#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tld s VAL 17 N 0.00 5.33 0.00 1.39 1.01 0.24 -4.05 120.40 124.33 1tld s VAL 17 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.15 1tld s VAL 17 Cb 0.00 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.93 1tld s VAL 17 CO 0.00 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.12 1tld n GLY 18 N 3.81 0.50 0.00 4.51 0.00 -1.23 -1.64 105.19 111.14 1tld n GLY 18 Ca -0.16 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1tld n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tld n GLY 19 N -2.92 1.77 3.20 -0.02 0.00 -1.26 -4.87 105.19 101.08 1tld n GLY 19 Ca 0.00 -2.00 -0.12 0.00 0.00 0.00 0.00 46.02 43.90 1tld n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1tld s TYR 20 N 1.98 1.03 -0.18 1.61 -0.85 0.67 -4.93 117.35 116.68 1tld s TYR 20 Ca 0.00 -0.95 -0.29 0.00 -0.52 0.00 0.00 57.07 55.31 1tld s TYR 20 Cb 0.00 -0.59 -0.04 0.00 0.38 0.00 0.00 41.96 41.72 1tld s TYR 20 CO 0.00 -0.17 1.76 0.99 -1.52 0.00 0.00 175.55 176.61 1tld s THR 21 N -3.63 3.49 0.22 -3.49 2.01 -1.26 0.07 115.64 113.05 1tld s THR 21 Ca 0.17 0.56 -0.08 0.00 0.31 0.00 0.00 61.69 62.64 1tld s THR 21 Cb 0.05 -3.50 0.16 0.00 0.01 0.00 0.00 72.50 69.22 1tld s THR 21 CO -0.01 -0.21 1.79 0.00 -0.69 0.00 0.00 174.62 175.51 1tld n GLY 23 N -1.29 2.40 3.64 0.00 0.00 -1.26 -4.80 105.19 103.86 1tld n GLY 23 Ca 0.10 -1.38 -0.49 0.00 0.00 0.00 0.00 46.02 44.25 1tld n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tld n ALA 24 N 2.08 0.25 -1.91 4.61 0.00 -1.26 -2.05 120.51 122.23 1tld n ALA 24 Ca 0.00 0.46 -0.19 0.00 0.00 0.00 0.00 53.44 53.71 1tld n ALA 24 Cb 0.00 -2.24 -0.05 0.00 0.00 0.00 0.00 19.45 17.16 1tld n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1tld n ASN 25 N 3.36 -5.26 0.07 0.00 3.02 -1.26 -4.86 115.26 110.32 1tld n ASN 25 Ca 0.18 0.29 0.13 0.00 -0.03 0.00 0.00 54.58 55.16 1tld n ASN 25 Cb 0.24 -4.56 0.48 0.00 -0.61 0.00 0.00 39.78 35.33 1tld n ASN 25 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1tld n THR 26 N -2.94 0.41 -3.36 3.41 -2.24 -0.87 -4.08 114.28 104.60 1tld n THR 26 Ca -0.21 -0.17 -0.26 0.00 -2.27 0.00 0.00 64.05 61.14 1tld n THR 26 Cb 0.65 -0.58 -0.08 0.00 -2.10 0.00 0.00 70.33 68.22 1tld n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1tld n VAL 27 N -2.00 1.45 0.43 2.28 0.31 -1.26 -4.97 118.33 114.57 1tld n VAL 27 Ca 0.06 -4.86 0.10 0.00 -0.01 0.00 0.00 64.34 59.63 1tld n VAL 27 Cb 0.39 -2.06 0.43 0.00 -0.91 0.00 0.00 33.84 31.70 1tld n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1tld n PRO 28 N 1.04 0.13 0.00 5.55 -0.04 -1.26 -1.53 135.00 138.90 1tld n PRO 28 Ca 0.27 0.37 0.12 0.00 -0.04 0.00 0.00 63.50 64.22 1tld n PRO 28 Cb 0.44 -1.75 0.26 0.00 -0.04 0.00 0.00 33.50 32.41 1tld n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1tld n TYR 29 N -2.00 0.00 -2.36 0.54 0.18 -1.16 -1.87 117.16 110.49 1tld n TYR 29 Ca 0.03 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.39 1tld n TYR 29 Cb 0.21 -0.19 -0.03 0.00 -0.38 0.00 0.00 39.34 38.95 1tld n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1tld s GLN 30 N -2.83 4.43 0.25 -3.48 2.00 -0.58 -0.76 119.66 118.69 1tld s GLN 30 Ca 0.15 1.86 0.11 0.00 -2.00 0.00 0.00 55.36 55.49 1tld s GLN 30 Cb 0.18 -3.29 -0.05 0.00 0.80 0.00 0.00 33.01 30.65 1tld s GLN 30 CO 0.65 -0.23 -0.18 0.14 -0.50 0.00 0.00 175.29 175.17 