#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qfu s THR 10 N 0.00 1.23 0.04 6.66 -4.23 -1.26 -5.16 115.64 112.91 1qfu s THR 10 Ca 0.00 -2.06 -0.17 0.00 -1.18 0.00 0.00 61.69 58.28 1qfu s THR 10 Cb 0.00 -2.36 0.03 0.00 1.34 0.00 0.00 72.50 71.51 1qfu s THR 10 CO 0.00 -0.33 0.38 0.00 -0.54 0.00 0.00 174.62 174.13 1qfu s ALA 11 N -3.29 -0.92 -0.06 3.99 0.00 -1.26 -5.17 121.76 115.05 1qfu s ALA 11 Ca 0.28 0.25 0.05 0.00 0.00 0.00 0.00 51.96 52.54 1qfu s ALA 11 Cb 0.05 0.31 -0.02 0.00 0.00 0.00 0.00 23.12 23.46 1qfu s ALA 11 CO 0.09 -0.42 -0.21 0.99 0.00 0.00 0.00 175.76 176.21 1qfu s THR 12 N -2.36 2.39 -0.12 0.00 2.01 -1.26 -5.11 115.64 111.19 1qfu s THR 12 Ca -0.06 -0.95 -0.00 0.00 0.31 0.00 0.00 61.69 60.99 1qfu s THR 12 Cb -0.01 -1.90 0.03 0.00 0.01 0.00 0.00 72.50 70.62 1qfu s THR 12 CO -0.02 0.57 -0.07 -0.22 -0.69 0.00 0.00 174.62 174.19 1qfu s LEU 13 N -0.24 1.28 -0.18 4.42 2.96 -1.26 -5.12 118.68 120.54 1qfu s LEU 13 Ca -0.00 -0.37 -0.00 0.00 -0.22 0.00 0.00 54.13 53.53 1qfu s LEU 13 Cb -0.13 -0.87 0.00 0.00 0.50 0.00 0.00 46.19 45.69 1qfu s LEU 13 CO 0.03 -0.13 -0.15 0.00 -1.32 0.00 0.00 176.35 174.79 1qfu s LEU 15 N 1.12 3.99 0.00 0.00 2.01 -1.26 -5.06 118.68 119.48 1qfu s LEU 15 Ca 0.01 1.40 -0.04 0.00 0.01 0.00 0.00 54.13 55.51 1qfu s LEU 15 Cb -0.14 -4.23 0.01 0.00 0.01 0.00 0.00 46.19 41.84 1qfu s LEU 15 CO -0.05 -0.28 0.17 0.61 1.01 0.00 0.00 176.35 177.81 1qfu n GLY 16 N -0.56 1.28 3.29 -3.19 0.00 -1.26 -5.19 105.19 99.56 1qfu n GLY 16 Ca 0.05 -0.98 -0.09 0.00 0.00 0.00 0.00 46.02 45.00 1qfu n GLY 16 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1qfu s HIS 17 N -5.73 0.49 0.96 1.61 -3.43 -1.26 -5.18 115.29 102.75 1qfu s HIS 17 Ca 0.04 -0.86 -0.14 0.00 -0.80 0.00 0.00 55.06 53.29 1qfu s HIS 17 Cb -0.01 -0.15 0.17 0.00 -1.43 0.00 0.00 32.58 31.16 1qfu s HIS 17 CO 0.01 -0.66 1.19 -3.38 -2.00 0.00 0.00 174.74 169.90 1qfu s HIS 18 N -3.98 1.99 0.06 0.38 -3.43 -1.26 -5.09 115.29 103.97 1qfu s HIS 18 Ca 0.18 0.64 -0.23 0.00 -0.80 0.00 0.00 55.06 54.85 1qfu s HIS 18 Cb 0.04 -3.61 0.06 0.00 -1.43 0.00 0.00 32.58 27.64 1qfu s HIS 18 CO -0.00 -2.61 0.54 0.00 -2.00 0.00 0.00 174.74 170.67 1qfu s ALA 19 N -3.44 -1.39 0.12 -1.38 0.00 -1.26 -4.72 121.76 109.68 1qfu s ALA 19 Ca 0.67 0.61 0.09 0.00 0.00 0.00 0.00 51.96 53.33 1qfu s ALA 19 Cb -0.11 0.45 -0.04 0.00 0.00 0.00 0.00 23.12 23.43 1qfu s ALA 19 CO 0.53 -0.55 -0.22 0.14 0.00 0.00 0.00 175.76 175.67 1qfu s VAL 20 N -2.64 1.84 0.14 0.00 -7.23 -1.26 -5.05 120.40 106.20 1qfu s VAL 20 Ca -0.04 -1.64 -0.19 0.00 -1.81 0.00 0.00 61.98 58.30 1qfu s VAL 20 Cb -0.00 -1.68 -0.01 0.00 0.56 0.00 0.00 36.38 35.25 1qfu s VAL 20 CO -0.03 -0.07 1.71 1.55 -0.31 0.00 0.00 175.10 177.96 1qfu h PRO 21 N 3.92 0.07 -4.69 4.82 0.13 -2.01 -3.41 132.00 130.83 1qfu h PRO 21 Ca -0.47 -0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.03 1qfu h PRO 21 Cb 1.18 -0.02 -0.37 0.00 0.13 0.00 0.00 31.00 31.93 1qfu h PRO 21 CO 0.41 0.05 -0.81 0.54 -0.23 0.00 0.00 178.00 177.95 1qfu s ASN 22 N -5.24 3.60 0.02 1.44 4.22 -1.26 -4.98 114.94 112.74 1qfu s ASN 22 Ca -0.13 -0.98 0.00 0.00 -2.14 0.00 0.00 52.86 49.61 1qfu s ASN 22 Cb 0.11 -1.33 0.00 0.00 1.28 0.00 0.00 41.25 41.31 1qfu s ASN 22 CO 0.69 -0.14 0.00 0.61 -2.04 0.00 0.00 177.10 176.22 1qfu n GLY 23 N 4.62 1.58 2.90 0.45 0.00 -1.26 -5.00 105.19 108.49 1qfu n GLY 23 Ca -0.15 -2.01 -0.25 0.00 0.00 0.00 0.00 46.02 43.61 1qfu n GLY 23 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qfu s THR 24 N 1.57 0.85 0.24 2.61 2.01 0.22 -4.91 115.64 118.23 1qfu s THR 24 Ca 0.00 -0.22 -0.30 0.00 0.31 0.00 0.00 61.69 61.48 1qfu s THR 24 Cb 0.00 -0.88 -0.09 0.00 0.01 0.00 0.00 72.50 71.54 1qfu s THR 24 CO 0.00 0.32 1.24 -0.76 -0.69 0.00 0.00 174.62 174.73 1qfu s LEU 25 N 1.43 4.46 0.26 4.42 1.43 -1.26 -1.18 118.68 128.24 1qfu s LEU 25 Ca -0.01 2.40 0.01 0.00 -1.03 0.00 0.00 54.13 55.50 1qfu s LEU 25 Cb -0.13 -3.62 -0.05 0.00 0.03 0.00 0.00 46.19 42.42 1qfu s LEU 25 CO -0.04 -0.41 0.11 0.68 0.23 0.00 0.00 176.35 176.92 1qfu s VAL 26 N -0.49 0.43 0.03 -1.59 -7.23 0.11 -4.86 120.40 106.79 1qfu s VAL 26 Ca 0.51 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.73 1qfu s VAL 26 Cb -0.35 -2.59 -0.03 0.00 0.56 0.00 0.00 36.38 33.96 1qfu s VAL 26 CO 0.42 0.00 -0.10 -0.75 -0.31 0.00 0.00 175.10 174.36 1qfu s LYS 27 N -4.01 2.37 0.09 4.82 2.20 -1.25 -0.47 119.74 123.49 1qfu s LYS 27 Ca 0.38 -0.83 0.01 0.00 -0.36 0.00 0.00 55.97 55.17 1qfu s LYS 27 Cb 0.07 -2.39 -0.01 0.00 -1.51 0.00 0.00 37.83 33.99 1qfu s LYS 27 CO 0.14 0.57 0.05 0.25 -0.36 0.00 0.00 175.35 176.01 1qfu n THR 28 N 1.43 0.00 -0.03 3.43 -2.24 -0.46 -4.99 114.28 111.42 1qfu n THR 28 Ca -0.15 -0.59 -0.02 0.00 -2.27 0.00 0.00 64.05 61.02 1qfu n THR 28 Cb 0.52 0.25 0.24 0.00 -2.10 0.00 0.00 70.33 69.24 1qfu n THR 28 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1qfu h ILE 29 N 1.21 1.23 0.00 2.28 1.08 -2.00 -3.31 117.51 118.00 1qfu h ILE 29 Ca -0.07 -0.95 0.00 0.00 -0.39 0.00 0.00 64.86 63.45 1qfu h ILE 29 Cb 0.30 1.01 0.00 0.00 -3.07 0.00 0.00 36.82 35.06 1qfu h ILE 29 CO 0.10 0.32 -0.90 0.35 -0.69 0.00 0.00 178.15 177.34 1qfu n THR 30 N -4.23 0.00 -4.72 -0.27 -2.24 -1.26 -5.01 114.28 96.56 1qfu n THR 30 Ca 0.01 -0.25 -0.25 0.00 -2.27 0.00 0.00 64.05 61.29 1qfu n THR 30 Cb 0.30 0.66 -0.16 0.00 -2.10 0.00 0.00 70.33 69.02 1qfu n THR 30 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1qfu s ASP 31 N -2.43 1.98 0.04 3.42 1.01 -1.25 -5.03 116.67 114.41 1qfu s ASP 31 Ca 0.00 -0.33 -0.29 0.00 0.71 0.00 0.00 52.55 52.64 1qfu s ASP 31 Cb 0.06 -0.72 -0.17 0.00 1.01 0.00 0.00 42.92 43.10 1qfu s ASP 31 CO 0.37 0.10 1.40 -0.78 0.21 0.00 0.00 175.17 176.47 1qfu h ASP 32 N 6.59 -0.63 -3.29 0.27 3.58 -1.87 -1.21 116.42 119.86 1qfu h ASP 32 Ca -0.31 -0.04 -0.46 0.00 0.42 0.00 0.00 57.03 56.65 1qfu h ASP 32 Cb 1.18 0.16 -0.37 0.00 1.72 0.00 0.00 39.33 42.03 1qfu h ASP 32 CO 0.48 -0.34 -0.78 -1.10 -2.88 0.00 0.00 179.24 174.62 1qfu s GLN 33 N -5.34 0.93 -0.03 0.28 -0.21 -1.25 -3.87 119.66 110.17 1qfu s GLN 33 Ca -0.16 -0.05 0.01 0.00 0.02 0.00 0.00 55.36 55.18 1qfu s GLN 33 Cb 0.03 -1.11 0.03 0.00 1.00 0.00 0.00 33.01 32.95 1qfu s GLN 33 CO 0.56 -0.23 -0.01 -1.50 -2.12 0.00 0.00 175.29 171.99 1qfu s ILE 34 N 1.61 0.22 -0.04 1.08 2.07 0.38 -4.88 121.20 121.64 1qfu s ILE 34 Ca 0.01 0.05 -0.30 0.00 -1.41 0.00 0.00 60.65 59.00 1qfu s ILE 34 Cb -0.13 -0.30 -0.03 0.00 0.13 0.00 0.00 42.46 42.13 1qfu s ILE 34 CO -0.04 0.15 1.06 -0.70 -1.91 0.00 0.00 174.94 173.50 1qfu s GLU 35 N 0.97 4.45 0.32 3.50 2.12 -1.26 -0.72 118.70 128.09 1qfu s GLU 35 Ca -0.10 1.51 0.08 0.00 0.36 0.00 0.00 54.97 56.82 1qfu s GLU 35 Cb -0.14 -3.49 -0.06 0.00 0.26 0.00 0.00 34.13 30.70 1qfu s GLU 35 CO -0.01 -0.25 -0.08 0.14 -0.54 0.00 0.00 175.26 174.51 1qfu s VAL 36 N 1.62 2.00 -0.28 3.70 -7.23 -0.32 -1.95 120.40 117.93 1qfu s VAL 36 Ca 0.52 -2.17 0.28 0.00 -1.81 0.00 0.00 61.98 58.80 1qfu s VAL 36 Cb -0.22 -2.57 0.32 0.00 0.56 0.00 0.00 36.38 34.47 1qfu s VAL 36 CO 0.23 -0.24 1.82 0.71 -0.31 0.00 0.00 175.10 177.31 1qfu h THR 37 N 2.12 0.00 -2.26 5.32 1.35 -1.28 0.64 112.91 118.80 1qfu h THR 37 Ca -0.41 -0.46 0.10 0.00 -0.55 0.00 0.00 66.41 65.09 1qfu h THR 37 Cb 1.24 1.36 -0.16 0.00 -1.73 0.00 0.00 68.15 68.87 1qfu h THR 37 CO 0.69 0.00 0.49 0.21 -0.25 0.00 0.00 175.52 176.66 1qfu s ASN 38 N -5.08 -0.37 0.08 5.36 2.47 -1.26 -4.72 114.94 111.42 1qfu s ASN 38 Ca 0.04 0.02 -0.26 0.00 0.42 0.00 0.00 52.86 53.09 1qfu s ASN 38 Cb 0.09 0.39 0.08 0.00 -1.45 0.00 0.00 41.25 40.35 1qfu s ASN 38 CO 0.51 -0.62 0.67 0.00 -3.72 0.00 0.00 177.10 173.94 1qfu s ALA 39 N -3.03 -1.68 0.06 1.71 0.00 -1.26 -2.11 121.76 115.46 1qfu s ALA 39 Ca 0.04 0.77 0.07 0.00 0.00 0.00 0.00 51.96 52.85 1qfu s ALA 39 Cb -0.01 0.58 -0.03 0.00 0.00 0.00 0.00 23.12 23.67 1qfu s ALA 39 CO -0.08 -0.66 -0.20 -0.08 0.00 0.00 0.00 175.76 174.74 1qfu s THR 40 N -3.03 1.58 -0.06 0.00 -1.32 0.26 -4.84 115.64 108.24 1qfu s THR 40 Ca -0.01 -1.30 -0.24 0.00 -1.21 0.00 0.00 61.69 58.93 1qfu s THR 40 Cb -0.01 -1.41 -0.04 0.00 -1.51 0.00 0.00 72.50 69.53 1qfu s THR 40 CO -0.07 0.07 0.73 -0.70 -2.21 0.00 0.00 174.62 172.44 1qfu s GLU 41 N -1.45 4.45 -0.00 7.08 2.56 -1.26 0.65 118.70 130.72 1qfu s GLU 41 Ca 0.06 0.94 0.22 0.00 0.00 0.00 0.00 54.97 56.19 1qfu s GLU 41 Cb -0.09 -3.45 -0.26 0.00 2.00 0.00 0.00 34.13 32.32 1qfu s GLU 41 CO 0.03 0.04 0.64 1.28 -0.56 0.00 0.00 175.26 176.69 1qfu n LEU 42 N 3.82 0.29 -4.39 2.70 4.77 -0.02 -4.88 117.00 119.30 1qfu n LEU 42 Ca -0.00 -0.06 -0.38 0.00 -0.03 0.00 0.00 56.01 55.53 1qfu n LEU 42 Cb 0.51 -0.01 -0.12 0.00 -2.33 0.00 0.00 43.42 41.47 1qfu n LEU 42 CO 0.48 0.03 -0.22 -0.69 -1.33 0.00 0.00 177.39 175.65 1qfu s VAL 43 N -3.39 4.34 -0.34 4.08 1.01 -1.26 -2.26 120.40 122.58 1qfu s VAL 43 Ca -0.04 -0.64 -0.29 0.00 0.00 0.00 0.00 61.98 61.02 1qfu s VAL 43 Cb 0.14 -3.27 0.01 0.00 0.00 0.00 0.00 36.38 33.25 1qfu s VAL 43 CO 0.88 0.00 1.31 -1.58 0.00 0.00 0.00 175.10 175.72 1qfu s GLN 44 N 1.55 3.82 0.00 2.72 2.00 0.18 -4.81 119.66 125.12 1qfu s GLN 44 Ca 0.03 1.12 0.04 0.00 -2.00 0.00 0.00 55.36 54.55 1qfu s GLN 44 Cb -0.18 -3.91 0.12 0.00 0.80 0.00 0.00 33.01 29.84 1qfu s GLN 44 CO 0.05 -1.24 1.08 -1.13 -0.50 0.00 0.00 175.29 173.54 1qfu n SER 45 N 7.92 2.32 -4.07 6.67 3.41 -1.26 -0.86 113.62 127.75 1qfu n SER 45 Ca 0.15 -1.96 -0.07 0.00 -0.26 0.00 0.00 58.87 56.73 1qfu n SER 45 Cb 0.47 -0.09 -0.10 0.00 -0.26 0.00 0.00 64.21 64.23 1qfu n SER 45 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1qfu s SER 46 N -0.97 0.45 0.19 4.04 1.04 -1.26 -4.74 113.70 112.45 1qfu s SER 46 Ca 0.09 -0.93 0.02 0.00 0.48 0.00 0.00 55.95 55.61 1qfu s SER 46 Cb 0.05 0.19 -0.05 0.00 0.10 0.00 0.00 66.02 66.31 1qfu s SER 46 CO 0.06 -0.57 0.00 -0.55 0.98 0.00 0.00 173.24 173.16 1qfu s SER 47 N -2.76 1.42 0.32 7.02 0.15 -1.26 -4.75 113.70 113.84 1qfu s SER 47 Ca 0.04 -1.19 0.22 0.00 0.70 0.00 0.00 55.95 55.72 1qfu s SER 47 Cb 0.06 0.08 0.17 0.00 -1.71 0.00 0.00 66.02 64.62 1qfu s SER 47 CO -0.09 -0.55 1.35 0.71 1.20 0.00 0.00 173.24 175.86 1qfu h THR 48 N 2.62 0.09 0.00 6.45 1.35 -1.84 -3.48 112.91 118.11 1qfu h THR 48 Ca -0.37 -1.15 0.00 0.00 -0.55 0.00 0.00 66.41 64.34 1qfu h THR 48 Cb 1.21 1.85 0.00 0.00 -1.73 0.00 0.00 68.15 69.48 1qfu h THR 48 CO 0.63 0.05 0.00 0.61 -0.25 0.00 0.00 175.52 176.56 1qfu n GLY 49 N 1.15 3.05 3.93 5.82 0.00 -1.17 -5.04 105.19 112.94 1qfu n GLY 49 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 1qfu