.24 -0.51 0.00 0.05 0.00 0.00 58.73 57.78 1ggu h TYR 227 Cb 1.08 -0.08 -0.11 0.00 1.01 0.00 0.00 36.73 38.63 1ggu h TYR 227 CO 0.82 1.00 -0.84 0.41 -1.05 0.00 0.00 178.16 178.50 1ggu n GLY 228 N 0.77 -0.38 0.22 3.88 0.00 -1.10 -4.50 105.19 104.09 1ggu n GLY 228 Ca -0.09 0.15 0.16 0.00 0.00 0.00 0.00 46.02 46.24 1ggu n GLY 228 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1ggu h GLN 229 N -1.74 0.00 -0.02 1.61 -0.00 -1.87 -2.44 115.11 110.65 1ggu h GLN 229 Ca -0.60 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.05 1ggu h GLN 229 Cb 1.38 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.86 1ggu h GLN 229 CO 0.70 0.00 -0.36 1.19 -0.00 0.00 0.00 178.83 180.36 1ggu n PHE 230 N -2.73 0.00 -1.67 0.06 3.72 -1.26 -4.33 117.46 111.25 1ggu n PHE 230 Ca 0.01 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.08 1ggu n PHE 230 Cb 0.24 -0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.84 1ggu n PHE 230 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1ggu s GLU 231 N -2.36 2.66 0.12 -1.08 0.41 -0.92 -0.96 118.70 116.56 1ggu s GLU 231 Ca 0.21 1.43 -0.34 0.00 -0.41 0.00 0.00 54.97 55.86 1ggu s GLU 231 Cb 0.19 -1.93 -0.13 0.00 -1.78 0.00 0.00 34.13 30.48 1ggu s GLU 231 CO 0.50 -1.37 1.66 -3.47 -0.49 0.00 0.00 175.26 172.10 1ggu n ASP 232 N -2.55 3.30 0.00 -0.19 2.03 -1.26 -2.70 116.55 115.19 1ggu n ASP 232 Ca 0.11 1.05 0.00 0.00 0.52 0.00 0.00 54.79 56.47 1ggu n ASP 232 Cb 0.52 -1.44 0.00 0.00 -0.72 0.00 0.00 41.12 39.48 1ggu n ASP 232 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ggu n GLY 233 N 3.69 3.05 0.25 0.27 0.00 -1.26 -4.93 105.19 106.26 1ggu n GLY 233 Ca 0.18 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.11 1ggu n GLY 233 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ggu h ILE 234 N 0.00 1.24 -0.31 -0.61 1.08 -1.81 -2.15 117.51 114.95 1ggu h ILE 234 Ca 0.00 -0.82 0.02 0.00 -0.39 0.00 0.00 64.86 63.66 1ggu h ILE 234 Cb 0.00 0.77 -0.02 0.00 -3.07 0.00 0.00 36.82 34.50 1ggu h ILE 234 CO 0.00 0.30 0.17 0.25 -0.69 0.00 0.00 178.15 178.18 1ggu h LEU 235 N 0.73 0.27 -1.33 1.44 6.46 -1.79 -1.46 115.31 119.64 1ggu h LEU 235 Ca 0.17 0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 57.89 1ggu h LEU 235 Cb 0.30 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.17 1ggu h LEU 235 CO -0.00 0.20 0.02 0.44 -0.62 0.00 0.00 178.44 178.48 1ggu h ASP 236 N 0.36 0.44 -0.05 1.25 3.32 -1.93 -2.56 116.42 117.23 1ggu h ASP 236 Ca 0.13 -0.07 -0.08 0.00 0.02 0.00 0.00 57.03 57.02 1ggu h ASP 236 Cb 0.02 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1ggu h ASP 236 CO -0.07 0.49 -0.21 0.74 -1.72 0.00 0.00 179.24 178.47 1ggu h THR 237 N 0.46 1.25 -0.44 0.35 2.02 -0.62 0.13 112.91 116.06 1ggu h THR 237 Ca 0.10 -1.16 -0.12 0.00 0.77 0.00 0.00 66.41 66.01 1ggu h THR 237 Cb 0.27 1.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 1ggu h THR 237 CO 0.01 0.37 -0.19 0.00 0.37 0.00 0.00 175.52 176.08 1ggu h LEU 239 N 0.76 0.97 -0.62 0.00 4.07 -1.11 -2.58 115.31 116.81 1ggu h LEU 239 Ca 0.11 -0.32 -0.07 0.00 0.08 0.00 0.00 57.88 57.68 1ggu h LEU 239 Cb 0.72 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 42.17 1ggu h LEU 239 CO 0.06 1.09 0.12 0.22 -1.08 0.00 0.00 178.44 178.84 1ggu h TYR 240 N 0.86 1.07 -0.08 1.13 3.20 -0.29 -1.52 116.97 121.34 1ggu h TYR 240 Ca 0.13 -0.14 0.03 0.00 3.14 0.00 0.00 58.73 61.89 1ggu h TYR 240 Cb 0.67 -0.30 -0.03 0.00 1.54 0.00 0.00 36.73 38.62 1ggu h TYR 240 CO 0.04 0.91 -0.09 0.28 -1.64 0.00 0.00 178.16 177.66 1ggu h VAL 241 N 0.92 0.74 -0.53 1.81 2.07 -0.26 0.19 116.25 121.18 1ggu h VAL 241 Ca 0.19 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.72 1ggu h VAL 241 Cb 0.40 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 1ggu h VAL 241 CO 0.01 0.00 0.35 0.24 0.02 0.00 0.00 177.57 178.19 1ggu h MET 242 N -0.12 0.68 -0.43 1.57 2.86 -1.32 -2.14 114.93 116.02 1ggu h MET 242 Ca 0.06 -0.04 -0.14 0.00 -2.06 0.00 0.00 59.70 57.52 1ggu h MET 242 Cb 0.21 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 1ggu h MET 242 CO -0.15 0.45 -0.29 -0.44 1.06 0.00 0.00 176.91 177.53 1ggu h ASP 243 N 0.70 1.00 0.13 1.22 3.32 -0.13 -1.54 116.42 121.12 1ggu h ASP 243 Ca 0.20 -0.43 -0.02 0.00 0.02 0.00 0.00 57.03 56.80 1ggu h ASP 243 Cb -0.05 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.22 1ggu h ASP 243 CO -0.04 1.22 -0.09 0.03 -1.72 0.00 0.00 179.24 178.63 1ggu h ARG 244 N 0.79 0.00 -0.05 3.56 2.47 -0.11 -1.40 114.38 119.63 1ggu h ARG 244 Ca 0.08 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 1ggu h ARG 244 Cb 0.88 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.20 1ggu h ARG 244 CO 0.08 0.09 0.00 0.00 0.56 0.00 0.00 179.97 180.70 1ggu n ALA 245 N -2.44 2.59 -3.98 0.04 0.00 -0.86 -4.93 120.51 110.92 1ggu n ALA 245 Ca -0.03 -0.37 -0.28 0.00 0.00 0.00 0.00 53.44 52.76 1ggu n ALA 245 Cb 0.17 -1.23 -0.01 0.00 0.00 0.00 0.00 19.45 18.38 1ggu n ALA 245 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1ggu n GLN 246 N -0.17 -3.89 -2.39 0.00 6.02 -0.53 -4.87 117.38 111.57 1ggu n GLN 246 Ca 0.18 0.46 -0.43 0.00 -0.01 0.00 0.00 57.00 57.21 1ggu n GLN 246 Cb 0.25 -4.93 -0.02 0.00 1.02 0.00 0.00 30.24 26.56 1ggu n GLN 246 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 1ggu s MET 247 N -6.59 4.10 -0.11 -1.09 1.75 -0.60 -4.84 119.30 111.91 1ggu s MET 247 Ca 0.31 1.55 -0.39 0.00 -1.25 0.00 0.00 55.69 55.91 1ggu s MET 247 Cb -0.16 -3.83 -0.17 0.00 2.84 0.00 0.00 34.83 33.51 1ggu s MET 247 CO 0.88 -0.89 1.49 -3.47 -0.65 0.00 0.00 175.02 172.39 1ggu n ASP 248 N 7.08 1.74 0.17 1.11 2.03 -1.26 -4.50 116.55 122.93 1ggu n ASP 248 Ca 0.15 1.11 0.06 0.00 0.52 0.00 0.00 54.79 56.63 1ggu n ASP 248 Cb 0.45 -1.12 0.56 0.00 -0.72 0.00 0.00 41.12 40.30 1ggu n ASP 248 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1ggu h LEU 249 N 5.49 0.16 0.00 -2.67 3.38 -1.58 -0.87 115.31 119.22 1ggu h LEU 249 Ca -0.47 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1ggu h LEU 249 Cb 1.34 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1ggu h LEU 249 CO 0.85 0.12 0.00 -1.54 0.09 0.00 0.00 178.44 177.97 1ggu n SER 250 N -4.51 0.00 -0.20 -0.43 3.41 -1.26 -2.35 113.62 108.29 1ggu n SER 250 Ca -0.01 -1.58 0.05 0.00 -0.26 0.00 0.00 58.87 57.07 1ggu n SER 250 Cb 0.08 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.03 1ggu n SER 250 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ggu n GLY 251 N 0.51 -0.11 0.00 5.00 0.00 -0.34 -4.48 105.19 105.76 1ggu n GLY 251 Ca 0.05 -0.29 0.13 0.00 0.00 0.00 0.00 46.02 45.91 1ggu n GLY 251 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ggu n ARG 252 N -0.40 0.40 0.02 1.61 1.74 -0.99 -1.97 116.66 117.06 1ggu n ARG 252 Ca 0.04 0.04 0.12 0.00 -0.77 0.00 0.00 57.85 57.27 1ggu n ARG 252 Cb 0.21 -1.50 0.16 0.00 -1.02 0.00 0.00 32.46 30.31 1ggu n ARG 252 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ggu n GLY 253 N 0.93 -1.28 3.52 -0.13 0.00 -1.26 -2.46 105.19 104.51 1ggu n GLY 253 Ca 0.13 -0.34 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 1ggu n GLY 253 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ggu s ASN 254 N -3.55 6.34 0.53 1.61 3.84 -0.83 -4.83 114.94 118.04 1ggu s ASN 254 Ca 0.08 -0.33 0.30 0.00 0.21 0.00 0.00 52.86 53.12 1ggu s ASN 254 Cb 0.16 -2.35 1.43 0.00 -0.55 0.00 0.00 41.25 39.94 1ggu s ASN 254 CO 0.74 -0.87 2.04 1.55 -2.79 0.00 0.00 177.10 177.76 1ggu h PRO 255 N 8.96 0.00 -0.31 0.43 0.13 -1.88 0.04 132.00 139.37 1ggu h PRO 255 Ca -0.25 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.76 1ggu h PRO 255 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 1ggu h PRO 255 CO 0.94 0.11 -0.24 0.82 -0.23 0.00 0.00 178.00 179.39 1ggu h ILE 256 N 0.00 1.30 -0.23 -3.56 2.04 -1.92 -1.70 117.51 113.43 1ggu h ILE 256 Ca -0.00 -1.39 -0.17 0.00 1.00 0.00 0.00 64.86 64.30 1ggu h ILE 256 Cb 0.42 1.50 -0.00 0.00 -0.74 0.00 0.00 36.82 38.00 1ggu h ILE 256 CO 0.01 0.45 -0.55 0.50 0.00 0.00 0.00 178.15 178.57 1ggu h LYS 257 N 0.48 0.70 -0.46 2.37 3.64 -1.47 -1.71 116.57 120.13 1ggu h LYS 257 Ca 0.06 -0.44 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 1ggu h LYS 257 Cb 0.80 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.65 1ggu h LYS 257 CO 0.06 1.06 0.29 0.28 -2.27 0.00 0.00 179.45 178.88 1ggu h VAL 258 N 0.54 1.13 -0.36 2.00 2.07 -1.00 -0.20 116.25 120.44 1ggu h VAL 258 Ca 0.01 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.22 1ggu h VAL 258 Cb 1.12 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 1ggu h VAL 258 CO 0.11 0.13 0.13 0.28 0.02 0.00 0.00 177.57 178.25 1ggu h SER 259 N 0.61 0.50 -0.53 0.57 0.02 -1.28 0.43 113.55 113.87 1ggu h SER 259 Ca 0.17 -0.18 0.01 0.00 -0.84 0.00 0.00 61.79 60.95 1ggu h SER 259 Cb -0.03 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.35 1ggu h SER 259 CO -0.03 0.54 0.34 -0.09 -1.14 0.00 0.00 176.83 176.45 1ggu h ARG 260 N 0.43 0.67 0.21 3.45 9.65 -0.92 -2.03 114.38 125.84 1ggu h ARG 260 Ca 0.12 -0.04 -0.32 0.00 -1.10 0.00 0.00 59.98 58.64 1ggu h ARG 260 Cb 0.20 -0.15 0.03 0.00 -1.39 0.00 0.00 29.97 28.66 1ggu h ARG 260 CO -0.01 0.45 -1.46 0.28 2.80 0.00 0.00 179.97 182.03 1ggu h VAL 261 N 0.69 1.20 -0.45 0.20 2.07 -1.05 -3.22 116.25 115.68 1ggu h VAL 261 Ca 0.20 -2.60 -0.01 0.00 0.82 0.00 0.00 66.70 65.11 1ggu h VAL 261 Cb -0.06 2.97 -0.02 0.00 -1.52 0.00 0.00 31.29 32.66 1ggu h VAL 261 CO -0.06 0.80 0.25 1.23 0.02 0.00 0.00 177.57 179.81 1ggu h GLY 262 N 0.21 0.68 1.43 2.17 0.00 -0.13 -2.68 103.07 104.75 1ggu h GLY 262 Ca -0.27 -0.31 -0.07 0.00 0.00 0.00 0.00 47.33 46.68 1ggu h GLY 262 CO 0.22 0.30 -0.04 1.48 0.00 0.00 0.00 176.54 178.50 1ggu h SER 263 N 0.59 0.67 0.45 0.19 4.64 -1.52 -0.41 113.55 118.17 1ggu h SER 263 Ca 0.16 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ggu h SER 263 Cb 0.06 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 61.97 1ggu h SER 263 CO -0.03 0.76 0.00 0.00 -0.87 0.00 0.00 176.83 176.70 1ggu h ALA 264 N 1.31 1.00 0.00 5.18 0.00 -1.51 -2.44 119.26 122.79 1ggu h ALA 264 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ggu h ALA 264 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1ggu h ALA 264 CO 0.02 0.00 -0.69 -1.33 0.00 0.00 0.00 179.25 177.26 1ggu n MET 265 N -2.96 0.27 -0.06 0.00 2.81 -0.18 -4.26 117.12 112.75 1ggu n MET 265 Ca -0.01 0.07 -0.12 0.00 -1.81 0.00 0.00 57.70 55.83 1ggu n MET 265 Cb 0.17 -1.66 -0.06 0.00 -0.71 0.00 0.00 33.22 30.96 1ggu n MET 265 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1ggu h VAL 266 N 0.00 1.26 -3.37 2.03 2.07 -1.28 0.11 116.25 117.06 1ggu h VAL 266 Ca 0.00 -0.87 -0.58 0.00 0.82 0.00 0.00 66.70 66.07 1ggu h VAL 266 Cb 0.73 1.49 -0.09 0.00 -1.52 0.00 0.00 31.29 31.90 1ggu h VAL 266 CO 0.00 0.26 -0.08 0.21 0.02 0.00 0.00 177.57 177.98 1ggu s ASN 267 N -5.82 6.67 -0.29 0.57 3.84 -1.26 -0.96 114.94 117.69 1ggu s ASN 267 Ca -0.14 0.80 -0.27 0.00 0.21 0.00 0.00 52.86 53.46 1ggu s ASN 267 Cb 0.06 -2.30 0.01 0.00 -0.55 0.00 0.00 41.25 38.47 1ggu s ASN 267 CO 0.72 -0.07 0.98 0.00 -2.79 0.00 0.00 177.10 175.94 1ggu s ALA 268 N 0.99 3.57 -0.36 1.71 0.00 0.38 -4.69 121.76 123.35 1ggu s ALA 268 Ca 0.26 -0.08 -0.11 0.00 0.00 0.00 0.00 51.96 52.03 1ggu s ALA 268 Cb -0.15 -3.52 0.02 0.00 0.00 0.00 0.00 23.12 19.46 1ggu s ALA 268 CO 0.11 -1.26 0.21 0.15 0.00 0.00 0.00 175.76 174.97 1ggu s LYS 269 N 3.30 2.98 7.96 0.00 1.02 -0.40 -4.67 119.74 129.94 1ggu s LYS 269 Ca 0.41 -0.98 0.00 0.00 0.02 0.00 0.00 55.97 55.42 1ggu s LYS 269 Cb -0.14 -3.72 0.00 0.00 -0.52 0.00 0.00 37.83 33.45 1ggu s LYS 269 CO 0.11 -0.63 0.00 -0.25 -0.92 0.00 0.00 175.35 173.66 1ggu n ASP 270 N 5.01 0.00 -1.52 2.83 8.00 -1.26 -2.61 116.55 127.00 1ggu n ASP 270 Ca -0.12 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.24 1ggu n ASP 270 Cb 0.47 0.00 0.12 0.00 -0.02 0.00 0.00 41.12 41.69 1ggu n ASP 270 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1ggu n ASP 271 N 9.05 3.85 -3.89 -2.24 9.92 -1.26 -4.91 116.55 127.06 1ggu n ASP 271 Ca 0.00 -3.80 -0.21 0.00 -0.53 0.00 0.00 54.79 50.25 1ggu n ASP 271 Cb 0.00 -0.53 -0.17 0.00 -0.64 0.00 0.00 41.12 39.78 1ggu n ASP 271 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1ggu s GLU 272 N -3.45 0.88 0.00 -1.24 0.41 -1.07 -4.71 118.70 109.51 1ggu s GLU 272 Ca 0.48 -0.10 0.00 0.00 -0.41 0.00 0.00 54.97 54.94 1ggu s GLU 272 Cb 0.41 -0.92 0.00 0.00 -1.78 0.00 0.00 34.13 31.84 1ggu s GLU 272 CO -0.00 -0.11 0.00 0.41 -0.49 0.00 0.00 175.26 175.07 1ggu n GLY 273 N 4.20 3.90 0.13 -1.39 0.00 -1.26 -1.27 105.19 109.51 1ggu n GLY 273 Ca -0.22 -1.65 -0.17 0.00 0.00 0.00 0.00 46.02 43.98 1ggu n GLY 273 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ggu h VAL 274 N 1.21 1.46 -4.22 1.61 2.07 -0.68 -3.32 116.25 114.38 1ggu h VAL 274 Ca 0.00 -2.10 -0.51 0.00 0.82 0.00 0.00 66.70 64.90 1ggu h VAL 274 Cb 0.00 2.69 -0.29 0.00 -1.52 0.00 0.00 31.29 32.16 1ggu h VAL 274 CO 0.00 0.60 -0.82 -0.76 0.02 0.00 0.00 177.57 176.61 1ggu s LEU 275 N -8.32 2.01 -0.28 2.57 1.43 -0.14 0.10 118.68 116.06 1ggu s LEU 275 Ca -0.14 -0.28 -0.21 0.00 -1.03 0.00 0.00 54.13 52.47 1ggu s LEU 275 Cb 0.03 -0.81 -0.01 0.00 0.03 0.00 0.00 46.19 45.42 1ggu s LEU 275 CO 0.81 0.18 0.64 -0.69 0.23 0.00 0.00 176.35 177.53 1ggu s VAL 276 N -0.31 4.95 0.28 -1.59 1.01 0.09 0.14 120.40 124.97 1ggu s VAL 276 Ca 0.05 1.03 -0.24 0.00 0.00 0.00 0.00 61.98 62.81 1ggu s VAL 276 Cb -0.07 -3.98 -0.09 0.00 0.00 0.00 0.00 36.38 32.24 1ggu s VAL 276 CO -0.00 -0.06 0.87 -0.83 0.00 0.00 0.00 175.10 175.07 1ggu s GLY 277 N 1.55 2.77 -0.21 4.51 0.00 -1.26 -1.09 107.32 113.59 1ggu s GLY 277 Ca 0.26 0.41 -0.18 0.00 0.00 0.00 0.00 44.72 45.22 1ggu s GLY 277 CO 0.10 0.84 0.54 -0.45 0.00 0.00 0.00 173.10 174.14 1ggu s SER 278 N -1.57 -0.59 -0.30 1.64 0.15 -0.73 -4.85 113.70 107.44 1ggu s SER 278 Ca 0.47 1.11 0.13 0.00 0.70 0.00 0.00 55.95 58.36 1ggu s SER 278 Cb -0.19 1.10 0.47 0.00 -1.71 0.00 0.00 66.02 65.70 1ggu s SER 278 CO 0.24 -0.19 1.14 0.79 1.20 0.00 0.00 173.24 176.41 1ggu n TRP 279 N 3.07 2.21 -0.28 3.44 8.01 -1.26 -4.67 117.44 127.95 1ggu n TRP 279 Ca -0.15 -2.32 0.11 0.00 -1.31 0.00 0.00 57.50 53.82 1ggu n TRP 279 Cb 0.56 -0.28 0.32 0.00 -2.01 0.00 0.00 31.31 29.90 1ggu n TRP 279 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.69 176.28 1ggu n ASP 280 N -0.61 3.94 0.00 -0.99 5.68 -1.26 -4.98 116.55 118.34 1ggu n ASP 280 Ca 0.29 -2.12 0.00 0.00 -0.50 0.00 0.00 54.79 52.46 1ggu n ASP 280 Cb 0.87 -0.49 0.00 0.00 -1.14 0.00 0.00 41.12 40.36 1ggu n ASP 280 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1ggu n ASN 281 N 1.41 -0.74 -0.03 -1.12 5.15 -1.26 -4.68 115.26 113.99 1ggu n ASN 281 Ca 0.24 0.00 -0.06 0.00 -0.60 0.00 0.00 54.58 54.16 1ggu n ASN 281 Cb 0.66 -2.59 -0.02 0.00 -0.53 0.00 0.00 39.78 37.30 1ggu n ASN 281 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1ggu n ILE 282 N -1.96 0.33 -3.73 -1.44 5.41 -1.26 -4.93 119.36 111.79 1ggu n ILE 282 Ca 0.00 -0.09 -0.23 0.00 1.00 0.00 0.00 62.75 63.43 1ggu n ILE 282 Cb 0.06 -1.37 0.02 0.00 -0.71 0.00 0.00 39.64 37.65 1ggu n ILE 282 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 1ggu n TYR 283 N -3.12 -1.88 -0.32 1.39 4.01 -1.26 -4.93 117.16 111.04 1ggu n TYR 283 Ca -0.12 0.79 0.12 0.00 -0.16 0.00 0.00 57.90 58.53 1ggu n TYR 283 Cb 0.59 -4.17 0.26 0.00 -0.31 0.00 0.00 39.34 35.70 1ggu n TYR 283 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ggu h ALA 284 N 0.82 1.07 -0.51 -0.72 0.00 -1.98 -2.97 119.26 114.98 1ggu h ALA 284 Ca -0.62 0.31 -0.37 0.00 0.00 0.00 0.00 54.91 54.23 1ggu h ALA 284 Cb 1.36 0.54 -0.33 0.00 0.00 0.00 0.00 17.79 19.36 1ggu h ALA 284 CO 0.56 -0.52 -0.81 0.66 0.00 0.00 0.00 179.25 179.14 1ggu n TYR 285 N -5.44 1.81 -2.36 0.00 4.01 -1.26 -5.05 117.16 108.87 1ggu n TYR 285 Ca 0.21 -1.97 0.00 0.00 -0.16 0.00 0.00 57.90 55.98 1ggu n TYR 285 Cb 0.68 -0.30 0.00 0.00 -0.31 0.00 0.00 39.34 39.41 1ggu n TYR 285 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ggu n GLY 286 N -0.72 3.84 3.55 2.72 0.00 -1.12 -4.95 105.19 108.51 1ggu n GLY 286 Ca 0.31 -1.00 -0.34 0.00 0.00 0.00 0.00 46.02 44.99 1ggu n GLY 286 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ggu s VAL 287 N -2.22 4.03 0.29 1.61 1.01 -0.23 -4.91 120.40 119.99 1ggu s VAL 287 Ca 0.00 -0.32 -0.30 0.00 0.00 0.00 0.00 61.98 61.36 1ggu s VAL 287 Cb 0.00 -2.75 -0.11 0.00 0.00 0.00 0.00 36.38 33.53 1ggu s VAL 287 CO 0.00 0.52 1.49 -2.84 0.00 0.00 0.00 175.10 174.27 1ggu s PRO 288 N 0.04 4.20 0.60 2.72 0.02 -1.26 -1.76 135.00 139.55 1ggu s PRO 288 Ca 0.01 2.44 0.28 0.00 0.02 0.00 0.00 61.00 63.75 1ggu s PRO 288 Cb -0.13 -3.05 1.31 0.00 0.02 0.00 0.00 34.50 32.65 1ggu s PRO 288 CO 0.02 -0.49 1.71 -1.35 -0.33 0.00 0.00 177.00 176.56 1ggu h PRO 289 N 4.48 0.00 0.00 5.54 0.11 -1.90 0.39 132.00 140.62 1ggu h PRO 289 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1ggu h PRO 289 