1tld s VAL 31 N 0.70 2.62 -0.18 1.34 -7.23 -0.15 -4.45 120.40 113.05 1tld s VAL 31 Ca 0.58 -2.23 -0.06 0.00 -1.81 0.00 0.00 61.98 58.47 1tld s VAL 31 Cb -0.32 -2.35 -0.03 0.00 0.56 0.00 0.00 36.38 34.24 1tld s VAL 31 CO 0.32 -0.32 0.01 -0.55 -0.31 0.00 0.00 175.10 174.25 1tld s SER 32 N -3.32 5.13 -0.18 4.85 0.15 -0.37 -2.14 113.70 117.82 1tld s SER 32 Ca 0.28 -0.07 -0.17 0.00 0.70 0.00 0.00 55.95 56.69 1tld s SER 32 Cb -0.06 -1.87 -0.04 0.00 -1.71 0.00 0.00 66.02 62.35 1tld s SER 32 CO 0.15 0.14 0.43 -0.76 1.20 0.00 0.00 173.24 174.40 1tld s LEU 33 N 0.58 4.19 -0.04 3.45 1.43 0.50 -0.57 118.68 128.22 1tld s LEU 33 Ca 0.00 0.62 0.04 0.00 -1.03 0.00 0.00 54.13 53.75 1tld s LEU 33 Cb -0.14 -2.59 0.00 0.00 0.03 0.00 0.00 46.19 43.50 1tld s LEU 33 CO 0.02 -0.07 -0.14 0.21 0.23 0.00 0.00 176.35 176.59 1tld s ASN 34 N 0.93 1.88 -0.34 2.29 3.84 0.46 -0.93 114.94 123.07 1tld s ASN 34 Ca 0.21 -0.31 0.15 0.00 0.21 0.00 0.00 52.86 53.13 1tld s ASN 34 Cb -0.15 -0.59 0.46 0.00 -0.55 0.00 0.00 41.25 40.42 1tld s ASN 34 CO 0.08 0.11 1.01 -1.54 -2.79 0.00 0.00 177.10 173.97 1tld n SER 37 N 3.30 2.28 0.00 -4.21 3.41 -1.26 -0.44 113.62 116.69 1tld n SER 37 Ca -0.19 -2.90 0.00 0.00 -0.26 0.00 0.00 58.87 55.52 1tld n SER 37 Cb 0.53 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 1tld n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tld n GLY 38 N -0.22 0.75 3.56 5.00 0.00 -1.26 -4.99 105.19 108.02 1tld n GLY 38 Ca 0.16 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.11 1tld n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1tld s TYR 39 N -2.50 -0.27 0.01 1.61 1.13 -1.26 -5.14 117.35 110.93 1tld s TYR 39 Ca 0.00 0.28 -0.30 0.00 -1.41 0.00 0.00 57.07 55.63 1tld s TYR 39 Cb 0.00 0.50 -0.05 0.00 -1.10 0.00 0.00 41.96 41.32 1tld s TYR 39 CO 0.00 -0.36 1.21 -1.58 -2.51 0.00 0.00 175.55 172.31 1tld s HIS 40 N -2.24 3.31 0.00 -3.49 5.65 -1.26 -4.32 115.29 112.95 1tld s HIS 40 Ca 0.05 1.24 0.00 0.00 0.25 0.00 0.00 55.06 56.60 1tld s HIS 40 Cb -0.01 -3.43 0.00 0.00 -1.18 0.00 0.00 32.58 27.96 1tld s HIS 40 CO -0.05 -1.35 0.00 1.97 -0.65 0.00 0.00 174.74 174.66 1tld n PHE 41 N 4.48 0.00 -3.61 3.88 1.16 -0.11 -4.99 117.46 118.28 1tld n PHE 41 Ca 0.10 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.58 1tld n PHE 41 Cb 0.46 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.31 1tld n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1tld n GLY 43 N -0.41 1.67 3.81 0.00 0.00 0.13 -0.37 105.19 110.02 1tld n GLY 43 Ca -0.11 -2.14 0.03 0.00 0.00 0.00 0.00 46.02 43.80 1tld n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tld s GLY 44 N -3.49 -0.30 -0.04 -0.02 0.00 -0.91 -3.82 107.32 98.74 1tld s GLY 44 Ca 0.33 0.43 0.03 0.00 0.00 0.00 0.00 44.72 45.51 1tld s GLY 44 CO 0.21 3.29 -0.11 -0.56 0.00 0.00 0.00 173.10 175.93 1tld s SER 45 N -3.45 1.52 -0.31 1.64 0.01 -0.47 -0.98 113.70 111.66 1tld s SER 45 Ca 0.23 -0.24 -0.29 0.00 1.31 0.00 0.00 55.95 56.96 1tld s SER 45 Cb 0.03 -0.51 0.01 0.00 0.21 0.00 0.00 66.02 65.76 1tld s SER 45 CO -0.03 0.07 1.20 -0.22 0.41 0.00 0.00 173.24 174.66 1tld s LEU 46 N 0.33 3.91 0.00 2.44 2.96 0.06 -0.58 118.68 127.80 1tld s LEU 46 Ca -0.07 1.13 0.13 0.00 -0.22 0.00 0.00 54.13 55.11 1tld s LEU 46 Cb -0.11 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.02 1tld s LEU 46 CO 0.02 -0.99 0.73 2.30 -1.32 0.00 0.00 176.35 177.09 1tld n