n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qfu s LYS 50 N -0.97 3.46 -0.08 1.61 3.01 -1.26 -4.03 119.74 121.48 1qfu s LYS 50 Ca 0.00 -0.48 -0.02 0.00 -1.01 0.00 0.00 55.97 54.46 1qfu s LYS 50 Cb 0.00 -2.96 -0.03 0.00 -1.01 0.00 0.00 37.83 33.82 1qfu s LYS 50 CO 0.00 0.53 0.03 0.42 0.51 0.00 0.00 175.35 176.84 1qfu s ILE 51 N -1.68 4.52 -0.15 2.17 1.01 -0.19 0.33 121.20 127.20 1qfu s ILE 51 Ca 0.36 -0.20 -0.08 0.00 0.00 0.00 0.00 60.65 60.73 1qfu s ILE 51 Cb -0.12 -2.93 -0.04 0.00 0.01 0.00 0.00 42.46 39.38 1qfu s ILE 51 CO 0.28 0.58 0.12 0.00 0.00 0.00 0.00 174.94 175.93 1qfu n ASN 53 N 2.70 0.00 -3.95 0.00 6.94 -0.90 -4.71 115.26 115.34 1qfu n ASN 53 Ca -0.18 -0.78 -0.12 0.00 -0.02 0.00 0.00 54.58 53.48 1qfu n ASN 53 Cb 0.54 0.00 -0.13 0.00 -2.36 0.00 0.00 39.78 37.83 1qfu n ASN 53 CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 1qfu s ASN 54 N -1.93 0.30 0.00 0.53 -0.87 -0.98 -4.34 114.94 107.65 1qfu s ASN 54 Ca 0.31 -0.27 0.24 0.00 -1.57 0.00 0.00 52.86 51.57 1qfu s ASN 54 Cb 0.14 0.03 1.04 0.00 -0.02 0.00 0.00 41.25 42.44 1qfu s ASN 54 CO 0.24 -0.13 1.72 -0.81 -2.57 0.00 0.00 177.10 175.55 1qfu n PRO 55 N 2.30 1.50 -3.60 -0.60 -0.04 -1.24 -0.99 135.00 132.33 1qfu n PRO 55 Ca -0.18 -0.74 -0.37 0.00 -0.04 0.00 0.00 63.50 62.17 1qfu n PRO 55 Cb 0.57 -1.42 -0.07 0.00 -0.04 0.00 0.00 33.50 32.55 1qfu n PRO 55 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1qfu s HIS 56 N -1.91 3.57 -0.48 0.54 3.76 -1.26 -5.02 115.29 114.48 1qfu s HIS 56 Ca 0.35 0.70 -0.28 0.00 -0.15 0.00 0.00 55.06 55.69 1qfu s HIS 56 Cb 0.18 -2.24 -0.01 0.00 1.11 0.00 0.00 32.58 31.62 1qfu s HIS 56 CO 0.29 0.46 1.74 0.50 -0.85 0.00 0.00 174.74 176.88 1qfu s ARG 57 N -0.30 3.06 -0.24 1.40 3.52 -1.26 -4.72 118.95 120.42 1qfu s ARG 57 Ca 0.18 0.93 -0.10 0.00 -0.13 0.00 0.00 55.73 56.61 1qfu s ARG 57 Cb -0.14 -4.25 -0.05 0.00 -1.56 0.00 0.00 34.95 28.96 1qfu s ARG 57 CO 0.07 -2.20 0.14 0.42 -0.81 0.00 0.00 175.30 172.92 1qfu s ILE 58 N 7.55 5.13 -0.36 4.11 -1.09 -1.26 0.22 121.20 135.49 1qfu s ILE 58 Ca 0.70 0.10 -0.11 0.00 -2.23 0.00 0.00 60.65 59.10 1qfu s ILE 58 Cb -0.16 -3.39 0.02 0.00 -1.58 0.00 0.00 42.46 37.34 1qfu s ILE 58 CO 0.27 0.34 0.21 -0.22 -1.23 0.00 0.00 174.94 174.31 1qfu s LEU 59 N 1.19 4.63 -0.14 2.97 2.96 -0.52 -4.98 118.68 124.78 1qfu s LEU 59 Ca 0.07 -0.85 -0.29 0.00 -0.22 0.00 0.00 54.13 52.83 1qfu s LEU 59 Cb -0.14 -2.04 -0.02 0.00 0.50 0.00 0.00 46.19 44.48 1qfu s LEU 59 CO 0.05 -0.35 1.35 -0.62 -1.32 0.00 0.00 176.35 175.47 1qfu s ASP 60 N 1.59 6.88 0.00 3.68 -1.08 -1.26 -1.68 116.67 124.81 1qfu s ASP 60 Ca 0.03 1.81 0.19 0.00 -0.52 0.00 0.00 52.55 54.07 1qfu s ASP 60 Cb -0.19 -2.54 0.83 0.00 -1.46 0.00 0.00 42.92 39.56 1qfu s ASP 60 CO 0.07 -0.80 1.61 0.61 0.52 0.00 0.00 175.17 177.18 1qfu n GLY 61 N 3.73 -1.14 7.00 2.66 0.00 -0.72 -4.93 105.19 111.78 1qfu n GLY 61 Ca 0.15 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1qfu n GLY 61 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1qfu n ILE 62 N -1.48 0.00 0.05 -0.61 5.41 -1.26 -0.27 119.36 121.20 1qfu n ILE 62 Ca 0.05 0.00 0.10 0.00 1.00 0.00 0.00 62.75 63.90 1qfu n ILE 62 Cb 0.22 0.00 0.27 0.00 -0.71 0.00 0.00 39.64 39.42 1qfu n ILE 62 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1qfu n ASP 63 N 6.04 3.28 -4.59 4.38 8.00 -1.26 -4.42 116.55 127.98 1qfu n ASP 63 Ca 0.00 -2.00 -0.34 0.00 0.71 0.00 0.00 54.79 53.16 1qfu n ASP 63 Cb 0.00 -0.41 -0.11 0.00 -0.02 0.00 0.00 41.12 40.58 1qfu n ASP 63 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1qfu s THR 65 N -0.84 2.06 0.05 0.00 -4.23 -1.26 -4.58 115.64 106.83 1qfu s THR 65 Ca 0.13 -0.20 -0.18 0.00 -1.18 0.00 0.00 61.69 60.26 1qfu s THR 65 Cb -0.11 -2.86 -0.16 0.00 1.34 0.00 0.00 72.50 70.70 1qfu s THR 65 CO 0.02 0.00 1.27 0.25 -0.54 0.00 0.00 174.62 175.62 1qfu h LEU 66 N -1.21 0.57 0.06 4.79 5.85 -1.98 -3.00 115.31 120.39 1qfu h LEU 66 Ca -0.42 -0.59 0.03 0.00 0.84 0.00 0.00 57.88 57.73 1qfu h LEU 66 Cb 1.25 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 42.07 1qfu h LEU 66 CO 0.42 1.06 -0.33 0.40 -0.34 0.00 0.00 178.44 179.65 1qfu h ILE 67 N 0.10 0.30 -0.02 4.05 1.08 -1.96 0.20 117.51 121.27 1qfu h ILE 67 Ca -0.01 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.46 1qfu h ILE 67 Cb 1.01 0.30 -0.00 0.00 -3.07 0.00 0.00 36.82 35.06 1qfu h ILE 67 CO 0.08 0.00 0.03 0.44 -0.69 0.00 0.00 178.15 178.02 1qfu h ASP 68 N -0.51 0.00 1.11 1.72 3.32 -1.96 0.52 116.42 120.61 1qfu h ASP 68 Ca 0.05 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.95 1qfu h ASP 68 Cb 0.57 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.10 1qfu h ASP 68 CO -0.23 0.00 -0.94 0.00 -1.72 0.00 0.00 179.24 176.35 1qfu h ALA 69 N 1.95 0.63 0.24 3.45 0.00 -1.05 -2.27 119.26 122.20 1qfu h ALA 69 Ca 0.01 -0.69 -0.01 0.00 0.00 0.00 0.00 54.91 54.22 1qfu h ALA 69 Cb 0.08 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1qfu h ALA 69 CO -0.00 0.84 -0.11 1.25 0.00 0.00 0.00 179.25 181.22 1qfu h LEU 70 N 0.00 -0.27 0.65 0.00 5.85 0.30 -3.34 115.31 118.50 1qfu h LEU 70 Ca -0.07 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.35 1qfu h LEU 70 Cb 1.52 0.07 0.01 0.00 0.37 0.00 0.00 40.66 42.63 1qfu h LEU 70 CO 0.07 0.20 -0.31 -0.07 -0.34 0.00 0.00 178.44 177.98 1qfu h LEU 71 N -0.83 -0.74 0.00 2.25 3.38 -1.08 -3.46 115.31 114.84 1qfu h LEU 71 Ca -0.03 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1qfu h LEU 71 Cb 0.51 0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1qfu h LEU 71 CO 0.05 -0.41 0.00 0.61 0.09 0.00 0.00 178.44 178.78 1qfu n GLY 72 N -0.90 0.90 3.62 0.83 0.00 -1.04 -1.83 105.19 106.76 1qfu n GLY 72 Ca -0.12 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.36 1qfu n GLY 72 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1qfu n ASP 73 N 0.00 1.73 -0.22 1.61 -0.08 -0.88 -1.90 116.55 116.81 1qfu n ASP 73 Ca 0.00 1.11 0.03 0.00 -1.51 0.00 0.00 54.79 54.42 1qfu n ASP 73 Cb 0.00 -1.16 0.07 0.00 2.34 0.00 0.00 41.12 42.37 1qfu n ASP 73 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1qfu n PRO 74 N 3.20 -0.07 0.00 -0.67 -0.02 -1.26 -0.07 135.00 136.11 1qfu n PRO 74 Ca 0.21 0.94 0.12 0.00 -2.02 0.00 0.00 63.50 62.74 1qfu n PRO 74 Cb 0.17 -1.40 0.68 0.00 -0.02 0.00 0.00 33.50 32.92 1qfu n PRO 74 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09 1qfu n HIS 75 N -4.97 0.00 0.46 6.00 1.44 -1.26 -2.47 115.22 114.42 1qfu n HIS 75 Ca 0.09 0.00 0.05 0.00 -2.01 0.00 0.00 57.72 55.85 1qfu n HIS 75 Cb 0.29 -0.02 0.01 0.00 0.12 0.00 0.00 29.99 30.38 1qfu n HIS 75 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1qfu n ASP 77 N -0.05 0.23 0.23 0.00 8.00 -1.03 -0.25 116.55 123.68 1qfu n ASP 77 Ca 0.05 0.60 0.16 0.00 0.71 0.00 0.00 54.79 56.30 1qfu n ASP 77 Cb 0.23 -0.63 0.67 0.00 -0.02 0.00 0.00 41.12 41.37 1qfu n ASP 77 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 1qfu h VAL 78 N 0.00 0.00 -0.63 2.53 3.04 -1.81 -2.69 116.25 116.69 1qfu h VAL 78 Ca 0.00 -0.34 -0.11 0.00 -1.01 0.00 0.00 66.70 65.24 1qfu h VAL 78 Cb 0.05 1.22 -0.07 0.00 -2.01 0.00 0.00 31.29 30.48 1qfu h VAL 78 CO 0.00 0.00 0.14 0.49 -1.01 0.00 0.00 177.57 177.19 1qfu n PHE 79 N -2.76 2.16 -2.23 3.17 3.72 0.66 -4.98 117.46 117.21 1qfu n PHE 79 Ca 0.01 -0.93 -0.42 0.00 -0.05 0.00 0.00 57.45 56.06 1qfu n PHE 79 Cb 0.24 -0.58 -0.03 0.00 -0.94 0.00 0.00 39.48 38.17 1qfu n PHE 79 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1qfu s GLN 80 N -2.74 4.34 -1.31 -1.08 -0.21 -1.02 -2.93 119.66 114.70 1qfu s GLN 80 Ca 0.51 2.00 0.00 0.00 0.02 0.00 0.00 55.36 57.89 1qfu s GLN 80 Cb 0.40 -3.32 0.00 0.00 1.00 0.00 0.00 33.01 31.10 1qfu s GLN 80 CO 0.14 -0.42 0.00 0.09 -2.12 0.00 0.00 175.29 172.97 1qfu n ASN 81 N 4.16 -4.58 -4.83 5.90 4.13 -1.08 -4.97 115.26 113.98 1qfu n ASN 81 Ca 0.11 0.31 -0.31 0.00 1.68 0.00 0.00 54.58 56.37 1qfu n ASN 81 Cb 0.43 -3.17 0.06 0.00 -1.54 0.00 0.00 39.78 35.56 1qfu n ASN 81 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1qfu s GLU 82 N -3.00 2.78 0.05 3.52 0.41 -1.15 -4.46 118.70 116.84 1qfu s GLU 82 Ca 0.00 0.75 0.03 0.00 -0.41 0.00 0.00 54.97 55.33 1qfu s GLU 82 Cb 0.00 -1.99 -0.03 0.00 -1.78 0.00 0.00 34.13 30.34 1qfu s GLU 82 CO 0.00 -1.16 -0.08 0.95 -0.49 0.00 0.00 175.26 174.48 1qfu s THR 83 N -3.15 0.62 0.24 3.63 -4.23 -1.26 -0.61 115.64 110.88 1qfu s THR 83 Ca 0.58 -1.17 -0.14 0.00 -1.18 0.00 0.00 61.69 59.79 1qfu s THR 83 Cb -0.13 -0.74 0.00 0.00 1.34 0.00 0.00 72.50 72.97 1qfu s THR 83 CO 0.54 -0.40 0.49 -1.66 -0.54 0.00 0.00 174.62 173.05 1qfu s TRP 84 N -1.53 0.26 -0.20 3.99 -2.14 -0.87 -4.82 118.94 113.64 1qfu s TRP 84 Ca -0.07 -0.63 -0.07 0.00 2.66 0.00 0.00 56.10 57.99 1qfu s TRP 84 Cb -0.09 0.24 -0.10 0.00 -3.10 0.00 0.00 33.47 30.42 1qfu s TRP 84 CO 0.00 -0.98 -0.23 -0.25 -2.66 0.00 0.00 176.95 172.83 1qfu n ASP 85 N -0.37 1.74 -3.79 -2.66 8.00 0.13 -4.72 116.55 114.89 1qfu n ASP 85 Ca -0.03 0.14 -0.25 0.00 0.71 0.00 0.00 54.79 55.36 1qfu n ASP 85 Cb 0.62 -0.51 -0.17 0.00 -0.02 0.00 0.00 41.12 41.04 1qfu n ASP 85 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1qfu s LEU 86 N -6.80 0.86 -0.09 0.64 2.96 -0.41 -0.20 118.68 115.65 1qfu s LEU 86 Ca -0.27 -0.31 -0.22 0.00 -0.22 0.00 0.00 54.13 53.11 1qfu s LEU 86 Cb 0.10 -0.56 -0.04 0.00 0.50 0.00 0.00 46.19 46.19 1qfu s LEU 86 CO 0.38 -0.21 0.62 0.12 -1.32 0.00 0.00 176.35 175.94 1qfu s PHE 87 N 1.89 3.55 -0.40 5.38 2.19 -0.57 -1.44 117.98 128.58 1qfu s PHE 87 Ca 0.03 1.12 -0.08 0.00 0.33 0.00 0.00 56.93 58.34 1qfu s PHE 87 Cb -0.13 -2.72 0.08 0.00 -1.31 0.00 0.00 43.02 38.93 1qfu s PHE 87 CO -0.06 0.11 0.22 0.08 1.83 0.00 0.00 175.22 177.39 1qfu s VAL 88 N 0.77 3.98 0.03 3.12 1.01 -0.67 -0.05 120.40 128.59 1qfu s VAL 88 Ca 0.33 -1.44 -0.27 0.00 0.00 0.00 0.00 61.98 60.61 1qfu s VAL 88 Cb -0.17 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 1qfu s VAL 88 CO 0.15 -0.46 0.84 -1.61 0.00 0.00 0.00 175.10 174.02 1qfu s GLU 89 N 1.38 4.54 0.08 2.72 2.02 0.75 -1.76 118.70 128.43 1qfu s GLU 89 Ca 0.03 1.18 -0.10 0.00 0.02 0.00 0.00 54.97 56.10 1qfu s GLU 89 Cb -0.22 -3.40 -0.06 0.00 0.10 0.00 0.00 34.13 30.55 1qfu s GLU 89 CO 0.01 0.16 0.41 1.03 0.02 0.00 0.00 175.26 176.89 1qfu s ARG 90 N 0.34 3.76 0.51 1.61 3.00 -1.26 -1.50 118.95 125.41 1qfu s ARG 90 Ca 0.43 0.18 0.20 0.00 0.00 0.00 0.00 55.73 56.54 1qfu s ARG 90 Cb -0.21 -2.99 1.28 0.00 0.00 0.00 0.00 34.95 33.04 1qfu s ARG 90 CO 0.24 0.55 2.03 0.66 0.00 0.00 0.00 175.30 178.78 1qfu h SER 91 N 3.68 0.09 -0.59 0.23 4.64 -1.94 -1.65 113.55 118.00 1qfu h SER 91 