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1ggu h PRO 289 CO 0.75 0.00 0.00 0.77 -0.21 0.00 0.00 178.00 179.31 1ggu h SER 290 N 0.00 0.00 0.19 -2.05 0.02 -1.89 -3.31 113.55 106.51 1ggu h SER 290 Ca 0.28 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.96 1ggu h SER 290 Cb 1.69 0.00 0.02 0.00 0.14 0.00 0.00 62.40 64.25 1ggu h SER 290 CO -0.00 0.00 -1.15 0.00 -1.14 0.00 0.00 176.83 174.54 1ggu h ALA 291 N 2.18 0.10 -2.26 3.77 0.00 -0.56 -3.42 119.26 119.07 1ggu h ALA 291 Ca 0.00 -0.76 -0.59 0.00 0.00 0.00 0.00 54.91 53.57 1ggu h ALA 291 Cb 0.86 0.07 0.10 0.00 0.00 0.00 0.00 17.79 18.82 1ggu h ALA 291 CO 0.00 0.74 0.38 0.91 0.00 0.00 0.00 179.25 181.28 1ggu n TRP 292 N -3.77 1.85 0.26 0.00 7.02 -1.24 -4.76 117.44 116.81 1ggu n TRP 292 Ca -0.11 0.59 0.07 0.00 -1.02 0.00 0.00 57.50 57.03 1ggu n TRP 292 Cb 0.94 -2.36 -0.10 0.00 -2.42 0.00 0.00 31.31 27.37 1ggu n TRP 292 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 1ggu n THR 293 N 0.61 0.00 -3.94 -0.99 -2.24 -1.26 -5.01 114.28 101.45 1ggu n THR 293 Ca 0.08 -0.27 0.01 0.00 -2.27 0.00 0.00 64.05 61.61 1ggu n THR 293 Cb 0.33 0.50 0.01 0.00 -2.10 0.00 0.00 70.33 69.07 1ggu n THR 293 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ggu n GLY 294 N 1.54 0.39 0.17 3.38 0.00 -1.26 -1.72 105.19 107.68 1ggu n GLY 294 Ca -0.01 -1.03 0.10 0.00 0.00 0.00 0.00 46.02 45.08 1ggu n GLY 294 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ggu h SER 295 N 1.63 0.00 0.23 1.61 0.02 -1.49 -3.40 113.55 112.15 1ggu h SER 295 Ca -0.19 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.76 1ggu h SER 295 Cb 0.97 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.49 1ggu h SER 295 CO 0.26 0.08 -0.30 0.58 -1.14 0.00 0.00 176.83 176.32 1ggu h VAL 296 N 0.00 0.00 0.00 2.27 2.07 -1.79 -0.30 116.25 118.50 1ggu h VAL 296 Ca -0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1ggu h VAL 296 Cb 1.07 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1ggu h VAL 296 CO 0.01 0.00 -0.03 -2.24 0.02 0.00 0.00 177.57 175.32 1ggu h ASP 297 N -0.55 0.00 -0.12 0.57 2.03 -1.95 -1.80 116.42 114.60 1ggu h ASP 297 Ca -0.03 0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 56.16 1ggu h ASP 297 Cb 0.49 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.00 1ggu h ASP 297 CO -0.07 0.03 -0.36 0.40 -1.03 0.00 0.00 179.24 178.21 1ggu h ILE 298 N 0.00 1.38 -0.22 4.15 2.04 -1.71 -2.03 117.51 121.12 1ggu h ILE 298 Ca -0.00 -1.67 -0.15 0.00 1.00 0.00 0.00 64.86 64.04 1ggu h ILE 298 Cb 0.08 2.12 -0.01 0.00 -0.74 0.00 0.00 36.82 38.27 1ggu h ILE 298 CO 0.00 0.50 -0.48 -0.07 0.00 0.00 0.00 178.15 178.10 1ggu h LEU 299 N 0.04 0.62 -0.78 1.44 3.38 -0.71 -1.70 115.31 117.60 1ggu h LEU 299 Ca -0.01 -0.30 -0.13 0.00 0.09 0.00 0.00 57.88 57.53 1ggu h LEU 299 Cb 0.98 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1ggu h LEU 299 CO 0.08 1.00 -0.48 -0.07 0.09 0.00 0.00 178.44 179.05 1ggu h LEU 300 N 0.45 0.33 0.07 1.67 3.38 -1.38 -1.73 115.31 118.10 1ggu h LEU 300 Ca 0.02 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 1ggu h LEU 300 Cb 1.00 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1ggu h LEU 300 CO 0.09 0.76 -0.03 -0.33 0.09 0.00 0.00 178.44 179.02 1ggu h GLU 301 N 0.25 -0.09 -0.73 1.13 4.39 -1.26 -0.27 114.58 117.99 1ggu h GLU 301 Ca 0.01 0.01 0.14 0.00 0.34 0.00 0.00 59.36 59.86 1ggu h GLU 301 Cb 0.94 0.02 -0.10 0.00 -0.10 0.00 0.00 28.75 29.52 1ggu h GLU 301 CO 0.08 0.30 0.26 -0.92 -1.16 0.00 0.00 179.01 177.57 1ggu h TYR 302 N -0.50 0.44 -0.42 4.33 3.20 -1.25 -1.25 116.97 121.52 1ggu h TYR 302 Ca -0.01 0.04 -0.08 0.00 3.14 0.00 0.00 58.73 61.81 1ggu h TYR 302 Cb 0.43 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 1ggu h TYR 302 CO 0.06 0.02 -0.06 -0.09 -1.64 0.00 0.00 178.16 176.45 1ggu h ARG 303 N 0.39 0.78 0.47 1.82 9.65 -1.04 0.33 114.38 126.77 1ggu h ARG 303 Ca 0.41 -0.28 -0.02 0.00 -1.10 0.00 0.00 59.98 58.98 1ggu h ARG 303 Cb 0.63 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.16 1ggu h ARG 303 CO -0.42 0.89 -0.22 0.77 2.80 0.00 0.00 179.97 183.78 1ggu h SER 304 N 0.60 -0.53 0.29 -3.80 0.02 -0.75 -3.29 113.55 106.09 1ggu h SER 304 Ca 0.11 0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 61.03 1ggu h SER 304 Cb 0.58 0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.25 1ggu h SER 304 CO 0.03 -0.30 -0.25 0.77 -1.14 0.00 0.00 176.83 175.95 1ggu h SER 305 N -0.79 0.00 -0.87 3.07 4.64 -1.33 -3.47 113.55 114.81 1ggu h SER 305 Ca -0.06 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 60.97 1ggu h SER 305 Cb 0.48 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.47 1ggu h SER 305 CO 0.11 0.25 -0.27 -0.62 -0.87 0.00 0.00 176.83 175.42 1ggu n GLU 306 N -4.12 -0.99 -4.28 4.77 1.02 0.12 -4.97 120.64 112.19 1ggu n GLU 306 Ca -0.02 0.94 -0.15 0.00 -0.02 0.00 0.00 57.16 57.91 1ggu n GLU 306 Cb 0.31 -5.06 -0.10 0.00 -0.02 0.00 0.00 31.44 26.57 1ggu n GLU 306 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1ggu s ASN 307 N -2.78 1.28 0.66 1.62 0.01 -1.22 -5.02 114.94 109.48 1ggu s ASN 307 Ca 0.00 -1.25 -0.17 0.00 -0.71 0.00 0.00 52.86 50.72 1ggu s ASN 307 Cb 0.00 0.12 -0.01 0.00 0.41 0.00 0.00 41.25 41.77 1ggu s ASN 307 CO 0.00 -0.62 1.17 -2.65 -1.51 0.00 0.00 177.10 173.49 1ggu n PRO 308 N -0.34 0.92 -3.93 -0.60 -0.02 -1.25 -4.42 135.00 125.36 1ggu n PRO 308 Ca -0.04 0.37 -0.36 0.00 -2.02 0.00 0.00 63.50 61.45 1ggu n PRO 308 Cb 0.64 -2.40 -0.08 0.00 -0.02 0.00 0.00 33.50 31.64 1ggu n PRO 308 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ggu s VAL 309 N -1.52 5.16 -0.21 -1.45 1.01 0.12 -4.88 120.40 118.62 1ggu s VAL 309 Ca 0.80 0.09 -0.06 0.00 0.00 0.00 0.00 61.98 62.81 1ggu s VAL 309 Cb -0.38 -3.29 -0.03 0.00 0.00 0.00 0.00 36.38 32.69 1ggu s VAL 309 CO 0.44 0.53 0.02 -0.13 0.00 0.00 0.00 175.10 175.95 1ggu s ARG 310 N -0.29 3.64 0.27 2.72 0.52 -1.26 -0.73 118.95 123.82 1ggu s ARG 310 Ca 0.10 -0.51 0.03 0.00 -0.52 0.00 0.00 55.73 54.84 1ggu s ARG 310 Cb -0.12 -3.13 -0.03 0.00 0.52 0.00 0.00 34.95 32.19 1ggu s ARG 310 CO 0.01 -0.02 0.23 0.71 0.02 0.00 0.00 175.30 176.24 1ggu s TYR 311 N 1.11 1.47 0.22 -0.53 2.02 -0.72 -1.07 117.35 119.85 1ggu s TYR 311 Ca 0.03 -1.52 0.01 0.00 -0.37 0.00 0.00 57.07 55.22 1ggu s TYR 311 Cb -0.14 -0.62 -0.05 0.00 -0.40 0.00 0.00 41.96 40.75 1ggu s TYR 311 CO 0.02 -0.79 0.07 0.20 -1.57 0.00 0.00 175.55 173.48 1ggu s GLY 312 N -3.28 1.53 0.16 0.71 0.00 -0.25 -3.83 107.32 102.36 1ggu s GLY 312 Ca 0.40 -1.76 0.03 0.00 0.00 0.00 0.00 44.72 43.39 1ggu s GLY 312 CO 0.21 -1.55 0.11 -1.06 0.00 0.00 0.00 173.10 170.80 1ggu n GLN 313 N -0.37 0.36 -0.20 2.90 6.02 -1.26 -1.78 117.38 123.05 1ggu n GLN 313 Ca -0.02 -1.50 0.00 0.00 -0.01 0.00 0.00 57.00 55.47 1ggu n GLN 313 Cb 0.65 1.10 0.11 0.00 1.02 0.00 0.00 30.24 33.13 1ggu n GLN 313 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ggu h TRP 315 N 0.37 0.00 0.04 0.00 0.09 -1.98 -1.23 115.95 113.23 1ggu h TRP 315 Ca 0.31 0.00 -0.13 0.00 0.09 0.00 0.00 58.89 59.16 1ggu h TRP 315 Cb 0.41 0.00 0.01 0.00 0.08 0.00 0.00 29.16 29.66 1ggu h TRP 315 CO -0.19 0.21 -0.54 0.28 0.09 0.00 0.00 178.44 178.29 1ggu h VAL 316 N 0.00 1.50 -0.64 0.12 2.07 -1.65 -0.75 116.25 116.91 1ggu h VAL 316 Ca -0.00 -2.18 0.04 0.00 0.82 0.00 0.00 66.70 65.38 1ggu h VAL 316 Cb 0.65 2.83 -0.05 0.00 -1.52 0.00 0.00 31.29 33.20 1ggu h VAL 316 CO 0.03 0.62 0.37 -0.26 0.02 0.00 0.00 177.57 178.35 1ggu h PHE 317 N -0.31 0.69 -0.47 1.57 0.04 -1.16 -1.49 116.94 115.82 1ggu h PHE 317 Ca -0.08 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.67 1ggu h PHE 317 Cb 1.31 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 39.22 1ggu h PHE 317 CO 0.17 0.37 0.09 0.00 -0.60 0.00 0.00 178.31 178.34 1ggu h ALA 318 N 1.30 1.29 0.06 2.45 0.00 -1.22 -1.04 119.26 122.10 1ggu h ALA 318 Ca 0.27 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1ggu h ALA 318 Cb 0.10 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1ggu h ALA 318 CO -0.14 0.50 -0.03 0.78 0.00 0.00 0.00 179.25 180.36 1ggu h GLY 319 N 0.91 -0.08 1.15 0.00 0.00 -0.39 -1.25 103.07 103.40 1ggu h GLY 319 Ca 0.15 0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1ggu h GLY 319 CO 0.00 -0.03 0.55 -2.08 0.00 0.00 0.00 176.54 174.99 1ggu h VAL 320 N -0.53 1.23 -0.20 4.60 2.07 -1.23 -2.52 116.25 119.68 1ggu h VAL 320 Ca -0.01 -0.44 -0.13 0.00 0.82 0.00 0.00 66.70 66.94 1ggu h VAL 320 Cb 0.47 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 1ggu h VAL 320 CO 0.01 0.22 -0.43 0.15 0.02 0.00 0.00 177.57 177.54 1ggu h PHE 321 N 1.17 0.58 -0.67 1.57 3.57 -1.13 -2.13 116.94 119.90 1ggu h PHE 321 Ca 0.31 -0.17 -0.08 0.00 3.53 0.00 0.00 57.97 61.56 1ggu h PHE 321 Cb -0.11 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.48 1ggu h PHE 321 CO 0.00 0.84 0.10 -0.97 -2.23 0.00 0.00 178.31 176.04 1ggu h ASN 322 N 0.39 1.07 -0.22 0.41 -1.24 -1.01 0.56 115.58 115.55 1ggu h ASN 322 Ca 0.03 -0.26 -0.00 0.00 0.71 0.00 0.00 56.30 56.78 1ggu h ASN 322 Cb 0.92 -0.29 -0.01 0.00 0.73 0.00 0.00 38.32 39.68 1ggu h ASN 322 CO 0.08 1.07 0.14 0.74 -1.29 0.00 0.00 177.43 178.16 1ggu h THR 323 N 1.04 1.08 -0.20 -3.57 2.02 -1.23 0.47 112.91 112.52 1ggu h THR 323 Ca 0.20 -0.17 0.05 0.00 0.77 0.00 0.00 66.41 67.26 1ggu h THR 323 Cb 0.46 0.80 -0.05 0.00 -1.74 0.00 0.00 68.15 67.62 1ggu h THR 323 CO 0.02 0.07 -0.13 0.15 0.37 0.00 0.00 175.52 176.00 1ggu h PHE 324 N 0.27 -0.32 0.50 3.16 3.57 -0.91 0.15 116.94 123.37 1ggu h PHE 324 Ca 0.08 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 1ggu h PHE 324 Cb 0.00 0.17 0.00 0.00 2.79 0.00 0.00 35.95 38.92 1ggu h PHE 324 CO -0.05 -0.19 -0.24 -0.07 -2.23 0.00 0.00 178.31 175.52 1ggu h LEU 325 N -0.12 -0.57 -1.94 0.59 3.38 -0.58 -2.54 115.31 113.52 1ggu h LEU 325 Ca 0.11 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1ggu h LEU 325 Cb 0.29 0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 1ggu h LEU 325 CO -0.27 -0.30 -0.06 0.03 0.09 0.00 0.00 178.44 177.93 1ggu h ARG 326 N -0.84 0.00 -0.23 1.13 3.08 -0.85 -0.57 114.38 116.10 1ggu h ARG 326 Ca -0.07 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.85 1ggu h ARG 326 Cb 0.59 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 1ggu h ARG 326 CO 0.11 0.06 -0.41 0.00 -1.07 0.00 0.00 179.97 178.67 1ggu h LEU 328 N 0.45 0.00 0.00 0.00 3.38 -1.13 -3.47 115.31 114.54 1ggu h LEU 328 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1ggu h LEU 328 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1ggu h LEU 328 CO 0.08 0.21 0.00 0.61 0.09 0.00 0.00 178.44 179.43 1ggu n GLY 329 N 1.17 1.48 3.61 0.83 0.00 -0.86 -1.30 105.19 110.12 1ggu n GLY 329 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 1ggu n GLY 329 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ggu s ILE 330 N -2.00 5.16 0.34 -0.61 1.01 -0.28 -4.22 121.20 120.60 1ggu s ILE 330 Ca 0.00 0.62 -0.29 0.00 0.00 0.00 0.00 60.65 60.99 1ggu s ILE 330 Cb 0.00 -3.72 -0.12 0.00 0.01 0.00 0.00 42.46 38.63 1ggu s ILE 330 CO 0.00 0.15 1.43 -2.65 0.00 0.00 0.00 174.94 173.88 1ggu n PRO 331 N 5.30 2.44 -3.62 2.79 -0.02 -1.26 -3.22 135.00 137.40 1ggu n PRO 331 Ca -0.08 0.86 -0.11 0.00 -2.02 0.00 0.00 63.50 62.15 1ggu n PRO 331 Cb 0.51 -2.54 -0.05 0.00 -0.02 0.00 0.00 33.50 31.40 1ggu n PRO 331 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ggu s ALA 332 N -0.83 -1.00 0.11 3.55 0.00 -0.76 -1.28 121.76 121.55 1ggu s ALA 332 Ca 0.57 0.09 -0.16 0.00 0.00 0.00 0.00 51.96 52.46 1ggu s ALA 332 Cb -0.53 0.62 0.03 0.00 0.00 0.00 0.00 23.12 23.24 1ggu s ALA 332 CO 0.60 -0.61 0.38 -0.98 0.00 0.00 0.00 175.76 175.16 1ggu s ARG 333 N -3.46 1.02 -0.13 0.00 1.70 -0.47 -4.58 118.95 113.03 1ggu s ARG 333 Ca 0.01 -0.66 -0.06 0.00 -0.47 0.00 0.00 55.73 54.55 1ggu s ARG 333 Cb 0.01 0.45 -0.04 0.00 -0.57 0.00 0.00 34.95 34.80 1ggu s ARG 333 CO -0.10 -0.38 0.09 0.42 -1.08 0.00 0.00 175.30 174.25 1ggu s ILE 334 N -3.54 5.03 0.06 4.99 1.01 -1.26 -0.71 121.20 126.78 1ggu s ILE 334 Ca 0.01 0.03 0.09 0.00 0.00 0.00 0.00 60.65 60.79 1ggu s ILE 334 Cb 0.02 -3.19 -0.03 0.00 0.01 0.00 0.00 42.46 39.26 1ggu s ILE 334 CO -0.10 0.57 -0.24 0.68 0.00 0.00 0.00 174.94 175.85 1ggu s VAL 335 N -0.61 2.36 -0.17 2.92 -7.23 -0.17 -4.50 120.40 113.00 1ggu s VAL 335 Ca 0.12 -1.39 -0.00 0.00 -1.81 0.00 0.00 61.98 58.90 1ggu s VAL 335 Cb -0.12 -1.97 0.00 0.00 0.56 0.00 0.00 36.38 34.86 1ggu s VAL 335 CO 0.02 0.31 -0.15 -0.89 -0.31 0.00 0.00 175.10 174.09 1ggu s THR 336 N -0.88 2.65 -0.23 5.32 2.01 0.60 -2.18 115.64 122.92 1ggu s THR 336 Ca 0.13 -0.77 -0.09 0.00 0.31 0.00 0.00 61.69 61.28 1ggu s THR 336 Cb -0.10 -2.13 -0.04 0.00 0.01 0.00 0.00 72.50 70.24 1ggu s THR 336 CO 0.04 0.51 0.10 0.21 -0.69 0.00 0.00 174.62 174.79 1ggu s ASN 337 N 0.97 5.63 -0.11 3.53 2.47 -0.11 -0.52 114.94 126.81 1ggu s ASN 337 Ca -0.02 -0.02 -0.18 0.00 0.42 0.00 0.00 52.86 53.06 1ggu s ASN 337 Cb -0.15 -2.00 -0.04 0.00 -1.45 0.00 0.00 41.25 37.61 1ggu s ASN 337 CO -0.03 0.05 0.49 -0.31 -3.72 0.00 0.00 177.10 173.59 1ggu s TYR 338 N 1.12 3.53 -0.33 0.43 2.02 0.70 -0.97 117.35 123.85 1ggu s TYR 338 Ca 0.05 0.93 -0.12 0.00 -0.37 0.00 0.00 57.07 57.56 1ggu s TYR 338 Cb -0.14 -2.56 0.02 0.00 -0.40 0.00 0.00 41.96 38.88 1ggu s TYR 338 CO 0.04 0.19 0.46 1.19 -1.57 0.00 0.00 175.55 175.86 1ggu n PHE 339 N 3.58 -2.69 -3.66 2.71 3.72 0.53 -2.75 117.46 118.90 1ggu n PHE 339 Ca -0.07 1.08 -0.36 0.00 -0.05 0.00 0.00 57.45 58.06 1ggu n PHE 339 Cb 0.52 -3.50 -0.08 0.00 -0.94 0.00 0.00 39.48 35.47 1ggu n PHE 339 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1ggu s SER 340 N -2.24 6.21 -1.08 4.37 0.15 0.39 -0.68 113.70 120.81 1ggu s SER 340 Ca 0.19 0.23 -0.15 0.00 0.70 0.00 0.00 55.95 56.92 1ggu s SER 340 Cb -0.05 -2.11 0.17 0.00 -1.71 0.00 0.00 66.02 62.32 1ggu s SER 340 CO 0.59 0.11 1.25 0.00 1.20 0.00 0.00 173.24 176.39 1ggu s ALA 341 N 0.72 3.89 0.37 5.45 0.00 -0.92 -1.61 121.76 129.65 1ggu s ALA 341 Ca 0.09 -3.23 -0.05 0.00 0.00 0.00 0.00 51.96 48.78 1ggu s ALA 341 Cb -0.12 -3.99 -0.05 0.00 0.00 0.00 0.00 23.12 18.95 1ggu s ALA 341 CO 0.02 -2.74 0.65 -1.58 0.00 0.00 0.00 175.76 172.11 1ggu s HIS 342 N 1.51 3.50 -1.27 0.00 5.04 -1.26 -3.98 115.29 118.82 1ggu s HIS 342 Ca 0.36 0.70 -0.06 0.00 -1.54 0.00 0.00 55.06 54.53 1ggu s HIS 342 Cb -0.05 -2.18 0.01 0.00 0.04 0.00 0.00 32.58 30.40 1ggu s HIS 342 CO -0.05 -0.00 0.78 -0.25 -2.34 0.00 0.00 174.74 172.88 1ggu n ASP 343 N -1.50 -5.70 0.13 9.88 8.00 -1.26 -4.93 116.55 121.17 1ggu n ASP 343 Ca -0.01 -0.36 0.01 0.00 0.71 0.00 0.00 54.79 55.15 1ggu n ASP 343 Cb 0.55 -4.42 0.04 0.00 -0.02 0.00 0.00 41.12 37.26 1ggu n ASP 343 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1ggu h ASN 344 N -1.78 0.00 -2.05 -2.24 7.08 -1.89 -3.48 115.58 111.22 1ggu h ASN 344 Ca -0.48 0.00 -0.34 0.00 -3.08 0.00 0.00 56.30 52.40 1ggu h ASN 344 Cb 1.32 0.00 -0.04 0.00 -2.08 0.00 0.00 38.32 37.52 1ggu h ASN 344 CO 0.49 0.58 -0.40 -0.67 -2.08 0.00 0.00 177.43 175.34 1ggu n ASP 345 N -3.28 -4.96 0.00 6.14 2.03 -1.26 -0.60 116.55 114.62 1ggu n ASP 345 Ca 0.01 0.07 0.00 0.00 0.52 0.00 0.00 54.79 55.40 1ggu n ASP 345 Cb 0.74 -4.03 0.00 0.00 -0.72 0.00 0.00 41.12 37.11 1ggu n ASP 345 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ggu n ALA 346 N -1.15 0.00 -2.20 -1.67 0.00 -1.26 -4.91 120.51 109.31 1ggu n ALA 346 Ca -0.19 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.84 1ggu n ALA 346 Cb 0.63 -0.39 -0.04 0.00 0.00 0.00 0.00 19.45 19.65 1ggu n ALA 346 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1ggu s ASN 347 N -2.52 7.37 -0.28 0.00 0.01 0.23 -1.37 114.94 118.38 1ggu s ASN 347 Ca 0.00 1.93 0.08 0.00 -0.71 0.00 0.00 52.86 54.16 1ggu s ASN 347 Cb 0.00 -2.59 0.65 0.00 0.41 0.00 0.00 41.25 39.71 1ggu s ASN 347 CO 0.00 -0.16 1.66 0.18 -1.51 0.00 0.00 177.10 177.27 1ggu n LEU 348 N 2.73 5.54 -3.73 0.60 4.77 0.11 -4.83 117.00 122.19 1ggu n LEU 348 Ca 0.03 -2.88 -0.22 0.00 -0.03 0.00 0.00 56.01 52.91 1ggu n LEU 348 Cb 0.48 -0.72 -0.18 0.00 -2.33 0.00 0.00 43.42 40.68 1ggu n LEU 348 CO 0.53 0.74 -0.37 -1.10 -1.33 0.00 0.00 177.39 175.86 1ggu s GLN 349 N -2.64 0.36 -0.19 3.23 -0.21 -1.26 -0.37 119.66 118.58 1ggu s GLN 349 Ca 0.47 0.19 -0.05 0.00 0.02 0.00 0.00 55.36 56.00 1ggu s GLN 349 Cb 0.38 -0.84 -0.02 0.00 1.00 0.00 0.00 33.01 33.52 1ggu s GLN 349 CO 0.12 -0.32 -0.01 1.41 -2.12 0.00 0.00 175.29 174.37 1ggu s MET 350 N 2.04 3.61 -0.03 2.91 -2.45 0.17 -4.93 119.30 120.63 1ggu s MET 350 Ca 0.05 -0.53 -0.13 0.00 -1.25 0.00 0.00 55.69 53.83 1ggu s MET 350 Cb -0.12 -3.05 -0.05 0.00 1.25 0.00 0.00 34.83 32.85 1ggu s MET 350 CO -0.05 0.03 0.35 -0.51 1.05 0.00 0.00 175.02 175.90 1ggu s ASP 351 N 0.93 6.71 -0.14 1.11 1.01 -1.26 0.12 116.67 125.15 1ggu s ASP 351 Ca 0.01 0.85 -0.01 0.00 0.71 0.00 0.00 52.55 54.11 1ggu s ASP 351 Cb -0.14 -2.21 0.03 0.00 1.01 0.00 0.00 42.92 41.61 1ggu s ASP 351 