ILE 47 N 6.05 0.00 -3.90 6.68 -5.35 -0.79 -0.72 119.36 121.34 1tld n ILE 47 Ca 0.13 -0.35 0.00 0.00 -0.27 0.00 0.00 62.75 62.27 1tld n ILE 47 Cb 0.47 1.14 0.01 0.00 -1.74 0.00 0.00 39.64 39.52 1tld n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1tld n ASN 48 N -0.28 -1.14 0.30 7.28 2.04 -1.21 -4.62 115.26 117.63 1tld n ASN 48 Ca 0.05 -1.43 0.19 0.00 -0.44 0.00 0.00 54.58 52.95 1tld n ASN 48 Cb 0.27 1.81 0.93 0.00 -2.53 0.00 0.00 39.78 40.26 1tld n ASN 48 CO 0.00 0.00 0.00 0.77 -0.44 0.00 0.00 177.26 177.59 1tld h SER 49 N 1.56 0.00 -0.03 0.53 4.64 -1.96 -3.19 113.55 115.09 1tld h SER 49 Ca -0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 1tld h SER 49 Cb 0.93 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 1tld h SER 49 CO 0.26 0.02 0.00 1.67 -0.87 0.00 0.00 176.83 177.91 1tld n GLN 50 N -3.16 0.30 -3.95 4.77 7.27 -1.26 -0.57 117.38 120.78 1tld n GLN 50 Ca -0.01 -1.00 -0.16 0.00 0.07 0.00 0.00 57.00 55.90 1tld n GLN 50 Cb 0.19 -1.12 -0.16 0.00 2.41 0.00 0.00 30.24 31.57 1tld n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1tld s TRP 51 N -0.57 0.28 0.02 3.69 0.52 -1.21 -0.56 118.94 121.10 1tld s TRP 51 Ca 0.08 -0.01 0.07 0.00 0.02 0.00 0.00 56.10 56.26 1tld s TRP 51 Cb 0.05 -0.32 -0.03 0.00 -1.15 0.00 0.00 33.47 32.03 1tld s TRP 51 CO 0.08 -0.09 -0.22 0.08 0.02 0.00 0.00 176.95 176.82 1tld s VAL 52 N 0.68 2.47 -0.10 4.03 1.01 0.06 -1.88 120.40 126.66 1tld s VAL 52 Ca -0.07 -1.16 -0.03 0.00 0.00 0.00 0.00 61.98 60.72 1tld s VAL 52 Cb -0.10 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 1tld s VAL 52 CO -0.01 0.44 0.04 -0.69 0.00 0.00 0.00 175.10 174.87 1tld s VAL 53 N -0.79 4.62 0.00 2.92 1.01 0.25 -0.33 120.40 128.09 1tld s VAL 53 Ca 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 61.98 1tld s VAL 53 Cb -0.10 -2.97 0.00 0.00 0.00 0.00 0.00 36.38 33.31 1tld s VAL 53 CO 0.02 0.60 0.00 -0.24 0.00 0.00 0.00 175.10 175.48 1tld n SER 54 N 2.18 0.00 -4.86 3.32 2.88 0.72 -1.36 113.62 116.50 1tld n SER 54 Ca -0.19 -0.44 -0.35 0.00 -1.33 0.00 0.00 58.87 56.57 1tld n SER 54 Cb 0.54 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.94 1tld n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1tld s ALA 55 N -1.71 3.69 0.33 -1.46 0.00 -1.26 -1.27 121.76 120.08 1tld s ALA 55 Ca 0.00 -0.31 0.04 0.00 0.00 0.00 0.00 51.96 51.69 1tld s ALA 55 Cb 0.00 -2.33 0.66 0.00 0.00 0.00 0.00 23.12 21.45 1tld s ALA 55 CO 0.00 0.54 1.90 0.00 0.00 0.00 0.00 175.76 178.20 1tld h ALA 56 N 3.74 1.65 0.00 0.00 0.00 -1.69 -1.48 119.26 121.49 1tld h ALA 56 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1tld h ALA 56 Cb 1.19 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1tld h ALA 56 CO 0.66 0.18 0.00 -2.39 0.00 0.00 0.00 179.25 177.70 1tld n HIS 57 N -4.52 0.00 1.36 0.00 1.44 -1.26 -1.26 115.22 110.97 1tld n HIS 57 Ca 0.15 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 55.99 1tld n HIS 57 Cb 0.30 -0.23 0.49 0.00 0.12 0.00 0.00 29.99 30.68 1tld n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1tld n TYR 59 N -0.64 2.30 -4.06 0.00 4.19 -0.39 -4.99 117.16 113.56 1tld n TYR 59 Ca 0.14 0.25 -0.10 0.00 3.31 0.00 0.00 57.90 61.50 1tld n TYR 59 Cb 0.32 -2.55 -0.08 0.00 0.49 0.00 0.00 39.34 37.51 1tld n TYR 59 CO 0.00 0.00 0.00 0.15 0.91 0.00 0.00 176.86 177.92 1tld s LYS 60 N 1.03 1.10 0.52 2.98 1.02 -1.26 -5.15 119.74 119.97 1tld s LYS 60 