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1qfu h SER 91 Cb 1.19 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1qfu h SER 91 CO 0.67 0.05 0.00 0.29 -0.87 0.00 0.00 176.83 176.97 1qfu n LYS 92 N -4.44 4.24 -1.97 4.77 4.76 -1.26 -4.97 118.16 119.29 1qfu n LYS 92 Ca 0.07 -3.01 -0.40 0.00 -2.87 0.00 0.00 58.31 52.10 1qfu n LYS 92 Cb 0.44 -2.06 0.00 0.00 -1.84 0.00 0.00 35.03 31.57 1qfu n LYS 92 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1qfu s ALA 93 N -2.32 3.28 0.08 7.82 0.00 -0.62 -4.98 121.76 125.02 1qfu s ALA 93 Ca 0.52 1.32 0.02 0.00 0.00 0.00 0.00 51.96 53.82 1qfu s ALA 93 Cb 0.37 -3.52 -0.04 0.00 0.00 0.00 0.00 23.12 19.93 1qfu s ALA 93 CO 0.20 -0.93 -0.07 -0.59 0.00 0.00 0.00 175.76 174.37 1qfu s PHE 94 N -1.23 0.80 -0.12 0.00 -0.12 -0.46 -4.88 117.98 111.97 1qfu s PHE 94 Ca 0.57 -0.80 -0.08 0.00 -0.05 0.00 0.00 56.93 56.57 1qfu s PHE 94 Cb -0.40 -0.47 -0.04 0.00 -0.63 0.00 0.00 43.02 41.47 1qfu s PHE 94 CO 0.52 -0.14 0.17 -1.12 -0.05 0.00 0.00 175.22 174.60 1qfu s SER 95 N -2.60 6.41 -0.34 1.98 0.01 -1.26 -4.79 113.70 113.11 1qfu s SER 95 Ca 0.05 0.49 0.16 0.00 1.31 0.00 0.00 55.95 57.96 1qfu s SER 95 Cb 0.01 -2.10 0.44 0.00 0.21 0.00 0.00 66.02 64.58 1qfu s SER 95 CO -0.04 0.36 0.93 -3.20 0.41 0.00 0.00 173.24 171.71 1qfu n ASN 96 N 2.24 1.67 0.00 2.44 5.15 -1.26 -5.07 115.26 120.43 1qfu n ASN 96 Ca -0.19 -2.85 0.00 0.00 -0.60 0.00 0.00 54.58 50.95 1qfu n ASN 96 Cb 0.54 -0.54 0.00 0.00 -0.53 0.00 0.00 39.78 39.26 1qfu n ASN 96 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1qfu s TYR 98 N -0.72 3.06 0.06 0.00 6.14 -1.26 -4.38 117.35 120.24 1qfu s TYR 98 Ca 0.00 0.77 -0.33 0.00 0.64 0.00 0.00 57.07 58.16 1qfu s TYR 98 Cb 0.00 -3.78 -0.12 0.00 0.42 0.00 0.00 41.96 38.48 1qfu s TYR 98 CO 0.00 -2.85 1.81 -0.35 0.64 0.00 0.00 175.55 174.80 1qfu n PRO 99 N 4.29 2.47 -4.44 4.97 -0.04 -1.26 -4.94 135.00 136.06 1qfu n PRO 99 Ca 0.13 0.90 -0.22 0.00 -0.04 0.00 0.00 63.50 64.27 1qfu n PRO 99 Cb 0.41 -2.76 -0.09 0.00 -0.04 0.00 0.00 33.50 31.02 1qfu n PRO 99 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1qfu s TYR 100 N 2.88 1.75 -0.00 0.54 1.13 -1.26 -2.24 117.35 120.14 1qfu s TYR 100 Ca 0.85 -1.26 -0.17 0.00 -1.41 0.00 0.00 57.07 55.08 1qfu s TYR 100 Cb -0.59 -1.07 0.03 0.00 -1.10 0.00 0.00 41.96 39.24 1qfu s TYR 100 CO 0.42 -0.33 0.36 0.16 -2.51 0.00 0.00 175.55 173.66 1qfu s ASP 101 N -3.50 -0.25 -0.16 -0.18 -4.77 -0.17 -4.85 116.67 102.79 1qfu s ASP 101 Ca 0.30 0.11 0.01 0.00 -3.30 0.00 0.00 52.55 49.67 1qfu s ASP 101 Cb 0.05 0.36 0.02 0.00 -1.09 0.00 0.00 42.92 42.26 1qfu s ASP 101 CO 0.16 -0.52 -0.16 -0.69 0.70 0.00 0.00 175.17 174.67 1qfu s VAL 102 N -1.62 1.73 -0.19 2.11 1.01 -1.26 -1.44 120.40 120.74 1qfu s VAL 102 Ca -0.11 -0.76 -0.29 0.00 0.00 0.00 0.00 61.98 60.81 1qfu s VAL 102 Cb -0.03 -1.62 -0.00 0.00 0.00 0.00 0.00 36.38 34.72 1qfu s VAL 102 CO 0.03 0.46 1.16 -2.84 0.00 0.00 0.00 175.10 173.90 1qfu s PRO 103 N 1.42 4.25 -0.22 2.72 0.02 -1.25 -3.19 135.00 138.75 1qfu s PRO 103 Ca 0.04 1.52 -0.00 0.00 0.02 0.00 0.00 61.00 62.58 1qfu s PRO 103 Cb -0.13 -3.70 -0.00 0.00 0.02 0.00 0.00 34.50 30.68 1qfu s PRO 103 CO -0.11 -0.66 0.18 -3.47 -0.33 0.00 0.00 177.00 172.61 1qfu n ASP 104 N 6.43 -2.32 -0.27 2.53 2.03 -1.26 -4.94 116.55 118.74 1qfu n ASP 104 Ca 0.13 -0.12 -0.05 0.00 0.52 0.00 0.00 54.79 55.27 1qfu n ASP 104 Cb 0.45 -1.38 0.09 0.00 -0.72 0.00 0.00 41.12 39.57 1qfu n ASP 104 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 1qfu h TYR 105 N -0.30 1.17 -0.13 -0.67 5.03 -1.97 -2.71 116.97 117.39 1qfu h TYR 105 Ca -0.11 -0.08 0.05 0.00 2.58 0.00 0.00 58.73 61.16 1qfu h TYR 105 Cb 1.06 -0.35 -0.05 0.00 1.55 0.00 0.00 36.73 38.94 1qfu h TYR 105 CO 0.07 0.89 -0.21 0.00 -1.32 0.00 0.00 178.16 177.59 1qfu h ALA 106 N 1.21 -0.16 -0.14 1.82 0.00 -1.93 0.07 119.26 120.13 1qfu h ALA 106 Ca 0.26 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 1qfu h ALA 106 Cb 0.21 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1qfu h ALA 106 CO -0.02 -0.66 -0.43 0.77 0.00 0.00 0.00 179.25 178.90 1qfu h SER 107 N -0.26 0.35 -0.20 0.00 0.02 -1.93 -0.17 113.55 111.35 1qfu h SER 107 Ca 0.10 -0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 60.87 1qfu h SER 107 Cb 0.41 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 1qfu h SER 107 CO -0.28 0.74 0.00 0.25 -1.14 0.00 0.00 176.83 176.40 1qfu h LEU 108 N 0.27 0.34 -0.60 5.07 5.85 -1.13 -1.65 115.31 123.46 1qfu h LEU 108 Ca 0.02 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.44 1qfu h LEU 108 Cb 0.87 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.78 1qfu h LEU 108 CO 0.07 0.56 0.39 -0.09 -0.34 0.00 0.00 178.44 179.03 1qfu h ARG 109 N 0.11 0.79 0.55 1.25 2.43 -0.88 -1.66 114.38 116.97 1qfu h ARG 109 Ca 0.06 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 1qfu h ARG 109 Cb 0.38 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1qfu h ARG 109 CO 0.01 0.53 -0.36 1.03 -1.51 0.00 0.00 179.97 179.67 1qfu h SER 110 N 0.81 -0.93 0.14 -3.80 0.87 -0.92 -1.29 113.55 108.44 1qfu h SER 110 Ca 0.22 0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.81 1qfu h SER 110 Cb -0.08 0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 62.15 1qfu h SER 110 CO -0.05 -0.56 -0.11 0.17 -0.53 0.00 0.00 176.83 175.75 1qfu h LEU 111 N -0.87 0.00 0.06 2.23 8.10 -1.15 0.46 115.31 124.13 1qfu h LEU 111 Ca -0.06 0.00 -0.22 0.00 0.11 0.00 0.00 57.88 57.71 1qfu h LEU 111 Cb 0.72 0.00 0.02 0.00 -0.44 0.00 0.00 40.66 40.96 1qfu h LEU 111 CO 0.05 0.11 -0.88 0.58 -4.11 0.00 0.00 178.44 174.19 1qfu h VAL 112 N 0.00 1.38 -0.51 0.15 2.07 -1.20 -2.38 116.25 115.76 1qfu h VAL 112 Ca -0.00 -2.30 0.06 0.00 0.82 0.00 0.00 66.70 65.29 1qfu h VAL 112 Cb 0.22 2.72 -0.05 0.00 -1.52 0.00 0.00 31.29 32.65 1qfu h VAL 112 CO 0.01 0.68 0.21 0.00 0.02 0.00 0.00 177.57 178.50 1qfu h ALA 113 N 0.27 0.64 0.00 1.67 0.00 -0.67 0.16 119.26 121.33 1qfu h ALA 113 Ca -0.13 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1qfu h ALA 113 Cb 1.60 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 1qfu h ALA 113 CO 0.17 -0.17 -0.39 1.03 0.00 0.00 0.00 179.25 179.89 1qfu h SER 114 N 0.41 0.00 -0.30 0.00 0.87 -0.99 -2.83 113.55 110.71 1qfu h SER 114 Ca 0.24 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.68 1qfu h SER 114 Cb 0.22 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.18 1qfu h SER 114 CO -0.22 0.39 -0.30 -1.28 -0.53 0.00 0.00 176.83 174.90 1qfu h SER 115 N 0.00 0.78 -0.13 6.23 0.87 -0.48 -3.37 113.55 117.45 1qfu h SER 115 Ca -0.00 -0.47 -0.04 0.00 -1.23 0.00 0.00 61.79 60.04 1qfu h SER 115 Cb 0.71 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.43 1qfu h SER 115 CO 0.05 1.09 -0.04 0.61 -0.53 0.00 0.00 176.83 178.01 1qfu n GLY 116 N 0.16 0.50 3.25 5.77 0.00 -0.36 -4.12 105.19 110.40 1qfu n GLY 116 Ca -0.04 -0.96 -0.13 0.00 0.00 0.00 0.00 46.02 44.89 1qfu n GLY 116 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1qfu s THR 117 N -2.08 0.03 -0.15 2.61 -1.32 -1.26 -2.04 115.64 111.43 1qfu s THR 117 Ca 0.00 -0.25 0.18 0.00 -1.21 0.00 0.00 61.69 60.40 1qfu s THR 117 Cb 0.00 -0.58 0.34 0.00 -1.51 0.00 0.00 72.50 70.75 1qfu s THR 117 CO 0.00 -0.14 1.20 0.18 -2.21 0.00 0.00 174.62 173.65 1qfu n LEU 118 N 1.96 2.63 -4.65 9.08 4.77 0.22 -4.90 117.00 126.12 1qfu n LEU 118 Ca -0.18 -3.18 -0.43 0.00 -0.03 0.00 0.00 56.01 52.20 1qfu n LEU 118 Cb 0.57 -0.46 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 1qfu n LEU 118 CO 0.19 0.79 1.22 -1.83 -1.33 0.00 0.00 177.39 176.42 1qfu s GLU 119 N -2.92 4.04 -0.03 3.23 -1.05 -1.26 -2.64 118.70 118.08 1qfu s GLU 119 Ca 0.34 1.67 -0.02 0.00 -0.15 0.00 0.00 54.97 56.81 1qfu s GLU 119 Cb 0.30 -3.90 -0.04 0.00 -0.44 0.00 0.00 34.13 30.05 1qfu s GLU 119 CO 0.03 -0.97 0.12 0.12 0.95 0.00 0.00 175.26 175.51 1qfu s PHE 120 N 4.22 3.42 -0.21 4.83 5.36 -1.26 -1.39 117.98 132.95 1qfu s PHE 120 Ca 0.63 0.30 0.01 0.00 -0.96 0.00 0.00 56.93 56.91 1qfu s PHE 120 Cb -0.23 -1.80 0.05 0.00 -0.34 0.00 0.00 43.02 40.69 1qfu s PHE 120 CO 0.23 0.61 -0.08 0.42 -1.46 0.00 0.00 175.22 174.94 1qfu s ILE 121 N -1.21 1.52 0.07 3.12 -1.09 0.60 -4.99 121.20 119.24 1qfu s ILE 121 Ca 0.23 -1.04 -0.31 0.00 -2.23 0.00 0.00 60.65 57.30 1qfu s ILE 121 Cb -0.12 -1.69 -0.06 0.00 -1.58 0.00 0.00 42.46 39.00 1qfu s ILE 121 CO 0.14 0.05 1.28 -0.89 -1.23 0.00 0.00 174.94 174.29 1qfu s THR 122 N 1.43 3.77 0.13 2.92 2.01 -1.26 -1.38 115.64 123.25 1qfu s THR 122 Ca -0.03 1.26 0.07 0.00 0.31 0.00 0.00 61.69 63.30 1qfu s THR 122 Cb -0.17 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 1qfu s THR 122 CO -0.07 0.09 -0.03 -1.61 -0.69 0.00 0.00 174.62 172.30 1qfu s GLU 123 N 1.18 2.35 -1.06 4.92 2.02 0.72 -4.90 118.70 123.94 1qfu s GLU 123 Ca 0.61 -1.01 -0.09 0.00 0.02 0.00 0.00 54.97 54.49 1qfu s GLU 123 Cb -0.32 -2.39 -0.07 0.00 0.10 0.00 0.00 34.13 31.45 1qfu s GLU 123 CO 0.29 0.49 2.25 0.41 0.02 0.00 0.00 175.26 178.72 1qfu n GLY 124 N 0.32 3.32 3.72 -1.39 0.00 -1.26 -4.64 105.19 105.25 1qfu n GLY 124 Ca -0.11 -1.07 -0.42 0.00 0.00 0.00 0.00 46.02 44.42 1qfu n GLY 124 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1qfu s PHE 125 N 3.40 3.54 -0.30 1.61 0.08 -1.26 -5.01 117.98 120.04 1qfu s PHE 125 Ca 0.48 1.48 -0.04 0.00 0.12 0.00 0.00 56.93 58.97 1qfu s PHE 125 Cb 0.12 -3.30 0.03 0.00 -0.57 0.00 0.00 43.02 39.31 1qfu s PHE 125 CO -0.02 -0.76 0.04 0.95 -0.10 0.00 0.00 175.22 175.33 1qfu s THR 126 N 0.78 3.43 -0.75 0.64 -4.23 -1.26 -5.05 115.64 109.20 1qfu s THR 126 Ca 0.55 -1.09 -0.16 0.00 -1.18 0.00 0.00 61.69 59.81 1qfu s THR 126 Cb -0.27 -2.87 0.17 0.00 1.34 0.00 0.00 72.50 70.87 1qfu s THR 126 CO 0.30 -0.03 0.76 0.26 -0.54 0.00 0.00 174.62 175.37 1qfu s TRP 127 N 1.37 3.45 -0.39 3.99 0.52 -1.26 -4.96 118.94 121.66 1qfu s TRP 127 Ca -0.01 -1.61 -0.28 0.00 0.02 0.00 0.00 56.10 54.22 1qfu s TRP 127 Cb -0.19 -3.92 -0.02 0.00 -1.15 0.00 0.00 33.47 28.19 1qfu s TRP 127 CO 0.00 -1.12 1.88 0.99 0.02 0.00 0.00 176.95 178.72 1qfu s THR 128 N 1.20 3.39 -0.80 2.01 2.01 -1.26 -4.09 115.64 118.11 1qfu s THR 128 Ca 0.16 0.37 -0.03 0.00 0.31 0.00 0.00 61.69 62.50 1qfu s THR 128 Cb -0.15 -3.63 -0.03 0.00 0.01 0.00 0.00 72.50 68.69 1qfu s THR 128 CO -0.04 -0.47 0.69 0.61 -0.69 0.00 0.00 174.62 174.71 1qfu n GLY 129 N 5.54 -0.44 3.40 4.40 0.00 -1.26 -4.89 105.19 111.93 1qfu n GLY 129 Ca 0.24 0.21 -0.10 0.00 0.00 0.00 0.00 46.02 46.37 1qfu n GLY 129 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1qfu s VAL 130 N -3.28 0.06 -0.35 1.61 -7.23 -1.26 -4.17 120.40 105.78 1qfu s