CO 0.02 0.34 -0.06 -0.63 0.21 0.00 0.00 175.17 175.05 1ggu s ILE 352 N -1.04 1.05 -0.19 0.77 1.09 -0.36 -4.60 121.20 117.92 1ggu s ILE 352 Ca 0.22 -0.45 -0.14 0.00 -1.10 0.00 0.00 60.65 59.17 1ggu s ILE 352 Cb -0.16 -1.16 -0.04 0.00 -1.06 0.00 0.00 42.46 40.04 1ggu s ILE 352 CO 0.11 0.24 0.32 -0.36 -0.10 0.00 0.00 174.94 175.15 1ggu s PHE 353 N 1.68 3.41 0.13 3.97 0.08 -1.26 -0.16 117.98 125.82 1ggu s PHE 353 Ca 0.03 0.55 0.05 0.00 0.12 0.00 0.00 56.93 57.69 1ggu s PHE 353 Cb -0.14 -2.41 -0.04 0.00 -0.57 0.00 0.00 43.02 39.86 1ggu s PHE 353 CO -0.08 0.11 0.03 -0.51 -0.10 0.00 0.00 175.22 174.67 1ggu s LEU 354 N 0.89 3.51 0.66 -0.37 1.02 0.34 0.95 118.68 125.68 1ggu s LEU 354 Ca 0.16 -0.22 -0.06 0.00 0.02 0.00 0.00 54.13 54.04 1ggu s LEU 354 Cb -0.14 -2.19 0.04 0.00 0.02 0.00 0.00 46.19 43.92 1ggu s LEU 354 CO 0.06 0.13 0.96 -1.61 0.02 0.00 0.00 176.35 175.91 1ggu s GLU 355 N -2.64 2.44 0.45 1.70 2.02 0.51 -0.08 118.70 123.09 1ggu s GLU 355 Ca 0.27 -0.21 0.15 0.00 0.02 0.00 0.00 54.97 55.20 1ggu s GLU 355 Cb -0.11 -2.22 1.08 0.00 0.10 0.00 0.00 34.13 32.98 1ggu s GLU 355 CO 0.20 -1.04 2.01 0.93 0.02 0.00 0.00 175.26 177.37 1ggu h GLU 356 N -0.43 0.32 -0.00 1.61 5.08 -1.89 -1.30 114.58 117.98 1ggu h GLU 356 Ca -0.45 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1ggu h GLU 356 Cb 1.30 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1ggu h GLU 356 CO 0.60 0.21 -0.01 -0.40 -1.00 0.00 0.00 179.01 178.41 1ggu n ASP 357 N -4.47 0.03 0.00 1.42 5.75 -1.26 -4.91 116.55 113.11 1ggu n ASP 357 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.86 1ggu n ASP 357 Cb 0.34 -0.32 0.00 0.00 -1.03 0.00 0.00 41.12 40.11 1ggu n ASP 357 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ggu n GLY 358 N 1.34 2.63 3.69 6.12 0.00 -0.49 -4.69 105.19 113.80 1ggu n GLY 358 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 1ggu n GLY 358 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ggu s ASN 359 N -1.59 3.37 0.16 1.61 0.02 -1.26 -4.62 114.94 112.64 1ggu s ASN 359 Ca 0.00 2.20 -0.28 0.00 -1.02 0.00 0.00 52.86 53.77 1ggu s ASN 359 Cb 0.00 -2.57 -0.08 0.00 0.02 0.00 0.00 41.25 38.63 1ggu s ASN 359 CO 0.00 -2.81 0.86 -0.69 0.02 0.00 0.00 177.10 174.48 1ggu s VAL 360 N -2.51 4.34 -0.53 1.60 1.01 -1.26 -0.37 120.40 122.69 1ggu s VAL 360 Ca 0.68 1.88 -0.18 0.00 0.00 0.00 0.00 61.98 64.37 1ggu s VAL 360 Cb -0.24 -4.23 0.08 0.00 0.00 0.00 0.00 36.38 31.99 1ggu s VAL 360 CO 0.55 0.46 0.59 0.21 0.00 0.00 0.00 175.10 176.91 1ggu s ASN 361 N -0.81 6.19 0.06 3.32 3.84 0.27 -4.75 114.94 123.06 1ggu s ASN 361 Ca 0.40 -1.25 0.27 0.00 0.21 0.00 0.00 52.86 52.49 1ggu s ASN 361 Cb -0.24 -2.26 1.09 0.00 -0.55 0.00 0.00 41.25 39.29 1ggu s ASN 361 CO 0.28 -0.91 1.86 -1.54 -2.79 0.00 0.00 177.10 174.00 1ggu n SER 362 N 5.93 0.22 0.10 -4.21 3.41 -1.26 -1.64 113.62 116.17 1ggu n SER 362 Ca -0.09 0.52 -0.18 0.00 -0.26 0.00 0.00 58.87 58.86 1ggu n SER 362 Cb 0.44 -0.58 -0.14 0.00 -0.26 0.00 0.00 64.21 63.66 1ggu n SER 362 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1ggu h LYS 363 N 0.00 0.33 0.00 4.33 3.64 -1.95 -3.35 116.57 119.57 1ggu h LYS 363 Ca 0.00 -0.56 -0.19 0.00 -1.27 0.00 0.00 60.65 58.63 1ggu h LYS 363 Cb 0.54 0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.54 1ggu h LYS 363 CO 0.00 1.25 -1.03 -0.07 -2.27 0.00 0.00 179.45 177.33 1ggu h LEU 364 N 0.09 0.00 -8.08 5.20 3.38 -1.91 -3.41 115.31 110.58 1ggu h LEU 364 Ca -0.19 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 57.14 1ggu h LEU 364 Cb 2.03 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 42.65 1ggu h LEU 364 CO 0.21 0.80 1.15 -0.89 0.09 0.00 0.00 178.44 179.80 1ggu s THR 365 N -2.79 4.27 -0.79 0.22 2.01 -0.65 -4.75 115.64 113.16 1ggu s THR 365 Ca 0.00 -1.02 0.12 0.00 0.31 0.00 0.00 61.69 61.11 1ggu s THR 365 Cb 0.09 -4.92 -0.07 0.00 0.01 0.00 0.00 72.50 67.61 1ggu s THR 365 CO 0.80 -1.73 0.58 0.29 -0.69 0.00 0.00 174.62 173.87 1ggu n LYS 366 N 7.88 2.67 -3.11 4.92 4.76 -1.26 -4.86 118.16 129.16 1ggu n LYS 366 Ca 0.26 -0.29 -0.39 0.00 -2.87 0.00 0.00 58.31 55.02 1ggu n LYS 366 Cb 0.50 -1.09 -0.06 0.00 -1.84 0.00 0.00 35.03 32.54 1ggu n LYS 366 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1ggu s ASP 367 N -1.84 7.23 0.05 4.39 1.01 -1.26 -5.06 116.67 121.18 1ggu s ASP 367 Ca 0.07 1.47 0.05 0.00 0.71 0.00 0.00 52.55 54.85 1ggu s ASP 367 Cb 0.09 -2.44 -0.03 0.00 1.01 0.00 0.00 42.92 41.56 1ggu s ASP 367 CO 0.40 0.22 -0.15 -0.44 0.21 0.00 0.00 175.17 175.40 1ggu s SER 368 N -1.19 1.77 -0.14 0.27 0.01 -1.26 -4.92 113.70 108.23 1ggu s SER 368 Ca 0.34 -0.53 -0.10 0.00 1.31 0.00 0.00 55.95 56.97 1ggu s SER 368 Cb -0.21 -0.10 -0.05 0.00 0.21 0.00 0.00 66.02 65.88 1ggu s SER 368 CO 0.23 0.01 0.19 -0.69 0.41 0.00 0.00 173.24 173.38 1ggu s VAL 369 N -1.00 5.40 0.17 3.43 1.01 -1.26 -4.74 120.40 123.40 1ggu s VAL 369 Ca 0.01 0.32 -0.30 0.00 0.00 0.00 0.00 61.98 62.01 1ggu s VAL 369 Cb -0.09 -3.49 -0.07 0.00 0.00 0.00 0.00 36.38 32.73 1ggu s VAL 369 CO 0.02 0.52 1.02 0.26 0.00 0.00 0.00 175.10 176.92 1ggu s TRP 370 N -0.31 3.74 0.23 5.22 0.52 -0.63 -3.55 118.94 124.17 1ggu s TRP 370 Ca 0.14 1.73 -0.06 0.00 0.02 0.00 0.00 56.10 57.93 1ggu s TRP 370 Cb -0.12 -3.14 0.36 0.00 -1.15 0.00 0.00 33.47 29.42 1ggu s TRP 370 CO 0.03 -0.12 1.79 -0.91 0.02 0.00 0.00 176.95 177.76 1ggu h ASN 371 N 5.07 0.55 -5.09 2.95 2.35 -1.01 0.12 115.58 120.53 1ggu h ASN 371 Ca -0.44 0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 55.32 1ggu h ASN 371 Cb 1.21 -0.04 -0.12 0.00 0.05 0.00 0.00 38.32 39.42 1ggu h ASN 371 CO 0.71 0.31 -0.05 -0.72 -1.65 0.00 0.00 177.43 176.03 1ggu s TYR 372 N -6.05 -0.14 -0.16 1.19 1.13 -1.26 -0.34 117.35 111.72 1ggu s TYR 372 Ca -0.12 -0.18 -0.10 0.00 -1.41 0.00 0.00 57.07 55.26 1ggu s TYR 372 Cb 0.19 0.29 0.05 0.00 -1.10 0.00 0.00 41.96 41.39 1ggu s TYR 372 CO 0.77 -0.78 0.40 -1.58 -2.51 0.00 0.00 175.55 171.85 1ggu s HIS 373 N -3.84 -0.56 -0.04 -3.49 2.46 -0.14 -4.82 115.29 104.86 1ggu s HIS 373 Ca 0.06 1.22 -0.02 0.00 0.47 0.00 0.00 55.06 56.79 1ggu s HIS 373 Cb 0.01 0.23 -0.04 0.00 -0.13 0.00 0.00 32.58 32.66 1ggu s HIS 373 CO -0.08 -0.32 0.10 0.00 -2.47 0.00 0.00 174.74 171.97 1ggu n TRP 375 N 1.45 -1.24 -4.36 0.00 2.14 -0.92 -4.63 117.44 109.87 1ggu n TRP 375 Ca -0.15 -2.23 -0.25 0.00 2.07 0.00 0.00 57.50 56.94 1ggu n TRP 375 Cb 0.53 0.46 -0.09 0.00 -0.81 0.00 0.00 31.31 31.40 1ggu n TRP 375 CO 0.00 0.00 0.00 -0.80 2.07 0.00 0.00 177.69 178.96 1ggu s ASN 376 N -3.01 4.13 -0.04 -0.67 -0.87 -0.66 -1.00 114.94 112.81 1ggu s ASN 376 Ca 0.28 -0.99 0.03 0.00 -1.57 0.00 0.00 52.86 50.61 1ggu s ASN 376 Cb -0.00 -0.52 0.00 0.00 -0.02 0.00 0.00 41.25 40.71 1ggu s ASN 376 CO 0.20 -0.21 -0.12 -1.61 -2.57 0.00 0.00 177.10 172.80 1ggu s GLU 377 N -3.69 1.40 -0.03 -0.60 2.02 0.11 -1.31 118.70 116.60 1ggu s GLU 377 Ca 0.34 -0.42 0.06 0.00 0.02 0.00 0.00 54.97 54.97 1ggu s GLU 377 Cb -0.01 -1.23 -0.01 0.00 0.10 0.00 0.00 34.13 32.98 1ggu s GLU 377 CO 0.19 0.12 -0.20 0.00 0.02 0.00 0.00 175.26 175.39 1ggu s ALA 378 N 0.30 1.76 -0.22 5.21 0.00 -0.81 -1.37 121.76 126.62 1ggu s ALA 378 Ca -0.07 -0.86 -0.12 0.00 0.00 0.00 0.00 51.96 50.92 1ggu s ALA 378 Cb -0.12 -0.51 -0.05 0.00 0.00 0.00 0.00 23.12 22.44 1ggu s ALA 378 CO 0.02 0.37 0.22 -0.46 0.00 0.00 0.00 175.76 175.90 1ggu s TRP 379 N -0.23 3.36 -0.01 0.00 -0.11 -0.40 -0.17 118.94 121.38 1ggu s TRP 379 Ca 0.01 0.36 -0.29 0.00 1.22 0.00 0.00 56.10 57.40 1ggu s TRP 379 Cb -0.11 -2.31 0.10 0.00 -1.50 0.00 0.00 33.47 29.66 1ggu s TRP 379 CO 0.01 0.10 0.99 0.00 -4.62 0.00 0.00 176.95 173.44 1ggu s MET 380 N 0.93 0.77 0.68 5.86 0.23 -0.88 -4.43 119.30 122.47 1ggu s MET 380 Ca 0.11 -0.33 -0.11 0.00 -1.03 0.00 0.00 55.69 54.32 1ggu s MET 380 Cb -0.13 0.32 0.00 0.00 -1.53 0.00 0.00 34.83 33.49 1ggu s MET 380 CO 0.04 -0.34 1.06 0.95 -2.03 0.00 0.00 175.02 174.70 1ggu s THR 381 N -2.98 4.05 -0.58 3.16 -4.23 0.17 -1.66 115.64 113.57 1ggu s THR 381 Ca 0.08 0.67 0.05 0.00 -1.18 0.00 0.00 61.69 61.30 1ggu s THR 381 Cb -0.01 -3.54 0.17 0.00 1.34 0.00 0.00 72.50 70.47 1ggu s THR 381 CO -0.06 -0.87 0.43 -0.13 -0.54 0.00 0.00 174.62 173.45 1ggu s ARG 382 N -5.16 1.78 0.54 3.99 1.81 -1.26 -4.89 118.95 115.75 1ggu s ARG 382 Ca 0.57 -2.81 0.31 0.00 -1.72 0.00 0.00 55.73 52.09 1ggu s ARG 382 Cb -0.13 -2.53 1.49 0.00 -0.45 0.00 0.00 34.95 33.33 1ggu s ARG 382 CO 0.54 -1.33 2.05 -1.35 -0.68 0.00 0.00 175.30 174.53 1ggu h PRO 383 N 5.49 0.00 0.00 3.54 0.11 -1.95 -2.44 132.00 136.74 1ggu h PRO 383 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1ggu h PRO 383 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 1ggu h PRO 383 CO 0.56 0.09 -0.02 -0.40 -0.21 0.00 0.00 178.00 178.02 1ggu n ASP 384 N -3.36 0.75 -4.66 -2.05 5.75 -1.26 -4.86 116.55 106.86 1ggu n ASP 384 Ca -0.01 0.55 -0.24 0.00 -0.01 0.00 0.00 54.79 55.08 1ggu n ASP 384 Cb 0.26 -0.74 -0.08 0.00 -1.03 0.00 0.00 41.12 39.54 1ggu n ASP 384 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1ggu s LEU 385 N -4.39 3.09 1.01 -2.12 1.43 -0.92 -5.08 118.68 111.69 1ggu s LEU 385 Ca 0.11 -0.85 -0.11 0.00 -1.03 0.00 0.00 54.13 52.25 1ggu s LEU 385 Cb 0.13 -1.54 0.20 0.00 0.03 0.00 0.00 46.19 45.01 1ggu s LEU 385 CO 0.60 -0.18 1.09 -2.84 0.23 0.00 0.00 176.35 175.25 1ggu s PRO 386 N -3.73 0.32 0.47 1.29 0.02 -1.26 -4.91 135.00 127.20 1ggu s PRO 386 Ca 0.34 1.19 -0.24 0.00 0.02 0.00 0.00 61.00 62.32 1ggu s PRO 386 Cb -0.03 -1.67 -0.08 0.00 0.02 0.00 0.00 34.50 32.74 1ggu s PRO 386 CO 0.20 -2.99 1.33 1.33 -0.33 0.00 0.00 177.00 176.54 1ggu n VAL 387 N -4.45 3.04 0.00 3.83 0.24 -1.26 -3.61 118.33 116.12 1ggu n VAL 387 Ca 0.08 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.88 1ggu n VAL 387 Cb 0.53 -1.67 0.00 0.00 -1.47 0.00 0.00 33.84 31.23 1ggu n VAL 387 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ggu n GLY 388 N 0.74 0.39 1.21 7.63 0.00 -1.26 -4.94 105.19 108.96 1ggu n GLY 388 Ca 0.07 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.18 1ggu n GLY 388 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ggu n PHE 389 N -1.78 1.29 -1.58 1.61 3.72 -1.24 -4.83 117.46 114.64 1ggu n PHE 389 Ca 0.00 -0.80 -0.05 0.00 -0.05 0.00 0.00 57.45 56.55 1ggu n PHE 389 Cb 0.00 -0.36 0.03 0.00 -0.94 0.00 0.00 39.48 38.21 1ggu n PHE 389 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ggu n GLY 390 N -0.04 -0.48 1.11 1.37 0.00 -1.26 -4.67 105.19 101.22 1ggu n GLY 390 Ca 0.23 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1ggu n GLY 390 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ggu n GLY 391 N 3.56 0.64 3.74 -0.02 0.00 -0.67 -4.78 105.19 107.66 1ggu n GLY 391 Ca 0.03 -1.58 -0.41 0.00 0.00 0.00 0.00 46.02 44.05 1ggu n GLY 391 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ggu s TRP 392 N 0.00 3.05 -0.11 1.61 0.52 -1.26 -2.07 118.94 120.68 1ggu s TRP 392 Ca 0.00 1.04 0.04 0.00 0.02 0.00 0.00 56.10 57.19 1ggu s TRP 392 Cb 0.00 -3.80 0.00 0.00 -1.15 0.00 0.00 33.47 28.53 1ggu s TRP 392 CO 0.00 -2.59 -0.23 -0.65 0.02 0.00 0.00 176.95 173.50 1ggu s GLN 393 N -0.28 2.95 -0.02 4.98 -1.52 0.76 -2.29 119.66 124.24 1ggu s GLN 393 Ca 0.59 -0.84 -0.27 0.00 -1.95 0.00 0.00 55.36 52.90 1ggu s GLN 393 Cb -0.41 -2.27 -0.04 0.00 -0.22 0.00 0.00 33.01 30.07 1ggu s GLN 393 CO 0.42 0.12 0.84 0.00 -0.25 0.00 0.00 175.29 176.42 1ggu s ALA 394 N 0.48 3.26 -0.06 6.09 0.00 0.86 -1.93 121.76 130.46 1ggu s ALA 394 Ca -0.16 0.34 -0.00 0.00 0.00 0.00 0.00 51.96 52.14 1ggu s ALA 394 Cb -0.17 -3.14 0.03 0.00 0.00 0.00 0.00 23.12 19.84 1ggu s ALA 394 CO 0.06 -0.14 -0.01 0.08 0.00 0.00 0.00 175.76 175.75 1ggu s VAL 395 N 0.78 0.42 -0.24 0.00 1.01 -0.43 -0.28 120.40 121.66 1ggu s VAL 395 Ca 0.44 0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.47 1ggu s VAL 395 Cb -0.20 -0.53 0.04 0.00 0.00 0.00 0.00 36.38 35.70 1ggu s VAL 395 CO 0.23 0.24 -0.10 -0.62 0.00 0.00 0.00 175.10 174.85 1ggu s ASP 396 N 1.57 4.18 0.00 3.32 2.15 0.13 -1.65 116.67 126.37 1ggu s ASP 396 Ca -0.01 -1.07 0.30 0.00 0.43 0.00 0.00 52.55 52.20 1ggu s ASP 396 Cb -0.13 -1.59 1.57 0.00 -0.30 0.00 0.00 42.92 42.47 1ggu s ASP 396 CO -0.03 -0.14 2.06 -1.54 -0.17 0.00 0.00 175.17 175.34 1ggu n SER 397 N 4.56 0.18 -4.62 -0.34 3.41 -1.26 -0.86 113.62 114.69 1ggu n SER 397 Ca -0.16 -0.61 -0.42 0.00 -0.26 0.00 0.00 58.87 57.41 1ggu n SER 397 Cb 0.45 -0.12 -0.03 0.00 -0.26 0.00 0.00 64.21 64.25 1ggu n SER 397 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1ggu s THR 398 N -2.32 4.62 0.69 6.66 2.01 -1.26 -4.45 115.64 121.60 1ggu s THR 398 Ca 0.36 1.38 -0.15 0.00 0.31 0.00 0.00 61.69 63.59 1ggu s THR 398 Cb 0.21 -4.30 0.02 0.00 0.01 0.00 0.00 72.50 68.43 1ggu s THR 398 CO 0.43 -0.43 1.17 -2.16 -0.69 0.00 0.00 174.62 172.93 1ggu s PRO 399 N 3.37 2.47 0.20 4.92 0.04 -1.26 -4.64 135.00 140.10 1ggu s PRO 399 Ca 0.39 1.61 -0.19 0.00 0.04 0.00 0.00 61.00 62.85 1ggu s PRO 399 Cb -0.13 -1.89 0.04 0.00 0.04 0.00 0.00 34.50 32.56 1ggu s PRO 399 CO 0.16 -1.55 0.57 1.14 0.04 0.00 0.00 177.00 177.36 1ggu s GLN 400 N -3.93 1.42 -0.28 4.56 -2.07 -0.91 -4.88 119.66 113.57 1ggu s GLN 400 Ca 0.72 -0.79 -0.29 0.00 -1.82 0.00 0.00 55.36 53.18 1ggu s GLN 400 Cb -0.26 0.55 -0.02 0.00 -1.09 0.00 0.00 33.01 32.20 1ggu s GLN 400 CO 0.43 -0.62 1.68 -1.21 -1.32 0.00 0.00 175.29 174.24 1ggu s GLU 401 N -3.85 3.58 0.00 9.60 0.41 -1.26 -1.97 118.70 125.21 1ggu s GLU 401 Ca 0.07 1.50 0.00 0.00 -0.41 0.00 0.00 54.97 56.13 1ggu s GLU 401 Cb -0.02 -4.10 0.00 0.00 -1.78 0.00 0.00 34.13 28.23 1ggu s GLU 401 CO -0.04 -1.56 0.00 0.27 -0.49 0.00 0.00 175.26 173.44 1ggu n ASN 402 N 9.26 1.15 0.29 -0.19 0.23 0.55 -4.47 115.26 122.09 1ggu n ASN 402 Ca 0.20 -0.40 0.17 0.00 -0.53 0.00 0.00 54.58 54.02 1ggu n ASN 402 Cb 0.46 0.00 0.88 0.00 -2.08 0.00 0.00 39.78 39.04 1ggu n ASN 402 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1ggu h SER 403 N 0.00 0.00 0.03 0.53 4.64 -1.98 -3.22 113.55 113.54 1ggu h SER 403 Ca 0.00 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.94 1ggu h SER 403 Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.02 1ggu h SER 403 CO 0.00 0.05 -2.39 0.47 -0.87 0.00 0.00 176.83 174.09 1ggu n ASP 404 N -3.36 1.32 0.00 4.97 9.92 -1.26 -5.10 116.55 123.04 1ggu n ASP 404 Ca -0.02 -0.05 0.00 0.00 -0.53 0.00 0.00 54.79 54.19 1ggu n ASP 404 Cb 0.19 0.02 0.00 0.00 -0.64 0.00 0.00 41.12 40.69 1ggu n ASP 404 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ggu n GLY 405 N 2.05 -0.54 3.47 0.44 0.00 -1.22 -5.04 105.19 104.36 1ggu n GLY 405 Ca -0.40 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.43 1ggu n GLY 405 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ggu s MET 406 N -1.60 3.23 0.27 1.61 -2.45 -1.26 -0.33 119.30 118.78 1ggu s MET 406 Ca 0.00 -0.94 -0.09 0.00 -1.25 0.00 0.00 55.69 53.41 1ggu s MET 406 Cb 0.00 -4.41 -0.00 0.00 1.25 0.00 0.00 34.83 31.66 1ggu s MET 406 CO 0.00 -1.87 0.46 0.71 1.05 0.00 0.00 175.02 175.36 1ggu s TYR 407 N 4.08 0.62 1.01 4.11 2.02 -0.83 -4.79 117.35 123.56 1ggu s TYR 407 Ca 0.27 -0.94 -0.12 0.00 -0.37 0.00 0.00 57.07 55.91 1ggu s TYR 407 Cb -0.13 0.07 0.19 0.00 -0.40 0.00 0.00 41.96 41.70 1ggu s TYR 407 CO 0.06 -1.02 1.08 -0.98 -1.57 0.00 0.00 175.55 173.12 1ggu s ARG 408 N -3.71 0.36 -0.02 -0.62 1.04 -1.26 -2.15 118.95 112.59 1ggu s ARG 408 Ca 0.26 0.75 0.04 0.00 -1.04 0.00 0.00 55.73 55.73 1ggu s ARG 408 Cb 0.00 -1.71 -0.01 0.00 -2.04 0.00 0.00 34.95 31.19 1ggu s ARG 408 CO 0.12 -2.84 -0.13 0.00 -0.04 0.00 0.00 175.30 172.41 1ggu n GLY 410 N 2.98 1.25 3.74 0.00 0.00 -1.21 0.22 105.19 112.18 1ggu n GLY 410 Ca -0.16 -2.27 -0.41 0.00 0.00 0.00 0.00 46.02 43.17 1ggu n GLY 410 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ggu s PRO 411 N -1.25 4.47 -0.13 1.61 0.04 -1.26 -4.66 135.00 133.82 1ggu s PRO 411 Ca 0.00 1.94 0.02 0.00 0.04 0.00 0.00 61.00 63.00 1ggu s PRO 411 Cb 0.00 -3.21 0.01 0.00 0.04 0.00 0.00 34.50 31.34 1ggu s PRO 411 CO 0.00 -0.11 -0.20 0.00 0.04 0.00 0.00 177.00 176.73 1ggu s ALA 412 N -0.17 2.09 -0.15 8.56 0.00 0.62 -1.59 121.76 131.11 1ggu s ALA 412 Ca 0.53 -1.00 -0.38 0.00 0.00 0.00 0.00 51.96 51.10 1ggu s ALA 412 Cb -0.34 -0.97 -0.15 0.00 0.00 0.00 0.00 23.12 21.66 1ggu s ALA 412 CO 0.39 -0.08 1.66 0.45 0.00 0.00 0.00 175.76 178.18 1ggu n SER 413 N 4.17 2.38 0.23 0.00 2.88 -1.26 -0.10 113.62 121.92 1ggu n SER 413 Ca -0.20 1.07 0.09 0.00 -1.33 0.00 0.00 58.87 58.50 1ggu n SER 413 Cb 0.51 -1.19 0.54 0.00 -0.75 0.00 0.00 64.21 63.32 1ggu n SER 413 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1ggu h VAL 414 N 4.75 0.77 0.00 2.46 2.07 -1.74 -2.20 116.25 122.37 1ggu h VAL 414 Ca -0.47 -0.95 -0.12 0.00 0.82 0.00 0.00 66.70 65.99 1ggu h VAL 414 Cb 1.31 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 32.65 1ggu h VAL 414 CO 0.91 0.23 -0.56 1.56 0.02 0.00 0.00 177.57 179.73 1ggu h GLN 415 N 0.00 0.00 -0.12 