Ca 0.79 -1.33 -0.06 0.00 0.02 0.00 0.00 55.97 55.38 1tld s LYS 60 Cb -0.67 0.32 -0.03 0.00 -0.52 0.00 0.00 37.83 36.92 1tld s LYS 60 CO 0.38 -0.37 0.84 -1.54 -0.92 0.00 0.00 175.35 173.74 1tld s SER 61 N -3.02 6.20 0.00 2.83 1.04 -1.26 -4.47 113.70 115.01 1tld s SER 61 Ca 0.23 1.00 0.00 0.00 0.48 0.00 0.00 55.95 57.66 1tld s SER 61 Cb 0.05 -2.24 0.00 0.00 0.10 0.00 0.00 66.02 63.93 1tld s SER 61 CO 0.03 -0.67 0.00 0.61 0.98 0.00 0.00 173.24 174.18 1tld n GLY 62 N -2.38 0.66 3.72 7.32 0.00 -1.26 -5.00 105.19 108.25 1tld n GLY 62 Ca 0.02 -0.70 -0.41 0.00 0.00 0.00 0.00 46.02 44.94 1tld n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tld s ILE 63 N -2.00 4.92 -0.17 -0.61 1.01 -1.26 -4.58 121.20 118.51 1tld s ILE 63 Ca 0.00 1.71 -0.05 0.00 0.00 0.00 0.00 60.65 62.31 1tld s ILE 63 Cb 0.00 -4.16 -0.03 0.00 0.01 0.00 0.00 42.46 38.28 1tld s ILE 63 CO 0.00 0.24 -0.01 -1.58 0.00 0.00 0.00 174.94 173.58 1tld s GLN 64 N 0.73 3.70 -0.18 2.79 0.74 0.41 -1.48 119.66 126.38 1tld s GLN 64 Ca 0.43 -0.50 -0.22 0.00 0.05 0.00 0.00 55.36 55.13 1tld s GLN 64 Cb -0.19 -3.00 -0.03 0.00 1.10 0.00 0.00 33.01 30.89 1tld s GLN 64 CO 0.23 0.19 0.66 0.08 -0.55 0.00 0.00 175.29 175.89 1tld s VAL 65 N 0.53 5.01 -0.28 1.34 1.01 0.62 -0.40 120.40 128.23 1tld s VAL 65 Ca -0.02 1.26 -0.05 0.00 0.00 0.00 0.00 61.98 63.18 1tld s VAL 65 Cb -0.14 -3.98 0.02 0.00 0.00 0.00 0.00 36.38 32.28 1tld s VAL 65 CO 0.02 0.12 0.03 -0.13 0.00 0.00 0.00 175.10 175.15 1tld s ARG 66 N 1.79 2.95 0.21 2.72 0.52 0.26 -0.85 118.95 126.55 1tld s ARG 66 Ca 0.31 -0.94 0.05 0.00 -0.52 0.00 0.00 55.73 54.63 1tld s ARG 66 Cb -0.16 -3.25 -0.03 0.00 0.52 0.00 0.00 34.95 32.03 1tld s ARG 66 CO 0.11 -0.45 0.28 -0.51 0.02 0.00 0.00 175.30 174.75 1tld s LEU 67 N 1.43 4.17 -1.54 2.53 1.43 0.56 -1.23 118.68 126.02 1tld s LEU 67 Ca 0.01 0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.13 1tld s LEU 67 Cb -0.17 -2.73 0.00 0.00 0.03 0.00 0.00 46.19 43.32 1tld s LEU 67 CO 0.00 -0.01 0.00 0.61 0.23 0.00 0.00 176.35 177.18 1tld n GLY 69 N -1.00 1.20 3.82 -3.19 0.00 -1.26 -1.00 105.19 103.76 1tld n GLY 69 Ca -0.08 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.31 1tld n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tld s GLU 70 N -3.56 4.24 0.03 1.61 0.41 -1.26 -4.17 118.70 115.99 1tld s GLU 70 Ca 0.00 1.10 0.00 0.00 -0.41 0.00 0.00 54.97 55.66 1tld s GLU 70 Cb 0.00 -2.24 0.00 0.00 -1.78 0.00 0.00 34.13 30.11 1tld s GLU 70 CO 0.00 0.01 0.00 -3.47 -0.49 0.00 0.00 175.26 171.31 1tld n ASP 71 N -0.54 0.10 -4.60 -0.19 2.03 -1.26 -4.63 116.55 107.47 1tld n ASP 71 Ca 0.06 0.04 -0.43 0.00 0.52 0.00 0.00 54.79 54.99 1tld n ASP 71 Cb 0.54 -0.01 -0.04 0.00 -0.72 0.00 0.00 41.12 40.89 1tld n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1tld s ASN 72 N -4.81 6.64 0.00 1.67 3.84 -1.26 -3.03 114.94 118.00 1tld s ASN 72 Ca 0.00 0.50 0.26 0.00 0.21 0.00 0.00 52.86 53.84 1tld s ASN 72 Cb 0.00 -2.45 1.25 0.00 -0.55 0.00 0.00 41.25 39.50 1tld s ASN 72 CO 0.00 -0.85 1.88 2.30 -2.79 0.00 0.00 177.10 177.63 1tld n ILE 73 N 5.99 0.17 0.67 -5.21 -5.35 0.50 -3.15 119.36 112.97 1tld n ILE 73 Ca 0.06 0.04 0.09 0.00 -0.27 0.00 0.00 62.75 62.67 1tld n ILE 73 Cb 0.48 -0.60 -0.11 0.00 -1.74 0.00 0.00 39.64 37.67 1tld n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1tld n ASN 74 N -1.37 0.83 -4.24 7.28 3.02 -1.26 -4.96 115.26 114.57 