VAL 130 Ca 0.22 -1.00 -0.14 0.00 -1.81 0.00 0.00 61.98 59.25 1qfu s VAL 130 Cb -0.03 -1.60 -0.01 0.00 0.56 0.00 0.00 36.38 35.30 1qfu s VAL 130 CO 0.53 -0.25 0.31 -0.89 -0.31 0.00 0.00 175.10 174.49 1qfu s THR 131 N -3.90 5.22 0.87 5.32 2.01 0.14 -4.81 115.64 120.49 1qfu s THR 131 Ca 0.11 -0.17 -0.13 0.00 0.31 0.00 0.00 61.69 61.81 1qfu s THR 131 Cb 0.01 -3.80 0.12 0.00 0.01 0.00 0.00 72.50 68.84 1qfu s THR 131 CO -0.04 -0.10 1.19 -1.10 -0.69 0.00 0.00 174.62 173.88 1qfu s GLN 132 N 1.86 1.49 -1.54 4.92 -0.21 -1.26 -0.57 119.66 124.35 1qfu s GLN 132 Ca 0.09 0.07 -0.14 0.00 0.02 0.00 0.00 55.36 55.40 1qfu s GLN 132 Cb -0.17 -1.90 0.09 0.00 1.00 0.00 0.00 33.01 32.03 1qfu s GLN 132 CO 0.11 -1.91 0.95 0.09 -2.12 0.00 0.00 175.29 172.41 1qfu n ASN 133 N -3.53 -4.51 -4.73 5.90 3.02 -1.11 -4.92 115.26 105.37 1qfu n ASN 133 Ca 0.09 -0.80 -0.37 0.00 -0.03 0.00 0.00 54.58 53.47 1qfu n ASN 133 Cb 0.60 -3.79 0.07 0.00 -0.61 0.00 0.00 39.78 36.05 1qfu n ASN 133 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1qfu s GLY 134 N -3.36 2.86 0.39 7.41 0.00 -0.93 -4.92 107.32 108.77 1qfu s GLY 134 Ca 0.64 1.22 0.05 0.00 0.00 0.00 0.00 44.72 46.63 1qfu s GLY 134 CO 0.84 1.65 0.18 -0.32 0.00 0.00 0.00 173.10 175.45 1qfu s GLY 135 N -1.37 2.54 0.08 0.20 0.00 -1.26 -4.56 107.32 102.95 1qfu s GLY 135 Ca 0.82 -1.47 -0.15 0.00 0.00 0.00 0.00 44.72 43.92 1qfu s GLY 135 CO 0.40 -1.71 0.34 -0.45 0.00 0.00 0.00 173.10 171.67 1qfu s SER 136 N -3.54 -0.15 0.00 1.64 0.15 0.22 -4.75 113.70 107.27 1qfu s SER 136 Ca 0.29 -0.27 0.15 0.00 0.70 0.00 0.00 55.95 56.81 1qfu s SER 136 Cb 0.02 0.41 0.50 0.00 -1.71 0.00 0.00 66.02 65.24 1qfu s SER 136 CO 0.19 -0.72 1.38 0.59 1.20 0.00 0.00 173.24 175.87 1qfu n ASN 137 N 0.19 1.70 0.04 5.45 3.02 -1.26 -0.05 115.26 124.34 1qfu n ASN 137 Ca -0.17 -1.87 -0.21 0.00 -0.03 0.00 0.00 54.58 52.30 1qfu n ASN 137 Cb 0.61 -0.17 -0.14 0.00 -0.61 0.00 0.00 39.78 39.47 1qfu n ASN 137 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1qfu h ALA 138 N 3.79 0.32 -1.37 5.41 0.00 -1.89 -3.36 119.26 122.16 1qfu h ALA 138 Ca 0.00 -1.26 -0.72 0.00 0.00 0.00 0.00 54.91 52.93 1qfu h ALA 138 Cb 0.45 0.54 -0.32 0.00 0.00 0.00 0.00 17.79 18.46 1qfu h ALA 138 CO 0.00 1.19 0.44 0.00 0.00 0.00 0.00 179.25 180.87 1qfu n LYS 140 N -0.36 2.67 -3.73 0.00 5.02 -1.23 -1.86 118.16 118.67 1qfu n LYS 140 Ca 0.46 0.96 -0.31 0.00 -2.02 0.00 0.00 58.31 57.40 1qfu n LYS 140 Cb 0.35 -2.78 -0.09 0.00 -0.02 0.00 0.00 35.03 32.48 1qfu n LYS 140 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1qfu n ARG 141 N 3.64 2.25 0.00 1.97 0.63 -0.77 -4.79 116.66 119.59 1qfu n ARG 141 Ca 0.15 -4.52 0.00 0.00 -0.92 0.00 0.00 57.85 52.56 1qfu n ARG 141 Cb 0.34 -2.33 0.00 0.00 0.45 0.00 0.00 32.46 30.92 1qfu n ARG 141 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1qfu n GLY 142 N 1.87 0.36 0.24 5.14 0.00 -1.26 -4.32 105.19 107.21 1qfu n GLY 142 Ca 0.22 -1.81 0.14 0.00 0.00 0.00 0.00 46.02 44.57 1qfu n GLY 142 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qfu h PRO 143 N 0.00 0.00 0.00 1.61 0.13 -2.03 -3.46 132.00 128.26 1qfu h PRO 143 Ca 0.00 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.61 1qfu h PRO 143 Cb 0.00 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.14 1qfu h PRO 143 CO 0.00 0.05 -0.13 0.41 -0.23 0.00 0.00 178.00 178.10 1qfu n GLY 144 N 0.56 2.20 3.80 1.56 0.00 -1.26 -5.11 105.19 106.93 1qfu n GLY 144 Ca 0.02 -2.25 -0.30 0.00 0.00 0.00 0.00 46.02 43.49 1qfu n GLY 144 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qfu s SER 145 N -4.53 4.52 0.00 1.61 1.04 -1.26 -1.84 113.70 113.23 1qfu s SER 145 Ca 0.53 1.38 0.00 0.00 0.48 0.00 0.00 55.95 58.33 1qfu s SER 145 Cb -0.04 -2.13 0.00 0.00 0.10 0.00 0.00 66.02 63.95 1qfu s SER 145 CO 0.33 -1.96 0.00 0.61 0.98 0.00 0.00 173.24 173.20 1qfu n GLY 146 N -1.97 2.01 0.00 7.32 0.00 0.93 -4.20 105.19 109.28 1qfu n GLY 146 Ca 0.07 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1qfu n GLY 146 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1qfu n PHE 147 N 0.00 -0.59 -2.33 1.61 7.35 -1.21 0.69 117.46 122.97 1qfu n PHE 147 Ca 0.00 0.00 -0.43 0.00 -0.76 0.00 0.00 57.45 56.26 1qfu n PHE 147 Cb 0.00 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 39.81 1qfu n PHE 147 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 1qfu s PHE 148 N -6.25 2.56 0.62 -5.13 0.08 -1.26 -4.53 117.98 104.06 1qfu s PHE 148 Ca 0.00 0.79 0.24 0.00 0.12 0.00 0.00 56.93 58.08 1qfu s PHE 148 Cb 0.00 -3.80 0.96 0.00 -0.57 0.00 0.00 43.02 39.60 1qfu s PHE 148 CO 0.00 -2.12 1.43 0.66 -0.10 0.00 0.00 175.22 175.09 1qfu h SER 149 N 9.29 0.00 -0.27 1.36 4.64 -1.52 -0.06 113.55 126.98 1qfu h SER 149 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1qfu h SER 149 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1qfu h SER 149 CO 1.00 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 177.50 1qfu n ARG 150 N -3.21 2.49 -5.02 4.77 5.12 -0.76 -4.96 116.66 115.09 1qfu n ARG 150 Ca 0.15 -1.87 -0.31 0.00 -1.93 0.00 0.00 57.85 53.89 1qfu n ARG 150 Cb 1.20 -1.24 -0.15 0.00 -1.16 0.00 0.00 32.46 31.11 1qfu n ARG 150 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1qfu s LEU 151 N -0.98 2.27 -0.48 0.55 1.43 -0.04 -3.65 118.68 117.79 1qfu s LEU 151 Ca 0.20 -0.47 -0.00 0.00 -1.03 0.00 0.00 54.13 52.83 1qfu s LEU 151 Cb 0.11 -1.38 0.13 0.00 0.03 0.00 0.00 46.19 45.07 1qfu s LEU 151 CO 0.14 0.29 0.25 0.21 0.23 0.00 0.00 176.35 177.48 1qfu s ASN 152 N -0.97 4.96 -0.02 2.29 2.47 0.19 -4.68 114.94 119.18 1qfu s ASN 152 Ca 0.12 -2.50 -0.30 0.00 0.42 0.00 0.00 52.86 50.60 1qfu s ASN 152 Cb -0.10 -1.76 -0.07 0.00 -1.45 0.00 0.00 41.25 37.88 1qfu s ASN 152 CO 0.01 -0.40 1.72 0.86 -3.72 0.00 0.00 177.10 175.58 1qfu s TRP 153 N 0.45 1.87 -0.19 0.43 -0.11 -1.26 -2.20 118.94 117.93 1qfu s TRP 153 Ca 0.13 0.06 -0.05 0.00 1.22 0.00 0.00 56.10 57.47 1qfu s TRP 153 Cb -0.22 -3.99 -0.03 0.00 -1.50 0.00 0.00 33.47 27.73 1qfu s TRP 153 CO -0.04 -4.22 0.00 -0.51 -4.62 0.00 0.00 176.95 167.56 1qfu s LEU 154 N 3.99 3.36 0.31 5.86 1.43 -1.25 -2.19 118.68 130.19 1qfu s LEU 154 Ca 0.77 -0.13 0.10 0.00 -1.03 0.00 0.00 54.13 53.84 1qfu s LEU 154 Cb -0.36 -1.84 -0.05 0.00 0.03 0.00 0.00 46.19 43.97 1qfu s LEU 154 CO 0.32 0.11 -0.08 0.42 0.23 0.00 0.00 176.35 177.36 1qfu s THR 155 N 0.72 2.62 0.42 5.49 -4.23 0.27 -4.71 115.64 116.21 1qfu s THR 155 Ca 0.00 -2.14 -0.26 0.00 -1.18 0.00 0.00 61.69 58.11 1qfu s THR 155 Cb -0.14 -2.63 -0.09 0.00 1.34 0.00 0.00 72.50 70.98 1qfu s THR 155 CO 0.02 -0.28 1.41 -1.59 -0.54 0.00 0.00 174.62 173.64 1qfu s LYS 156 N -3.63 3.87 -0.18 3.99 0.00 0.20 0.27 119.74 124.27 1qfu s LYS 156 Ca 0.32 2.39 -0.10 0.00 0.00 0.00 0.00 55.97 58.59 1qfu s LYS 156 Cb -0.02 -2.77 -0.05 0.00 0.00 0.00 0.00 37.83 34.99 1qfu s LYS 156 CO 0.18 -0.66 0.15 0.45 0.00 0.00 0.00 175.35 175.47 1qfu s SER 157 N -0.47 6.28 0.29 0.03 0.15 -0.97 -4.34 113.70 114.67 1qfu s SER 157 Ca 0.58 0.31 0.00 0.00 0.70 0.00 0.00 55.95 57.54 1qfu s SER 157 Cb -0.43 -2.10 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 1qfu s SER 157 CO 0.56 0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.82 1qfu n GLY 158 N 3.22 0.41 0.43 9.45 0.00 -1.26 -1.59 105.19 115.85 1qfu n GLY 158 Ca -0.16 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1qfu n GLY 158 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1qfu n SER 159 N 4.78 0.00 -3.74 1.61 3.41 -1.26 -5.09 113.62 113.33 1qfu n SER 159 Ca 0.00 -1.60 -0.13 0.00 -0.26 0.00 0.00 58.87 56.88 1qfu n SER 159 Cb 0.00 -0.12 -0.10 0.00 -0.26 0.00 0.00 64.21 63.73 1qfu n SER 159 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1qfu s THR 160 N 0.00 0.01 -0.32 6.66 -4.23 -0.62 -4.93 115.64 112.21 1qfu s THR 160 Ca 0.00 -0.10 -0.06 0.00 -1.18 0.00 0.00 61.69 60.36 1qfu s THR 160 Cb 0.00 -0.57 0.03 0.00 1.34 0.00 0.00 72.50 73.31 1qfu s THR 160 CO 0.00 -0.05 0.08 -0.47 -0.54 0.00 0.00 174.62 173.64 1qfu s TYR 161 N -0.14 3.23 0.50 3.99 6.14 -1.26 -2.30 117.35 127.51 1qfu s TYR 161 Ca -0.03 -1.40 -0.19 0.00 0.64 0.00 0.00 57.07 56.09 1qfu s TYR 161 Cb -0.03 -2.25 -0.08 0.00 0.42 0.00 0.00 41.96 40.02 1qfu s TYR 161 CO 0.02 -0.71 1.01 -1.25 0.64 0.00 0.00 175.55 175.26 1qfu s PRO 162 N 1.40 3.82 -0.59 4.97 0.04 -1.26 -4.89 135.00 138.49 1qfu s PRO 162 Ca -0.01 1.22 -0.27 0.00 0.04 0.00 0.00 61.00 61.98 1qfu s PRO 162 Cb -0.19 -2.11 -0.02 0.00 0.04 0.00 0.00 34.50 32.22 1qfu s PRO 162 CO 0.02 -0.39 1.83 0.08 0.04 0.00 0.00 177.00 178.58 1qfu s VAL 163 N -2.21 3.38 0.47 -0.36 1.01 -1.26 -4.66 120.40 116.77 1qfu s VAL 163 Ca 0.64 0.24 -0.23 0.00 0.00 0.00 0.00 61.98 62.63 1qfu s VAL 163 Cb -0.14 -3.96 -0.07 0.00 0.00 0.00 0.00 36.38 32.22 1qfu s VAL 163 CO 0.23 -0.90 1.22 -0.76 0.00 0.00 0.00 175.10 174.89 1qfu s LEU 164 N 8.76 4.01 -0.49 3.92 1.43 0.19 -4.89 118.68 131.61 1qfu s LEU 164 Ca 0.67 2.45 0.06 0.00 -1.03 0.00 0.00 54.13 56.28 1qfu s LEU 164 Cb -0.13 -4.20 0.23 0.00 0.03 0.00 0.00 46.19 42.12 1qfu s LEU 164 CO 0.22 -1.05 0.83 -3.20 0.23 0.00 0.00 176.35 173.38 1qfu n ASN 165 N -0.51 -2.93 -4.95 2.29 5.15 -1.25 -1.65 115.26 111.41 1qfu n ASN 165 Ca 0.07 -3.18 -0.23 0.00 -0.60 0.00 0.00 54.58 50.64 1qfu n ASN 165 Cb 0.47 1.72 0.03 0.00 -0.53 0.00 0.00 39.78 41.47 1qfu n ASN 165 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1qfu s VAL 166 N 0.68 3.25 0.03 3.44 -7.23 -0.38 -4.95 120.40 115.24 1qfu s VAL 166 Ca 0.32 -0.45 -0.04 0.00 -1.81 0.00 0.00 61.98 60.00 1qfu s VAL 166 Cb 0.17 -3.24 -0.02 0.00 0.56 0.00 0.00 36.38 33.85 1qfu s VAL 166 CO -0.20 -0.19 0.05 0.28 -0.31 0.00 0.00 175.10 174.73 1qfu s THR 167 N -2.78 0.13 -0.29 5.32 -1.32 -1.26 -1.76 115.64 113.68 1qfu s THR 167 Ca 0.54 -1.06 0.02 0.00 -1.21 0.00 0.00 61.69 59.99 1qfu s THR 167 Cb -0.10 -0.70 0.17 0.00 -1.51 0.00 0.00 72.50 70.36 1qfu s THR 167 CO 0.40 -0.58 0.46 -0.32 -2.21 0.00 0.00 174.62 172.36 1qfu s MET 168 N -2.21 0.45 0.12 7.08 1.75 0.10 -4.96 119.30 121.63 1qfu s MET 168 Ca -0.09 0.30 -0.30 0.00 -1.25 0.00 0.00 55.69 54.35 1qfu s MET 168 Cb -0.04 -0.16 -0.06 0.00 2.84 0.00 0.00 34.83 37.41 1qfu s MET 168 CO -0.03 -0.99 1.10 -1.25 -0.65 0.00 0.00 175.02 173.20 1qfu s PRO 169 N 2.62 4.56 -0.92 4.11 0.04 -1.26 -0.36 135.00 143.79 1qfu s PRO 169 Ca 0.10 1.67 -0.22 0.00 0.04 0.00 0.00 61.00 62.60 1qfu s PRO 169 Cb -0.12 -3.33 0.08 0.00 0.04 0.00 0.00 34.50 31.17 1qfu s PRO 169 CO -0.28 -0.01 1.28 1.21 0.04 0.00 0.00 177.00 179.24 1qfu s ASN 170 N 0.33 6.48 -0.03 6.66 3.84 0.31 -4.76 114.94 127.76 1qfu s ASN 170 Ca 0.52 -1.50 0.21 0.00 0.21 0.00 0.00 52.86 52.30 1qfu s ASN 170 Cb -0.28 -2.50 0.66 0.00 -0.55 0.00 0.00 41.25 38.58 1qfu s ASN 170 CO 0.32 -1.39 1.55 0.59 -2.79 0.00 0.00 177.10 175.39 1qfu n ASN 171 N 8.04 4.08 -4.97 -4.21 5.03 -1.26 -0.53 115.26 121.44 1qfu n ASN 171 Ca 0.23 -2.11 -0.19 0.00 0.87 0.00 0.00 54.58 53.38 1qfu n ASN 171 Cb 0.50 -0.51 -0.01 0.00 -1.02 0.00 0.00 39.78 38.74 1qfu n ASN 171 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1qfu s ASP 172 N -0.97 5.68 -0.52 6.41 1.01 -1.26 -4.98 116.67 122.03 1qfu s ASP 172 Ca 0.49 -0.37 -0.02 0.00 0.71 0.00 0.00 52.55 53.36 1qfu s ASP 172 Cb 0.27 -0.91 0.33 0.00 1.01 0.00 0.00 42.92 43.62 1qfu s ASP 172 CO 0.31 -0.57 2.06 -0.46 0.21 0.00 0.00 175.17 176.72 1qfu n ASN 173 N -1.68 7.14 -3.70 0.27 0.23 -1.26 -4.44 115.26 111.83 1qfu n ASN 173 Ca 0.03 -3.47 -0.11 0.00 -0.53 0.00 0.00 54.58 50.50 1qfu n ASN 173 Cb 0.59 -1.03 -0.06 0.00 -2.08 0.00 0.00 39.78 37.20 1qfu n ASN 173 CO 0.00 0.00 0.00 0.72 -0.93 0.00 0.00 177.26 177.05 1qfu s PHE 174 N -2.92 -0.16 0.63 -2.53 -0.12 -1.26 -4.99 117.98 106.64 1qfu s PHE 174 Ca 0.50 -0.05 -0.16 0.00 -0.05 0.00 0.00 56.93 57.17 1qfu s PHE 174 Cb 0.39 0.17 -0.01 0.00 -0.63 0.00 0.00 43.02 42.94 1qfu s PHE 174 CO -0.03 -0.60 1.14 -0.51 -0.05 0.00 0.00 175.22 175.17 1qfu s ASP 175 N -2.40 5.15 -0.05 1.98 1.11 -1.26 -4.15 116.67 117.05 1qfu s ASP 175 Ca -0.01 2.13 0.04 0.00 0.18 0.00 0.00 52.55 54.88 1qfu s ASP 175 Cb 0.01 -2.57 0.00 0.00 1.07 0.00 0.00 42.92 41.43 1qfu s ASP 175 CO -0.07 -1.61 -0.15 -0.54 1.18 0.00 0.00 175.17 173.98 1qfu s LYS 176 N -3.79 1.69 -0.27 8.23 1.02 -0.46 -3.94 119.74 122.22 1qfu s LYS 176 Ca 0.70 -0.53 -0.10 0.00 0.02 0.00 0.00 55.97 56.06 1qfu s LYS 176 Cb -0.23 -1.45 -0.05 0.00 -0.52 0.00 0.00 37.83 35.58 1qfu s LYS 176 CO 0.37 0.18 0.17 -1.17 -0.92 0.00 0.00 175.35 173.98 1qfu s LEU 177 N 0.20 3.93 -0.25 3.17 2.96 -0.71 -0.01 118.68 127.97 1qfu s LEU 177 Ca -0.07 -0.03 -0.05 0.00 -0.22 0.00 0.00 54.13 53.76 1qfu s LEU 177 Cb -0.12 -2.08 -0.00 0.00 0.50 0.00 0.00 46.19 44.48 1qfu s LEU 177 CO 0.02 -0.04 0.01 -0.31 -1.32 0.00 0.00 176.35 174.72 1qfu s TYR 178 N 1.66 3.06 -0.31 5.38 2.02 0.22 -1.27 117.35 128.10 1qfu s TYR 178 Ca 0.07 -0.97 -0.11 0.00 -0.37 0.00 0.00 57.07 55.68 1qfu s TYR 178 Cb -0.16 -2.17 -0.02 0.00 -0.40 0.00 0.00 41.96 39.21 1qfu s TYR 178 CO 0.09 -0.56 0.20 0.42 -1.57 0.00 0.00 175.55 174.13 1qfu s ILE 179 N 1.48 5.10 0.31 2.71 -1.09 -1.26 -0.48 121.20 127.97 1qfu s ILE 179 Ca 0.04 -0.16 0.04 0.00 -2.23 0.00 0.00 60.65 58.35 1qfu s ILE 179 Cb -0.16 -3.55 -0.03 0.00 -1.58 0.00 0.00 42.46 37.14 1qfu s ILE 179 CO -0.01 0.09 0.20 -1.66 -1.23 0.00 0.00 174.94 172.33 1qfu s TRP 180 N 1.70 1.63 0.03 3.97 1.48 -1.09 -4.32 118.94 122.34 1qfu s TRP 180 Ca 0.06 -1.47 -0.00 0.00 -1.06 0.00 0.00 56.10 53.62 1qfu s TRP 180 Cb -0.17 -0.81 0.00 0.00 -1.16 0.00 0.00 33.47 31.34 1qfu s TRP 180 CO 0.09 -0.64 0.05 0.41 -4.06 0.00 0.00 176.95 172.80 1qfu n GLY 181 N -0.60 2.93 3.00 3.67 0.00 -1.05 -0.68 105.19 112.46 1qfu n GLY 181 Ca 0.03 -1.36 -0.11 0.00 0.00 0.00 0.00 46.02 44.57 1qfu n GLY 181 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1qfu s ILE 182 N -2.51 0.05 0.19 -0.61 2.07 -0.31 -2.96 121.20 117.12 1qfu s ILE 182 Ca 0.03 -0.40 -0.03 0.00 -1.41 0.00 0.00 60.65 58.83 1qfu s ILE 182 Cb -0.00 -0.23 -0.05 0.00 0.13 0.00 0.00 42.46 42.31 1qfu s ILE 182 CO 0.02 -0.22 0.42 -2.28 -1.91 0.00 0.00 174.94 170.97 1qfu s HIS 183 N -0.69 3.48 -0.38 3.50 5.65 -0.39 -1.17 115.29 125.29 1qfu s HIS 183 Ca -0.08 0.50 0.01 0.00 0.25 0.00 0.00 55.06 55.73 1qfu s HIS 183 Cb -0.05 -1.97 0.13 0.00 -1.18 0.00 0.00 32.58 29.51 1qfu s HIS 183 CO 0.00 0.36 0.20 -1.01 -0.65 0.00 0.00 174.74 173.65 1qfu s HIS 184 N -1.82 1.34 0.43 3.88 0.09 -0.14 -4.55 115.29 114.52 1qfu s HIS 184 Ca 0.41 -1.93 -0.25 0.00 -0.00 0.00 0.00 55.06 53.29 1qfu s HIS 184 Cb -0.11 -1.41 -0.08 0.00 -0.00 0.00 0.00 32.58 30.97 1qfu s HIS 184 CO 0.27 -0.82 1.27 -2.14 -0.00 0.00 0.00 174.74 173.32 1qfu s PRO 185 N 0.89 3.82 0.23 8.40 0.02 -1.26 -2.85 135.00 144.25 1qfu s PRO 185 Ca 0.16 2.06 0.25 0.00 0.02 0.00 0.00 61.00 63.50 1qfu s PRO 185 Cb -0.23 -2.61 0.68 0.00 0.02 0.00 0.00 34.50 32.37 1qfu s PRO 185 CO -0.04 -0.58 1.69 0.66 -0.33 0.00 0.00 177.00 178.39 1qfu h SER 186 N 2.38 0.00 -4.65 2.53 4.64 -1.79 -2.44 113.55 114.23 1qfu h SER 186 Ca -0.50 -0.03 -0.29 0.00 -0.47 0.00 0.00 61.79 60.51 1qfu h SER 186 Cb 1.25 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.15 1qfu h SER 186 CO 0.61 0.01 -0.73 0.42 -0.87 0.00 0.00 176.83 176.28 1qfu s THR 187 N -3.13 0.68 0.04 2.95 -4.23 -1.26 -3.19 115.64 107.51 1qfu s THR 187 Ca 0.09 -1.34 0.33 0.00 -1.18 0.00 0.00 61.69 59.59 1qfu s THR 187 Cb 0.12 -0.96 0.39 0.00 1.34 0.00 0.00 72.50 73.38 1qfu s THR 187 CO 0.62 -0.48 1.95 0.78 -0.54 0.00 0.00 174.62 176.95 1qfu h ASN 188 N 4.05 0.00 0.76 3.99 2.35 -1.99 -1.02 115.58 123.73 1qfu h ASN 188 Ca -0.36 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.35 1qfu h ASN 188 Cb 1.19 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.57 1qfu h ASN 188 CO 0.47 0.00 -0.36 -0.61 -1.65 0.00 0.00 177.43 175.27 1qfu h GLN 189 N 0.00 -0.98 -0.65 0.81 4.15 -1.99 -2.36 115.11 114.09 1qfu h GLN 189 Ca 0.00 0.07 0.14 0.00 0.77 0.00 0.00 58.65 59.62 1qfu h GLN 189 Cb 0.55 0.22 -0.11 0.00 0.21 0.00 0.00 27.48 28.35 1qfu h GLN 189 CO 0.00 -0.65 0.00 1.49 -1.93 0.00 0.00 178.83 177.74 1qfu h GLU 190 N -1.13 0.11 0.01 1.69 4.81 -1.86 0.49 114.58 118.71 1qfu h GLU 190 Ca -0.10 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 1qfu h GLU 190 Cb 0.78 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1qfu h GLU 190 CO 0.17 0.08 -0.06 0.37 -0.73 0.00 0.00 179.01 178.83 1qfu h GLN 191 N 0.12 -0.08 -0.44 1.92 5.75 -1.14 0.36 115.11 121.60 1qfu h GLN 191 Ca 0.34 0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.83 1qfu h GLN 191 Cb 0.56 0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.11 1qfu h GLN 191 CO -0.56 -0.06 0.21 1.79 -2.65 0.00 0.00 178.83 177.57 1qfu h THR 192 N -0.09 1.15 0.44 2.39 1.35 -1.11 0.41 112.91 117.45 1qfu h THR 192 Ca -0.00 -0.42 -0.01 0.00 -0.55 0.00 0.00 66.41 65.43 1qfu h THR 192 Cb 0.09 0.59 -0.02 0.00 -1.73 0.00 0.00 68.15 67.08 1qfu h THR 192 CO -0.04 0.17 -0.39 0.28 -0.25 0.00 0.00 175.52 175.30 1qfu h SER 193 N 0.61 -1.04 0.07 5.36 0.02 0.40 -2.87 113.55 116.10 1qfu h SER 193 Ca 0.15 0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 61.18 1qfu h SER 193 Cb 0.06 0.34 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1qfu h SER 193 CO -0.02 -0.55 -0.03 -0.07 -1.14 0.00 0.00 176.83 175.02 1qfu h LEU 194 N -0.83 -0.08 -7.72 5.07 3.38 0.00 -3.42 115.31 111.72 1qfu h LEU 194 Ca -0.04 -0.54 -0.66 0.00 0.09 0.00 0.00 57.88 56.73 1qfu h LEU 194 Cb 0.73 0.02 -0.39 0.00 0.09 0.00 0.00 40.66 41.10 1qfu h LEU 194 CO -0.03 0.58 -0.75 -0.31 0.09 0.00 0.00 178.44 178.02 1qfu s TYR 195 N -3.17 3.51 0.64 1.13 2.02 0.14 -0.63 117.35 120.99 1qfu s TYR 195 Ca -0.14 -2.73 0.22 0.00 -0.37 0.00 0.00 57.07 54.05 1qfu s TYR 195 Cb -0.00 -2.55 1.06 0.00 -0.40 0.00 0.00 41.96 40.06 1qfu s TYR 195 CO 0.55 -0.92 1.57 0.28 -1.57 0.00 0.00 175.55 175.46 1qfu h VAL 196 N 6.65 0.09 0.00 0.71 2.07 -1.66 -3.12 116.25 121.00 1qfu h VAL 196 Ca -0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.43 1qfu h VAL 196 Cb 1.03 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1qfu h VAL 196 CO 0.50 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.09 1qfu n GLN 197 N -3.06 0.27 0.00 1.57 6.02 -1.26 -4.69 117.38 116.24 1qfu n GLN 197 Ca 0.06 0.07 0.00 0.00 -0.01 0.00 0.00 57.00 57.12 1qfu n GLN 197 Cb 0.82 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.58 1qfu n GLN 197 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1qfu n ALA 198 N -1.32 0.00 -2.11 -1.58 0.00 -1.18 -4.72 120.51 109.59 1qfu n ALA 198 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1qfu n ALA 198 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.65 1qfu n ALA 198 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1qfu n SER 199 N 0.36 0.04 0.00 0.00 2.88 -1.26 -4.89 113.62 110.75 1qfu n SER 199 Ca 0.00 -0.09 0.00 0.00 -1.33 0.00 0.00 58.87 57.45 1qfu n SER 199 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1qfu n SER 199 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1qfu n GLY 200 N 5.00 4.18 3.42 0.46 0.00 -1.26 -4.88 105.19 112.11 1qfu n GLY 200 Ca 0.00 -0.40 -0.16 0.00 0.00 0.00 0.00 46.02 45.46 1qfu n GLY 200 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1qfu s ARG 201 N -1.90 0.86 -0.05 1.61 1.70 -1.21 -4.11 118.95 115.84 1qfu s ARG 201 Ca 0.00 0.21 0.06 0.00 -0.47 0.00 0.00 55.73 55.53 1qfu s ARG 201 Cb 0.00 0.40 -0.01 0.00 -0.57 0.00 0.00 34.95 34.77 1qfu s ARG 201 CO 0.00 -0.24 -0.24 0.08 -1.08 0.00 0.00 175.30 173.82 1qfu s VAL 202 N -0.97 2.00 -0.32 4.99 1.01 0.56 -3.24 120.40 124.43 1qfu s VAL 202 Ca -0.10 -1.04 -0.02 0.00 0.00 0.00 0.00 61.98 60.82 1qfu s VAL 202 Cb -0.02 -1.69 0.11 0.00 0.00 0.00 0.00 36.38 34.78 1qfu s VAL 202 CO 0.06 0.56 0.15 -0.89 0.00 0.00 0.00 175.10 174.98 1qfu s THR 203 N -0.17 0.32 -0.19 3.92 2.01 -0.62 0.03 115.64 120.93 1qfu s THR 203 Ca -0.03 -1.26 -0.09 0.00 0.31 0.00 0.00 61.69 60.62 1qfu s THR 203 Cb -0.13 -1.26 -0.05 0.00 0.01 0.00 0.00 72.50 71.07 1qfu s THR 203 CO 0.03 -0.78 0.12 -0.69 -0.69 0.00 0.00 174.62 172.61 1qfu s VAL 204 N 1.63 5.29 0.27 3.82 1.01 0.13 -1.98 120.40 130.57 1qfu s VAL 204 Ca 0.12 0.15 -0.20 0.00 0.00 0.00 0.00 61.98 62.04 1qfu s VAL 204 Cb -0.18 -3.40 0.02 0.00 0.00 0.00 0.00 36.38 32.81 1qfu s VAL 204 CO -0.23 0.45 0.69 -0.94 0.00 0.00 0.00 175.10 175.07 1qfu s SER 205 N 0.29 -0.26 0.24 3.32 1.04 -1.22 0.57 113.70 117.68 1qfu s SER 205 Ca 0.07 -0.61 0.04 0.00 0.48 0.00 0.00 55.95 55.93 1qfu s SER 205 Cb -0.11 0.71 -0.02 0.00 0.10 0.00 0.00 66.02 66.70 1qfu s SER 205 CO -0.01 -1.31 0.15 0.35 0.98 0.00 0.00 173.24 173.40 1qfu n THR 206 N -0.45 0.00 0.28 2.02 -2.24 -0.31 -1.45 114.28 112.13 1qfu n THR 206 Ca -0.04 -1.63 0.17 0.00 -2.27 0.00 0.00 64.05 60.28 1qfu n THR 206 Cb 0.60 0.73 0.76 0.00 -2.10 0.00 0.00 70.33 70.31 1qfu n THR 206 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1qfu h ARG 207 N 0.00 0.00 0.01 -0.78 3.08 -1.97 -3.24 114.38 111.48 1qfu h ARG 207 Ca -0.18 0.00 -0.40 0.00 0.07 0.00 0.00 59.98 59.47 1qfu h ARG 207 Cb 0.81 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.80 1qfu h ARG 207 CO 0.27 0.03 -2.41 0.54 -1.07 0.00 0.00 179.97 177.33 