1.57 1.08 -1.83 -2.39 115.11 113.42 1ggu h GLN 415 Ca -0.00 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 57.00 1ggu h GLN 415 Cb 0.56 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.99 1ggu h GLN 415 CO 0.03 0.56 -0.74 0.00 -0.95 0.00 0.00 178.83 177.74 1ggu h ALA 416 N 1.44 0.49 -0.04 3.87 0.00 -1.74 -2.58 119.26 120.71 1ggu h ALA 416 Ca -0.01 -0.60 -0.00 0.00 0.00 0.00 0.00 54.91 54.30 1ggu h ALA 416 Cb 1.06 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 1ggu h ALA 416 CO 0.07 0.73 0.01 0.82 0.00 0.00 0.00 179.25 180.88 1ggu h ILE 417 N 0.39 1.17 -0.82 0.00 2.04 -1.39 0.40 117.51 119.31 1ggu h ILE 417 Ca -0.04 -0.52 0.08 0.00 1.00 0.00 0.00 64.86 65.39 1ggu h ILE 417 Cb 1.33 1.46 -0.05 0.00 -0.74 0.00 0.00 36.82 38.81 1ggu h ILE 417 CO 0.14 0.14 0.53 0.50 0.00 0.00 0.00 178.15 179.46 1ggu h LYS 418 N -0.15 0.81 -0.51 2.37 3.64 -1.39 0.44 116.57 121.79 1ggu h LYS 418 Ca 0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1ggu h LYS 418 Cb 0.22 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 1ggu h LYS 418 CO -0.00 0.54 0.00 0.72 -2.27 0.00 0.00 179.45 178.44 1ggu n HIS 419 N -4.50 0.67 -1.37 1.91 8.25 -0.98 -4.66 115.22 114.55 1ggu n HIS 419 Ca 0.13 -0.34 -0.13 0.00 -0.26 0.00 0.00 57.72 57.13 1ggu n HIS 419 Cb 0.26 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.32 1ggu n HIS 419 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ggu n GLY 420 N 1.43 1.32 2.40 -1.41 0.00 0.14 -4.38 105.19 104.70 1ggu n GLY 420 Ca 0.19 -0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.53 1ggu n GLY 420 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ggu n HIS 421 N -2.54 2.53 1.67 1.61 8.25 0.12 -2.10 115.22 124.77 1ggu n HIS 421 Ca -0.13 -2.97 0.13 0.00 -0.26 0.00 0.00 57.72 54.49 1ggu n HIS 421 Cb 0.46 -2.20 0.76 0.00 1.12 0.00 0.00 29.99 30.13 1ggu n HIS 421 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1ggu n VAL 422 N 2.79 0.00 0.24 1.59 0.24 -1.26 -3.34 118.33 118.59 1ggu n VAL 422 Ca 0.70 0.00 0.13 0.00 -2.04 0.00 0.00 64.34 63.14 1ggu n VAL 422 Cb 0.24 -0.56 0.47 0.00 -1.47 0.00 0.00 33.84 32.52 1ggu n VAL 422 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ggu s PHE 424 N -3.51 3.62 0.69 0.00 0.08 -1.21 -5.03 117.98 112.61 1ggu s PHE 424 Ca 0.03 1.63 -0.17 0.00 0.12 0.00 0.00 56.93 58.54 1ggu s PHE 424 Cb 0.08 -3.17 0.01 0.00 -0.57 0.00 0.00 43.02 39.37 1ggu s PHE 424 CO 0.61 -0.24 1.19 0.00 -0.10 0.00 0.00 175.22 176.68 1ggu n GLN 425 N 3.90 0.78 -5.22 0.44 10.64 -1.26 -4.34 117.38 122.32 1ggu n GLN 425 Ca 0.07 0.33 -0.30 0.00 -1.83 0.00 0.00 57.00 55.26 1ggu n GLN 425 Cb 0.50 -2.43 -0.16 0.00 -0.86 0.00 0.00 30.24 27.29 1ggu n GLN 425 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 1ggu s PHE 426 N -1.63 2.28 -1.14 2.61 0.40 -0.62 -4.54 117.98 115.33 1ggu s PHE 426 Ca 0.79 -0.58 -0.05 0.00 -0.60 0.00 0.00 56.93 56.49 1ggu s PHE 426 Cb -0.36 -1.49 0.04 0.00 0.51 0.00 0.00 43.02 41.73 1ggu s PHE 426 CO 0.45 -0.14 0.29 -0.25 0.70 0.00 0.00 175.22 176.27 1ggu n ASP 427 N 2.76 -3.71 0.10 1.36 8.00 -1.26 -3.29 116.55 120.51 1ggu n ASP 427 Ca -0.17 -0.13 0.05 0.00 0.71 0.00 0.00 54.79 55.25 1ggu n ASP 427 Cb 0.52 -3.11 0.49 0.00 -0.02 0.00 0.00 41.12 39.00 1ggu n ASP 427 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ggu h ALA 428 N 0.98 1.79 0.00 2.24 0.00 -1.78 -1.65 119.26 120.83 1ggu h ALA 428 Ca -0.36 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.44 1ggu h ALA 428 Cb 1.25 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1ggu h ALA 428 CO 0.44 0.19 -0.33 -1.35 0.00 0.00 0.00 179.25 178.19 1ggu h PRO 429 N 0.34 0.00 -0.00 0.00 0.11 -1.90 -0.64 132.00 129.90 1ggu h PRO 429 Ca 0.09 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.94 1ggu h PRO 429 Cb -0.00 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.12 1ggu h PRO 429 CO -0.02 0.33 -1.03 0.74 -0.21 0.00 0.00 178.00 177.82 1ggu h PHE 430 N 0.00 0.98 -0.21 0.65 0.04 -1.67 -2.56 116.94 114.17 1ggu h PHE 430 Ca -0.00 -0.53 -0.17 0.00 2.80 0.00 0.00 57.97 60.07 1ggu h PHE 430 Cb 0.60 -0.11 -0.00 0.00 2.20 0.00 0.00 35.95 38.64 1ggu h PHE 430 CO 0.00 1.37 -0.56 0.28 -0.60 0.00 0.00 178.31 178.80 1ggu h VAL 431 N 0.37 1.31 -0.76 -0.55 2.07 -1.35 -2.37 116.25 114.98 1ggu h VAL 431 Ca -0.12 -1.79 0.04 0.00 0.82 0.00 0.00 66.70 65.65 1ggu h VAL 431 Cb 1.68 1.75 -0.05 0.00 -1.52 0.00 0.00 31.29 33.14 1ggu h VAL 431 CO 0.20 0.56 0.47 0.15 0.02 0.00 0.00 177.57 178.97 1ggu h PHE 432 N 0.48 0.88 0.00 1.57 3.57 -1.13 -1.98 116.94 120.33 1ggu h PHE 432 Ca 0.01 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 1ggu h PHE 432 Cb 1.12 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.56 1ggu h PHE 432 CO 0.05 0.48 -0.33 0.00 -2.23 0.00 0.00 178.31 176.28 1ggu h ALA 433 N 1.34 0.92 -0.93 2.41 0.00 -1.37 -0.12 119.26 121.51 1ggu h ALA 433 Ca 0.32 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1ggu h ALA 433 Cb 0.08 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1ggu h ALA 433 CO -0.14 0.41 0.62 0.93 0.00 0.00 0.00 179.25 181.07 1ggu h GLU 434 N 0.00 1.17 0.00 0.00 4.39 -0.81 -2.73 114.58 116.60 1ggu h GLU 434 Ca -0.00 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.63 1ggu h GLU 434 Cb 0.96 -0.26 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 1ggu h GLU 434 CO 0.04 0.78 -1.45 1.33 -1.16 0.00 0.00 179.01 178.55 1ggu n VAL 435 N -4.42 0.04 -0.04 3.13 0.24 -1.12 -2.17 118.33 113.98 1ggu n VAL 435 Ca 0.12 -0.28 0.03 0.00 -2.04 0.00 0.00 64.34 62.17 1ggu n VAL 435 Cb 0.07 0.39 0.07 0.00 -1.47 0.00 0.00 33.84 32.91 1ggu n VAL 435 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1ggu n ASN 436 N -1.94 2.35 -4.73 -1.34 3.02 -0.07 -3.93 115.26 108.61 1ggu n ASN 436 Ca -0.00 -1.89 -0.32 0.00 -0.03 0.00 0.00 54.58 52.34 1ggu n ASN 436 Cb 0.46 -0.11 0.10 0.00 -0.61 0.00 0.00 39.78 39.62 1ggu n ASN 436 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1ggu s SER 437 N -0.92 4.17 -0.02 6.41 0.01 -1.04 -4.93 113.70 117.38 1ggu s SER 437 Ca 0.12 2.11 0.03 0.00 1.31 0.00 0.00 55.95 59.52 1ggu s SER 437 Cb 0.06 -2.56 -0.03 0.00 0.21 0.00 0.00 66.02 63.70 1ggu s SER 437 CO 0.08 -2.27 -0.08 -1.81 0.41 0.00 0.00 173.24 169.58 1ggu s ASP 438 N -2.62 4.54 -0.09 2.44 1.01 0.50 -4.44 116.67 118.02 1ggu s ASP 438 Ca 0.68 -0.13 -0.22 0.00 0.71 0.00 0.00 52.55 53.59 1ggu s ASP 438 Cb -0.23 -1.06 -0.04 0.00 1.01 0.00 0.00 42.92 42.60 1ggu s ASP 438 CO 0.50 0.31 0.63 -0.76 0.21 0.00 0.00 175.17 176.05 1ggu s LEU 439 N -1.22 4.30 -0.22 1.23 1.43 -0.52 0.45 118.68 124.14 1ggu s LEU 439 Ca 0.15 1.06 -0.00 0.00 -1.03 0.00 0.00 54.13 54.31 1ggu s LEU 439 Cb -0.11 -2.95 0.02 0.00 0.03 0.00 0.00 46.19 43.18 1ggu s LEU 439 CO 0.05 -0.08 -0.12 -0.63 0.23 0.00 0.00 176.35 175.80 1ggu s ILE 440 N 0.77 2.55 -0.15 -0.59 -1.09 0.32 -1.08 121.20 121.93 1ggu s ILE 440 Ca 0.34 -0.95 -0.22 0.00 -2.23 0.00 0.00 60.65 57.58 1ggu s ILE 440 Cb -0.17 -2.20 -0.03 0.00 -1.58 0.00 0.00 42.46 38.49 1ggu s ILE 440 CO 0.15 0.36 0.69 -0.31 -1.23 0.00 0.00 174.94 174.61 1ggu s TYR 441 N 1.32 3.45 -0.01 3.97 2.02 0.67 -1.22 117.35 127.55 1ggu s TYR 441 Ca 0.02 1.10 0.02 0.00 -0.37 0.00 0.00 57.07 57.85 1ggu s TYR 441 Cb -0.15 -2.84 -0.00 0.00 -0.40 0.00 0.00 41.96 38.57 1ggu s TYR 441 CO -0.08 -0.09 -0.08 0.42 -1.57 0.00 0.00 175.55 174.15 1ggu s ILE 442 N 1.56 0.63 -0.12 2.71 1.01 0.77 -1.21 121.20 126.55 1ggu s ILE 442 Ca 0.33 -0.33 -0.16 0.00 0.00 0.00 0.00 60.65 60.49 1ggu s ILE 442 Cb -0.16 -0.53 -0.05 0.00 0.01 0.00 0.00 42.46 41.73 1ggu s ILE 442 CO 0.13 0.18 0.41 -0.89 0.00 0.00 0.00 174.94 174.77 1ggu s THR 443 N -0.14 5.21 -0.35 2.92 2.01 0.74 0.13 115.64 126.15 1ggu s THR 443 Ca 0.02 0.80 -0.09 0.00 0.31 0.00 0.00 61.69 62.73 1ggu s THR 443 Cb -0.04 -3.74 0.03 0.00 0.01 0.00 0.00 72.50 68.76 1ggu s THR 443 CO -0.00 0.38 0.16 0.00 -0.69 0.00 0.00 174.62 174.47 1ggu s ALA 444 N 0.33 3.19 0.58 7.40 0.00 0.89 -1.59 121.76 132.55 1ggu s ALA 444 Ca 0.22 -1.68 -0.08 0.00 0.00 0.00 0.00 51.96 50.42 1ggu s ALA 444 Cb -0.15 -2.44 -0.02 0.00 0.00 0.00 0.00 23.12 20.51 1ggu s ALA 444 CO 0.09 -1.29 0.94 0.15 0.00 0.00 0.00 175.76 175.64 1ggu s LYS 445 N 1.51 3.35 0.49 0.00 1.02 -0.95 -4.29 119.74 120.87 1ggu s LYS 445 Ca 0.01 0.40 0.33 0.00 0.02 0.00 0.00 55.97 56.73 1ggu s LYS 445 Cb -0.19 -2.20 1.49 0.00 -0.52 0.00 0.00 37.83 36.41 1ggu s LYS 445 CO 0.05 -0.55 1.98 0.87 -0.92 0.00 0.00 175.35 176.78 1ggu h LYS 446 N -0.17 0.00 -0.11 1.68 1.57 -1.98 -1.42 116.57 116.13 1ggu h LYS 446 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1ggu h LYS 446 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1ggu h LYS 446 CO 0.62 0.00 0.00 -0.40 -0.57 0.00 0.00 179.45 179.10 1ggu n ASP 447 N -2.83 1.11 0.00 0.86 5.68 -1.26 -4.93 116.55 115.18 1ggu n ASP 447 Ca 0.00 -1.61 0.00 0.00 -0.50 0.00 0.00 54.79 52.68 1ggu n ASP 447 Cb 0.22 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.13 1ggu n ASP 447 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ggu n GLY 448 N 1.01 2.94 3.83 6.12 0.00 -0.54 -5.04 105.19 113.51 1ggu n GLY 448 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1ggu n GLY 448 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ggu s THR 449 N -1.73 2.76 -0.01 2.61 -4.23 -1.26 -4.74 115.64 109.04 1ggu s THR 449 Ca 0.00 0.25 0.07 0.00 -1.18 0.00 0.00 61.69 60.83 1ggu s THR 449 Cb 0.00 -3.08 -0.02 0.00 1.34 0.00 0.00 72.50 70.75 1ggu s THR 449 CO 0.00 -0.32 -0.23 -1.00 -0.54 0.00 0.00 174.62 172.53 1ggu s HIS 450 N -3.28 2.04 -0.09 3.99 3.76 -1.26 -2.24 115.29 118.22 1ggu s HIS 450 Ca 0.61 -0.39 0.03 0.00 -0.15 0.00 0.00 55.06 55.16 1ggu s HIS 450 Cb -0.13 -1.31 0.01 0.00 1.11 0.00 0.00 32.58 32.26 1ggu s HIS 450 CO 0.53 -0.02 -0.16 0.54 -0.85 0.00 0.00 174.74 174.78 1ggu s VAL 451 N -0.56 1.47 -0.41 -0.90 0.11 -0.62 -4.97 120.40 114.52 1ggu s VAL 451 Ca 0.09 -0.66 -0.27 0.00 -2.93 0.00 0.00 61.98 58.20 1ggu s VAL 451 Cb -0.09 -1.32 0.02 0.00 -1.53 0.00 0.00 36.38 33.47 1ggu s VAL 451 CO -0.01 0.43 1.02 0.54 -3.33 0.00 0.00 175.10 173.76 1ggu s VAL 452 N 0.66 4.43 -0.08 2.04 0.11 -1.26 -0.18 120.40 126.12 1ggu s VAL 452 Ca -0.14 1.23 -0.01 0.00 -2.93 0.00 0.00 61.98 60.13 1ggu s VAL 452 Cb -0.16 -4.45 -0.00 0.00 -1.53 0.00 0.00 36.38 30.23 1ggu s VAL 452 CO 0.04 -0.73 -0.03 -0.33 -3.33 0.00 0.00 175.10 170.72 1ggu h GLU 453 N 8.74 0.00 -2.96 1.54 4.39 -1.53 -3.49 114.58 121.27 1ggu h GLU 453 Ca -0.23 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.39 1ggu h GLU 453 Cb 1.07 0.00 -0.17 0.00 -0.10 0.00 0.00 28.75 29.55 1ggu h GLU 453 CO 1.05 0.00 -0.09 0.54 -1.16 0.00 0.00 179.01 179.34 1ggu s ASN 454 N -4.89 -0.31 -0.22 1.42 4.22 -1.19 -4.93 114.94 109.03 1ggu s ASN 454 Ca -0.02 0.05 -0.03 0.00 -2.14 0.00 0.00 52.86 50.72 1ggu s ASN 454 Cb 0.00 0.43 0.00 0.00 1.28 0.00 0.00 41.25 42.96 1ggu s ASN 454 CO 0.03 -0.65 -0.06 0.54 -2.04 0.00 0.00 177.10 174.92 1ggu s VAL 455 N -2.34 3.14 -0.47 3.54 0.11 -1.26 -0.24 120.40 122.88 1ggu s VAL 455 Ca -0.06 -0.65 -0.17 0.00 -2.93 0.00 0.00 61.98 58.17 1ggu s VAL 455 Cb -0.01 -2.45 0.05 0.00 -1.53 0.00 0.00 36.38 32.44 1ggu s VAL 455 CO -0.01 0.39 0.48 -0.62 -3.33 0.00 0.00 175.10 172.01 1ggu s ASP 456 N 1.43 6.18 0.00 3.54 -1.08 -0.24 -4.93 116.67 121.58 1ggu s ASP 456 Ca 0.05 -1.01 0.21 0.00 -0.52 0.00 0.00 52.55 51.28 1ggu s ASP 456 Cb -0.15 -2.23 0.61 0.00 -1.46 0.00 0.00 42.92 39.69 1ggu s ASP 456 CO -0.05 -0.71 1.48 0.00 0.52 0.00 0.00 175.17 176.41 1ggu n ALA 457 N 5.63 2.48 -0.25 3.66 0.00 -1.26 -1.44 120.51 129.33 1ggu n ALA 457 Ca -0.09 -0.70 0.07 0.00 0.00 0.00 0.00 53.44 52.72 1ggu n ALA 457 Cb 0.45 -1.00 0.19 0.00 0.00 0.00 0.00 19.45 19.09 1ggu n ALA 457 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ggu n THR 458 N 0.77 1.06 -0.08 0.00 -2.24 -1.26 -4.77 114.28 107.75 1ggu n THR 458 Ca 0.17 -1.03 -0.09 0.00 -2.27 0.00 0.00 64.05 60.83 1ggu n THR 458 Cb 0.43 0.47 -0.03 0.00 -2.10 0.00 0.00 70.33 69.10 1ggu n THR 458 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1ggu n HIS 459 N 0.71 0.70 -2.12 4.78 -0.00 -1.26 -4.76 115.22 113.27 1ggu n HIS 459 Ca 0.15 0.31 -0.42 0.00 0.46 0.00 0.00 57.72 58.21 1ggu n HIS 459 Cb 0.49 -0.76 -0.03 0.00 -0.12 0.00 0.00 29.99 29.57 1ggu n HIS 459 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 1ggu s ILE 460 N -2.41 3.09 -1.24 3.57 1.01 -1.26 -3.48 121.20 120.47 1ggu s ILE 460 Ca -0.20 0.82 -0.07 0.00 0.00 0.00 0.00 60.65 61.19 1ggu s ILE 460 Cb 0.03 -3.52 0.01 0.00 0.01 0.00 0.00 42.46 38.99 1ggu s ILE 460 CO 0.32 0.08 0.92 0.61 0.00 0.00 0.00 174.94 176.87 1ggu n GLY 461 N 3.15 -0.37 0.21 6.18 0.00 0.15 -4.65 105.19 109.86 1ggu n GLY 461 Ca 0.10 0.12 0.10 0.00 0.00 0.00 0.00 46.02 46.34 1ggu n GLY 461 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1ggu h LYS 462 N -2.11 0.00 -2.35 1.61 3.64 -1.57 -3.42 116.57 112.37 1ggu h LYS 462 Ca -0.49 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 58.84 1ggu h LYS 462 Cb 1.32 0.00 -0.25 0.00 -0.41 0.00 0.00 32.23 32.90 1ggu h LYS 462 CO 0.49 0.18 -0.27 -1.17 -2.27 0.00 0.00 179.45 176.41 1ggu s LEU 463 N -6.40 -0.75 -0.17 5.20 0.20 -1.26 -5.03 118.68 110.47 1ggu s LEU 463 Ca 0.04 1.18 0.00 0.00 0.69 0.00 0.00 54.13 56.04 1ggu s LEU 463 Cb 0.08 1.68 0.01 0.00 -0.43 0.00 0.00 46.19 47.53 1ggu s LEU 463 CO 0.66 -0.23 -0.17 -0.63 -0.29 0.00 0.00 176.35 175.69 1ggu s ILE 464 N 2.51 2.35 0.15 6.68 1.01 -1.26 -0.22 121.20 132.42 1ggu s ILE 464 Ca -0.04 -0.85 0.06 0.00 0.00 0.00 0.00 60.65 59.82 1ggu s ILE 464 Cb -0.11 -2.00 -0.04 0.00 0.01 0.00 0.00 42.46 40.32 1ggu s ILE 464 CO -0.15 0.52 -0.14 0.54 0.00 0.00 0.00 174.94 175.71 1ggu s VAL 465 N 1.16 1.45 0.06 2.92 0.11 0.32 -1.34 120.40 125.07 1ggu s VAL 465 Ca 0.01 -1.93 -0.17 0.00 -2.93 0.00 0.00 61.98 56.97 1ggu s VAL 465 Cb -0.14 -1.75 0.03 0.00 -1.53 0.00 0.00 36.38 32.99 1ggu s VAL 465 CO -0.07 -0.52 0.38 0.28 -3.33 0.00 0.00 175.10 171.84 1ggu s THR 466 N -2.58 0.07 0.53 5.04 -1.32 0.09 -0.29 115.64 117.17 1ggu s THR 466 Ca 0.15 -0.54 -0.22 0.00 -1.21 0.00 0.00 61.69 59.87 1ggu s THR 466 Cb -0.02 -0.99 -0.05 0.00 -1.51 0.00 0.00 72.50 69.92 1ggu s THR 466 CO 0.04 -0.30 1.34 -0.75 -2.21 0.00 0.00 174.62 172.74 1ggu s LYS 467 N -2.71 3.26 0.62 7.08 2.20 -1.26 0.15 119.74 129.07 1ggu s LYS 467 Ca -0.04 2.20 -0.13 0.00 -0.36 0.00 0.00 55.97 57.64 1ggu s LYS 467 Cb -0.00 -2.31 -0.03 0.00 -1.51 0.00 0.00 37.83 33.98 1ggu s LYS 467 CO -0.04 -1.09 1.04 1.14 -0.36 0.00 0.00 175.35 176.04 1ggu s GLN 468 N -2.84 3.40 0.28 4.03 -2.07 0.35 -4.63 119.66 118.18 1ggu s GLN 468 Ca 0.70 0.95 0.02 0.00 -1.82 0.00 0.00 55.36 55.21 1ggu s GLN 468 Cb -0.39 -2.05 0.40 0.00 -1.09 0.00 0.00 33.01 29.88 1ggu s GLN 468 CO 0.47 -0.73 1.71 0.82 -1.32 0.00 0.00 175.29 176.25 1ggu h ILE 469 N -0.03 1.27 0.00 3.63 2.04 -1.95 -3.36 117.51 119.11 1ggu h ILE 469 Ca -0.45 -1.29 0.00 0.00 1.00 0.00 0.00 64.86 64.12 1ggu h ILE 469 Cb 1.20 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 38.65 1ggu h ILE 469 CO 0.59 0.41 0.00 0.61 0.00 0.00 0.00 178.15 179.76 1ggu n GLY 470 N -0.35 -2.79 0.00 5.37 0.00 -1.26 -4.94 105.19 101.22 1ggu n GLY 470 Ca -0.00 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1ggu n GLY 470 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ggu n GLY 471 N -0.36 4.37 0.52 -0.02 0.00 -1.26 -5.04 105.19 103.41 1ggu n GLY 471 Ca 0.00 -0.61 0.04 0.00 0.00 0.00 0.00 46.02 45.45 1ggu n GLY 471 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ggu n ASP 472 N 0.00 1.50 -4.90 1.61 8.00 -1.26 -3.86 116.55 117.64 1ggu n ASP 472 Ca 0.00 -2.03 -0.29 0.00 0.71 0.00 0.00 54.79 53.19 1ggu n ASP 472 Cb 0.00 -0.21 0.07 0.00 -0.02 0.00 0.00 41.12 40.97 1ggu n ASP 472 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1ggu s GLY 473 N -0.94 1.61 -0.11 0.44 0.00 -1.26 -4.81 107.32 102.24 1ggu s GLY 473 Ca 0.18 -0.60 -0.09 0.00 0.00 0.00 0.00 44.72 44.20 1ggu s GLY 473 CO 0.11 -0.17 0.19 -3.16 0.00 0.00 0.00 173.10 170.08 1ggu s MET 474 N -5.44 3.68 -0.29 2.90 0.23 -1.26 -0.50 119.30 118.62 1ggu s MET 474 Ca 0.60 -0.03 -0.09 0.00 -1.03 0.00 0.00 55.69 55.14 1ggu s MET 474 Cb -0.11 -3.24 -0.01 0.00 -1.53 0.00 0.00 34.83 29.94 1ggu s MET 474 CO 0.49 0.66 0.12 1.41 -2.03 0.00 0.00 175.02 175.67 1ggu s MET 475 N -0.74 3.39 -0.25 3.16 0.00 0.39 -4.82 119.30 120.44 1ggu s MET 475 Ca 0.16 -0.67 -0.28 0.00 0.00 0.00 0.00 55.69 54.89 1ggu s MET 475 Cb -0.13 -3.48 0.01 0.00 0.00 0.00 0.00 34.83 31.23 1ggu s MET 475 CO 0.05 -0.36 1.01 0.34 0.00 0.00 0.00 175.02 176.06 1ggu s ASP 476 N 1.60 7.03 -0.11 1.11 2.15 -1.26 -0.73 116.67 126.46 1ggu s ASP 476 Ca 0.05 1.27 0.14 0.00 0.43 0.00 0.00 52.55 54.44 1ggu s ASP 476 Cb -0.17 -2.52 0.28 0.00 -0.30 0.00 0.00 42.92 40.21 1ggu s ASP 476 CO 0.05 -0.68 1.14 2.30 -0.17 0.00 0.00 175.17 177.81 1ggu n ILE 477 N 5.40 1.46 0.06 4.11 -5.35 -0.45 -4.82 119.36 119.77 1ggu n ILE 477 Ca 0.11 -1.96 0.08 0.00 -0.27 0.00 0.00 62.75 60.71 1ggu n ILE 477 Cb 0.46 -0.00 0.52 0.00 -1.74 0.00 0.00 39.64 38.88 1ggu n ILE 477 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1ggu h THR 478 N 2.09 1.00 0.00 7.28 2.02 -1.86 -1.42 112.91 122.03 1ggu h THR 478 Ca -0.02 -0.11 -0.00 0.00 0.77 0.00 0.00 66.41 67.05 1ggu h THR 478 Cb 1.15 0.65 -0.00 0.00 -1.74 0.00 0.00 68.15 68.21 1ggu h THR 478 CO 0.01 0.06 -0.01 -2.24 0.37 0.00 0.00 175.52 173.71 1ggu h ASP 479 N 0.32 0.00 1.13 4.18 2.03 -1.88 -1.61 116.42 120.60 1ggu h ASP 479 Ca 0.14 0.00 -0.12 0.00 -0.73 0.00 0.00 57.03 56.32 1ggu h ASP 479 Cb 0.16 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.64 1ggu h ASP 479 CO -0.03 0.01 -0.56 0.71 -1.03 0.00 0.00 179.24 178.33 1ggu h THR 480 N 0.00 1.07 0.00 1.15 1.35 -1.64 -3.33 112.91 111.51 1ggu h THR 480 Ca -0.00 -2.21 -0.25 0.00 -0.55 0.00 0.00 66.41 63.40 1ggu h THR 480 Cb 0.46 2.32 -0.05 0.00 -1.73 0.00 0.00 68.15 69.16 1ggu h THR 480 CO 0.00 0.55 -1.79 -1.22 -0.25 0.00 0.00 175.52 172.82 1ggu n TYR 481 N -3.39 0.71 -3.66 4.73 4.02 -0.93 -4.60 117.16 114.04 1ggu n TYR 481 Ca 0.01 0.25 -0.14 0.00 -0.01 0.00 0.00 57.90 58.00 1ggu n TYR 481 Cb 0.69 -1.07 -0.07 0.00 -0.02 0.00 0.00 39.34 38.87 1ggu n TYR 481 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 176.86 174.26 1ggu s LYS 482 N -2.73 0.88 0.83 -0.72 -2.85 -0.65 -3.40 119.74 111.10 1ggu s LYS 482 Ca -0.05 -0.17 -0.12 0.00 -1.00 0.00 0.00 55.97 54.63 1ggu s LYS 482 Cb 0.08 0.40 0.09 0.00 -2.06 0.00 0.00 37.83 36.34 1ggu s LYS 482 CO 0.83 -0.28 1.15 -0.06 0.10 0.00 0.00 175.35 177.08 1ggu s PHE 483 N -1.83 2.83 0.41 1.78 0.08 -1.26 -4.07 117.98 115.91 1ggu s PHE 483 Ca -0.09 0.87 -0.25 0.00 0.12 0.00 0.00 56.93 57.57 1ggu s PHE 483 Cb -0.02 -3.37 -0.10 0.00 -0.57 0.00 0.00 43.02 38.96 1ggu s PHE 483 CO 0.02 -1.91 1.20 0.94 -0.10 0.00 0.00 175.22 175.37 1ggu n GLN 484 N -3.45 1.77 -2.42 0.44 7.27 -1.26 -4.87 117.38 114.86 1ggu n GLN 484 Ca 0.07 0.63 -0.42 0.00 0.07 0.00 0.00 57.00 57.35 1ggu n GLN 484 Cb 0.59 -2.28 -0.03 0.00 2.41 0.00 0.00 30.24 30.93 1ggu n GLN 484 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 1ggu s GLU 485 N -2.13 4.45 0.00 3.69 8.01 -1.26 -3.71 118.70 127.75 1ggu s GLU 485 Ca 0.61 1.78 0.00 0.00 0.01 0.00 0.00 54.97 57.38 1ggu s GLU 485 Cb -0.53 -3.33 0.00 0.00 -4.31 0.00 0.00 34.13 25.97 1ggu s GLU 485 CO 0.58 -0.21 0.00 0.41 0.01 0.00 0.00 175.26 176.05 1ggu n GLY 486 N 2.99 3.21 3.88 -1.39 0.00 -1.26 -5.09 105.19 107.53 1ggu n GLY 486 Ca 0.08 -0.92 -0.30 0.00 0.00 0.00 0.00 46.02 44.88 1ggu n GLY 486 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ggu s GLN 487 N 0.00 3.06 0.21 1.61 -1.52 -1.24 -4.92 119.66 116.86 1ggu s GLN 487 Ca 0.00 0.57 -0.14 0.00 -1.95 0.00 0.00 55.36 53.84 1ggu s GLN 487 Cb 0.00 -2.03 0.25 0.00 -0.22 0.00 0.00 33.01 31.01 1ggu s GLN 487 CO 0.00 -0.92 1.38 -1.91 -0.25 0.00 0.00 175.29 173.59 1ggu n GLU 488 N -2.95 -0.18 -0.34 2.91 0.00 -1.26 -2.35 120.64 116.47 1ggu n GLU 488 Ca 0.07 1.37 0.13 0.00 0.00 0.00 0.00 57.16 58.73 1ggu n GLU 488 Cb 0.56 -2.03 0.32 0.00 0.00 0.00 0.00 31.44 30.29 1ggu n GLU 488 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1ggu h GLU 489 N 0.00 0.68 -0.22 5.31 5.08 -1.95 -1.06 114.58 122.43 1ggu h GLU 489 Ca 0.33 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.50 1ggu h GLU 489 Cb 0.55 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 1ggu h GLU 489 CO -0.89 0.45 -0.50 1.49 -1.00 0.00 0.00 179.01 178.56 1ggu h GLU 490 N 0.71 0.61 -0.28 2.33 4.81 -1.73 -1.18 114.58 119.85 1ggu h GLU 490 Ca 0.58 -0.36 -0.17 0.00 -0.13 0.00 0.00 59.36 59.28 1ggu h GLU 490 Cb 0.94 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.35 1ggu h GLU 490 CO -0.40 0.97 -0.50 -0.09 -0.73 0.00 0.00 179.01 178.26 1ggu h ARG 491 N 0.48 0.79 0.49 1.92 2.43 -1.47 -1.96 114.38 117.06 1ggu h ARG 491 Ca 0.02 -0.47 -0.02 0.00 -0.81 0.00 0.00 59.98 58.69 1ggu h ARG 491 Cb 1.04 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 1ggu h ARG 491 CO 0.10 1.10 -0.24 1.25 -1.51 0.00 0.00 179.97 180.68 1ggu h LEU 492 N 0.62 -0.56 -0.98 3.80 5.85 -1.16 0.96 115.31 123.84 1ggu h LEU 492 Ca 0.03 -0.05 0.22 0.00 0.84 0.00 0.00 57.88 58.91 1ggu h LEU 492 Cb 1.08 0.14 -0.12 0.00 0.37 0.00 0.00 40.66 42.14 1ggu h LEU 492 CO 0.11 -0.27 0.56 0.00 -0.34 0.00 0.00 178.44 178.50 1ggu h ALA 493 N -0.43 1.67 -0.04 1.25 0.00 -1.21 0.87 119.26 121.38 1ggu h ALA 493 Ca -0.07 0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 1ggu h ALA 493 Cb 0.58 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1ggu h ALA 493 CO 0.11 -0.20 -0.68 1.25 0.00 0.00 0.00 179.25 179.73 1ggu h LEU 494 N 0.61 0.21 0.13 0.00 7.12 -1.24 -1.56 115.31 120.58 1ggu h LEU 494 Ca 0.60 -0.13 -0.01 0.00 0.13 0.00 0.00 57.88 58.47 1ggu h LEU 494 Cb 1.07 -0.06 0.00 0.00 -0.53 0.00 0.00 40.66 41.14 1ggu h LEU 494 CO -0.45 0.82 -0.06 -0.08 -0.13 0.00 0.00 178.44 178.54 1ggu h GLU 495 N 0.12 -0.16 -0.53 1.25 4.81 0.30 -2.65 114.58 117.73 1ggu h GLU 495 Ca -0.01 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.29 1ggu h GLU 495 Cb 1.21 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.57 1ggu h GLU 495 CO 0.10 0.22 0.23 1.15 -0.73 0.00 0.00 179.01 179.98 1ggu h THR 496 N -0.59 0.87 -0.58 0.32 2.02 0.18 -2.89 112.91 112.25 1ggu h THR 496 Ca -0.02 -0.15 0.02 0.00 0.77 0.00 0.00 66.41 67.03 1ggu h THR 496 Cb 0.46 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 67.24 1ggu h THR 496 CO 0.03 0.08 0.37 0.00 0.37 0.00 0.00 175.52 176.36 1ggu h ALA 497 N 1.33 0.74 -0.19 6.16 0.00 -0.72 -1.83 119.26 124.74 1ggu h ALA 497 Ca 0.25 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.19 1ggu h ALA 497 Cb 0.23 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1ggu h ALA 497 CO -0.22 0.12 0.26 -0.07 0.00 0.00 0.00 179.25 179.34 1ggu h LEU 498 N 0.74 0.00 -2.15 0.00 4.07 -1.25 0.16 115.31 116.88 1ggu h LEU 498 Ca 0.22 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.18 1ggu h LEU 498 Cb -0.04 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.70 1ggu h LEU 498 CO -0.07 0.00 0.00 1.15 -1.08 0.00 0.00 178.44 178.44 1ggu n MET 499 N -3.59 2.43 -2.07 1.13 0.00 -0.69 -4.35 117.12 109.97 1ggu n MET 499 Ca 0.02 -2.13 -0.02 0.00 0.00 0.00 0.00 57.70 55.57 1ggu n MET 499 Cb 0.38 -1.50 0.05 0.00 0.00 0.00 0.00 33.22 32.16 1ggu n MET 499 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 1ggu n TYR 500 N 1.41 0.98 0.00 3.17 4.01 -0.03 -4.99 117.16 121.71 1ggu n TYR 500 Ca 0.18 -1.60 0.00 0.00 -0.16 0.00 0.00 57.90 56.32 1ggu n TYR 500 Cb 0.60 -0.23 0.00 0.00 -0.31 0.00 0.00 39.34 39.40 1ggu n TYR 500 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ggu n GLY 501 N -0.34 1.81 3.80 2.72 0.00 -1.15 -3.89 105.19 108.13 1ggu n GLY 501 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 1ggu n GLY 501 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ggu s ALA 502 N -2.00 3.55 -0.03 4.61 0.00 -0.73 -4.83 121.76 122.35 1ggu s ALA 502 Ca 0.00 0.10 0.02 0.00 0.00 0.00 0.00 51.96 52.09 1ggu s ALA 502 Cb 0.00 -2.71 0.00 0.00 0.00 0.00 0.00 23.12 20.41 1ggu s ALA 502 CO 0.00 0.36 -0.08 0.15 0.00 0.00 0.00 175.76 176.19 1ggu s LYS 503 N -1.04 0.89 -0.46 0.00 1.02 -0.47 -4.31 119.74 115.38 1ggu s LYS 503 Ca 0.31 -0.27 0.03 0.00 0.02 0.00 0.00 55.97 56.06 1ggu s LYS 503 Cb -0.20 -0.84 0.12 0.00 -0.52 0.00 0.00 37.83 36.39 1ggu s LYS 503 CO 0.20 0.09 0.21 0.15 -0.92 0.00 0.00 175.35 175.09 1ggu s LYS 504 N 0.24 1.65 0.41 1.68 1.02 -1.26 0.07 119.74 123.54 1ggu s LYS 504 Ca -0.04 -2.26 0.28 0.00 0.02 0.00 0.00 55.97 53.97 1ggu s LYS 504 Cb -0.09 -2.97 1.50 0.00 -0.52 0.00 0.00 37.83 35.75 1ggu s LYS 504 CO 0.00 -1.09 1.84 -1.00 -0.92 0.00 0.00 175.35 174.19 1ggu h PRO 505 N 6.82 0.00 -5.61 -1.68 0.13 -1.97 -3.43 132.00 126.27 1ggu h PRO 505 Ca -0.06 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.62 1ggu h PRO 505 Cb 0.93 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 31.86 1ggu h PRO 505 CO 0.60 0.00 -0.78 -0.51 -0.23 0.00 0.00 178.00 177.08 1ggu s LEU 506 N -4.93 2.36 -0.12 1.56 1.43 -1.26 -5.16 118.68 112.56 1ggu s LEU 506 Ca -0.03 -0.75 -0.09 0.00 -1.03 0.00 0.00 54.13 52.23 1ggu s LEU 506 Cb 0.08 -0.64 -0.04 0.00 0.03 0.00 0.00 46.19 45.61 1ggu s LEU 506 CO 0.25 -0.08 0.19 0.21 0.23 0.00 0.00 176.35 177.15 1ggu s ASN 507 N -2.21 6.41 0.32 2.29 2.47 -1.26 -5.13 114.94 117.83 1ggu s ASN 507 Ca 0.07 0.49 0.09 0.00 0.42 0.00 0.00 52.86 53.93 1ggu s ASN 507 Cb -0.07 -2.11 -0.05 0.00 -1.45 0.00 0.00 41.25 37.58 1ggu s ASN 507 CO 0.04 0.33 0.07 0.42 -3.72 0.00 0.00 177.10 174.24 1ggu s THR 508 N -0.65 3.02 0.00 -5.21 -4.23 -1.26 -5.05 115.64 102.26 1ggu s THR 508 Ca 0.15 -1.82 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 1ggu s THR 508 Cb -0.12 -2.90 0.00 0.00 1.34 0.00 0.00 72.50 70.82 1ggu s THR 508 CO 0.04 -0.23 0.01 -1.54 -0.54 0.00 0.00 174.62 172.36 1ggu n SER 516 N -1.04 0.00 -2.21 3.99 3.41 -1.26 -5.64 113.62 110.88 1ggu n SER 516 Ca -0.04 -1.00 -0.14 0.00 -0.26 0.00 0.00 58.87 57.43 1ggu n SER 516 Cb 0.61 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.60 1ggu n SER 516 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1ggu n ASN 517 N 0.00 -4.56 -4.27 4.04 5.03 -1.26 -4.71 115.26 109.53 1ggu n ASN 517 Ca 0.00 -0.27 -0.32 0.00 0.87 0.00 0.00 54.58 54.86 1ggu n ASN 517 Cb 0.26 -3.26 -0.16 0.00 -1.02 0.00 0.00 39.78 35.60 1ggu n ASN 517 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1ggu s VAL 518 N -3.09 2.39 0.24 2.41 1.01 -1.26 -0.97 120.40 121.14 1ggu s VAL 518 Ca 0.29 -0.90 0.08 0.00 0.00 0.00 0.00 61.98 61.44 1ggu s VAL 518 Cb -0.13 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 1ggu s VAL 518 CO 0.36 0.55 0.13 -1.81 0.00 0.00 0.00 175.10 174.33 1ggu s ASP 519 N 0.32 5.23 -0.27 3.32 1.01 -0.05 -4.94 116.67 121.28 1ggu s ASP 519 Ca -0.16 -0.35 -0.24 0.00 0.71 0.00 0.00 52.55 52.51 1ggu s ASP 519 Cb -0.17 -1.24 0.08 0.00 1.01 0.00 0.00 42.92 42.60 1ggu s ASP 519 CO 0.08 -0.01 0.76 -0.32 0.21 0.00 0.00 175.17 175.89 1ggu s MET 520 N -3.70 0.77 0.22 8.23 -2.45 -1.26 -0.98 119.30 120.13 1ggu s MET 520 Ca 0.32 0.97 -0.15 0.00 -1.25 0.00 0.00 55.69 55.58 1ggu s MET 520 Cb -0.08 0.35 0.01 0.00 1.25 0.00 0.00 34.83 36.36 1ggu s MET 520 CO 0.23 -0.10 0.49 0.34 1.05 0.00 0.00 175.02 177.03 1ggu s ASP 521 N 0.53 -0.15 0.06 1.11 2.15 -0.96 -4.91 116.67 114.51 1ggu s ASP 521 Ca -0.01 -0.72 -0.15 0.00 0.43 0.00 0.00 52.55 52.10 1ggu s ASP 521 Cb -0.05 0.57 0.02 0.00 -0.30 0.00 0.00 42.92 43.17 1ggu s ASP 521 CO -0.03 -1.09 0.33 0.72 -0.17 0.00 0.00 175.17 174.94 1ggu s PHE 522 N -3.95 -0.13 0.11 -5.34 -0.71 -1.26 -1.61 117.98 105.09 1ggu s PHE 522 Ca 0.16 -0.05 0.10 0.00 -1.04 0.00 0.00 56.93 56.10 1ggu s PHE 522 Cb -0.01 0.14 -0.04 0.00 -1.21 0.00 0.00 43.02 41.90 1ggu s PHE 522 CO 0.03 -0.56 -0.26 -1.21 -1.34 0.00 0.00 175.22 171.88 1ggu s GLU 523 N -2.93 1.53 -0.09 1.99 2.02 -0.58 -4.97 118.70 115.67 1ggu s GLU 523 Ca -0.02 -1.28 0.01 0.00 0.02 0.00 0.00 54.97 53.70 1ggu s GLU 523 Cb 0.00 -1.95 0.02 0.00 0.10 0.00 0.00 34.13 32.31 1ggu s GLU 523 CO -0.06 0.47 -0.11 0.08 0.02 0.00 0.00 175.26 175.66 1ggu s VAL 524 N -1.02 1.14 0.25 2.63 1.01 -1.26 -0.39 120.40 122.76 1ggu s VAL 524 Ca 0.14 -0.43 -0.30 0.00 0.00 0.00 0.00 61.98 61.40 1ggu s VAL 524 Cb -0.10 -1.08 -0.10 0.00 0.00 0.00 0.00 36.38 35.10 1ggu s VAL 524 CO 0.06 0.37 1.34 -0.70 0.00 0.00 0.00 175.10 176.17 1ggu s GLU 525 N 1.10 4.35 0.02 2.72 2.12 -0.03 -4.99 118.70 123.98 1ggu s GLU 525 Ca -0.06 2.16 -0.26 0.00 0.36 0.00 0.00 54.97 57.17 1ggu s GLU 525 Cb -0.14 -3.14 -0.05 0.00 0.26 0.00 0.00 34.13 31.06 1ggu s GLU 525 CO -0.02 -0.27 0.82 -0.80 -0.54 0.00 0.00 175.26 174.45 1ggu s ASN 526 N 0.10 7.23 0.37 -1.70 0.01 -1.26 -4.67 114.94 115.01 1ggu s ASN 526 Ca 0.55 1.47 0.09 0.00 -0.71 0.00 0.00 52.86 54.26 1ggu s ASN 526 Cb -0.39 -2.49 -0.07 0.00 0.41 0.00 0.00 41.25 38.71 1ggu s ASN 526 CO 0.43 -0.08 -0.06 0.00 -1.51 0.00 0.00 177.10 175.88 1ggu s ALA 527 N 0.37 3.01 0.04 0.60 0.00 -1.26 -5.04 121.76 119.50 1ggu s ALA 527 Ca 0.42 -2.17 -0.17 0.00 0.00 0.00 0.00 51.96 50.05 1ggu s ALA 527 Cb -0.20 0.04 -0.06 0.00 0.00 0.00 0.00 23.12 22.90 1ggu s ALA 527 CO 0.24 0.00 0.50 0.08 0.00 0.00 0.00 175.76 176.58 1ggu s VAL 528 N -2.66 4.87 -0.17 0.00 1.01 -1.26 -1.76 120.40 120.43 1ggu s VAL 528 Ca 0.33 1.03 -0.38 0.00 0.00 0.00 0.00 61.98 62.97 1ggu s VAL 528 Cb 0.05 -3.81 -0.14 0.00 0.00 0.00 0.00 36.38 32.48 1ggu s VAL 528 CO 0.17 0.55 1.75 -0.11 0.00 0.00 0.00 175.10 177.46 1ggu n LEU 529 N 1.71 2.71 0.00 3.92 7.94 -0.59 -1.33 117.00 131.37 1ggu n LEU 529 Ca -0.12 1.05 0.00 0.00 -1.11 0.00 0.00 56.01 55.83 1ggu n LEU 529 Cb 0.51 -1.23 0.00 0.00 0.53 0.00 0.00 43.42 43.23 1ggu n LEU 529 CO 0.40 -0.35 0.00 0.61 -1.11 0.00 0.00 177.39 176.94 1ggu n GLY 530 N 4.09 0.65 3.68 -3.96 0.00 -1.26 -5.01 105.19 103.37 1ggu n GLY 530 Ca 0.24 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.03 1ggu n GLY 530 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ggu s LYS 531 N -0.59 2.42 0.74 1.61 -0.14 -0.44 -4.74 119.74 118.61 1ggu s LYS 531 Ca 0.00 -1.32 -0.11 0.00 -1.36 0.00 0.00 55.97 53.18 1ggu s LYS 531 Cb 0.00 -2.25 0.04 0.00 -1.68 0.00 0.00 37.83 33.93 1ggu s LYS 531 CO 0.00 0.38 1.08 -0.51 -0.76 0.00 0.00 175.35 175.54 1ggu s ASP 532 N -3.64 4.88 0.17 2.83 1.11 -1.26 -4.08 116.67 116.69 1ggu s ASP 532 Ca 0.31 1.68 -0.18 0.00 0.18 0.00 0.00 52.55 54.54 1ggu s ASP 532 Cb -0.07 -2.47 0.04 0.00 1.07 0.00 0.00 42.92 41.49 1ggu s ASP 532 CO 0.21 -1.77 0.51 0.72 1.18 0.00 0.00 175.17 176.01 1ggu s PHE 533 N -2.99 -0.20 0.28 4.23 -0.12 0.23 -4.88 117.98 114.53 1ggu s PHE 533 Ca 0.60 -0.12 0.12 0.00 -0.05 0.00 0.00 56.93 57.48 1ggu s PHE 533 Cb -0.15 0.39 -0.05 0.00 -0.63 0.00 0.00 43.02 42.57 1ggu s PHE 533 CO 0.55 -0.86 -0.18 0.15 -0.05 0.00 0.00 175.22 174.84 1ggu s LYS 534 N -3.84 1.72 -0.04 1.99 1.02 -1.26 -0.38 119.74 118.96 1ggu s LYS 534 Ca 0.06 -1.76 0.02 0.00 0.02 0.00 0.00 55.97 54.31 1ggu s LYS 534 Cb -0.00 -1.79 0.01 0.00 -0.52 0.00 0.00 37.83 35.53 1ggu s LYS 534 CO -0.06 0.32 -0.09 -1.17 -0.92 0.00 0.00 175.35 173.42 1ggu s LEU 535 N -3.53 1.69 -0.13 3.17 0.20 -0.59 -0.85 118.68 118.64 1ggu s LEU 535 Ca 0.30 -0.21 -0.00 0.00 0.69 0.00 0.00 54.13 54.91 1ggu s LEU 535 Cb -0.05 -0.60 0.03 0.00 -0.43 0.00 0.00 46.19 45.14 1ggu s LEU 535 CO 0.15 0.04 -0.09 -0.55 -0.29 0.00 0.00 176.35 175.62 1ggu s SER 536 N 0.39 2.39 -0.18 3.68 0.15 0.48 0.23 113.70 120.85 1ggu s SER 536 Ca -0.07 -0.39 -0.09 0.00 0.70 0.00 0.00 55.95 56.10 1ggu s SER 536 Cb -0.11 -0.94 -0.05 0.00 -1.71 0.00 0.00 66.02 63.21 1ggu s SER 536 CO 0.01 -0.11 0.13 -0.63 1.20 0.00 0.00 173.24 173.84 1ggu s ILE 537 N 1.64 5.43 -0.06 6.45 1.01 0.75 -1.53 121.20 134.88 1ggu s ILE 537 Ca 0.05 0.19 0.04 0.00 0.00 0.00 0.00 60.65 60.93 1ggu s ILE 537 Cb -0.13 -3.44 -0.00 0.00 0.01 0.00 0.00 42.46 38.90 1ggu s ILE 537 CO -0.09 0.49 -0.19 0.28 0.00 0.00 0.00 174.94 175.44 1ggu s THR 538 N -0.05 1.59 -0.12 2.92 -1.32 -0.63 0.06 115.64 118.08 1ggu s THR 538 Ca 0.10 -0.79 0.00 0.00 -1.21 0.00 0.00 61.69 59.79 1ggu s THR 538 Cb -0.11 -1.38 -0.02 0.00 -1.51 0.00 0.00 72.50 69.48 1ggu s THR 538 CO -0.00 0.45 -0.12 -0.36 -2.21 0.00 0.00 174.62 172.38 1ggu s PHE 539 N 0.17 2.82 -0.22 9.09 0.40 -0.06 -2.26 117.98 127.91 1ggu s PHE 539 Ca -0.08 -0.52 0.00 0.00 -0.60 0.00 0.00 56.93 55.72 1ggu s PHE 539 Cb -0.14 -1.82 0.03 0.00 0.51 0.00 0.00 43.02 41.60 1ggu s PHE 539 CO 0.04 -0.12 -0.12 1.03 0.70 0.00 0.00 175.22 176.74 1ggu s ARG 540 N 0.16 2.81 -0.51 0.44 0.52 -0.16 -1.81 118.95 120.40 1ggu s ARG 540 Ca -0.07 -0.97 -0.19 0.00 -0.52 0.00 0.00 55.73 53.98 1ggu s ARG 540 Cb -0.15 -2.81 0.06 0.00 0.52 0.00 0.00 34.95 32.57 1ggu s ARG 540 CO 0.05 -0.35 0.62 1.21 0.02 0.00 0.00 175.30 176.85 1ggu s ASN 541 N 1.28 6.22 0.00 0.23 3.84 0.40 -0.87 114.94 126.03 1ggu s ASN 541 Ca 0.01 -0.91 0.21 0.00 0.21 0.00 0.00 52.86 52.37 1ggu s ASN 541 Cb -0.16 -2.29 0.69 0.00 -0.55 0.00 0.00 41.25 38.94 1ggu s ASN 541 CO -0.08 -0.89 1.52 0.59 -2.79 0.00 0.00 177.10 175.45 1ggu n ASN 542 N 6.16 1.91 -3.78 -4.21 3.02 -0.14 -0.99 115.26 117.23 1ggu n ASN 542 Ca -0.07 -1.76 -0.14 0.00 -0.03 0.00 0.00 54.58 52.59 1ggu n ASN 542 Cb 0.45 -0.13 0.02 0.00 -0.61 0.00 0.00 39.78 39.52 1ggu n ASN 542 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1ggu n SER 543 N 0.49 1.66 -0.88 6.41 3.41 -1.25 -4.81 113.62 118.66 1ggu n SER 543 Ca 0.16 -2.05 0.11 0.00 -0.26 0.00 0.00 58.87 56.84 1ggu n SER 543 Cb 0.37 -0.15 0.10 0.00 -0.26 0.00 0.00 64.21 64.26 1ggu n SER 543 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1ggu n HIS 544 N -1.55 0.03 -3.40 7.33 8.25 -1.26 -0.36 115.22 124.25 1ggu n HIS 544 Ca 0.05 -0.02 -0.33 