1tld n ASN 74 Ca 0.10 -0.73 -0.26 0.00 -0.03 0.00 0.00 54.58 53.66 1tld n ASN 74 Cb 0.25 1.18 -0.15 0.00 -0.61 0.00 0.00 39.78 40.44 1tld n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1tld s VAL 75 N -2.81 1.66 -0.36 2.41 1.01 -1.19 -5.10 120.40 116.02 1tld s VAL 75 Ca 0.04 -1.06 -0.27 0.00 0.00 0.00 0.00 61.98 60.69 1tld s VAL 75 Cb 0.13 -1.42 0.02 0.00 0.00 0.00 0.00 36.38 35.11 1tld s VAL 75 CO 0.74 0.33 0.97 -0.69 0.00 0.00 0.00 175.10 176.46 1tld s VAL 76 N -0.65 4.55 -0.04 2.92 1.01 -1.26 -4.73 120.40 122.20 1tld s VAL 76 Ca 0.08 1.34 0.15 0.00 0.00 0.00 0.00 61.98 63.55 1tld s VAL 76 Cb -0.08 -4.37 -0.24 0.00 0.00 0.00 0.00 36.38 31.69 1tld s VAL 76 CO 0.01 -0.54 0.34 -0.62 0.00 0.00 0.00 175.10 174.29 1tld n GLU 77 N 6.85 0.50 0.00 2.72 1.02 -1.26 -5.12 120.64 125.34 1tld n GLU 77 Ca 0.09 -0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 1tld n GLU 77 Cb 0.48 -1.36 0.00 0.00 -0.02 0.00 0.00 31.44 30.54 1tld n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1tld n GLY 78 N 1.63 2.50 2.45 0.62 0.00 -1.26 -5.03 105.19 106.11 1tld n GLY 78 Ca -0.03 -2.10 -0.14 0.00 0.00 0.00 0.00 46.02 43.76 1tld n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1tld n ASN 79 N 0.00 -4.73 -4.86 1.61 3.02 -1.26 -4.93 115.26 104.11 1tld n ASN 79 Ca 0.00 0.35 -0.35 0.00 -0.03 0.00 0.00 54.58 54.55 1tld n ASN 79 Cb 0.00 -3.95 -0.06 0.00 -0.61 0.00 0.00 39.78 35.16 1tld n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1tld s GLU 80 N -3.14 3.81 -0.09 3.52 8.01 -1.26 -4.11 118.70 125.44 1tld s GLU 80 Ca 0.00 0.25 0.01 0.00 0.01 0.00 0.00 54.97 55.24 1tld s GLU 80 Cb 0.00 -3.02 0.02 0.00 -4.31 0.00 0.00 34.13 26.82 1tld s GLU 80 CO 0.00 0.57 -0.09 -0.65 0.01 0.00 0.00 175.26 175.10 1tld s GLN 81 N -1.79 1.48 -0.31 1.61 -0.21 -0.17 -4.98 119.66 115.29 1tld s GLN 81 Ca 0.32 -0.28 -0.10 0.00 0.02 0.00 0.00 55.36 55.32 1tld s GLN 81 Cb -0.14 -1.43 -0.02 0.00 1.00 0.00 0.00 33.01 32.42 1tld s GLN 81 CO 0.17 -0.15 0.17 -0.06 -2.12 0.00 0.00 175.29 173.30 1tld s PHE 82 N 1.29 3.18 -0.07 0.91 2.99 -1.26 -0.32 117.98 124.71 1tld s PHE 82 Ca -0.03 -0.40 0.01 0.00 0.00 0.00 0.00 56.93 56.51 1tld s PHE 82 Cb -0.14 -2.37 0.02 0.00 0.00 0.00 0.00 43.02 40.53 1tld s PHE 82 CO -0.03 -0.39 -0.07 0.42 -0.00 0.00 0.00 175.22 175.14 1tld s ILE 83 N 1.65 0.82 0.45 0.64 1.01 -0.03 -4.99 121.20 120.75 1tld s ILE 83 Ca 0.05 -0.25 -0.25 0.00 0.00 0.00 0.00 60.65 60.20 1tld s ILE 83 Cb -0.17 -0.81 -0.08 0.00 0.01 0.00 0.00 42.46 41.41 1tld s ILE 83 CO 0.07 0.30 1.35 -0.44 0.00 0.00 0.00 174.94 176.22 1tld s SER 84 N 1.06 5.94 0.25 3.58 0.01 -1.26 -0.27 113.70 123.00 1tld s SER 84 Ca -0.08 2.75 -0.30 0.00 1.31 0.00 0.00 55.95 59.63 1tld s SER 84 Cb -0.14 -2.64 -0.09 0.00 0.21 0.00 0.00 66.02 63.35 1tld s SER 84 CO -0.01 -1.11 1.17 0.00 0.41 0.00 0.00 173.24 173.70 1tld s ALA 85 N -1.27 3.43 -0.24 1.44 0.00 -0.55 -0.99 121.76 123.59 1tld s ALA 85 Ca 0.62 0.97 -0.13 0.00 0.00 0.00 0.00 51.96 53.42 1tld s ALA 85 Cb -0.40 -3.38 -0.16 0.00 0.00 0.00 0.00 23.12 19.18 1tld s ALA 85 CO 0.50 -0.31 -0.09 0.45 0.00 0.00 0.00 175.76 176.31 1tld n SER 86 N 1.59 1.95 -4.00 0.00 2.88 0.79 -4.76 113.62 112.07 1tld n SER 86 Ca 0.01 0.27 -0.17 0.00 -1.33 0.00 0.00 58.87 57.65 1tld n SER 86 Cb 0.44 -0.80 -0.14 0.00 -0.75 0.00 0.00 64.21 62.96 1tld n SER 86 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1tld