1qfu n ARG 208 N -3.15 0.65 -4.08 0.04 1.74 -1.26 -5.03 116.66 105.56 1qfu n ARG 208 Ca -0.00 0.19 -0.24 0.00 -0.77 0.00 0.00 57.85 57.03 1qfu n ARG 208 Cb 0.27 -1.54 -0.07 0.00 -1.02 0.00 0.00 32.46 30.11 1qfu n ARG 208 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1qfu s SER 209 N -6.78 4.54 -0.23 0.55 1.04 -1.22 -5.15 113.70 106.45 1qfu s SER 209 Ca -0.34 -0.96 -0.14 0.00 0.48 0.00 0.00 55.95 54.99 1qfu s SER 209 Cb 0.10 -0.55 0.07 0.00 0.10 0.00 0.00 66.02 65.73 1qfu s SER 209 CO 0.60 -0.47 0.58 -1.58 0.98 0.00 0.00 173.24 173.34 1qfu s GLN 210 N -3.90 0.59 -0.03 4.02 0.74 -1.26 -1.16 119.66 118.65 1qfu s GLN 210 Ca 0.41 1.03 0.00 0.00 0.05 0.00 0.00 55.36 56.84 1qfu s GLN 210 Cb 0.01 0.10 0.03 0.00 1.10 0.00 0.00 33.01 34.25 1qfu s GLN 210 CO 0.23 -0.15 0.01 -0.65 -0.55 0.00 0.00 175.29 174.18 1qfu s GLN 211 N 1.42 0.23 -0.13 1.67 -0.21 0.19 -4.98 119.66 117.86 1qfu s GLN 211 Ca -0.09 0.12 0.00 0.00 0.02 0.00 0.00 55.36 55.42 1qfu s GLN 211 Cb -0.06 -0.47 0.02 0.00 1.00 0.00 0.00 33.01 33.50 1qfu s GLN 211 CO -0.15 -0.17 -0.11 0.99 -2.12 0.00 0.00 175.29 173.73 1qfu s THR 212 N 1.19 1.30 -0.13 -0.19 2.01 -1.26 0.20 115.64 118.77 1qfu s THR 212 Ca -0.07 -0.47 -0.00 0.00 0.31 0.00 0.00 61.69 61.45 1qfu s THR 212 Cb -0.13 -1.26 -0.02 0.00 0.01 0.00 0.00 72.50 71.10 1qfu s THR 212 CO -0.02 0.41 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.57 1qfu s ILE 213 N 1.52 3.13 -0.22 1.82 -1.09 0.10 -4.94 121.20 121.52 1qfu s ILE 213 Ca 0.04 -0.64 -0.05 0.00 -2.23 0.00 0.00 60.65 57.76 1qfu s ILE 213 Cb -0.13 -2.31 -0.02 0.00 -1.58 0.00 0.00 42.46 38.42 1qfu s ILE 213 CO -0.08 0.53 0.01 -0.63 -1.23 0.00 0.00 174.94 173.53 1qfu s ILE 214 N 0.27 3.86 0.85 2.92 1.09 -1.26 -0.32 121.20 128.60 1qfu s ILE 214 Ca -0.09 -0.33 -0.10 0.00 -1.10 0.00 0.00 60.65 59.03 1qfu s ILE 214 Cb -0.15 -2.77 0.11 0.00 -1.06 0.00 0.00 42.46 38.58 1qfu s ILE 214 CO 0.05 0.40 1.13 -2.16 -0.10 0.00 0.00 174.94 174.26 1qfu s PRO 215 N 1.36 1.52 -0.16 2.79 0.04 -1.26 -5.04 135.00 134.25 1qfu s PRO 215 Ca 0.05 1.43 -0.00 0.00 0.04 0.00 0.00 61.00 62.51 1qfu s PRO 215 Cb -0.15 -1.79 0.04 0.00 0.04 0.00 0.00 34.50 32.64 1qfu s PRO 215 CO 0.01 -2.24 -0.08 -0.80 0.04 0.00 0.00 177.00 173.93 1qfu s ASN 216 N -2.89 2.86 0.24 6.66 0.01 -1.26 -5.01 114.94 115.55 1qfu s ASN 216 Ca 0.65 -0.65 -0.28 0.00 -0.71 0.00 0.00 52.86 51.88 1qfu s ASN 216 Cb -0.21 -1.01 -0.09 0.00 0.41 0.00 0.00 41.25 40.35 1qfu s ASN 216 CO 0.56 -0.15 0.89 -0.63 -1.51 0.00 0.00 177.10 176.27 1qfu s ILE 217 N 1.57 4.18 0.00 0.60 1.09 -1.26 -4.41 121.20 122.98 1qfu s ILE 217 Ca 0.01 1.93 0.00 0.00 -1.10 0.00 0.00 60.65 61.49 1qfu s ILE 217 Cb -0.15 -4.22 0.00 0.00 -1.06 0.00 0.00 42.46 37.04 1qfu s ILE 217 CO -0.08 0.44 0.00 0.61 -0.10 0.00 0.00 174.94 175.80 1qfu n GLY 218 N 1.33 2.45 3.67 6.18 0.00 -0.92 -4.98 105.19 112.93 1qfu n GLY 218 Ca -0.02 -0.94 -0.40 0.00 0.00 0.00 0.00 46.02 44.65 1qfu n GLY 218 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qfu s SER 219 N 0.00 6.74 0.43 1.61 0.01 -1.25 -4.01 113.70 117.22 1qfu s SER 219 Ca 0.00 0.90 0.07 0.00 1.31 0.00 0.00 55.95 58.23 1qfu s SER 219 Cb 0.00 -2.36 -0.05 0.00 0.21 0.00 0.00 66.02 63.82 1qfu s SER 219 CO 0.00 -0.25 0.15 -0.13 0.41 0.00 0.00 173.24 173.42 1qfu s ARG 220 N 1.73 2.18 0.66 12.44 3.00 -1.16 -5.11 118.95 132.69 1qfu s ARG 220 Ca 0.30 -1.95 -0.15 0.00 0.00 0.00 0.00 55.73 53.94 1qfu s ARG 220 Cb -0.16 -1.89 0.00 0.00 0.00 0.00 0.00 34.95 32.90 1qfu s ARG 220 CO 0.11 -0.15 1.12 -2.14 0.00 0.00 0.00 175.30 174.23 1qfu s PRO 221 N -3.89 2.77 0.21 3.54 0.02 -1.26 -4.76 135.00 131.64 1qfu s PRO 221 Ca 0.37 1.42 -0.30 0.00 0.02 0.00 0.00 61.00 62.50 1qfu s PRO 221 Cb 0.04 -1.94 -0.10 0.00 0.02 0.00 0.00 34.50 32.52 1qfu s PRO 221 CO 0.20 -1.28 1.47 -1.58 -0.33 0.00 0.00 177.00 175.48 1qfu s TRP 222 N -2.30 3.05 -0.18 6.54 0.52 -1.26 -4.49 118.94 120.82 1qfu s TRP 222 Ca 0.68 0.92 -0.04 0.00 0.02 0.00 0.00 56.10 57.67 1qfu s TRP 222 Cb -0.21 -3.83 0.08 0.00 -1.15 0.00 0.00 33.47 28.36 1qfu s TRP 222 CO 0.41 -2.82 0.16 0.08 0.02 0.00 0.00 176.95 174.81 1qfu s VAL 223 N 0.38 -0.22 -1.20 4.03 1.01 0.64 -4.87 120.40 120.17 1qfu s VAL 223 Ca 0.62 -0.10 -0.08 0.00 0.00 0.00 0.00 61.98 62.42 1qfu s VAL 223 Cb -0.42 -0.61 -0.02 0.00 0.00 0.00 0.00 36.38 35.34 1qfu s VAL 223 CO 0.39 -0.21 0.77 0.54 0.00 0.00 0.00 175.10 176.59 1qfu n ARG 224 N 5.30 -3.12 0.00 2.72 1.74 -1.26 -2.48 116.66 119.56 1qfu n ARG 224 Ca -0.06 0.61 0.00 0.00 -0.77 0.00 0.00 57.85 57.63 1qfu n ARG 224 Cb 0.49 -4.95 0.00 0.00 -1.02 0.00 0.00 32.46 26.98 1qfu n ARG 224 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1qfu n GLY 225 N -1.55 1.91 3.35 -0.13 0.00 -1.26 -4.50 105.19 103.01 1qfu n GLY 225 Ca -0.19 -0.06 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 1qfu n GLY 225 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1qfu n LEU 226 N 0.00 -1.15 0.00 0.99 4.77 -1.03 -4.74 117.00 115.83 1qfu n LEU 226 Ca 0.00 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 1qfu n LEU 226 Cb 0.00 -1.10 0.00 0.00 -2.33 0.00 0.00 43.42 39.99 1qfu n LEU 226 CO 0.00 -3.61 0.18 -0.24 -1.33 0.00 0.00 177.39 172.39 1qfu n SER 227 N -1.08 0.06 -4.85 -1.43 2.88 -1.26 -0.26 113.62 107.68 1qfu n SER 227 Ca 0.04 -1.02 -0.21 0.00 -1.33 0.00 0.00 58.87 56.35 1qfu n SER 227 Cb 0.56 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.98 1qfu n SER 227 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1qfu s SER 228 N -0.02 4.97 0.29 -3.46 1.04 -1.26 -3.00 113.70 112.27 1qfu s SER 228 Ca 0.00 -0.76 0.01 0.00 0.48 0.00 0.00 55.95 55.68 1qfu s SER 228 Cb 0.00 -0.61 -0.02 0.00 0.10 0.00 0.00 66.02 65.49 1qfu s SER 228 CO 0.00 -0.59 0.31 -0.13 0.98 0.00 0.00 173.24 173.81 1qfu s ARG 229 N -4.07 1.64 -0.02 4.02 1.81 -1.13 -4.72 118.95 116.48 1qfu s ARG 229 Ca 0.46 -1.80 0.01 0.00 -1.72 0.00 0.00 55.73 52.68 1qfu s ARG 229 Cb -0.02 0.35 0.01 0.00 -0.45 0.00 0.00 34.95 34.84 1qfu s ARG 229 CO 0.27 -0.62 -0.04 0.42 -0.68 0.00 0.00 175.30 174.65 1qfu s ILE 230 N -3.56 0.37 -0.19 1.52 1.01 -0.95 -0.97 121.20 118.43 1qfu s ILE 230 Ca 0.36 -0.13 -0.07 0.00 0.00 0.00 0.00 60.65 60.82 1qfu s ILE 230 Cb 0.03 -0.36 -0.04 0.00 0.01 0.00 0.00 42.46 42.10 1qfu s ILE 230 CO 0.21 0.14 0.04 -0.44 0.00 0.00 0.00 174.94 174.89 1qfu s SER 231 N 0.33 5.36 -0.01 3.58 0.01 -0.31 -1.00 113.70 121.67 1qfu s SER 231 Ca -0.04 -0.01 -0.11 0.00 1.31 0.00 0.00 55.95 57.11 1qfu s SER 231 Cb -0.07 -1.92 -0.05 0.00 0.21 0.00 0.00 66.02 64.19 1qfu s SER 231 CO -0.00 0.14 0.33 -0.63 0.41 0.00 0.00 173.24 173.48 1qfu s ILE 232 N 0.57 5.19 0.34 1.44 -1.09 -0.52 -1.16 121.20 125.97 1qfu s ILE 232 Ca 0.02 0.51 0.05 0.00 -2.23 0.00 0.00 60.65 58.99 1qfu s ILE 232 Cb -0.13 -3.61 -0.03 0.00 -1.58 0.00 0.00 42.46 37.11 1qfu s ILE 232 CO 0.02 0.49 0.19 -0.31 -1.23 0.00 0.00 174.94 174.09 1qfu s TYR 233 N -1.18 1.69 0.12 3.97 1.51 0.15 -3.85 117.35 119.76 1qfu s TYR 233 Ca 0.25 -1.45 -0.14 0.00 -1.01 0.00 0.00 57.07 54.71 1qfu s TYR 233 Cb -0.15 -0.88 0.03 0.00 -0.11 0.00 0.00 41.96 40.85 1qfu s TYR 233 CO 0.13 -0.59 0.35 1.67 -1.11 0.00 0.00 175.55 176.00 1qfu s TRP 234 N -3.46 -0.11 -0.13 2.71 -2.14 -1.26 -2.68 118.94 111.86 1qfu s TRP 234 Ca 0.34 -0.24 -0.08 0.00 2.66 0.00 0.00 56.10 58.78 1qfu s TRP 234 Cb 0.03 0.18 0.05 0.00 -3.10 0.00 0.00 33.47 30.63 1qfu s TRP 234 CO 0.20 -0.66 0.33 0.99 -2.66 0.00 0.00 176.95 175.14 1qfu s THR 235 N -3.82 -0.03 -0.21 0.66 2.01 0.37 -4.97 115.64 109.65 1qfu s THR 235 Ca 0.04 0.10 -0.08 0.00 0.31 0.00 0.00 61.69 62.05 1qfu s THR 235 Cb 0.03 -0.49 -0.04 0.00 0.01 0.00 0.00 72.50 72.01 1qfu s THR 235 CO -0.12 0.04 0.09 -0.63 -0.69 0.00 0.00 174.62 173.32 1qfu s ILE 236 N 1.12 4.87 -0.32 1.82 1.01 -1.26 0.68 121.20 129.13 1qfu s ILE 236 Ca -0.08 0.00 -0.09 0.00 0.00 0.00 0.00 60.65 60.49 1qfu s ILE 236 Cb -0.08 -3.23 0.01 0.00 0.01 0.00 0.00 42.46 39.16 1qfu s ILE 236 CO -0.09 0.41 0.14 -0.69 0.00 0.00 0.00 174.94 174.71 1qfu s VAL 237 N 0.77 4.37 0.47 2.92 1.01 0.99 -4.91 120.40 126.02 1qfu s VAL 237 Ca 0.05 -0.61 -0.21 0.00 0.00 0.00 0.00 61.98 61.21 1qfu s VAL 237 Cb -0.13 -3.28 -0.09 0.00 0.00 0.00 0.00 36.38 32.88 1qfu s VAL 237 CO 0.02 0.01 1.02 -0.54 0.00 0.00 0.00 175.10 175.61 1qfu s LYS 238 N 1.56 3.92 0.18 2.72 1.02 -1.26 -1.36 119.74 126.53 1qfu s LYS 238 Ca 0.03 1.33 -0.32 0.00 0.02 0.00 0.00 55.97 57.02 1qfu s LYS 238 Cb -0.18 -2.15 -0.15 0.00 -0.52 0.00 0.00 37.83 34.83 1qfu s LYS 238 CO 0.05 -0.32 1.18 -2.30 -0.92 0.00 0.00 175.35 173.04 1qfu n PRO 239 N -0.81 1.26 -0.50 -1.68 -0.02 -1.26 -1.67 135.00 130.31 1qfu n PRO 239 Ca 0.08 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1qfu n PRO 239 Cb 0.53 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 1qfu n PRO 239 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qfu n GLY 240 N 1.99 1.58 3.99 -1.23 0.00 0.31 -5.02 105.19 106.82 1qfu n GLY 240 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.98 1qfu n GLY 240 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1qfu s ASP 241 N -3.28 5.47 0.03 1.61 -1.08 -0.67 -4.85 116.67 113.90 1qfu s ASP 241 Ca 0.00 -0.24 0.04 0.00 -0.52 0.00 0.00 52.55 51.83 1qfu s ASP 241 Cb 0.00 -0.74 -0.02 0.00 -1.46 0.00 0.00 42.92 40.70 1qfu s ASP 241 CO 0.00 -0.95 -0.13 0.68 0.52 0.00 0.00 175.17 175.29 1qfu s VAL 242 N -2.54 1.05 -0.00 1.11 -7.23 -1.26 -0.53 120.40 110.99 1qfu s VAL 242 Ca 0.56 -0.91 -0.09 0.00 -1.81 0.00 0.00 61.98 59.74 1qfu s VAL 242 Cb -0.10 -0.94 -0.05 0.00 0.56 0.00 0.00 36.38 35.85 1qfu s VAL 242 CO 0.36 0.03 0.29 -0.22 -0.31 0.00 0.00 175.10 175.25 1qfu s LEU 243 N -1.00 4.39 -0.30 1.32 2.96 0.52 -4.02 118.68 122.54 1qfu s LEU 243 Ca 0.02 0.65 -0.03 0.00 -0.22 0.00 0.00 54.13 54.55 1qfu s LEU 243 Cb -0.07 -2.61 0.11 0.00 0.50 0.00 0.00 46.19 44.11 1qfu s LEU 243 CO 0.01 0.28 0.15 -0.69 -1.32 0.00 0.00 176.35 174.78 1qfu s VAL 244 N -1.24 -0.03 -0.01 1.68 1.01 -0.53 0.01 120.40 121.29 1qfu s VAL 244 Ca 0.26 -0.97 -0.29 0.00 0.00 0.00 0.00 61.98 60.97 1qfu s VAL 244 Cb -0.14 -1.01 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 1qfu s VAL 244 CO 0.14 -0.78 0.96 -0.63 0.00 0.00 0.00 175.10 174.79 1qfu s ILE 245 N 1.87 4.88 -0.17 2.22 1.01 -0.72 -3.43 121.20 126.85 1qfu s ILE 245 Ca 0.11 2.01 -0.04 0.00 0.00 0.00 0.00 60.65 62.73 1qfu s ILE 245 Cb -0.18 -4.30 0.06 0.00 0.01 0.00 0.00 42.46 38.06 1qfu s ILE 245 CO -0.28 0.15 0.08 0.21 0.00 0.00 0.00 174.94 175.10 1qfu s ASN 246 N 1.00 2.46 0.19 3.58 3.84 -0.84 -1.25 114.94 123.93 1qfu