0.00 -0.26 0.00 0.00 57.72 57.17 1ggu n HIS 544 Cb 0.38 -0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.43 1ggu n HIS 544 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 1ggu s ASN 545 N -1.78 6.67 -0.18 0.41 0.01 -1.26 -4.68 114.94 114.13 1ggu s ASN 545 Ca 0.26 0.96 -0.08 0.00 -0.71 0.00 0.00 52.86 53.28 1ggu s ASN 545 Cb 0.18 -2.24 -0.05 0.00 0.41 0.00 0.00 41.25 39.55 1ggu s ASN 545 CO 0.27 -0.05 0.11 -0.60 -1.51 0.00 0.00 177.10 175.32 1ggu s ARG 546 N -2.67 3.95 0.34 -0.60 3.00 -1.26 -3.64 118.95 118.07 1ggu s ARG 546 Ca 0.46 -0.24 0.08 0.00 -1.00 0.00 0.00 55.73 55.04 1ggu s ARG 546 Cb -0.12 -3.30 -0.07 0.00 0.00 0.00 0.00 34.95 31.47 1ggu s ARG 546 CO 0.21 0.40 -0.07 0.71 0.00 0.00 0.00 175.30 176.55 1ggu s TYR 547 N 0.04 2.33 -0.07 5.12 2.02 -0.56 -5.00 117.35 121.23 1ggu s TYR 547 Ca 0.08 -0.57 0.01 0.00 -0.37 0.00 0.00 57.07 56.22 1ggu s TYR 547 Cb -0.12 -1.40 0.02 0.00 -0.40 0.00 0.00 41.96 40.07 1ggu s TYR 547 CO -0.00 0.50 -0.08 0.99 -1.57 0.00 0.00 175.55 175.38 1ggu s THR 548 N -2.71 0.90 0.19 -0.71 2.01 -1.26 -1.20 115.64 112.86 1ggu s THR 548 Ca 0.33 -0.31 0.10 0.00 0.31 0.00 0.00 61.69 62.12 1ggu s THR 548 Cb 0.04 -0.88 -0.04 0.00 0.01 0.00 0.00 72.50 71.62 1ggu s THR 548 CO 0.16 0.32 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.58 1ggu s ILE 549 N 1.04 2.05 -0.21 1.82 1.01 -0.09 -0.21 121.20 126.60 1ggu s ILE 549 Ca -0.08 -2.04 -0.01 0.00 0.00 0.00 0.00 60.65 58.52 1ggu s ILE 549 Cb -0.14 -2.00 0.06 0.00 0.01 0.00 0.00 42.46 40.38 1ggu s ILE 549 CO -0.00 -0.30 -0.03 -0.89 0.00 0.00 0.00 174.94 173.72 1ggu s THR 550 N -2.08 1.13 0.15 2.92 2.01 -0.47 -0.90 115.64 118.40 1ggu s THR 550 Ca 0.20 -0.90 0.01 0.00 0.31 0.00 0.00 61.69 61.30 1ggu s THR 550 Cb -0.06 -1.46 -0.04 0.00 0.01 0.00 0.00 72.50 70.95 1ggu s THR 550 CO 0.09 -0.09 0.31 0.00 -0.69 0.00 0.00 174.62 174.24 1ggu s ALA 551 N 1.58 3.92 0.01 7.40 0.00 0.15 -0.76 121.76 134.07 1ggu s ALA 551 Ca -0.03 -0.91 0.04 0.00 0.00 0.00 0.00 51.96 51.06 1ggu s ALA 551 Cb -0.18 -1.88 -0.01 0.00 0.00 0.00 0.00 23.12 21.05 1ggu s ALA 551 CO -0.07 0.55 -0.12 0.71 0.00 0.00 0.00 175.76 176.83 1ggu s TYR 552 N -1.75 1.08 -0.08 0.00 2.02 0.44 -1.29 117.35 117.78 1ggu s TYR 552 Ca 0.36 -0.28 0.01 0.00 -0.37 0.00 0.00 57.07 56.80 1ggu s TYR 552 Cb -0.11 -0.67 0.02 0.00 -0.40 0.00 0.00 41.96 40.80 1ggu s TYR 552 CO 0.28 0.00 -0.09 -1.17 -1.57 0.00 0.00 175.55 173.00 1ggu s LEU 553 N -0.71 1.43 -0.10 -1.29 1.98 0.25 -1.84 118.68 118.41 1ggu s LEU 553 Ca 0.02 -0.27 0.01 0.00 -2.89 0.00 0.00 54.13 51.00 1ggu s LEU 553 Cb -0.06 -0.77 0.02 0.00 0.66 0.00 0.00 46.19 46.04 1ggu s LEU 553 CO 0.00 -0.03 -0.10 -0.55 -1.89 0.00 0.00 176.35 173.78 1ggu s SER 554 N 1.05 2.05 -0.18 3.68 0.15 -0.97 -0.89 113.70 118.60 1ggu s SER 554 Ca -0.08 -0.31 -0.00 0.00 0.70 0.00 0.00 55.95 56.26 1ggu s SER 554 Cb -0.15 -0.86 0.01 0.00 -1.71 0.00 0.00 66.02 63.31 1ggu s SER 554 CO -0.01 -0.05 -0.15 0.00 1.20 0.00 0.00 173.24 174.23 1ggu s ALA 555 N 1.28 2.49 0.12 5.45 0.00 0.26 -0.75 121.76 130.62 1ggu s ALA 555 Ca -0.03 -1.13 0.08 0.00 0.00 0.00 0.00 51.96 50.88 1ggu s ALA 555 Cb -0.14 -1.29 -0.04 0.00 0.00 0.00 0.00 23.12 21.65 1ggu s ALA 555 CO -0.04 -0.22 -0.13 -0.80 0.00 0.00 0.00 175.76 174.57 1ggu s ASN 556 N 1.11 4.15 -0.11 0.00 0.02 0.18 -0.32 114.94 119.97 1ggu s ASN 556 Ca 0.00 -0.50 -0.17 0.00 -1.02 0.00 0.00 52.86 51.18 1ggu s ASN 556 Cb -0.14 -0.69 -0.05 0.00 0.02 0.00 0.00 41.25 40.39 1ggu s ASN 556 CO -0.05 0.16 0.43 -0.63 0.02 0.00 0.00 177.10 177.03 1ggu s ILE 557 N -1.27 5.19 0.27 0.60 1.09 0.06 -0.82 121.20 126.31 1ggu s ILE 557 Ca 0.20 0.85 0.03 0.00 -1.10 0.00 0.00 60.65 60.64 1ggu s ILE 557 Cb -0.10 -3.76 -0.04 0.00 -1.06 0.00 0.00 42.46 37.50 1ggu s ILE 557 CO 0.12 0.38 0.19 0.42 -0.10 0.00 0.00 174.94 175.95 1ggu s THR 558 N 0.33 0.09 0.52 2.92 -4.23 -1.03 -0.27 115.64 113.97 1ggu s THR 558 Ca 0.24 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.71 1ggu s THR 558 Cb -0.15 -2.50 -0.01 0.00 1.34 0.00 0.00 72.50 71.18 1ggu s THR 558 CO 0.09 0.00 0.79 0.12 -0.54 0.00 0.00 174.62 175.09 1ggu s PHE 559 N -3.77 3.31 0.59 3.99 5.36 -0.05 -4.08 117.98 123.34 1ggu s PHE 559 Ca 0.39 0.54 0.32 0.00 -0.96 0.00 0.00 56.93 57.21 1ggu s PHE 559 Cb 0.05 -2.49 1.89 0.00 -0.34 0.00 0.00 43.02 42.13 1ggu s PHE 559 CO 0.19 -0.54 2.26 0.10 -1.46 0.00 0.00 175.22 175.78 1ggu h TYR 560 N 0.12 0.00 0.00 10.12 -0.00 -1.90 -0.26 116.97 125.05 1ggu h TYR 560 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.27 1ggu h TYR 560 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.97 1ggu h TYR 560 CO 0.49 0.01 0.00 0.25 -0.00 0.00 0.00 178.16 178.91 1ggu n THR 561 N -3.73 0.20 -0.21 -0.90 -2.24 -1.26 -0.41 114.28 105.73 1ggu n THR 561 Ca -0.03 0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1ggu n THR 561 Cb 0.09 -0.70 0.00 0.00 -2.10 0.00 0.00 70.33 67.62 1ggu n THR 561 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ggu n GLY 562 N 0.46 1.31 3.65 3.38 0.00 -0.11 -3.61 105.19 110.28 1ggu n GLY 562 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 1ggu n GLY 562 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ggu s VAL 563 N -2.75 3.97 0.30 1.61 1.01 -1.26 -4.71 120.40 118.57 1ggu s VAL 563 Ca 0.00 1.15 -0.25 0.00 0.00 0.00 0.00 61.98 62.87 1ggu s VAL 563 Cb 0.00 -3.83 -0.10 0.00 0.00 0.00 0.00 36.38 32.45 1ggu s VAL 563 CO 0.00 -0.20 0.91 -2.16 0.00 0.00 0.00 175.10 173.65 1ggu s PRO 564 N 3.97 4.56 -0.21 2.72 0.04 -1.26 -0.87 135.00 143.94 1ggu s PRO 564 Ca 0.63 1.28 -0.01 0.00 0.04 0.00 0.00 61.00 62.93 1ggu s PRO 564 Cb -0.24 -2.85 -0.13 0.00 0.04 0.00 0.00 34.50 31.31 1ggu s PRO 564 CO 0.22 0.32 -0.21 1.17 0.04 0.00 0.00 177.00 178.54 1ggu n LYS 565 N 0.67 0.52 -3.62 4.56 4.81 0.63 -4.95 118.16 120.78 1ggu n LYS 565 Ca 0.01 0.14 -0.16 0.00 -0.87 0.00 0.00 58.31 57.43 1ggu n LYS 565 Cb 0.50 -1.40 -0.07 0.00 0.02 0.00 0.00 35.03 34.08 1ggu n LYS 565 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ggu s ALA 566 N -2.42 -1.40 -0.24 3.14 0.00 -1.23 -4.98 121.76 114.63 1ggu s ALA 566 Ca -0.29 0.99 -0.22 0.00 0.00 0.00 0.00 51.96 52.43 1ggu s ALA 566 Cb 0.08 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 23.15 1ggu s ALA 566 CO 0.47 -0.32 0.73 -2.00 0.00 0.00 0.00 175.76 174.63 1ggu s GLU 567 N -1.14 4.16 0.00 0.00 2.12 -1.26 -0.76 118.70 121.82 1ggu s GLU 567 Ca -0.11 0.75 0.22 0.00 0.36 0.00 0.00 54.97 56.19 1ggu s GLU 567 Cb -0.02 -3.64 -0.19 0.00 0.26 0.00 0.00 34.13 30.54 1ggu s GLU 567 CO 0.07 -0.44 0.82 1.97 -0.54 0.00 0.00 175.26 177.14 1ggu n PHE 568 N 5.74 0.05 -3.65 5.30 1.16 0.56 -4.96 117.46 121.68 1ggu n PHE 568 Ca 0.02 0.02 -0.10 0.00 -1.87 0.00 0.00 57.45 55.52 1ggu n PHE 568 Cb 0.48 -0.24 -0.08 0.00 -1.61 0.00 0.00 39.48 38.04 1ggu n PHE 568 CO 0.00 0.00 0.00 0.21 -1.87 0.00 0.00 176.76 175.10 1ggu s LYS 569 N -3.19 0.71 -0.01 3.97 2.20 -1.20 -4.88 119.74 117.35 1ggu s LYS 569 Ca 0.03 1.06 0.00 0.00 -0.36 0.00 0.00 55.97 56.70 1ggu s LYS 569 Cb 0.15 0.23 0.01 0.00 -1.51 0.00 0.00 37.83 36.70 1ggu s LYS 569 CO 0.86 -0.13 -0.00 0.21 -0.36 0.00 0.00 175.35 175.93 1ggu s LYS 570 N 1.08 0.11 -0.12 4.03 2.47 -1.26 -0.57 119.74 125.49 1ggu s LYS 570 Ca -0.06 0.01 -0.11 0.00 -1.56 0.00 0.00 55.97 54.25 1ggu s LYS 570 Cb -0.05 -0.18 0.03 0.00 -1.46 0.00 0.00 37.83 36.17 1ggu s LYS 570 CO -0.11 -0.02 0.31 -1.21 0.16 0.00 0.00 175.35 174.48 1ggu s GLU 571 N 0.28 0.36 -0.03 4.03 2.02 -0.06 -4.97 118.70 120.33 1ggu s GLU 571 Ca -0.02 0.45 0.03 0.00 0.02 0.00 0.00 54.97 55.45 1ggu s GLU 571 Cb -0.04 0.17 -0.00 0.00 0.10 0.00 0.00 34.13 34.35 1ggu s GLU 571 CO -0.01 -0.05 -0.12 -0.08 0.02 0.00 0.00 175.26 175.02 1ggu s THR 572 N 0.22 1.03 0.03 3.63 -1.32 -1.26 0.87 115.64 118.85 1ggu s THR 572 Ca -0.00 -0.51 -0.04 0.00 -1.21 0.00 0.00 61.69 59.92 1ggu s THR 572 Cb -0.03 -0.89 -0.01 0.00 -1.51 0.00 0.00 72.50 70.06 1ggu s THR 572 CO -0.00 0.31 0.07 0.72 -2.21 0.00 0.00 174.62 173.50 1ggu s PHE 573 N 0.02 0.23 -0.13 9.09 -0.71 -0.41 -4.99 117.98 121.07 1ggu s PHE 573 Ca -0.01 -0.54 -0.05 0.00 -1.04 0.00 0.00 56.93 55.30 1ggu s PHE 573 Cb -0.08 -0.17 -0.04 0.00 -1.21 0.00 0.00 43.02 41.52 1ggu s PHE 573 CO 0.01 -0.34 0.04 -0.51 -1.34 0.00 0.00 175.22 173.08 1ggu s ASP 574 N -2.05 5.49 0.06 1.98 1.11 -1.26 -0.67 116.67 121.33 1ggu s ASP 574 Ca -0.06 0.14 0.06 0.00 0.18 0.00 0.00 52.55 52.87 1ggu s ASP 574 Cb -0.02 -1.78 -0.03 0.00 1.07 0.00 0.00 42.92 42.17 1ggu s ASP 574 CO -0.04 0.28 -0.17 -0.69 1.18 0.00 0.00 175.17 175.73 1ggu s VAL 575 N -0.30 1.40 -0.28 -1.27 1.01 -0.08 -5.00 120.40 115.88 1ggu s VAL 575 Ca 0.08 -1.22 0.03 0.00 0.00 0.00 0.00 61.98 60.87 1ggu s VAL 575 Cb -0.12 -1.26 0.07 0.00 0.00 0.00 0.00 36.38 35.07 1ggu s VAL 575 CO 0.02 0.02 -0.05 -0.89 0.00 0.00 0.00 175.10 174.20 1ggu s THR 576 N -0.96 2.10 -0.27 3.92 2.01 -1.26 -0.92 115.64 120.26 1ggu s THR 576 Ca 0.04 -1.81 -0.25 0.00 0.31 0.00 0.00 61.69 59.98 1ggu s THR 576 Cb -0.09 -2.34 -0.00 0.00 0.01 0.00 0.00 72.50 70.08 1ggu s THR 576 CO 0.02 -0.23 0.84 -0.76 -0.69 0.00 0.00 174.62 173.81 1ggu s LEU 577 N 1.08 4.07 0.62 4.42 1.43 -0.34 -4.98 118.68 124.98 1ggu s LEU 577 Ca -0.02 0.91 -0.12 0.00 -1.03 0.00 0.00 54.13 53.87 1ggu s LEU 577 Cb -0.20 -3.19 -0.03 0.00 0.03 0.00 0.00 46.19 42.80 1ggu s LEU 577 CO -0.07 -0.59 1.03 -0.70 0.23 0.00 0.00 176.35 176.26 1ggu s GLU 578 N 2.98 3.46 0.28 1.70 2.56 -1.26 -1.50 118.70 126.91 1ggu s GLU 578 Ca 0.35 0.86 -0.30 0.00 0.00 0.00 0.00 54.97 55.88 1ggu s GLU 578 Cb -0.15 -2.06 -0.10 0.00 2.00 0.00 0.00 34.13 33.82 1ggu s GLU 578 CO 0.10 -0.68 1.41 -2.14 -0.56 0.00 0.00 175.26 173.39 1ggu s PRO 579 N -4.93 4.27 -0.55 4.30 0.02 -1.24 -4.04 135.00 132.83 1ggu s PRO 579 Ca 0.57 2.30 -0.17 0.00 0.02 0.00 0.00 61.00 63.72 1ggu s PRO 579 Cb -0.12 -3.09 0.02 0.00 0.02 0.00 0.00 34.50 31.34 1ggu s PRO 579 CO 0.50 -0.37 0.64 1.28 -0.33 0.00 0.00 177.00 178.72 1ggu n LEU 580 N 1.82 -5.28 -3.65 -5.54 4.77 0.51 -4.95 117.00 104.68 1ggu n LEU 580 Ca 0.05 -0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.98 1ggu n LEU 580 Cb 0.40 -2.61 -0.02 0.00 -2.33 0.00 0.00 43.42 38.87 1ggu n LEU 580 CO 0.60 -1.05 0.74 -0.94 -1.33 0.00 0.00 177.39 175.42 1ggu s SER 581 N -2.41 -0.23 0.16 -1.43 1.04 -0.16 -4.97 113.70 105.70 1ggu s SER 581 Ca 0.21 -0.23 0.05 0.00 0.48 0.00 0.00 55.95 56.46 1ggu s SER 581 Cb -0.04 0.42 -0.04 0.00 0.10 0.00 0.00 66.02 66.46 1ggu s SER 581 CO 0.82 -0.74 0.11 -0.36 0.98 0.00 0.00 173.24 174.05 1ggu s PHE 582 N -3.14 3.10 -0.20 5.02 0.40 -1.26 -0.46 117.98 121.45 1ggu s PHE 582 Ca 0.10 -0.03 -0.09 0.00 -0.60 0.00 0.00 56.93 56.31 1ggu s PHE 582 Cb -0.01 -1.50 0.08 0.00 0.51 0.00 0.00 43.02 42.10 1ggu s PHE 582 CO -0.02 0.52 0.46 0.21 0.70 0.00 0.00 175.22 177.08 1ggu s LYS 583 N -3.05 0.41 0.19 0.44 2.47 -0.75 -4.97 119.74 114.48 1ggu s LYS 583 Ca 0.30 0.97 0.08 0.00 -1.56 0.00 0.00 55.97 55.76 1ggu s LYS 583 Cb -0.10 0.18 -0.04 0.00 -1.46 0.00 0.00 37.83 36.41 1ggu s LYS 583 CO 0.23 -0.20 -0.00 0.15 0.16 0.00 0.00 175.35 175.69 1ggu s LYS 584 N 1.98 2.38 -0.10 4.03 1.02 -1.26 -0.88 119.74 126.91 1ggu s LYS 584 Ca -0.06 -1.17 -0.03 0.00 0.02 0.00 0.00 55.97 54.72 1ggu s LYS 584 Cb -0.10 -2.32 0.05 0.00 -0.52 0.00 0.00 37.83 34.95 1ggu s LYS 584 CO -0.14 0.44 0.11 -1.21 -0.92 0.00 0.00 175.35 173.63 1ggu s GLU 585 N -3.10 0.02 -0.02 1.68 0.41 0.11 -4.98 118.70 112.82 1ggu s GLU 585 Ca 0.28 0.30 -0.03 0.00 -0.41 0.00 0.00 54.97 55.11 1ggu s GLU 585 Cb -0.09 -0.86 -0.04 0.00 -1.78 0.00 0.00 34.13 31.37 1ggu s GLU 585 CO 0.19 -0.45 0.17 0.00 -0.49 0.00 0.00 175.26 174.68 1ggu s ALA 586 N 2.21 3.90 -0.02 5.21 0.00 -1.26 -0.18 121.76 131.62 1ggu s ALA 586 Ca 0.04 -0.77 0.03 0.00 0.00 0.00 0.00 51.96 51.26 1ggu s ALA 586 Cb -0.13 -1.85 -0.00 0.00 0.00 0.00 0.00 23.12 21.13 1ggu s ALA 586 CO -0.06 0.73 -0.12 0.08 0.00 0.00 0.00 175.76 176.39 1ggu s VAL 587 N -1.28 0.98 -0.19 0.00 1.01 0.14 -4.99 120.40 116.06 1ggu s VAL 587 Ca 0.26 -0.49 -0.07 0.00 0.00 0.00 0.00 61.98 61.68 1ggu s VAL 587 Cb -0.12 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.37 1ggu s VAL 587 CO 0.17 0.29 0.06 -0.22 0.00 0.00 0.00 175.10 175.40 1ggu s LEU 588 N 0.02 3.68 -0.27 3.92 0.20 -1.26 -1.55 118.68 123.42 1ggu s LEU 588 Ca -0.01 -0.00 -0.04 0.00 0.69 0.00 0.00 54.13 54.77 1ggu s LEU 588 Cb -0.08 -1.94 0.02 0.00 -0.43 0.00 0.00 46.19 43.76 1ggu s LEU 588 CO 0.01 0.13 0.01 -0.63 -0.29 0.00 0.00 176.35 175.58 1ggu s ILE 589 N 0.64 3.45 0.15 6.68 -1.09 0.49 -5.00 121.20 126.53 1ggu s ILE 589 Ca 0.03 -0.85 -0.14 0.00 -2.23 0.00 0.00 60.65 57.46 1ggu s ILE 589 Cb -0.13 -2.77 -0.07 0.00 -1.58 0.00 0.00 42.46 37.91 1ggu s ILE 589 CO 0.02 0.14 0.55 -1.10 -1.23 0.00 0.00 174.94 173.31 1ggu s GLN 590 N 1.42 3.96 0.26 2.79 -0.21 -1.26 -0.60 119.66 126.00 1ggu s GLN 590 Ca 0.01 0.46 -0.06 0.00 0.02 0.00 0.00 55.36 55.79 1ggu s GLN 590 Cb -0.17 -2.90 0.48 0.00 1.00 0.00 0.00 33.01 31.42 1ggu s GLN 590 CO -0.01 0.46 1.61 0.00 -2.12 0.00 0.00 175.29 175.24 1ggu h ALA 591 N 3.46 0.81 -0.49 6.09 0.00 -1.85 0.31 119.26 127.58 1ggu h ALA 591 Ca -0.48 0.28 0.14 0.00 0.00 0.00 0.00 54.91 54.85 1ggu h ALA 591 Cb 1.19 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 19.46 1ggu h ALA 591 CO 0.66 -0.44 0.53 0.78 0.00 0.00 0.00 179.25 180.78 1ggu h GLY 592 N 0.07 0.00 2.00 0.00 0.00 -1.92 -0.14 103.07 103.08 1ggu h GLY 592 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.78 1ggu h GLY 592 CO -0.75 0.00 0.00 0.83 0.00 0.00 0.00 176.54 176.62 1ggu h GLU 593 N 0.00 0.00 0.00 4.80 5.08 -0.76 -3.37 114.58 120.34 1ggu h GLU 593 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1ggu h GLU 593 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1ggu h GLU 593 CO -0.00 0.00 -0.05 2.48 -1.00 0.00 0.00 179.01 180.44 1ggu n TYR 594 N -3.02 0.00 0.10 4.33 0.18 -0.15 -4.81 117.16 113.79 1ggu n TYR 594 Ca 0.01 0.00 -0.11 0.00 1.88 0.00 0.00 57.90 59.68 1ggu n TYR 594 Cb 0.34 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.23 1ggu n TYR 594 CO 0.00 0.00 0.00 0.52 -2.08 0.00 0.00 176.86 175.30 1ggu h MET 595 N 0.00 -0.52 -0.04 -3.48 2.86 -1.47 -2.58 114.93 109.71 1ggu h MET 595 Ca 0.00 0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1ggu h MET 595 Cb 0.00 0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.78 1ggu h MET 595 CO 0.00 -0.34 0.00 0.41 1.06 0.00 0.00 176.91 178.04 1ggu n GLY 596 N -1.33 -0.24 0.55 8.32 0.00 -1.26 -3.70 105.19 107.53 1ggu n GLY 596 Ca -0.06 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.00 1ggu n GLY 596 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ggu n GLN 597 N -0.40 0.47 -2.61 1.61 10.64 -0.97 -5.08 117.38 121.04 1ggu n GLN 597 Ca 0.00 -1.77 -0.32 0.00 -1.83 0.00 0.00 57.00 53.08 1ggu n GLN 597 Cb 0.01 -0.78 -0.04 0.00 -0.86 0.00 0.00 30.24 28.57 1ggu n GLN 597 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1ggu s LEU 598 N -1.03 3.74 0.27 2.61 1.43 -1.24 -4.96 118.68 119.49 1ggu s LEU 598 Ca 0.17 1.47 0.05 0.00 -1.03 0.00 0.00 54.13 54.79 1ggu s LEU 598 Cb 0.17 -4.37 -0.02 0.00 0.03 0.00 0.00 46.19 41.99 1ggu s LEU 598 CO -0.02 -0.49 0.39 -0.76 0.23 0.00 0.00 176.35 175.70 1ggu s LEU 599 N -3.83 4.22 0.34 1.79 1.43 -1.26 -4.97 118.68 116.40 1ggu s LEU 599 Ca 0.57 0.01 -0.27 0.00 -1.03 0.00 0.00 54.13 53.41 1ggu s LEU 599 Cb -0.10 -2.84 -0.12 0.00 0.03 0.00 0.00 46.19 43.15 1ggu s LEU 599 CO 0.28 -0.17 1.14 -1.84 0.23 0.00 0.00 176.35 175.99 1ggu n GLU 600 N -1.48 1.70 -0.13 1.70 0.28 -1.26 -1.08 120.64 120.37 1ggu n GLU 600 Ca -0.07 0.60 0.00 0.00 -0.16 0.00 0.00 57.16 57.53 1ggu n GLU 600 Cb 0.57 -2.11 0.00 0.00 1.43 0.00 0.00 31.44 31.33 1ggu n GLU 600 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1ggu n GLN 601 N 0.51 0.00 -4.08 3.44 6.02 -1.26 -4.65 117.38 117.36 1ggu n GLN 601 Ca 0.07 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.67 1ggu n GLN 601 Cb 0.35 -0.96 -0.01 0.00 1.02 0.00 0.00 30.24 30.64 1ggu n GLN 601 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ggu n ALA 602 N -0.76 -2.41 -2.36 -1.58 0.00 -0.24 -4.43 120.51 108.73 1ggu n ALA 602 Ca 0.00 -0.48 -0.32 0.00 0.00 0.00 0.00 53.44 52.64 1ggu n ALA 602 Cb 0.00 -2.27 -0.06 0.00 0.00 0.00 0.00 19.45 17.13 1ggu n ALA 602 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1ggu s SER 603 N -3.81 6.68 0.02 0.00 0.01 -1.26 -0.79 113.70 114.55 1ggu s SER 603 Ca 0.33 1.00 0.02 0.00 1.31 0.00 0.00 55.95 58.61 1ggu s SER 603 Cb -0.17 -2.26 -0.01 0.00 0.21 0.00 0.00 66.02 63.79 1ggu s SER 603 CO 0.96 -0.07 -0.07 -0.76 0.41 0.00 0.00 173.24 173.70 1ggu s LEU 604 N -2.73 2.11 -0.03 2.44 1.02 0.69 -2.47 118.68 119.70 1ggu s LEU 604 Ca 0.47 -0.30 0.04 0.00 0.02 0.00 0.00 54.13 54.37 1ggu s LEU 604 Cb -0.12 -0.28 -0.00 0.00 0.02 0.00 0.00 46.19 45.81 1ggu s LEU 604 