s LYS 87 N -2.47 0.62 -0.23 -1.46 1.02 -1.20 -5.01 119.74 111.01 1tld s LYS 87 Ca -0.34 -0.30 -0.01 0.00 0.02 0.00 0.00 55.97 55.34 1tld s LYS 87 Cb 0.10 -0.59 0.07 0.00 -0.52 0.00 0.00 37.83 36.89 1tld s LYS 87 CO 0.57 0.16 0.02 -1.12 -0.92 0.00 0.00 175.35 174.06 1tld s SER 88 N -0.25 3.38 -0.58 2.83 0.01 -1.26 -0.77 113.70 117.06 1tld s SER 88 Ca 0.02 -1.07 -0.09 0.00 1.31 0.00 0.00 55.95 56.13 1tld s SER 88 Cb -0.03 -0.82 0.15 0.00 0.21 0.00 0.00 66.02 65.53 1tld s SER 88 CO -0.00 -0.30 0.46 -0.63 0.41 0.00 0.00 173.24 173.17 1tld s ILE 89 N 1.68 4.42 0.19 1.44 1.01 0.17 -4.96 121.20 125.14 1tld s ILE 89 Ca -0.01 -2.17 -0.30 0.00 0.00 0.00 0.00 60.65 58.17 1tld s ILE 89 Cb -0.18 -3.86 -0.08 0.00 0.01 0.00 0.00 42.46 38.36 1tld s ILE 89 CO -0.10 -0.85 1.15 -0.69 0.00 0.00 0.00 174.94 174.45 1tld s VAL 90 N 0.82 3.68 0.16 2.92 1.01 -1.26 -0.76 120.40 126.98 1tld s VAL 90 Ca 0.11 1.45 -0.34 0.00 0.00 0.00 0.00 61.98 63.19 1tld s VAL 90 Cb -0.22 -3.92 -0.14 0.00 0.00 0.00 0.00 36.38 32.10 1tld s VAL 90 CO -0.03 0.24 1.51 1.57 0.00 0.00 0.00 175.10 178.40 1tld n HIS 91 N 2.38 2.14 0.33 5.22 -0.00 -0.48 -4.84 115.22 119.97 1tld n HIS 91 Ca 0.03 0.35 0.22 0.00 0.46 0.00 0.00 57.72 58.79 1tld n HIS 91 Cb 0.45 -2.50 1.19 0.00 -0.12 0.00 0.00 29.99 29.01 1tld n HIS 91 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1tld h PRO 92 N 5.43 0.00 -0.44 1.57 0.11 -1.93 -1.83 132.00 134.91 1tld h PRO 92 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1tld h PRO 92 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1tld h PRO 92 CO 0.85 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 179.07 1tld n SER 93 N -3.04 4.26 -4.69 -2.05 7.64 -1.26 -4.97 113.62 109.52 1tld n SER 93 Ca -0.03 -2.64 -0.45 0.00 1.01 0.00 0.00 58.87 56.76 1tld n SER 93 Cb 0.08 -0.52 -0.04 0.00 -1.01 0.00 0.00 64.21 62.73 1tld n SER 93 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1tld n TYR 94 N 0.35 2.47 -3.95 1.43 -0.00 -0.69 -4.73 117.16 112.04 1tld n TYR 94 Ca 0.22 0.07 -0.35 0.00 -0.00 0.00 0.00 57.90 57.84 1tld n TYR 94 Cb 0.85 -2.64 -0.14 0.00 -0.00 0.00 0.00 39.34 37.41 1tld n TYR 94 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.86 178.07 1tld s ASN 95 N 1.92 4.25 0.00 2.98 3.84 -0.94 -5.00 114.94 122.00 1tld s ASN 95 Ca 0.81 -0.73 0.29 0.00 0.21 0.00 0.00 52.86 53.44 1tld s ASN 95 Cb -0.59 -1.68 1.51 0.00 -0.55 0.00 0.00 41.25 39.93 1tld s ASN 95 CO 0.39 -0.09 2.01 -1.54 -2.79 0.00 0.00 177.10 175.07 1tld n SER 96 N 4.71 0.00 -0.03 -4.21 3.41 -1.26 0.42 113.62 116.66 1tld n SER 96 Ca -0.17 -0.27 -0.12 0.00 -0.26 0.00 0.00 58.87 58.05 1tld n SER 96 Cb 0.48 -0.23 -0.14 0.00 -0.26 0.00 0.00 64.21 64.06 1tld n SER 96 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1tld n ASN 97 N -1.23 1.14 -0.02 4.04 5.03 -1.26 -4.27 115.26 118.69 1tld n ASN 97 Ca 0.15 0.29 0.09 0.00 0.87 0.00 0.00 54.58 55.99 1tld n ASN 97 Cb 0.20 -0.16 -0.17 0.00 -1.02 0.00 0.00 39.78 38.63 1tld n ASN 97 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1tld n THR 98 N -3.13 0.11 -1.61 3.41 -2.24 -1.15 -4.98 114.28 104.69 1tld n THR 98 Ca -0.24 -0.53 -0.17 0.00 -2.27 0.00 0.00 64.05 60.84 1tld n THR 98 Cb 1.06 -0.04 -0.06 0.00 -2.10 0.00 0.00 70.33 69.19 1tld n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1tld n LEU 99 N -2.30 -1.32 -4.76 3.22 4.77 0.17 -5.00 117.00 111.79 