s ASN 246 Ca 0.51 -0.65 -0.12 0.00 0.21 0.00 0.00 52.86 52.81 1qfu s ASN 246 Cb -0.21 -0.32 0.00 0.00 -0.55 0.00 0.00 41.25 40.17 1qfu s ASN 246 CO 0.26 -0.34 0.39 -0.94 -2.79 0.00 0.00 177.10 173.69 1qfu s SER 247 N 2.07 -0.07 -0.14 -4.21 1.04 -0.66 -1.59 113.70 110.15 1qfu s SER 247 Ca 0.01 -0.79 0.15 0.00 0.48 0.00 0.00 55.95 55.80 1qfu s SER 247 Cb -0.16 0.51 0.37 0.00 0.10 0.00 0.00 66.02 66.83 1qfu s SER 247 CO -0.09 -1.00 1.18 -0.46 0.98 0.00 0.00 173.24 173.86 1qfu n ASN 248 N -0.29 1.57 0.00 7.02 6.94 -1.20 0.57 115.26 129.87 1qfu n ASN 248 Ca -0.06 -3.24 0.00 0.00 -0.02 0.00 0.00 54.58 51.26 1qfu n ASN 248 Cb 0.63 -0.44 0.00 0.00 -2.36 0.00 0.00 39.78 37.60 1qfu n ASN 248 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1qfu n GLY 249 N -0.79 4.25 2.31 4.83 0.00 -1.26 -4.63 105.19 109.89 1qfu n GLY 249 Ca 0.14 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.79 1qfu n GLY 249 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1qfu n ASN 250 N 0.00 0.00 -4.77 1.61 4.13 -1.26 -3.32 115.26 111.64 1qfu n ASN 250 Ca 0.00 0.00 -0.41 0.00 1.68 0.00 0.00 54.58 55.85 1qfu n ASN 250 Cb 0.00 0.00 -0.00 0.00 -1.54 0.00 0.00 39.78 38.24 1qfu n ASN 250 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1qfu s LEU 251 N 0.00 4.30 -0.58 3.41 2.96 -1.26 -1.27 118.68 126.24 1qfu s LEU 251 Ca 0.00 2.92 0.06 0.00 -0.22 0.00 0.00 54.13 56.90 1qfu s LEU 251 Cb 0.00 -3.73 0.27 0.00 0.50 0.00 0.00 46.19 43.23 1qfu s LEU 251 CO 0.00 -0.85 0.75 -0.38 -1.32 0.00 0.00 176.35 174.55 1qfu n ILE 252 N 0.39 1.97 -1.11 6.68 2.08 -1.15 -3.75 119.36 124.46 1qfu n ILE 252 Ca 0.02 -5.10 -0.37 0.00 0.56 0.00 0.00 62.75 57.87 1qfu n ILE 252 Cb 0.41 -1.89 0.05 0.00 -0.75 0.00 0.00 39.64 37.45 1qfu n ILE 252 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1qfu n ALA 253 N 0.71 -3.54 -1.95 -1.39 0.00 -0.94 -2.52 120.51 110.89 1qfu n ALA 253 Ca 0.29 -0.39 -0.28 0.00 0.00 0.00 0.00 53.44 53.06 1qfu n ALA 253 Cb 0.43 -1.46 0.16 0.00 0.00 0.00 0.00 19.45 18.58 1qfu n ALA 253 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1qfu s PRO 254 N -2.10 0.97 0.00 0.00 0.04 -1.26 0.56 135.00 133.21 1qfu s PRO 254 Ca 0.53 -0.64 0.00 0.00 0.04 0.00 0.00 61.00 60.93 1qfu s PRO 254 Cb -0.31 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.23 1qfu s PRO 254 CO 0.70 -2.11 0.49 0.54 0.04 0.00 0.00 177.00 176.66 1qfu n ARG 255 N -3.47 0.51 -2.02 4.56 1.74 -1.24 -4.41 116.66 112.34 1qfu n ARG 255 Ca 0.15 -0.60 0.00 0.00 -0.77 0.00 0.00 57.85 56.63 1qfu n ARG 255 Cb 0.60 -0.70 0.00 0.00 -1.02 0.00 0.00 32.46 31.34 1qfu n ARG 255 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1qfu n GLY 256 N -0.11 0.11 3.36 -0.13 0.00 -1.26 -0.20 105.19 106.96 1qfu n GLY 256 Ca 0.00 -1.39 -0.19 0.00 0.00 0.00 0.00 46.02 44.44 1qfu n GLY 256 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1qfu s TYR 257 N -3.14 1.71 -0.10 1.61 1.13 -0.48 -4.66 117.35 113.42 1qfu s TYR 257 Ca 0.00 -0.74 -0.04 0.00 -1.41 0.00 0.00 57.07 54.87 1qfu s TYR 257 Cb 0.00 -0.93 -0.04 0.00 -1.10 0.00 0.00 41.96 39.89 1qfu s TYR 257 CO 0.00 0.18 0.06 -0.06 -2.51 0.00 0.00 175.55 173.22 1qfu s PHE 258 N -3.16 3.34 0.34 -3.49 0.08 -0.40 -0.29 117.98 114.41 1qfu s PHE 258 Ca 0.26 0.32 -0.27 0.00 0.12 0.00 0.00 56.93 57.37 1qfu s PHE 258 Cb 0.03 -1.87 -0.09 0.00 -0.57 0.00 0.00 43.02 40.52 1qfu s PHE 258 CO 0.09 0.56 1.05 0.15 -0.10 0.00 0.00 175.22 176.97 1qfu s LYS 259 N -0.87 4.42 -0.14 0.44 1.02 -0.48 -1.74 119.74 122.38 1qfu s LYS 259 Ca 0.13 1.61 -0.04 0.00 0.02 0.00 0.00 55.97 57.69 1qfu s LYS 259 Cb -0.12 -2.86 -0.03 0.00 -0.52 0.00 0.00 37.83 34.30 1qfu s LYS 259 CO 0.03 0.07 0.00 -1.64 -0.92 0.00 0.00 175.35 172.89 1qfu s MET 260 N -1.97 3.59 0.00 1.68 -1.94 -1.25 -4.79 119.30 114.61 1qfu s MET 260 Ca 0.51 -0.44 0.06 0.00 -1.71 0.00 0.00 55.69 54.11 1qfu s MET 260 Cb -0.26 -2.97 -0.02 0.00 2.01 0.00 0.00 34.83 33.59 1qfu s MET 260 CO 0.33 0.37 -0.18 1.03 -0.01 0.00 0.00 175.02 176.56 1qfu s ARG 261 N 0.03 1.37 -0.15 2.03 0.52 -1.26 -4.80 118.95 116.69 1qfu s ARG 261 Ca 0.03 -0.70 -0.07 0.00 -0.52 0.00 0.00 55.73 54.47 1qfu s ARG 261 Cb -0.13 -1.36 -0.04 0.00 0.52 0.00 0.00 34.95 33.94 1qfu s ARG 261 CO 0.02 0.36 0.10 0.95 0.02 0.00 0.00 175.30 176.75 1qfu s THR 262 N -0.53 5.13 -0.60 0.02 -4.23 -1.26 -4.05 115.64 110.13 1qfu s THR 262 Ca 0.06 0.08 0.00 0.00 -1.18 0.00 0.00 61.69 60.65 1qfu s THR 262 Cb -0.07 -3.27 0.00 0.00 1.34 0.00 0.00 72.50 70.50 1qfu s THR 262 CO -0.00 0.54 0.00 0.61 -0.54 0.00 0.00 174.62 175.23 1qfu n GLY 263 N 2.73 -0.90 0.58 3.99 0.00 -1.26 -5.01 105.19 105.32 1qfu n GLY 263 Ca -0.18 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.09 1qfu n GLY 263 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1qfu n LYS 264 N 0.00 1.14 -2.76 1.61 2.85 -1.26 -4.92 118.16 114.82 1qfu n LYS 264 Ca 0.00 -0.12 -0.29 0.00 -1.05 0.00 0.00 58.31 56.85 1qfu n LYS 264 Cb 0.00 -1.51 -0.02 0.00 -0.65 0.00 0.00 35.03 32.86 1qfu n LYS 264 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 1qfu s SER 265 N 0.02 6.41 0.00 -5.58 0.01 -1.26 -4.87 113.70 108.44 1qfu s SER 265 Ca 0.02 1.05 0.00 0.00 1.31 0.00 0.00 55.95 58.33 1qfu s SER 265 Cb 0.02 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 63.95 1qfu s SER 265 CO 0.01 -0.47 0.00 -0.24 0.41 0.00 0.00 173.24 172.94 1qfu n SER 266 N -1.69 0.00 -3.84 2.44 2.88 0.72 -4.06 113.62 110.07 1qfu n SER 266 Ca 0.02 -0.45 -0.12 0.00 -1.33 0.00 0.00 58.87 56.98 1qfu n SER 266 Cb 0.54 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.90 1qfu n SER 266 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 1qfu s ILE 267 N -2.82 0.05 -0.00 2.46 2.07 -1.26 -1.52 121.20 120.18 1qfu s ILE 267 Ca 0.00 -0.40 0.00 0.00 -1.41 0.00 0.00 60.65 58.84 1qfu s ILE 267 Cb 0.00 -0.36 0.00 0.00 0.13 0.00 0.00 42.46 42.23 1qfu s ILE 267 CO 0.00 -0.22 -0.00 -0.32 -1.91 0.00 0.00 174.94 172.49 1qfu s MET 268 N -0.77 0.02 -0.24 3.50 -2.45 0.93 -4.90 119.30 115.40 1qfu s MET 268 Ca -0.09 0.01 -0.19 0.00 -1.25 0.00 0.00 55.69 54.18 1qfu s MET 268 Cb -0.05 -0.04 -0.03 0.00 1.25 0.00 0.00 34.83 35.96 1qfu s MET 268 CO 0.01 -0.01 0.54 1.03 1.05 0.00 0.00 175.02 177.64 1qfu s ARG 269 N 0.09 4.12 -0.29 4.11 0.52 -1.26 -0.18 118.95 126.07 1qfu s ARG 269 Ca -0.01 0.40 -0.22 0.00 -0.52 0.00 0.00 55.73 55.38 1qfu s ARG 269 Cb -0.01 -3.62 0.13 0.00 0.52 0.00 0.00 34.95 31.97 1qfu s ARG 269 CO -0.00 -0.28 1.03 0.45 0.02 0.00 0.00 175.30 176.52 1qfu s SER 270 N 1.38 -0.45 -0.17 0.23 0.15 -0.56 -4.74 113.70 109.53 1qfu s SER 270 Ca 0.23 0.82 0.16 0.00 0.70 0.00 0.00 55.95 57.86 1qfu s SER 270 Cb -0.16 0.95 0.77 0.00 -1.71 0.00 0.00 66.02 65.87 1qfu s SER 270 CO 0.09 -0.14 1.68 0.47 1.20 0.00 0.00 173.24 176.55 1qfu n ASP 271 N 2.68 5.22 -4.76 5.45 8.00 -1.26 -4.36 116.55 127.51 1qfu n ASP 271 Ca -0.14 -2.68 -0.39 0.00 0.71 0.00 0.00 54.79 52.29 1qfu n ASP 271 Cb 0.56 -0.63 -0.04 0.00 -0.02 0.00 0.00 41.12 40.99 1qfu n ASP 271 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1qfu s ALA 272 N -2.28 3.30 0.76 2.24 0.00 -1.26 -5.02 121.76 119.50 1qfu s ALA 272 Ca 0.53 0.81 -0.14 0.00 0.00 0.00 0.00 51.96 53.16 1qfu s ALA 272 Cb 0.37 -3.30 0.06 0.00 0.00 0.00 0.00 23.12 20.25 1qfu s ALA 272 CO 0.20 -0.14 1.18 -2.14 0.00 0.00 0.00 175.76 174.87 1qfu s PRO 273 N -1.74 1.97 -0.30 0.00 0.02 -1.26 -4.80 135.00 128.89 1qfu s PRO 273 Ca 0.48 1.67 -0.01 0.00 0.02 0.00 0.00 61.00 63.16 1qfu s PRO 273 Cb -0.28 -1.82 0.06 0.00 0.02 0.00 0.00 34.50 32.47 1qfu s PRO 273 CO 0.36 -1.94 -0.00 0.42 -0.33 0.00 0.00 177.00 175.50 1qfu s ILE 274 N -2.18 2.82 0.22 2.83 1.01 -1.26 -1.03 121.20 123.62 1qfu s ILE 274 Ca 0.72 -1.53 0.05 0.00 0.00 0.00 0.00 60.65 59.89 1qfu s ILE 274 Cb -0.27 -2.67 -0.03 0.00 0.01 0.00 0.00 42.46 39.50 1qfu s ILE 274 CO 0.48 -0.16 0.31 -0.62 0.00 0.00 0.00 174.94 174.95 1qfu s ASP 275 N 1.25 6.16 -1.30 3.58 -1.08 0.11 -4.91 116.67 120.48 1qfu s ASP 275 Ca -0.04 0.02 -0.17 0.00 -0.52 0.00 0.00 52.55 51.85 1qfu s ASP 275 Cb -0.20 -1.77 0.09 0.00 -1.46 0.00 0.00 42.92 39.57 1qfu s ASP 275 CO -0.02 -0.04 1.72 1.07 0.52 0.00 0.00 175.17 178.42 1qfu n THR 276 N -1.18 3.98 -4.25 1.71 5.66 -1.26 -2.11 114.28 116.82 1qfu n THR 276 Ca -0.08 -4.15 -0.16 0.00 -3.05 0.00 0.00 64.05 56.61 1qfu n THR 276 Cb 0.57 -2.39 -0.06 0.00 -1.55 0.00 0.00 70.33 66.90 1qfu n THR 276 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1qfu s ILE 278 N -2.97 1.98 -0.27 0.00 1.01 -1.26 -2.31 121.20 117.37 1qfu s ILE 278 Ca 0.28 -0.95 -0.25 0.00 0.00 0.00 0.00 60.65 59.72 1qfu s ILE 278 Cb 0.01 -1.74 0.13 0.00 0.01 0.00 0.00 42.46 40.87 1qfu s ILE 278 CO 0.19 0.54 1.05 -0.44 0.00 0.00 0.00 174.94 176.28 1qfu s SER 279 N 0.59 -0.43 0.00 3.58 0.01 -0.16 -4.99 113.70 112.31 1qfu s SER 279 Ca -0.13 0.81 0.20 0.00 1.31 0.00 0.00 55.95 58.14 1qfu s SER 279 Cb -0.17 0.81 -0.10 0.00 0.21 0.00 0.00 66.02 66.78 1qfu s SER 279 CO 0.04 -0.16 0.93 -0.62 0.41 0.00 0.00 173.24 173.84 1qfu n GLU 280 N 2.09 1.05 -4.08 12.44 1.02 -1.26 -3.62 120.64 128.28 1qfu n GLU 280 Ca -0.12 -0.54 -0.33 0.00 -0.02 0.00 0.00 57.16 56.15 1qfu n GLU 280 Cb 0.56 -1.41 -0.16 0.00 -0.02 0.00 0.00 31.44 30.41 1qfu n GLU 280 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1qfu s ILE 282 N 1.32 2.35 0.05 0.00 1.01 0.18 -2.78 121.20 123.32 1qfu s ILE 282 Ca 0.05 -0.99 -0.01 0.00 0.00 0.00 0.00 60.65 59.69 1qfu s ILE 282 Cb -0.13 -1.85 -0.03 0.00 0.01 0.00 0.00 42.46 40.45 1qfu s ILE 282 CO -0.11 0.58 -0.01 0.42 0.00 0.00 0.00 174.94 175.82 1qfu s THR 283 N -0.64 0.19 0.44 2.92 -4.23 -0.86 -0.92 115.64 112.55 1qfu s THR 283 Ca 0.10 -1.58 0.28 0.00 -1.18 0.00 0.00 61.69 59.31 1qfu s THR 283 Cb -0.10 -1.25 0.47 0.00 1.34 0.00 0.00 72.50 72.97 1qfu s THR 283 CO -0.00 -0.87 1.69 -0.65 -0.54 0.00 0.00 174.62 174.24 1qfu h PRO 284 N 3.43 0.17 0.00 3.99 0.11 -1.85 0.25 132.00 138.10 1qfu h PRO 284 Ca -0.34 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1qfu h PRO 284 Cb 1.16 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1qfu h PRO 284 CO 0.60 0.11 0.00 0.09 -0.21 0.00 0.00 178.00 178.59 1qfu n ASN 285 N -4.58 0.74 0.00 -2.05 4.13 -1.26 -4.54 115.26 107.70 1qfu n ASN 285 Ca 0.32 0.61 0.00 0.00 1.68 0.00 0.00 54.58 57.20 1qfu n ASN 285 Cb 1.26 -0.80 0.00 0.00 -1.54 0.00 0.00 39.78 38.70 1qfu n ASN 285 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1qfu n GLY 286 N 0.75 0.97 3.85 7.41 0.00 0.89 -3.03 105.19 116.02 1qfu n GLY 286 Ca 0.04 -2.07 -0.32 0.00 0.00 0.00 0.00 46.02 43.67 1qfu n GLY 286 