CO 0.20 -0.03 -0.16 -2.28 0.02 0.00 0.00 176.35 174.11 1ggu s HIS 605 N -0.65 1.54 -0.07 0.29 2.46 -0.01 -0.49 115.29 118.36 1ggu s HIS 605 Ca -0.02 -0.40 0.04 0.00 0.47 0.00 0.00 55.06 55.14 1ggu s HIS 605 Cb -0.06 -1.04 0.00 0.00 -0.13 0.00 0.00 32.58 31.36 1ggu s HIS 605 CO 0.00 -0.13 -0.20 -0.06 -2.47 0.00 0.00 174.74 171.89 1ggu s PHE 606 N -0.03 2.08 -0.02 3.88 0.08 0.32 0.50 117.98 124.80 1ggu s PHE 606 Ca -0.02 -0.74 0.05 0.00 0.12 0.00 0.00 56.93 56.35 1ggu s PHE 606 Cb -0.10 -1.41 -0.03 0.00 -0.57 0.00 0.00 43.02 40.92 1ggu s PHE 606 CO 0.01 -0.29 -0.16 -0.06 -0.10 0.00 0.00 175.22 174.62 1ggu s PHE 607 N 0.26 2.64 -0.23 0.36 0.08 0.08 -1.57 117.98 119.59 1ggu s PHE 607 Ca -0.12 -0.20 -0.03 0.00 0.12 0.00 0.00 56.93 56.70 1ggu s PHE 607 Cb -0.15 -1.57 0.07 0.00 -0.57 0.00 0.00 43.02 40.80 1ggu s PHE 607 CO 0.05 0.19 0.07 0.08 -0.10 0.00 0.00 175.22 175.51 1ggu s VAL 608 N -0.79 0.42 0.09 -0.44 1.01 0.27 -2.28 120.40 118.68 1ggu s VAL 608 Ca 0.12 -0.69 0.10 0.00 0.00 0.00 0.00 61.98 61.51 1ggu s VAL 608 Cb -0.11 -1.08 -0.03 0.00 0.00 0.00 0.00 36.38 35.16 1ggu s VAL 608 CO 0.02 -0.38 -0.26 0.42 0.00 0.00 0.00 175.10 174.90 1ggu s THR 609 N 1.89 2.14 0.14 3.92 -4.23 -0.77 -0.77 115.64 117.95 1ggu s THR 609 Ca 0.03 -1.57 -0.05 0.00 -1.18 0.00 0.00 61.69 58.92 1ggu s THR 609 Cb -0.17 -1.87 -0.02 0.00 1.34 0.00 0.00 72.50 71.78 1ggu s THR 609 CO -0.16 0.19 0.17 0.00 -0.54 0.00 0.00 174.62 174.28 1ggu s ALA 610 N -0.95 0.39 -0.03 3.99 0.00 -0.17 0.17 121.76 125.15 1ggu s ALA 610 Ca 0.12 -1.15 -0.00 0.00 0.00 0.00 0.00 51.96 50.93 1ggu s ALA 610 Cb -0.10 0.83 0.03 0.00 0.00 0.00 0.00 23.12 23.88 1ggu s ALA 610 CO 0.04 -0.56 0.02 0.50 0.00 0.00 0.00 175.76 175.76 1ggu s ARG 611 N -4.00 0.19 -0.38 0.00 3.00 0.06 -2.26 118.95 115.56 1ggu s ARG 611 Ca 0.19 0.16 -0.25 0.00 -1.00 0.00 0.00 55.73 54.83 1ggu s ARG 611 Cb 0.05 -0.49 0.01 0.00 0.00 0.00 0.00 34.95 34.53 1ggu s ARG 611 CO -0.00 -0.20 0.87 0.42 0.00 0.00 0.00 175.30 176.40 1ggu s ILE 612 N 1.35 4.62 0.19 4.11 1.01 -0.36 -1.37 121.20 130.75 1ggu s ILE 612 Ca -0.05 1.02 -0.12 0.00 0.00 0.00 0.00 60.65 61.49 1ggu s ILE 612 Cb -0.13 -4.30 0.14 0.00 0.01 0.00 0.00 42.46 38.17 1ggu s ILE 612 CO -0.03 -0.54 1.70 0.78 0.00 0.00 0.00 174.94 176.85 1ggu h ASN 613 N 8.56 -0.10 -0.24 3.58 2.35 -0.91 -0.63 115.58 128.20 1ggu h ASN 613 Ca -0.24 0.11 -0.03 0.00 -0.55 0.00 0.00 56.30 55.60 1ggu h ASN 613 Cb 1.08 0.17 -0.02 0.00 0.05 0.00 0.00 38.32 39.61 1ggu h ASN 613 CO 0.96 -0.03 0.08 -0.33 -1.65 0.00 0.00 177.43 176.47 1ggu h GLU 614 N 0.19 0.44 -0.00 0.81 3.07 -1.94 -3.26 114.58 113.89 1ggu h GLU 614 Ca 0.27 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 1ggu h GLU 614 Cb 0.40 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.23 1ggu h GLU 614 CO -0.39 0.41 -0.16 0.25 -1.40 0.00 0.00 179.01 177.72 1ggu n THR 615 N -4.37 0.00 -0.93 1.13 -2.24 -1.19 -4.99 114.28 101.69 1ggu n THR 615 Ca 0.01 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 1ggu n THR 615 Cb 0.17 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 1ggu n THR 615 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ggu n ARG 616 N -1.07 -0.73 -1.82 -0.78 5.12 -0.25 -4.99 116.66 112.14 1ggu n ARG 616 Ca 0.01 0.18 -0.38 0.00 -1.93 0.00 0.00 57.85 55.73 1ggu n ARG 616 Cb 0.05 -3.87 0.04 0.00 -1.16 0.00 0.00 32.46 27.52 1ggu n ARG 616 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1ggu s ASP 617 N -2.14 5.25 -0.08 0.55 1.11 -1.23 -4.74 116.67 115.40 1ggu s ASP 617 Ca 0.00 2.70 0.03 0.00 0.18 0.00 0.00 52.55 55.46 1ggu s ASP 617 Cb 0.00 -2.63 -0.02 0.00 1.07 0.00 0.00 42.92 41.34 1ggu s ASP 617 CO 0.00 -1.58 -0.17 -0.69 1.18 0.00 0.00 175.17 173.91 1ggu s VAL 618 N -1.34 2.75 -0.09 -1.27 1.01 -1.26 -1.23 120.40 118.96 1ggu s VAL 618 Ca 0.73 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.93 1ggu s VAL 618 Cb -0.39 -2.08 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 1ggu s VAL 618 CO 0.45 0.56 -0.21 -0.76 0.00 0.00 0.00 175.10 175.15 1ggu s LEU 619 N -0.22 2.30 -0.06 3.92 1.43 -0.96 -4.87 118.68 120.21 1ggu s LEU 619 Ca -0.00 -0.45 -0.12 0.00 -1.03 0.00 0.00 54.13 52.53 1ggu s LEU 619 Cb -0.13 -1.46 0.02 0.00 0.03 0.00 0.00 46.19 44.65 1ggu s LEU 619 CO 0.03 0.21 0.28 0.00 0.23 0.00 0.00 176.35 177.10 1ggu s ALA 620 N 0.07 -0.70 -0.09 4.21 0.00 -1.26 -1.00 121.76 122.99 1ggu s ALA 620 Ca -0.09 0.52 -0.27 0.00 0.00 0.00 0.00 51.96 52.12 1ggu s ALA 620 Cb -0.15 -0.20 0.06 0.00 0.00 0.00 0.00 23.12 22.83 1ggu s ALA 620 CO 0.06 -0.19 0.62 0.15 0.00 0.00 0.00 175.76 176.39 1ggu s LYS 621 N -0.59 0.94 0.08 0.00 -0.14 0.05 -4.98 119.74 115.09 1ggu s LYS 621 Ca -0.07 0.33 0.06 0.00 -1.36 0.00 0.00 55.97 54.93 1ggu s LYS 621 Cb -0.04 0.44 -0.03 0.00 -1.68 0.00 0.00 37.83 36.52 1ggu s LYS 621 CO 0.02 -0.26 -0.15 1.14 -0.76 0.00 0.00 175.35 175.34 1ggu s GLN 622 N -0.88 0.88 0.01 1.68 -2.07 -1.26 -0.56 119.66 117.46 1ggu s GLN 622 Ca -0.09 -1.01 -0.14 0.00 -1.82 0.00 0.00 55.36 52.30 1ggu s GLN 622 Cb -0.02 -0.93 0.02 0.00 -1.09 0.00 0.00 33.01 30.99 1ggu s GLN 622 CO 0.07 0.21 0.29 0.15 -1.32 0.00 0.00 175.29 174.69 1ggu s LYS 623 N -1.82 0.73 0.14 9.60 3.01 -0.61 -5.01 119.74 125.76 1ggu s LYS 623 Ca 0.00 -0.36 0.08 0.00 -1.01 0.00 0.00 55.97 54.68 1ggu s LYS 623 Cb -0.10 0.32 -0.04 0.00 -1.01 0.00 0.00 37.83 37.00 1ggu s LYS 623 CO 0.03 -0.22 -0.18 -1.12 0.51 0.00 0.00 175.35 174.37 1ggu s SER 624 N -1.70 2.51 0.04 2.83 0.01 -1.26 -0.52 113.70 115.61 1ggu s SER 624 Ca -0.09 -0.79 -0.07 0.00 1.31 0.00 0.00 55.95 56.31 1ggu s SER 624 Cb -0.03 -0.14 -0.01 0.00 0.21 0.00 0.00 66.02 66.06 1ggu s SER 624 CO 0.00 -0.02 0.12 0.28 0.41 0.00 0.00 173.24 174.04 1ggu s THR 625 N -1.75 0.12 0.01 1.44 -1.32 0.35 -4.90 115.64 109.59 1ggu s THR 625 Ca 0.11 -1.01 0.06 0.00 -1.21 0.00 0.00 61.69 59.64 1ggu s THR 625 Cb -0.07 -0.87 -0.02 0.00 -1.51 0.00 0.00 72.50 70.03 1ggu s THR 625 CO 0.05 -0.56 -0.18 0.68 -2.21 0.00 0.00 174.62 172.40 1ggu s VAL 626 N -2.52 1.46 0.14 5.08 -7.23 -1.26 -0.22 120.40 115.84 1ggu s VAL 626 Ca -0.06 -0.92 -0.26 0.00 -1.81 0.00 0.00 61.98 58.93 1ggu s VAL 626 Cb -0.02 -1.24 -0.07 0.00 0.56 0.00 0.00 36.38 35.61 1ggu s VAL 626 CO -0.04 0.30 0.80 -0.76 -0.31 0.00 0.00 175.10 175.09 1ggu s LEU 627 N -0.73 4.55 -0.27 1.32 1.43 0.03 -4.52 118.68 120.50 1ggu s LEU 627 Ca 0.06 1.63 -0.29 0.00 -1.03 0.00 0.00 54.13 54.51 1ggu s LEU 627 Cb -0.08 -3.33 -0.00 0.00 0.03 0.00 0.00 46.19 42.81 1ggu s LEU 627 CO 0.00 0.13 1.29 -0.89 0.23 0.00 0.00 176.35 177.11 1ggu s THR 628 N -0.76 4.19 -0.26 5.49 2.01 -0.72 -4.73 115.64 120.85 1ggu s THR 628 Ca 0.38 1.36 -0.17 0.00 0.31 0.00 0.00 61.69 63.57 1ggu s THR 628 Cb -0.23 -4.13 -0.03 0.00 0.01 0.00 0.00 72.50 68.12 1ggu s THR 628 CO 0.26 -0.40 0.47 -0.63 -0.69 0.00 0.00 174.62 173.64 1ggu s ILE 629 N 4.17 5.10 0.66 1.82 1.01 -1.26 -1.54 121.20 131.17 1ggu s ILE 629 Ca 0.55 0.80 -0.18 0.00 0.00 0.00 0.00 60.65 61.83 1ggu s ILE 629 Cb -0.18 -3.79 -0.00 0.00 0.01 0.00 0.00 42.46 38.50 1ggu s ILE 629 CO 0.21 0.12 1.28 -2.65 0.00 0.00 0.00 174.94 173.89 1ggu n PRO 630 N 5.39 1.02 -0.96 2.79 -0.02 -1.26 -4.92 135.00 137.03 1ggu n PRO 630 Ca -0.05 0.41 -0.29 0.00 -2.02 0.00 0.00 63.50 61.55 1ggu n PRO 630 Cb 0.50 -2.52 0.19 0.00 -0.02 0.00 0.00 33.50 31.66 1ggu n PRO 630 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1ggu s GLU 631 N -3.43 0.14 0.13 -0.52 0.41 -1.26 -4.71 118.70 109.45 1ggu s GLU 631 Ca 0.82 0.70 0.01 0.00 -0.41 0.00 0.00 54.97 56.08 1ggu s GLU 631 Cb -0.37 -1.69 -0.04 0.00 -1.78 0.00 0.00 34.13 30.25 1ggu s GLU 631 CO 0.41 -2.97 0.28 0.42 -0.49 0.00 0.00 175.26 172.91 1ggu s ILE 632 N -2.79 5.32 -0.17 -1.63 1.01 -0.90 -4.75 121.20 117.29 1ggu s ILE 632 Ca 0.66 -0.51 -0.03 0.00 0.00 0.00 0.00 60.65 60.77 1ggu s ILE 632 Cb -0.21 -3.70 -0.02 0.00 0.01 0.00 0.00 42.46 38.54 1ggu s ILE 632 CO 0.60 -0.02 -0.06 -0.63 0.00 0.00 0.00 174.94 174.82 1ggu s ILE 633 N -1.68 3.55 -0.09 2.92 -1.09 -0.22 -4.56 121.20 120.02 1ggu s ILE 633 Ca 0.36 -0.47 0.04 0.00 -2.23 0.00 0.00 60.65 58.34 1ggu s ILE 633 Cb -0.12 -2.56 -0.01 0.00 -1.58 0.00 0.00 42.46 38.20 1ggu s ILE 633 CO 0.28 0.48 -0.21 -0.63 -1.23 0.00 0.00 174.94 173.63 1ggu s ILE 634 N 0.65 2.37 0.04 2.92 1.01 -1.26 0.10 121.20 127.03 1ggu s ILE 634 Ca -0.04 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 59.71 1ggu s ILE 634 Cb -0.15 -1.92 -0.02 0.00 0.01 0.00 0.00 42.46 40.38 1ggu s ILE 634 CO 0.02 0.56 -0.08 -0.54 0.00 0.00 0.00 174.94 174.90 1ggu s LYS 635 N 0.12 0.55 0.08 2.79 1.02 0.22 -4.84 119.74 119.68 1ggu s LYS 635 Ca -0.10 -0.73 0.04 0.00 0.02 0.00 0.00 55.97 55.19 1ggu s LYS 635 Cb -0.16 -0.35 -0.03 0.00 -0.52 0.00 0.00 37.83 36.77 1ggu s LYS 635 CO 0.06 0.07 -0.11 0.14 -0.92 0.00 0.00 175.35 174.59 1ggu s VAL 636 N -1.28 0.92 0.13 3.17 -7.23 -1.26 0.20 120.40 115.05 1ggu s VAL 636 Ca -0.08 -1.50 -0.13 0.00 -1.81 0.00 0.00 61.98 58.46 1ggu s VAL 636 Cb -0.09 -1.20 0.01 0.00 0.56 0.00 0.00 36.38 35.66 1ggu s VAL 636 CO 0.01 -0.47 0.33 0.00 -0.31 0.00 0.00 175.10 174.66 1ggu s ARG 637 N -2.41 1.06 0.02 4.82 1.70 -0.39 -4.96 118.95 118.79 1ggu s ARG 637 Ca 0.02 -0.89 0.00 0.00 -0.47 0.00 0.00 55.73 54.38 1ggu s ARG 637 Cb -0.05 0.42 0.00 0.00 -0.57 0.00 0.00 34.95 34.75 1ggu s ARG 637 CO 0.01 -0.40 0.00 0.41 -1.08 0.00 0.00 175.30 174.24 1ggu n GLY 638 N -0.19 -0.78 3.57 3.88 0.00 -1.26 -0.09 105.19 110.31 1ggu n GLY 638 Ca -0.13 -1.89 -0.42 0.00 0.00 0.00 0.00 46.02 43.58 1ggu n GLY 638 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ggu s THR 639 N 0.00 4.86 -1.04 2.61 -4.23 -1.06 -4.94 115.64 111.83 1ggu s THR 639 Ca 0.00 0.59 -0.14 0.00 -1.18 0.00 0.00 61.69 60.96 1ggu s THR 639 Cb 0.00 -4.11 0.20 0.00 1.34 0.00 0.00 72.50 69.93 1ggu s THR 639 CO 0.00 -0.36 1.15 -1.10 -0.54 0.00 0.00 174.62 173.77 1ggu s GLN 640 N 2.78 3.91 -0.05 3.99 -0.21 -1.26 -3.86 119.66 124.96 1ggu s GLN 640 Ca 0.25 -2.54 -0.08 0.00 0.02 0.00 0.00 55.36 53.02 1ggu s GLN 640 Cb -0.14 -4.77 0.01 0.00 1.00 0.00 0.00 33.01 29.11 1ggu s GLN 640 CO 0.15 -1.54 0.19 0.08 -2.12 0.00 0.00 175.29 172.06 1ggu s VAL 641 N 0.81 0.03 -0.03 1.09 1.01 -1.26 0.05 120.40 122.10 1ggu s VAL 641 Ca 0.32 -0.23 -0.33 0.00 0.00 0.00 0.00 61.98 61.75 1ggu s VAL 641 Cb -0.07 -0.35 -0.11 0.00 0.00 0.00 0.00 36.38 35.86 1ggu s VAL 641 CO -0.06 -0.12 1.89 0.52 0.00 0.00 0.00 175.10 177.33 1ggu n VAL 642 N 2.43 0.59 -0.44 2.92 0.31 0.71 -1.37 118.33 123.48 1ggu n VAL 642 Ca -0.16 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 1ggu n VAL 642 Cb 0.58 -1.99 0.00 0.00 -0.91 0.00 0.00 33.84 31.51 1ggu n VAL 642 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ggu n GLY 643 N 4.39 1.01 3.37 2.92 0.00 -0.10 -4.97 105.19 111.81 1ggu n GLY 643 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 1ggu n GLY 643 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ggu s SER 644 N -3.04 3.39 0.26 1.61 0.01 -0.47 -4.97 113.70 110.50 1ggu s SER 644 Ca 0.00 -0.41 -0.30 0.00 1.31 0.00 0.00 55.95 56.55 1ggu s SER 644 Cb 0.00 -0.49 -0.10 0.00 0.21 0.00 0.00 66.02 65.64 1ggu s SER 644 CO 0.00 0.31 1.38 -1.81 0.41 0.00 0.00 173.24 173.53 1ggu s ASP 645 N -0.81 6.73 0.01 2.44 1.01 -1.26 -4.30 116.67 120.48 1ggu s ASP 645 Ca 0.11 2.62 0.01 0.00 0.71 0.00 0.00 52.55 56.00 1ggu s ASP 645 Cb -0.10 -2.63 -0.01 0.00 1.01 0.00 0.00 42.92 41.19 1ggu s ASP 645 CO 0.00 -0.63 -0.02 0.00 0.21 0.00 0.00 175.17 174.73 1ggu s MET 646 N -0.67 0.20 -0.19 8.23 0.23 -1.04 -2.56 119.30 123.50 1ggu s MET 646 Ca 0.56 -0.20 -0.10 0.00 -1.03 0.00 0.00 55.69 54.92 1ggu s MET 646 Cb -0.40 -0.11 -0.05 0.00 -1.53 0.00 0.00 34.83 32.74 1ggu s MET 646 CO 0.45 0.02 0.15 0.99 -2.03 0.00 0.00 175.02 174.60 1ggu s THR 647 N -0.37 5.40 -0.10 3.16 2.01 0.87 -1.51 115.64 125.10 1ggu s THR 647 Ca -0.03 0.23 -0.08 0.00 0.31 0.00 0.00 61.69 62.12 1ggu s THR 647 Cb -0.03 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 1ggu s THR 647 CO -0.00 0.45 0.18 -0.69 -0.69 0.00 0.00 174.62 173.87 1ggu s VAL 648 N 0.28 5.44 -0.19 3.82 1.01 0.25 -1.26 120.40 129.74 1ggu s VAL 648 Ca 0.09 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.38 1ggu s VAL 648 Cb -0.11 -3.45 0.04 0.00 0.00 0.00 0.00 36.38 32.86 1ggu s VAL 648 CO -0.01 0.61 -0.08 -0.89 0.00 0.00 0.00 175.10 174.74 1ggu s THR 649 N -1.04 1.43 -0.14 3.92 2.01 0.53 -0.92 115.64 121.44 1ggu s THR 649 Ca 0.16 -0.90 -0.02 0.00 0.31 0.00 0.00 61.69 61.25 1ggu s THR 649 Cb -0.13 -1.57 -0.02 0.00 0.01 0.00 0.00 72.50 70.79 1ggu s THR 649 CO 0.05 0.12 -0.09 0.68 -0.69 0.00 0.00 174.62 174.69 1ggu s VAL 650 N 1.48 3.40 -0.00 3.82 -7.23 0.09 0.71 120.40 122.66 1ggu s VAL 650 Ca -0.01 -0.54 0.01 0.00 -1.81 0.00 0.00 61.98 59.63 1ggu s VAL 650 Cb -0.16 -2.45 -0.00 0.00 0.56 0.00 0.00 36.38 34.32 1ggu s VAL 650 CO -0.08 0.51 -0.05 -1.83 -0.31 0.00 0.00 175.10 173.35 1ggu s GLU 651 N 0.34 0.38 -0.11 4.82 -1.05 0.12 -0.17 118.70 123.03 1ggu s GLU 651 Ca -0.08 -0.16 0.02 0.00 -0.15 0.00 0.00 54.97 54.60 1ggu s GLU 651 Cb -0.15 -0.37 0.01 0.00 -0.44 0.00 0.00 34.13 33.18 1ggu s GLU 651 CO 0.05 0.09 -0.17 0.12 0.95 0.00 0.00 175.26 176.30 1ggu s PHE 652 N -0.08 2.10 -0.37 4.83 5.36 -0.50 -1.06 117.98 128.27 1ggu s PHE 652 Ca 0.01 -0.96 -0.11 0.00 -0.96 0.00 0.00 56.93 54.92 1ggu s PHE 652 Cb -0.02 -1.48 0.02 0.00 -0.34 0.00 0.00 43.02 41.20 1ggu s PHE 652 CO -0.00 -0.46 0.19 0.99 -1.46 0.00 0.00 175.22 174.48 1ggu s THR 653 N 0.81 4.53 -0.42 0.12 2.01 -1.26 -2.02 115.64 119.41 1ggu s THR 653 Ca -0.10 -0.83 -0.32 0.00 0.31 0.00 0.00 61.69 60.75 1ggu s THR 653 Cb -0.16 -3.51 -0.11 0.00 0.01 0.00 0.00 72.50 68.74 1ggu s THR 653 CO 0.01 -0.20 2.28 -3.20 -0.69 0.00 0.00 174.62 172.82 1ggu n ASN 654 N 4.99 2.12 0.04 3.53 2.85 -0.85 -4.86 115.26 123.07 1ggu n ASN 654 Ca -0.12 0.21 -0.07 0.00 -0.11 0.00 0.00 54.58 54.49 1ggu n ASN 654 Cb 0.46 -1.32 0.10 0.00 1.24 0.00 0.00 39.78 40.26 1ggu n ASN 654 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1ggu h PRO 655 N 13.90 0.42 -7.27 1.20 0.13 -1.95 -3.17 132.00 135.27 1ggu h PRO 655 Ca -0.26 -0.26 -0.51 0.00 -0.87 0.00 0.00 66.00 64.11 1ggu h PRO 655 Cb 1.30 0.03 0.18 0.00 0.13 0.00 0.00 31.00 32.64 1ggu h PRO 655 CO 1.07 0.85 0.22 -0.51 -0.23 0.00 0.00 178.00 179.40 1ggu s LEU 656 N -8.22 2.59 -0.02 1.56 1.02 -1.26 -4.83 118.68 109.51 1ggu s LEU 656 Ca -0.06 1.99 0.18 0.00 0.02 0.00 0.00 54.13 56.26 1ggu s LEU 656 Cb 0.12 -4.37 0.57 0.00 0.02 0.00 0.00 46.19 42.53 1ggu s LEU 656 CO 0.82 -3.01 1.47 0.29 0.02 0.00 0.00 176.35 175.94 1ggu n LYS 657 N -4.16 2.66 -4.40 1.70 4.01 -1.26 -4.12 118.16 112.59 1ggu n LYS 657 Ca 0.10 -2.30 -0.24 0.00 -0.51 0.00 0.00 58.31 55.36 1ggu n LYS 657 Cb 0.53 -1.56 -0.09 0.00 -0.51 0.00 0.00 35.03 33.40 1ggu n LYS 657 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 1ggu s GLU 658 N -1.32 1.97 -0.01 1.97 -1.05 -1.26 -4.91 118.70 114.09 1ggu s GLU 658 Ca 0.42 -1.71 -0.15 0.00 -0.15 0.00 0.00 54.97 53.39 1ggu s GLU 658 Cb 0.23 -1.90 -0.06 0.00 -0.44 0.00 0.00 34.13 31.97 1ggu s GLU 658 CO 0.27 0.25 0.41 -0.08 0.95 0.00 0.00 175.26 177.06 1ggu s THR 659 N -2.48 5.04 -0.18 1.83 -1.32 -1.26 -4.15 115.64 113.11 1ggu s THR 659 Ca 0.32 0.85 -0.09 0.00 -1.21 0.00 0.00 61.69 61.56 1ggu s THR 659 Cb -0.03 -3.72 -0.05 0.00 -1.51 0.00 0.00 72.50 67.19 1ggu s THR 659 CO 0.18 0.55 0.13 -0.76 -2.21 0.00 0.00 174.62 172.51 1ggu s LEU 660 N -0.90 4.25 -0.12 9.08 1.43 -0.90 -4.94 118.68 126.59 1ggu s LEU 660 Ca 0.24 0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 53.62 1ggu s LEU 660 Cb -0.17 -2.08 -0.03 0.00 0.03 0.00 0.00 46.19 43.95 1ggu s LEU 660 CO 0.13 0.24 -0.06 -0.13 0.23 0.00 0.00 176.35 176.76 1ggu s ARG 661 N -0.01 3.25 -1.22 1.70 3.00 -1.26 -0.74 118.95 123.67 1ggu s ARG 661 Ca 0.10 -0.55 -0.00 0.00 0.00 0.00 0.00 55.73 55.28 1ggu s ARG 661 Cb -0.11 -2.75 0.00 0.00 0.00 0.00 0.00 34.95 32.09 1ggu s ARG 661 CO -0.00 0.42 0.96 0.09 0.00 0.00 0.00 175.30 176.76 1ggu n ASN 662 N 2.97 -2.01 -4.64 0.23 5.03 -0.63 -1.16 115.26 115.04 1ggu n ASN 662 Ca -0.18 -0.65 -0.43 0.00 0.87 0.00 0.00 54.58 54.19 1ggu n ASN 662 Cb 0.53 -4.95 -0.02 0.00 -1.02 0.00 0.00 39.78 34.31 1ggu n ASN 662 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1ggu s VAL 663 N -3.41 3.97 -0.17 2.41 1.01 0.36 -4.02 120.40 120.56 1ggu s VAL 663 Ca 0.02 1.14 -0.06 0.00 0.00 0.00 0.00 61.98 63.08 1ggu s VAL 663 Cb -0.01 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 1ggu s VAL 663 CO 0.74 -0.25 0.01 0.26 0.00 0.00 0.00 175.10 175.87 1ggu s TRP 664 N 4.25 3.13 -0.11 5.22 0.52 0.12 -0.57 118.94 131.51 1ggu s TRP 664 Ca 0.63 -0.13 0.01 0.00 0.02 0.00 0.00 56.10 56.63 1ggu s TRP 664 Cb -0.23 -2.02 -0.02 0.00 -1.15 0.00 0.00 33.47 30.05 1ggu s TRP 664 CO 0.23 0.04 -0.15 0.08 0.02 0.00 0.00 176.95 177.17 1ggu s VAL 665 N 0.40 