1tld n LEU 99 Ca -0.06 0.36 -0.41 0.00 -0.03 0.00 0.00 56.01 55.87 1tld n LEU 99 Cb 0.62 -2.44 -0.02 0.00 -2.33 0.00 0.00 43.42 39.24 1tld n LEU 99 CO 0.46 -0.79 0.99 0.21 -1.33 0.00 0.00 177.39 176.92 1tld s ASN 100 N -2.74 6.81 -0.97 -1.43 3.04 -1.22 -2.99 114.94 115.44 1tld s ASN 100 Ca 0.00 2.58 -0.06 0.00 0.04 0.00 0.00 52.86 55.42 1tld s ASN 100 Cb 0.00 -2.63 0.01 0.00 -1.54 0.00 0.00 41.25 37.08 1tld s ASN 100 CO 0.00 -0.54 0.84 0.59 -3.04 0.00 0.00 177.10 174.96 1tld n ASN 101 N 1.58 -5.15 -4.16 -4.21 4.13 -1.26 -2.21 115.26 103.98 1tld n ASN 101 Ca 0.03 -0.38 -0.43 0.00 1.68 0.00 0.00 54.58 55.48 1tld n ASN 101 Cb 0.42 -3.74 0.00 0.00 -1.54 0.00 0.00 39.78 34.92 1tld n ASN 101 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1tld n ASP 102 N -1.72 4.56 -3.77 6.41 2.03 -1.16 -4.29 116.55 118.60 1tld n ASP 102 Ca 0.01 -2.91 -0.13 0.00 0.52 0.00 0.00 54.79 52.28 1tld n ASP 102 Cb 0.54 -1.67 -0.12 0.00 -0.72 0.00 0.00 41.12 39.16 1tld n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1tld s ILE 103 N 3.18 -0.01 -0.00 5.18 2.07 -1.26 -3.93 121.20 126.43 1tld s ILE 103 Ca 0.49 0.02 -0.00 0.00 -1.41 0.00 0.00 60.65 59.75 1tld s ILE 103 Cb 0.08 -0.39 -0.00 0.00 0.13 0.00 0.00 42.46 42.28 1tld s ILE 103 CO -0.00 0.01 0.01 -0.32 -1.91 0.00 0.00 174.94 172.73 1tld s MET 104 N 0.35 0.03 0.03 3.50 -2.45 -0.40 -1.38 119.30 118.99 1tld s MET 104 Ca -0.02 -0.02 0.01 0.00 -1.25 0.00 0.00 55.69 54.41 1tld s MET 104 Cb -0.03 0.01 -0.04 0.00 1.25 0.00 0.00 34.83 36.02 1tld s MET 104 CO -0.01 -0.00 0.09 -0.51 1.05 0.00 0.00 175.02 175.63 1tld s LEU 105 N -0.09 3.91 -0.08 4.11 2.01 0.06 -0.20 118.68 128.41 1tld s LEU 105 Ca -0.01 0.11 0.01 0.00 0.01 0.00 0.00 54.13 54.25 1tld s LEU 105 Cb -0.01 -2.39 0.02 0.00 0.01 0.00 0.00 46.19 43.82 1tld s LEU 105 CO -0.00 0.23 -0.10 -0.63 1.01 0.00 0.00 176.35 176.87 1tld s ILE 106 N -1.28 1.05 -0.18 -0.59 1.01 0.55 0.46 121.20 122.23 1tld s ILE 106 Ca 0.26 -0.38 -0.18 0.00 0.00 0.00 0.00 60.65 60.35 1tld s ILE 106 Cb -0.12 -1.01 -0.04 0.00 0.01 0.00 0.00 42.46 41.30 1tld s ILE 106 CO 0.17 0.35 0.49 -0.75 0.00 0.00 0.00 174.94 175.21 1tld s LYS 107 N 1.10 4.23 0.47 2.79 2.20 0.05 -0.76 119.74 129.83 1tld s LYS 107 Ca -0.07 0.40 -0.22 0.00 -0.36 0.00 0.00 55.97 55.72 1tld s LYS 107 Cb -0.14 -3.52 -0.08 0.00 -1.51 0.00 0.00 37.83 32.58 1tld s LYS 107 CO -0.01 -0.04 1.09 -0.51 -0.36 0.00 0.00 175.35 175.52 1tld s LEU 108 N 1.29 3.94 0.30 5.43 1.43 0.28 -0.15 118.68 131.20 1tld s LEU 108 Ca 0.24 2.11 -0.02 0.00 -1.03 0.00 0.00 54.13 55.43 1tld s LEU 108 Cb -0.15 -4.39 0.44 0.00 0.03 0.00 0.00 46.19 42.12 1tld s LEU 108 CO 0.10 -0.84 1.95 0.50 0.23 0.00 0.00 176.35 178.28 1tld h LYS 109 N 1.83 1.05 -4.94 1.70 1.63 -1.36 -3.43 116.57 113.06 1tld h LYS 109 Ca -0.49 -0.08 -0.34 0.00 -0.85 0.00 0.00 60.65 58.89 1tld h LYS 109 Cb 1.24 -0.23 -0.21 0.00 -0.60 0.00 0.00 32.23 32.43 1tld h LYS 109 CO 0.60 0.72 -0.75 0.45 -3.45 0.00 0.00 179.45 177.02 1tld s SER 110 N -6.33 1.29 0.23 4.20 0.15 -1.26 -5.00 113.70 106.97 1tld s SER 110 Ca -0.11 -0.63 -0.30 0.00 0.70 0.00 0.00 55.95 55.61 1tld s SER 110 Cb 0.17 -0.00 -0.10 0.00 -1.71 0.00 0.00 66.02 64.39 1tld s SER 110 CO 0.79 -0.17 1.41 0.00 1.20 0.00 0.00 173.24 176.47 1tld s ALA 111 N -1.56 3.60 0.73 5.45 0.00 -1.26 -4.87 121.76 123.86 1tld s ALA 111 Ca -0.04 1.27 -0.13 0.00 0.00 0.00 0.00 