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qfu s SER 287 N -0.20 6.62 0.02 1.61 0.01 0.15 -2.02 113.70 119.88 1qfu s SER 287 Ca 0.00 1.45 0.03 0.00 1.31 0.00 0.00 55.95 58.74 1qfu s SER 287 Cb 0.00 -2.46 -0.02 0.00 0.21 0.00 0.00 66.02 63.76 1qfu s SER 287 CO 0.00 -0.51 -0.10 0.27 0.41 0.00 0.00 173.24 173.31 1qfu s ILE 288 N -2.51 0.75 0.33 1.44 -4.36 -1.12 -3.61 121.20 112.12 1qfu s ILE 288 Ca 0.57 -0.73 -0.28 0.00 -0.26 0.00 0.00 60.65 59.95 1qfu s ILE 288 Cb -0.10 -0.69 -0.09 0.00 1.25 0.00 0.00 42.46 42.83 1qfu s ILE 288 CO 0.30 -0.02 1.15 -2.16 0.24 0.00 0.00 174.94 174.45 1qfu s PRO 289 N -0.83 4.40 -0.66 0.37 0.04 -1.26 -4.40 135.00 132.65 1qfu s PRO 289 Ca -0.01 1.87 -0.00 0.00 0.04 0.00 0.00 61.00 62.89 1qfu s PRO 289 Cb -0.06 -2.98 0.42 0.00 0.04 0.00 0.00 34.50 31.92 1qfu s PRO 289 CO 0.00 -0.03 1.87 0.27 0.04 0.00 0.00 177.00 179.16 1qfu n ASN 290 N 0.72 7.13 0.09 6.66 6.94 -1.26 -4.52 115.26 131.02 1qfu n ASN 290 Ca 0.01 -3.79 -0.12 0.00 -0.02 0.00 0.00 54.58 50.65 1qfu n ASN 290 Cb 0.45 -0.89 -0.08 0.00 -2.36 0.00 0.00 39.78 36.90 1qfu n ASN 290 CO 0.00 0.00 0.00 -2.24 -1.03 0.00 0.00 177.26 173.99 1qfu h ASP 291 N 2.35 0.36 -3.28 0.53 3.04 -1.97 -3.46 116.42 113.99 1qfu h ASP 291 Ca 0.55 -0.33 -0.47 0.00 -3.24 0.00 0.00 57.03 53.54 1qfu h ASP 291 Cb 0.68 -0.11 0.04 0.00 -1.04 0.00 0.00 39.33 38.90 1qfu h ASP 291 CO 1.40 1.19 0.05 -0.54 -2.04 0.00 0.00 179.24 179.30 1qfu s LYS 292 N -2.97 3.11 0.03 4.15 1.02 -1.26 -5.01 119.74 118.81 1qfu s LYS 292 Ca -0.04 -0.16 0.24 0.00 0.02 0.00 0.00 55.97 56.04 1qfu s LYS 292 Cb 0.09 -2.41 0.34 0.00 -0.52 0.00 0.00 37.83 35.33 1qfu s LYS 292 CO 0.86 -0.42 1.29 -0.35 -0.92 0.00 0.00 175.35 175.81 1qfu n PRO 293 N -2.31 0.11 -4.29 -1.68 -0.04 -1.24 -4.63 135.00 120.92 1qfu n PRO 293 Ca 0.02 0.02 -0.19 0.00 -0.04 0.00 0.00 63.50 63.30 1qfu n PRO 293 Cb 0.57 -1.55 -0.11 0.00 -0.04 0.00 0.00 33.50 32.37 1qfu n PRO 293 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1qfu s PHE 294 N -3.07 1.60 0.05 0.54 0.08 -0.96 -1.97 117.98 114.25 1qfu s PHE 294 Ca 0.09 -0.53 -0.07 0.00 0.12 0.00 0.00 56.93 56.53 1qfu s PHE 294 Cb 0.16 -0.81 -0.01 0.00 -0.57 0.00 0.00 43.02 41.80 1qfu s PHE 294 CO 0.73 0.24 0.13 1.14 -0.10 0.00 0.00 175.22 177.37 1qfu s GLN 295 N -2.88 0.66 -0.04 0.44 1.03 0.50 -0.65 119.66 118.72 1qfu s GLN 295 Ca 0.13 -0.77 0.22 0.00 0.04 0.00 0.00 55.36 54.99 1qfu s GLN 295 Cb -0.04 0.26 0.40 0.00 0.03 0.00 0.00 33.01 33.66 1qfu s GLN 295 CO 0.05 -0.18 1.17 -1.71 -2.54 0.00 0.00 175.29 172.08 1qfu n ASN 296 N 0.60 1.07 -0.10 12.60 2.85 -0.04 -1.66 115.26 130.58 1qfu n ASN 296 Ca -0.18 -2.33 -0.19 0.00 -0.11 0.00 0.00 54.58 51.77 1qfu n ASN 296 Cb 0.59 -0.33 -0.10 0.00 1.24 0.00 0.00 39.78 41.17 1qfu n ASN 296 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 1qfu h VAL 297 N 5.91 0.90 -2.07 3.44 2.07 -1.86 -3.47 116.25 121.17 1qfu h VAL 297 Ca -0.17 -2.05 -0.05 0.00 0.82 0.00 0.00 66.70 65.25 1qfu h VAL 297 Cb 1.71 2.07 -0.21 0.00 -1.52 0.00 0.00 31.29 33.34 1qfu h VAL 297 CO 0.08 0.30 0.10 0.21 0.02 0.00 0.00 177.57 178.28 1qfu s ASN 298 N -6.64 -0.71 0.00 0.57 3.84 -1.26 -4.97 114.94 105.77 1qfu s ASN 298 Ca -0.26 1.36 0.25 0.00 0.21 0.00 0.00 52.86 54.42 1qfu s ASN 298 Cb 0.04 1.37 1.50 0.00 -0.55 0.00 0.00 41.25 43.61 1qfu s ASN 298 CO 0.55 -0.25 1.95 2.29 -2.79 0.00 0.00 177.10 178.85 1qfu n LYS 299 N 2.63 0.97 -3.75 0.43 2.85 -1.26 -4.54 118.16 115.50 1qfu n LYS 299 Ca -0.14 0.00 -0.37 0.00 -1.05 0.00 0.00 58.31 56.75 1qfu n LYS 299 Cb 0.55 -1.40 -0.12 0.00 -0.65 0.00 0.00 35.03 33.40 1qfu n LYS 299 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1qfu s ILE 300 N -2.00 4.05 0.07 0.58 1.01 -1.26 -5.03 121.20 118.62 1qfu s ILE 300 Ca 0.38 -0.61 -0.09 0.00 0.00 0.00 0.00 60.65 60.33 1qfu s ILE 300 Cb 0.17 -3.06 -0.00 0.00 0.01 0.00 0.00 42.46 39.58 1qfu s ILE 300 CO 0.29 0.11 0.19 0.42 0.00 0.00 0.00 174.94 175.95 1qfu s THR 301 N 1.52 0.13 -0.03 2.92 -4.23 -1.26 -4.15 115.64 110.54 1qfu s THR 301 Ca 0.03 -1.09 -0.01 0.00 -1.18 0.00 0.00 61.69 59.44 1qfu s THR 301 Cb -0.17 -1.19 0.03 0.00 1.34 0.00 0.00 72.50 72.52 1qfu s THR 301 CO 0.03 -0.60 0.07 -0.47 -0.54 0.00 0.00 174.62 173.10 1qfu s TYR 302 N -3.39 -0.03 0.00 3.99 5.04 -0.09 -4.98 117.35 117.88 1qfu s TYR 302 Ca 0.01 0.24 0.00 0.00 -2.44 0.00 0.00 57.07 54.88 1qfu s TYR 302 Cb 0.03 -0.18 0.00 0.00 0.35 0.00 0.00 41.96 42.16 1qfu s TYR 302 CO -0.08 -0.11 0.00 0.41 -1.34 0.00 0.00 175.55 174.43 1qfu n GLY 303 N 4.12 -0.03 3.49 8.97 0.00 -1.26 -0.65 105.19 119.83 1qfu n GLY 303 Ca -0.27 -2.24 -0.42 0.00 0.00 0.00 0.00 46.02 43.09 1qfu n GLY 303 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qfu s ALA 304 N -2.00 3.02 0.14 4.61 0.00 -0.55 -4.93 121.76 122.04 1qfu s ALA 304 Ca 0.00 -1.91 0.08 0.00 0.00 0.00 0.00 51.96 50.13 1qfu s ALA 304 Cb 0.00 -4.06 -0.04 0.00 0.00 0.00 0.00 23.12 19.02 1qfu s ALA 304 CO 0.00 -3.03 -0.18 0.00 0.00 0.00 0.00 175.76 172.55 1qfu s PRO 306 N -2.51 4.19 0.68 0.00 0.02 -1.26 -4.93 135.00 131.19 1qfu s PRO 306 Ca 0.12 2.46 -0.17 0.00 0.02 0.00 0.00 61.00 63.43 1qfu s PRO 306 Cb -0.07 -3.00 0.01 0.00 0.02 0.00 0.00 34.50 31.46 1qfu s PRO 306 CO 0.05 -0.43 1.28 0.15 -0.33 0.00 0.00 177.00 177.72 1qfu s LYS 307 N -1.96 2.35 -0.06 5.54 1.02 -0.83 -4.39 119.74 121.41 1qfu s LYS 307 Ca 0.52 2.00 -0.10 0.00 0.02 0.00 0.00 55.97 58.41 1qfu s LYS 307 Cb -0.44 -1.83 -0.05 0.00 -0.52 0.00 0.00 37.83 34.99 1qfu s LYS 307 CO 0.60 -1.74 0.26 -0.47 -0.92 0.00 0.00 175.35 173.08 1qfu s TYR 308 N -1.55 3.65 0.15 3.18 6.14 -1.26 -0.37 117.35 127.29 1qfu s TYR 308 Ca 0.81 0.73 -0.01 0.00 0.64 0.00 0.00 57.07 59.24 1qfu s TYR 308 Cb -0.36 -2.09 -0.04 0.00 0.42 0.00 0.00 41.96 39.89 1qfu s TYR 308 CO 0.42 0.69 0.07 0.14 0.64 0.00 0.00 175.55 177.51 1qfu s VAL 309 N -1.07 0.08 -0.36 3.14 -7.23 -0.67 -4.91 120.40 109.38 1qfu s VAL 309 Ca 0.20 -1.93 0.21 0.00 -1.81 0.00 0.00 61.98 58.64 1qfu s VAL 309 Cb -0.14 -2.16 0.25 0.00 0.56 0.00 0.00 36.38 34.90 1qfu s VAL 309 CO 0.09 -0.35 1.53 0.11 -0.31 0.00 0.00 175.10 176.16 1qfu h LYS 310 N 2.81 0.00 -6.69 4.82 1.57 -1.98 -3.40 116.57 113.70 1qfu h LYS 310 Ca -0.35 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 57.91 1qfu h LYS 310 Cb 1.21 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.54 1qfu h LYS 310 CO 0.58 0.11 0.55 -0.65 -0.57 0.00 0.00 179.45 179.46 1qfu s GLN 311 N -3.16 4.51 0.07 3.15 1.11 -1.26 -4.93 119.66 119.14 1qfu s GLN 311 Ca 0.06 1.87 0.26 0.00 0.01 0.00 0.00 55.36 57.56 1qfu s GLN 311 Cb 0.06 -3.23 0.72 0.00 -1.01 0.00 0.00 33.01 29.55 1qfu s GLN 311 CO 0.70 -0.05 1.60 0.27 0.01 0.00 0.00 175.29 177.82 1qfu n ASN 312 N 2.30 0.46 -3.57 5.90 2.04 -1.26 -4.68 115.26 116.46 1qfu n ASN 312 Ca 0.03 0.20 -0.16 0.00 -0.44 0.00 0.00 54.58 54.21 1qfu n ASN 312 Cb 0.45 -0.17 -0.06 0.00 -2.53 0.00 0.00 39.78 37.47 1qfu n ASN 312 CO 0.00 0.00 0.00 0.28 -0.44 0.00 0.00 177.26 177.10 1qfu s THR 313 N -3.06 0.00 -0.31 5.53 -1.32 -1.26 -4.76 115.64 110.46 1qfu s THR 313 Ca 0.11 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.63 1qfu s THR 313 Cb 0.16 -1.00 0.18 0.00 -1.51 0.00 0.00 72.50 70.33 1qfu s THR 313 CO 0.64 0.00 0.50 -0.76 -2.21 0.00 0.00 174.62 172.79 1qfu s LEU 314 N -0.55 -1.13 -0.15 9.08 1.43 -1.26 -4.95 118.68 121.15 1qfu s LEU 314 Ca -0.06 -0.29 -0.25 0.00 -1.03 0.00 0.00 54.13 52.50 1qfu s LEU 314 Cb -0.02 1.51 -0.02 0.00 0.03 0.00 0.00 46.19 47.69 1qfu s LEU 314 CO 0.06 -0.31 0.80 -0.54 0.23 0.00 0.00 176.35 176.59 1qfu s LYS 315 N 2.51 4.32 -0.21 1.70 -0.14 -1.26 -0.84 119.74 125.82 1qfu s LYS 315 Ca 0.11 0.97 -0.14 0.00 -1.36 0.00 0.00 55.97 55.55 1qfu s LYS 315 Cb -0.11 -3.55 -0.04 0.00 -1.68 0.00 0.00 37.83 32.45 1qfu s LYS 315 CO -0.25 -0.25 0.30 -1.17 -0.76 0.00 0.00 175.35 173.23 1qfu s LEU 316 N 1.88 4.15 -0.06 3.17 2.96 0.21 -4.72 118.68 126.27 1qfu s LEU 316 Ca 0.38 0.37 -0.30 0.00 -0.22 0.00 0.00 54.13 54.36 1qfu s LEU 316 Cb -0.17 -2.35 -0.06 0.00 0.50 0.00 0.00 46.19 44.11 1qfu s LEU 316 CO 0.14 -0.01 1.79 0.00 -1.32 0.00 0.00 176.35 176.95 1qfu s ALA 317 N 1.16 3.49 -0.25 5.97 0.00 -1.26 -0.57 121.76 130.29 1qfu s ALA 317 Ca 0.15 0.99 0.11 0.00 0.00 0.00 0.00 51.96 53.20 1qfu s ALA 317 Cb -0.14 -3.82 0.47 0.00 0.00 0.00 0.00 23.12 19.63 1qfu s ALA 317 CO 0.06 -1.63 1.37 0.25 0.00 0.00 0.00 175.76 175.82 1qfu n THR 318 N 5.80 2.39 -3.90 0.00 -2.24 -0.89 -4.93 114.28 110.50 1qfu n THR 318 Ca 0.19 -2.77 -0.10 0.00 -2.27 0.00 0.00 64.05 59.10 1qfu n THR 318 Cb 0.43 -0.29 -0.00 0.00 -2.10 0.00 0.00 70.33 68.37 1qfu n THR 318 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1qfu s GLY 319 N -2.70 0.66 0.72 3.38 0.00 -1.21 -4.79 107.32 103.39 1qfu s GLY 319 Ca 0.42 -0.94 -0.03 0.00 0.00 0.00 0.00 44.72 44.17 1qfu s GLY 319 CO -0.01 -0.51 1.00 -3.16 0.00 0.00 0.00 173.10 170.43 1qfu s MET 320 N -2.73 1.72 0.54 2.90 0.23 -1.26 -4.73 119.30 115.97 1qfu s MET 320 Ca 0.20 -0.93 -0.22 0.00 -1.03 0.00 0.00 55.69 53.71 1qfu s MET 320 Cb -0.04 -2.29 -0.05 0.00 -1.53 0.00 0.00 34.83 30.93 1qfu s MET 320 CO 0.13 -1.44 1.34 0.50 -2.03 0.00 0.00 175.02 173.52 1qfu s ARG 321 N -5.18 3.18 -0.33 3.16 3.52 -1.26 -0.94 118.95 121.10 1qfu s ARG 321 Ca 0.65 2.19 -0.07 0.00 -0.13 0.00 0.00 55.73 58.38 1qfu s ARG 321 Cb -0.06 -2.26 0.03 0.00 -1.56 0.00 0.00 34.95 31.09 1qfu s ARG 321 CO 0.44 -1.14 0.10 1.21 -0.81 0.00 0.00 175.30 175.10 1qfu s ASN 322 N -1.00 5.26 -0.54 -2.12 2.47 -0.82 -4.56 114.94 113.63 1qfu s ASN 322 Ca 0.71 -0.99 0.03 0.00 0.42 0.00 0.00 52.86 53.04 1qfu s ASN 322 Cb -0.39 -1.88 0.14 0.00 -1.45 0.00 0.00 41.25 37.66 1qfu s ASN 322 CO 0.46 -0.28 0.29 -0.69 -3.72 0.00 0.00 177.10 173.16 1qfu s VAL 323 N 1.44 2.74 0.67 -5.21 1.01 -1.26 -4.82 120.40 114.97 1qfu s VAL 323 Ca -0.00 -3.33 -0.15 0.00 0.00 0.00 0.00 61.98 58.50 1qfu s VAL 323 Cb -0.19 -2.88 0.00 0.00 0.00 0.00 0.00 36.38 33.32 1qfu s VAL 323 CO 0.03 -0.82 1.12 -2.16 0.00 0.00 0.00 175.10 173.27 1qfu s PRO 324 N -0.33 2.73 -0.38 2.72 0.04 -1.26 -4.82 135.00 133.70 1qfu s PRO 324 Ca 0.17 1.44 -0.28 0.00 0.04 0.00 0.00 61.00 62.37 1qfu s PRO 324 Cb -0.24 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 32.34 1qfu s PRO 324 CO -0.01 -1.31 1.76 -1.21 0.04 0.00 0.00 177.00 176.27 1qfu s GLU 325 N -4.06 3.26 0.00 4.56 2.02 -1.26 -5.12 118.70 118.10 1qfu s GLU 325 Ca 0.68 1.25 0.00 0.00 0.02 0.00 0.00 54.97 56.92 1qfu s GLU 325 Cb -0.21 -4.20 0.00 0.00 0.10 0.00 0.00 34.13 29.81 1qfu s GLU 325 CO 0.42 -1.95 0.00 1.17 0.02 0.00 0.00 175.26 174.92