2.90 0.12 4.03 1.01 -0.70 -0.42 120.40 127.74 1ggu s VAL 665 Ca -0.01 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 61.33 1ggu s VAL 665 Cb -0.13 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 1ggu s VAL 665 CO 0.02 0.54 -0.15 -1.00 0.00 0.00 0.00 175.10 174.51 1ggu s HIS 666 N 0.11 2.60 0.00 5.22 3.76 0.34 -1.69 115.29 125.63 1ggu s HIS 666 Ca -0.07 -0.23 0.03 0.00 -0.15 0.00 0.00 55.06 54.64 1ggu s HIS 666 Cb -0.15 -1.36 -0.01 0.00 1.11 0.00 0.00 32.58 32.17 1ggu s HIS 666 CO 0.05 0.41 -0.11 -1.17 -0.85 0.00 0.00 174.74 173.08 1ggu s LEU 667 N -2.25 2.06 0.27 0.89 2.96 0.10 -1.67 118.68 121.05 1ggu s LEU 667 Ca 0.20 -0.25 -0.19 0.00 -0.22 0.00 0.00 54.13 53.66 1ggu s LEU 667 Cb -0.10 -0.51 0.02 0.00 0.50 0.00 0.00 46.19 46.09 1ggu s LEU 667 CO 0.12 0.09 0.67 -0.62 -1.32 0.00 0.00 176.35 175.29 1ggu s ASP 668 N -0.47 -0.22 0.00 3.68 -1.08 0.21 -1.94 116.67 116.84 1ggu s ASP 668 Ca 0.03 -0.68 0.00 0.00 -0.52 0.00 0.00 52.55 51.38 1ggu s ASP 668 Cb -0.05 0.70 0.00 0.00 -1.46 0.00 0.00 42.92 42.11 1ggu s ASP 668 CO -0.00 -1.31 0.00 0.61 0.52 0.00 0.00 175.17 174.99 1ggu n GLY 669 N -0.44 -0.20 3.68 2.66 0.00 -1.25 0.76 105.19 110.39 1ggu n GLY 669 Ca -0.04 0.66 -0.45 0.00 0.00 0.00 0.00 46.02 46.20 1ggu n GLY 669 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ggu n PRO 670 N 0.00 2.26 0.00 1.61 -0.04 -1.26 -0.51 135.00 137.05 1ggu n PRO 670 Ca 0.00 0.81 0.00 0.00 -0.04 0.00 0.00 63.50 64.27 1ggu n PRO 670 Cb 0.00 -2.57 0.00 0.00 -0.04 0.00 0.00 33.50 30.89 1ggu n PRO 670 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ggu n GLY 671 N 3.15 2.84 0.30 0.55 0.00 -1.26 -4.72 105.19 106.04 1ggu n GLY 671 Ca 0.15 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.98 1ggu n GLY 671 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ggu n VAL 672 N -2.00 1.09 -3.66 1.61 0.31 -0.55 -0.04 118.33 115.09 1ggu n VAL 672 Ca 0.00 -0.32 -0.12 0.00 -0.01 0.00 0.00 64.34 63.89 1ggu n VAL 672 Cb 0.00 -1.60 -0.06 0.00 -0.91 0.00 0.00 33.84 31.27 1ggu n VAL 672 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1ggu s THR 673 N -2.37 0.06 0.46 2.52 -1.32 0.33 -4.04 115.64 111.29 1ggu s THR 673 Ca -0.27 -0.49 -0.17 0.00 -1.21 0.00 0.00 61.69 59.55 1ggu s THR 673 Cb 0.10 -0.98 -0.09 0.00 -1.51 0.00 0.00 72.50 70.02 1ggu s THR 673 CO 0.37 -0.27 0.94 -0.60 -2.21 0.00 0.00 174.62 172.85 1ggu s ARG 674 N -2.66 4.02 0.27 7.08 6.06 -1.26 -3.88 118.95 128.59 1ggu s ARG 674 Ca -0.04 0.94 -0.30 0.00 -2.50 0.00 0.00 55.73 53.83 1ggu s ARG 674 Cb -0.00 -2.20 -0.10 0.00 0.06 0.00 0.00 34.95 32.71 1ggu s ARG 674 CO -0.04 -0.14 1.45 -1.25 -2.50 0.00 0.00 175.30 172.82 1ggu s PRO 675 N -3.70 4.25 0.18 5.12 0.04 -1.26 -4.75 135.00 134.88 1ggu s PRO 675 Ca 0.59 2.35 -0.12 0.00 0.04 0.00 0.00 61.00 63.86 1ggu s PRO 675 Cb -0.10 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.36 1ggu s PRO 675 CO 0.25 -0.44 0.37 0.00 0.04 0.00 0.00 177.00 177.22 1ggu s MET 676 N -0.63 1.27 0.06 4.56 0.23 -0.82 -5.01 119.30 118.96 1ggu s MET 676 Ca 0.58 -1.11 -0.15 0.00 -1.03 0.00 0.00 55.69 53.98 1ggu s MET 676 Cb -0.43 0.43 0.03 0.00 -1.53 0.00 0.00 34.83 33.32 1ggu s MET 676 CO 0.46 -0.49 0.35 -1.59 -2.03 0.00 0.00 175.02 171.72 1ggu s LYS 677 N -3.95 0.88 0.02 3.16 -2.85 -1.26 -0.72 119.74 115.02 1ggu s LYS 677 Ca 0.16 -0.50 0.02 0.00 -1.00 0.00 0.00 55.97 54.65 1ggu s LYS 677 Cb 0.02 0.39 -0.01 0.00 -2.06 0.00 0.00 37.83 36.16 1ggu s LYS 677 CO 0.01 -0.30 -0.06 0.21 0.10 0.00 0.00 175.35 175.30 1ggu s LYS 678 N -2.74 0.45 -0.04 1.78 2.20 -0.68 -4.98 119.74 115.73 1ggu s LYS 678 Ca -0.04 -0.47 0.01 0.00 -0.36 0.00 0.00 55.97 55.12 1ggu s LYS 678 Cb -0.00 -0.32 -0.03 0.00 -1.51 0.00 0.00 37.83 35.97 1ggu s LYS 678 CO -0.04 0.07 -0.04 1.41 -0.36 0.00 0.00 175.35 176.39 1ggu s MET 679 N -0.86 2.76 -0.31 4.03 -2.45 -1.26 -1.73 119.30 119.48 1ggu s MET 679 Ca -0.04 -0.57 -0.00 0.00 -1.25 0.00 0.00 55.69 53.82 1ggu s MET 679 Cb -0.06 -2.63 0.07 0.00 1.25 0.00 0.00 34.83 33.45 1ggu s MET 679 CO 0.00 0.65 0.01 -0.06 1.05 0.00 0.00 175.02 176.67 1ggu s PHE 680 N -0.93 3.37 0.56 4.11 0.08 0.27 -4.99 117.98 120.46 1ggu s PHE 680 Ca 0.15 -2.19 0.31 0.00 0.12 0.00 0.00 56.93 55.32 1ggu s PHE 680 Cb -0.11 -2.33 1.47 0.00 -0.57 0.00 0.00 43.02 41.48 1ggu s PHE 680 CO 0.05 -0.86 1.86 0.00 -0.10 0.00 0.00 175.22 176.17 1ggu h ARG 681 N 7.91 0.00 -1.44 0.44 2.47 -1.92 0.11 114.38 121.95 1ggu h ARG 681 Ca -0.17 0.00 0.12 0.00 -1.26 0.00 0.00 59.98 58.66 1ggu h ARG 681 Cb 1.05 0.00 -0.28 0.00 -1.65 0.00 0.00 29.97 29.09 1ggu h ARG 681 CO 0.54 0.00 0.52 -1.83 0.56 0.00 0.00 179.97 179.76 1ggu s GLU 682 N -4.84 0.34 -0.38 0.04 -1.05 -1.25 -1.61 118.70 109.95 1ggu s GLU 682 Ca -0.05 0.49 0.04 0.00 -0.15 0.00 0.00 54.97 55.30 1ggu s GLU 682 Cb 0.20 0.12 0.11 0.00 -0.44 0.00 0.00 34.13 34.11 1ggu s GLU 682 CO 0.70 -0.05 0.10 0.42 0.95 0.00 0.00 175.26 177.37 1ggu s ILE 683 N 0.72 2.31 1.03 1.83 1.01 0.08 -4.96 121.20 123.22 1ggu s ILE 683 Ca -0.02 -2.55 -0.15 0.00 0.00 0.00 0.00 60.65 57.93 1ggu s ILE 683 Cb -0.04 -2.68 0.10 0.00 0.01 0.00 0.00 42.46 39.84 1ggu s ILE 683 CO -0.11 -0.65 0.40 0.54 0.00 0.00 0.00 174.94 175.11 1ggu n ARG 684 N 3.99 -0.98 -1.45 2.79 5.12 -1.26 -2.12 116.66 122.75 1ggu n ARG 684 Ca 0.04 -0.25 -0.36 0.00 -1.93 0.00 0.00 57.85 55.35 1ggu n ARG 684 Cb 0.40 -1.88 0.08 0.00 -1.16 0.00 0.00 32.46 29.89 1ggu n ARG 684 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 1ggu n PRO 685 N -2.40 0.64 -0.64 5.56 -0.02 -1.26 -2.45 135.00 134.42 1ggu n PRO 685 Ca 0.05 0.27 -0.02 0.00 -2.02 0.00 0.00 63.50 61.77 1ggu n PRO 685 Cb 0.56 -2.21 -0.01 0.00 -0.02 0.00 0.00 33.50 31.83 1ggu n PRO 685 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1ggu n ASN 686 N -1.38 -2.54 -4.90 2.55 4.13 -1.20 -4.93 115.26 106.99 1ggu n ASN 686 Ca 0.13 0.06 -0.28 0.00 1.68 0.00 0.00 54.58 56.17 1ggu n ASN 686 Cb 0.49 -1.95 0.08 0.00 -1.54 0.00 0.00 39.78 36.86 1ggu n ASN 686 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1ggu s SER 687 N -1.09 4.59 -0.10 6.41 0.15 -1.03 -4.85 113.70 117.78 1ggu s SER 687 Ca 0.00 0.67 -0.05 0.00 0.70 0.00 0.00 55.95 57.27 1ggu s SER 687 Cb 0.00 -1.21 0.05 0.00 -1.71 0.00 0.00 66.02 63.15 1ggu s SER 687 CO 0.00 -1.81 0.24 -0.89 1.20 0.00 0.00 173.24 171.98 1ggu s THR 688 N -3.47 -0.08 0.23 6.45 2.01 -1.26 -2.01 115.64 117.50 1ggu s THR 688 Ca 0.61 0.17 0.07 0.00 0.31 0.00 0.00 61.69 62.86 1ggu s THR 688 Cb -0.11 -0.38 -0.04 0.00 0.01 0.00 0.00 72.50 71.99 1ggu s THR 688 CO 0.48 0.07 0.10 0.68 -0.69 0.00 0.00 174.62 175.26 1ggu s VAL 689 N 1.39 4.08 -0.02 3.82 -7.23 -0.86 -4.96 120.40 116.63 1ggu s VAL 689 Ca -0.08 -1.48 -0.02 0.00 -1.81 0.00 0.00 61.98 58.59 1ggu s VAL 689 Cb -0.11 -3.15 0.01 0.00 0.56 0.00 0.00 36.38 33.69 1ggu s VAL 689 CO -0.08 -0.27 0.05 -1.58 -0.31 0.00 0.00 175.10 172.90 1ggu s GLN 690 N -3.52 0.05 -0.00 4.82 0.74 -1.26 -1.41 119.66 119.09 1ggu s GLN 690 Ca 0.31 0.08 0.04 0.00 0.05 0.00 0.00 55.36 55.85 1ggu s GLN 690 Cb -0.08 0.00 -0.01 0.00 1.10 0.00 0.00 33.01 34.02 1ggu s GLN 690 CO 0.22 -0.02 -0.14 -0.46 -0.55 0.00 0.00 175.29 174.34 1ggu s TRP 691 N 0.12 1.27 -0.04 1.67 -0.00 0.76 -4.99 118.94 117.74 1ggu s TRP 691 Ca -0.01 -0.26 0.01 0.00 -0.00 0.00 0.00 56.10 55.84 1ggu s TRP 691 Cb -0.01 -0.80 0.02 0.00 -0.00 0.00 0.00 33.47 32.68 1ggu s TRP 691 CO -0.00 -0.01 -0.03 -1.21 -0.00 0.00 0.00 176.95 175.70 1ggu s GLU 692 N -0.49 0.62 0.03 5.86 2.02 -1.25 -0.73 118.70 124.76 1ggu s GLU 692 Ca 0.05 -0.06 0.04 0.00 0.02 0.00 0.00 54.97 55.02 1ggu s GLU 692 Cb -0.06 -0.68 -0.02 0.00 0.10 0.00 0.00 34.13 33.47 1ggu s GLU 692 CO -0.00 -0.08 -0.11 -1.21 0.02 0.00 0.00 175.26 173.88 1ggu s GLU 693 N 0.84 0.75 -0.33 1.61 0.41 -0.10 -4.94 118.70 116.94 1ggu s GLU 693 Ca -0.10 -0.63 -0.17 0.00 -0.41 0.00 0.00 54.97 53.66 1ggu s GLU 693 Cb -0.13 -0.70 -0.01 0.00 -1.78 0.00 0.00 34.13 31.50 1ggu s GLU 693 CO -0.00 0.17 0.46 0.54 -0.49 0.00 0.00 175.26 175.94 1ggu s VAL 694 N -0.79 5.08 -0.14 2.63 0.11 -1.26 0.84 120.40 126.87 1ggu s VAL 694 Ca -0.01 0.35 -0.03 0.00 -2.93 0.00 0.00 61.98 59.37 1ggu s VAL 694 Cb -0.07 -3.88 -0.03 0.00 -1.53 0.00 0.00 36.38 30.87 1ggu s VAL 694 CO 0.01 -0.10 -0.04 0.00 -3.33 0.00 0.00 175.10 171.63 1ggu s ARG 696 N 0.22 2.43 0.32 0.00 3.52 -1.26 -2.50 118.95 121.68 1ggu s ARG 696 Ca -0.03 -2.47 -0.29 0.00 -0.13 0.00 0.00 55.73 52.82 1ggu s ARG 696 Cb -0.14 -3.66 -0.13 0.00 -1.56 0.00 0.00 34.95 29.46 1ggu s ARG 696 CO 0.03 -1.15 1.26 -0.35 -0.81 0.00 0.00 175.30 174.27 1ggu n PRO 697 N 3.55 1.97 -0.01 5.12 -0.04 -1.26 -4.70 135.00 139.64 1ggu n PRO 697 Ca 0.07 0.69 0.02 0.00 -0.04 0.00 0.00 63.50 64.24 1ggu n PRO 697 Cb 0.38 -2.25 0.02 0.00 -0.04 0.00 0.00 33.50 31.61 1ggu n PRO 697 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1ggu n TRP 698 N 0.56 0.02 -4.77 0.54 2.14 0.94 -0.92 117.44 115.94 1ggu n TRP 698 Ca 0.07 -0.07 -0.25 0.00 2.07 0.00 0.00 57.50 59.31 1ggu n TRP 698 Cb 0.35 -0.01 -0.16 0.00 -0.81 0.00 0.00 31.31 30.68 1ggu n TRP 698 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 1ggu s VAL 699 N -0.42 1.34 0.39 -1.67 1.01 -0.88 -4.96 120.40 115.21 1ggu s VAL 699 Ca 0.05 -0.67 0.08 0.00 0.00 0.00 0.00 61.98 61.43 1ggu s VAL 699 Cb 0.03 -1.15 -0.02 0.00 0.00 0.00 0.00 36.38 35.25 1ggu s VAL 699 CO 0.05 0.39 0.37 -0.94 0.00 0.00 0.00 175.10 174.97 1ggu s SER 700 N 0.01 5.18 0.00 3.32 1.04 -1.26 -4.81 113.70 117.17 1ggu s SER 700 Ca -0.03 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 55.76 1ggu s SER 700 Cb -0.11 -0.70 0.00 0.00 0.10 0.00 0.00 66.02 65.32 1ggu s SER 700 CO 0.02 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.27 1ggu n GLY 701 N -1.53 -1.83 3.65 7.32 0.00 -0.61 -4.88 105.19 107.31 1ggu n GLY 701 Ca 0.02 -1.94 -0.43 0.00 0.00 0.00 0.00 46.02 43.68 1ggu n GLY 701 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ggu s HIS 702 N 0.00 2.30 0.50 1.61 5.65 -1.26 -0.98 115.29 123.11 1ggu s HIS 702 Ca 0.00 0.56 0.01 0.00 0.25 0.00 0.00 55.06 55.89 1ggu s HIS 702 Cb 0.00 -3.82 -0.01 0.00 -1.18 0.00 0.00 32.58 27.58 1ggu s HIS 702 CO 0.00 -2.86 0.03 1.03 -0.65 0.00 0.00 174.74 172.30 1ggu s ARG 703 N 4.07 2.17 -0.09 2.88 1.81 0.20 -4.99 118.95 125.00 1ggu s ARG 703 Ca 0.66 -2.39 -0.13 0.00 -1.72 0.00 0.00 55.73 52.16 1ggu s ARG 703 Cb -0.27 -1.30 0.03 0.00 -0.45 0.00 0.00 34.95 32.96 1ggu s ARG 703 CO 0.25 -0.43 0.33 0.21 -0.68 0.00 0.00 175.30 174.98 1ggu s LYS 704 N -3.84 0.48 -0.11 3.54 2.47 -1.26 -1.42 119.74 119.60 1ggu s LYS 704 Ca 0.07 0.27 -0.03 0.00 -1.56 0.00 0.00 55.97 54.72 1ggu s LYS 704 Cb 0.01 0.23 -0.03 0.00 -1.46 0.00 0.00 37.83 36.57 1ggu s LYS 704 CO 0.04 -0.09 -0.00 -0.51 0.16 0.00 0.00 175.35 174.95 1ggu s LEU 705 N -0.28 3.53 0.01 5.43 1.43 0.17 -3.99 118.68 124.98 1ggu s LEU 705 Ca -0.04 0.08 0.02 0.00 -1.03 0.00 0.00 54.13 53.17 1ggu s LEU 705 Cb -0.03 -1.82 -0.01 0.00 0.03 0.00 0.00 46.19 44.35 1ggu s LEU 705 CO 0.02 0.32 -0.07 -0.63 0.23 0.00 0.00 176.35 176.21 1ggu s ILE 706 N -0.53 0.55 0.12 -0.59 1.01 0.23 -0.20 121.20 121.78 1ggu s ILE 706 Ca 0.09 -0.54 -0.08 0.00 0.00 0.00 0.00 60.65 60.12 1ggu s ILE 706 Cb -0.12 -0.51 -0.01 0.00 0.01 0.00 0.00 42.46 41.83 1ggu s ILE 706 CO 0.02 -0.01 0.20 0.00 0.00 0.00 0.00 174.94 175.15 1ggu s ALA 707 N -0.53 -0.01 0.21 9.38 0.00 0.46 0.63 121.76 131.90 1ggu s ALA 707 Ca -0.01 -0.82 -0.12 0.00 0.00 0.00 0.00 51.96 51.01 1ggu s ALA 707 Cb -0.05 0.65 -0.00 0.00 0.00 0.00 0.00 23.12 23.72 1ggu s ALA 707 CO 0.00 -0.55 0.41 -1.54 0.00 0.00 0.00 175.76 174.08 1ggu s SER 708 N -2.92 -0.07 -0.08 0.00 1.04 -0.67 -1.07 113.70 109.94 1ggu s SER 708 Ca 0.11 -0.88 -0.05 0.00 0.48 0.00 0.00 55.95 55.61 1ggu s SER 708 Cb 0.05 0.53 0.03 0.00 0.10 0.00 0.00 66.02 66.73 1ggu s SER 708 CO -0.06 -1.04 0.19 -0.32 0.98 0.00 0.00 173.24 172.99 1ggu s MET 709 N -3.99 0.19 -0.06 4.02 1.75 0.14 -0.50 119.30 120.84 1ggu s MET 709 Ca 0.20 0.35 -0.03 0.00 -1.25 0.00 0.00 55.69 54.96 1ggu s MET 709 Cb 0.01 -0.01 0.04 0.00 2.84 0.00 0.00 34.83 37.71 1ggu s MET 709 CO 0.05 -0.09 0.14 0.45 -0.65 0.00 0.00 175.02 174.92 1ggu s SER 710 N 0.59 -0.01 0.27 1.11 0.15 0.44 -3.49 113.70 112.75 1ggu s SER 710 Ca -0.04 0.28 0.00 0.00 0.70 0.00 0.00 55.95 56.89 1ggu s SER 710 Cb -0.06 0.17 -0.00 0.00 -1.71 0.00 0.00 66.02 64.42 1ggu s SER 710 CO -0.03 -0.16 0.01 -1.54 1.20 0.00 0.00 173.24 172.72 1ggu n SER 711 N 4.31 2.55 0.11 5.45 3.41 -0.37 0.10 113.62 129.18 1ggu n SER 711 Ca -0.25 -2.20 0.08 0.00 -0.26 0.00 0.00 58.87 56.25 1ggu n SER 711 Cb 0.51 0.24 0.42 0.00 -0.26 0.00 0.00 64.21 65.12 1ggu n SER 711 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1ggu n ASP 712 N -1.24 0.41 0.00 4.04 9.92 -0.31 -4.50 116.55 124.87 1ggu n ASP 712 Ca -0.10 0.67 0.00 0.00 -0.53 0.00 0.00 54.79 54.83 1ggu n ASP 712 Cb 0.35 -0.73 0.00 0.00 -0.64 0.00 0.00 41.12 40.09 1ggu n ASP 712 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1ggu n SER 713 N -2.03 0.00 -4.68 -2.24 3.41 -1.26 -5.03 113.62 101.79 1ggu n SER 713 Ca -0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.18 1ggu n SER 713 Cb 0.06 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.01 1ggu n SER 713 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1ggu n LEU 714 N -0.39 3.22 0.00 1.04 7.94 -1.26 -4.90 117.00 122.66 1ggu n LEU 714 Ca 0.00 1.20 -0.02 0.00 -1.11 0.00 0.00 56.01 56.08 1ggu n LEU 714 Cb 0.00 -1.45 0.02 0.00 0.53 0.00 0.00 43.42 42.52 1ggu n LEU 714 CO 0.00 -0.65 0.74 -1.14 -1.11 0.00 0.00 177.39 175.23 1ggu n ARG 715 N 0.63 0.55 -2.95 1.96 0.63 -1.26 -1.24 116.66 114.99 1ggu n ARG 715 Ca 0.06 -1.28 -0.13 0.00 -0.92 0.00 0.00 57.85 55.58 1ggu n ARG 715 Cb 0.35 1.75 0.04 0.00 0.45 0.00 0.00 32.46 35.05 1ggu n ARG 715 CO 0.00 0.00 0.00 1.58 -2.51 0.00 0.00 177.63 176.70 1ggu n HIS 716 N -0.66 -1.39 -4.38 -0.14 -0.00 -1.25 -4.62 115.22 102.79 1ggu n HIS 716 Ca -0.02 0.46 -0.34 0.00 0.46 0.00 0.00 57.72 58.28 1ggu n HIS 716 Cb 0.52 -3.07 -0.13 0.00 -0.12 0.00 0.00 29.99 27.19 1ggu n HIS 716 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1ggu s VAL 717 N -3.07 3.59 0.24 3.57 1.01 -1.23 -4.92 120.40 119.58 1ggu s VAL 717 Ca 0.27 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 61.80 1ggu s VAL 717 Cb -0.12 -2.57 -0.05 0.00 0.00 0.00 0.00 36.38 33.64 1ggu s VAL 717 CO 0.33 0.48 0.07 -0.31 0.00 0.00 0.00 175.10 175.67 1ggu s TYR 718 N 0.63 1.46 0.18 5.22 2.02 -1.26 -0.68 117.35 124.91 1ggu s TYR 718 Ca -0.04 -1.14 -0.24 0.00 -0.37 0.00 0.00 57.07 55.29 1ggu s TYR 718 Cb -0.15 -0.85 0.06 0.00 -0.40 0.00 0.00 41.96 40.62 1ggu s TYR 718 CO 0.03 -0.30 0.77 0.20 -1.57 0.00 0.00 175.55 174.67 1ggu s GLY 719 N -3.28 -0.33 0.21 0.71 0.00 -0.24 -2.11 107.32 102.29 1ggu s GLY 719 Ca 0.34 0.21 -0.23 0.00 0.00 0.00 0.00 44.72 45.04 1ggu s GLY 719 CO 0.11 0.06 0.76 -1.83 0.00 0.00 0.00 173.10 172.21 1ggu s GLU 720 N -3.61 1.49 -0.21 2.90 -1.05 -1.26 -0.40 118.70 116.56 1ggu s GLU 720 Ca 0.08 -0.77 -0.10 0.00 -0.15 0.00 0.00 54.97 54.03 1ggu s GLU 720 Cb -0.03 0.55 0.08 0.00 -0.44 0.00 0.00 34.13 34.28 1ggu s GLU 720 CO -0.02 -0.68 0.48 -1.17 0.95 0.00 0.00 175.26 174.82 1ggu s LEU 721 N -2.86 -0.46 0.23 1.83 1.98 0.71 -4.59 118.68 115.52 1ggu s LEU 721 Ca 0.09 1.08 -0.30 0.00 -2.89 0.00 0.00 54.13 52.11 1ggu s LEU 721 Cb -0.04 1.61 -0.09 0.00 0.66 0.00 0.00 46.19 48.34 1ggu s LEU 721 CO 0.01 -0.21 0.97 -1.81 -1.89 0.00 0.00 176.35 173.41 1ggu s ASP 722 N 1.84 7.58 0.01 3.68 1.01 -1.26 0.42 116.67 129.95 1ggu s ASP 722 Ca -0.08 1.98 -0.00 0.00 0.71 0.00 0.00 52.55 55.16 1ggu s ASP 722 Cb -0.09 -2.61 -0.01 0.00 1.01 0.00 0.00 42.92 41.22 1ggu s ASP 722 CO -0.15 0.09 -0.02 0.68 0.21 0.00 0.00 175.17 175.99 1ggu s VAL 723 N -1.04 0.07 -0.26 -1.27 -7.23 -0.50 -4.94 120.40 105.23 1ggu s VAL 723 Ca 0.42 -0.62 -0.08 0.00 -1.81 0.00 0.00 61.98 59.89 1ggu s VAL 723 Cb -0.27 -0.18 -0.03 0.00 0.56 0.00 0.00 36.38 36.46 1ggu s VAL 723 CO 0.33 -0.34 0.10 -1.10 -0.31 0.00 0.00 175.10 173.78 1ggu s GLN 724 N -1.00 3.69 -0.27 4.82 -1.52 -1.26 -0.63 119.66 123.50 1ggu s GLN 724 Ca -0.11 -0.46 -0.10 0.00 -1.95 0.00 0.00 55.36 52.74 1ggu s GLN 724 Cb -0.07 -3.40 -0.05 0.00 -0.22 0.00 0.00 33.01 29.28 1ggu s GLN 724 CO -0.01 -0.20 0.17 0.42 -0.25 0.00 0.00 175.29 175.42 1ggu s ILE 725 N 1.64 5.19 0.83 1.08 1.09 -0.15 -4.81 121.20 126.07 1ggu s ILE 725 Ca 0.06 0.13 -0.12 0.00 -1.10 0.00 0.00 60.65 59.62 1ggu s ILE 725 Cb -0.15 -3.45 0.09 0.00 -1.06 0.00 0.00 42.46 37.88 1ggu s ILE 725 CO 0.05 0.28 1.11 -1.10 -0.10 0.00 0.00 174.94 175.18 1ggu s GLN 726 N 1.59 1.80 0.00 2.79 -1.52 0.11 -1.57 119.66 122.86 1ggu s GLN 726 Ca 0.07 0.55 0.26 0.00 -1.95 0.00 0.00 55.36 54.29 1ggu s GLN 726 Cb -0.15 -1.89 0.65 0.00 -0.22 0.00 0.00 33.01 31.39 1ggu s GLN 726 CO 0.09 -1.80 1.52 0.54 -0.25 0.00 0.00 175.29 175.39