51.96 53.07 1tld s ALA 111 Cb -0.08 -3.54 0.04 0.00 0.00 0.00 0.00 23.12 19.54 1tld s ALA 111 CO 0.01 -0.69 1.12 0.00 0.00 0.00 0.00 175.76 176.20 1tld s ALA 112 N 0.05 2.24 -0.51 0.00 0.00 0.27 -4.99 121.76 118.81 1tld s ALA 112 Ca 0.59 0.50 -0.19 0.00 0.00 0.00 0.00 51.96 52.86 1tld s ALA 112 Cb -0.41 -3.34 0.06 0.00 0.00 0.00 0.00 23.12 19.44 1tld s ALA 112 CO 0.42 -1.68 0.65 -1.12 0.00 0.00 0.00 175.76 174.03 1tld s SER 113 N -2.79 6.23 0.18 0.00 0.01 -1.26 -4.89 113.70 111.18 1tld s SER 113 Ca 0.66 -0.90 -0.29 0.00 1.31 0.00 0.00 55.95 56.73 1tld s SER 113 Cb -0.21 -2.30 -0.08 0.00 0.21 0.00 0.00 66.02 63.64 1tld s SER 113 CO 0.49 -0.93 0.93 -0.76 0.41 0.00 0.00 173.24 173.38 1tld s LEU 114 N 2.73 4.59 0.00 2.44 1.02 -1.26 -4.79 118.68 123.41 1tld s LEU 114 Ca 0.16 1.85 0.00 0.00 0.02 0.00 0.00 54.13 56.16 1tld s LEU 114 Cb -0.19 -3.56 0.00 0.00 0.02 0.00 0.00 46.19 42.46 1tld s LEU 114 CO 0.12 0.08 0.00 -0.46 0.02 0.00 0.00 176.35 176.11 1tld n ASN 115 N 1.99 0.00 0.24 2.29 0.23 -0.15 -4.96 115.26 114.90 1tld n ASN 115 Ca -0.01 -0.45 0.11 0.00 -0.53 0.00 0.00 54.58 53.70 1tld n ASN 115 Cb 0.48 0.00 0.55 0.00 -2.08 0.00 0.00 39.78 38.73 1tld n ASN 115 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1tld h SER 116 N 0.00 0.00 0.90 0.53 4.64 -2.00 -2.86 113.55 114.76 1tld h SER 116 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1tld h SER 116 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1tld h SER 116 CO 0.00 0.19 -1.11 0.54 -0.87 0.00 0.00 176.83 175.58 1tld n ARG 117 N -3.46 0.61 -3.71 4.77 3.00 -1.26 -4.79 116.66 111.81 1tld n ARG 117 Ca -0.01 0.12 -0.29 0.00 -0.01 0.00 0.00 57.85 57.66 1tld n ARG 117 Cb 0.37 -1.81 -0.16 0.00 0.00 0.00 0.00 32.46 30.86 1tld n ARG 117 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1tld s VAL 118 N -3.32 0.64 0.01 1.55 1.01 -1.08 -4.48 120.40 114.74 1tld s VAL 118 Ca -0.01 -1.01 -0.08 0.00 0.00 0.00 0.00 61.98 60.88 1tld s VAL 118 Cb 0.10 -1.35 0.00 0.00 0.00 0.00 0.00 36.38 35.12 1tld s VAL 118 CO 0.80 -0.50 0.15 0.00 0.00 0.00 0.00 175.10 175.55 1tld s ALA 119 N 1.76 -0.35 0.47 5.51 0.00 -0.78 -0.98 121.76 127.40 1tld s ALA 119 Ca 0.05 -0.13 -0.13 0.00 0.00 0.00 0.00 51.96 51.76 1tld s ALA 119 Cb -0.17 0.12 -0.07 0.00 0.00 0.00 0.00 23.12 23.01 1tld s ALA 119 CO -0.20 -0.22 0.88 -1.54 0.00 0.00 0.00 175.76 174.67 1tld s SER 120 N -1.45 6.52 -0.09 0.00 1.04 -1.26 -2.98 113.70 115.48 1tld s SER 120 Ca -0.14 1.32 -0.00 0.00 0.48 0.00 0.00 55.95 57.61 1tld s SER 120 Cb -0.07 -2.40 -0.03 0.00 0.10 0.00 0.00 66.02 63.62 1tld s SER 120 CO 0.01 -0.53 -0.06 -0.51 0.98 0.00 0.00 173.24 173.13 1tld s ILE 121 N -2.57 3.76 0.37 -1.02 1.10 0.11 -4.89 121.20 118.05 1tld s ILE 121 Ca 0.54 -0.45 -0.25 0.00 -0.51 0.00 0.00 60.65 59.98 1tld s ILE 121 Cb -0.10 -2.56 -0.09 0.00 0.15 0.00 0.00 42.46 39.86 1tld s ILE 121 CO 0.34 0.58 1.05 -0.44 -2.11 0.00 0.00 174.94 174.37 1tld s SER 122 N -0.59 6.91 0.40 4.50 0.01 -1.26 -4.48 113.70 119.19 1tld s SER 122 Ca 0.09 2.07 -0.14 0.00 1.31 0.00 0.00 55.95 59.29 1tld s SER 122 Cb -0.12 -2.59 -0.08 0.00 0.21 0.00 0.00 66.02 63.44 1tld s SER 122 CO 0.02 -0.39 0.81 -0.76 0.41 0.00 0.00 173.24 173.33 1tld s LEU 123 N -2.34 3.87 0.66 2.44 1.43 -1.26 -0.87 118.68 122.61 1tld s LEU 123 Ca 0.54 1.30 -0.16 0.00 -1.03 0.00 0.00 54.13 54.78 1tld s LEU 123 Cb -0.24 -4.16 0.00 0.00 0.03 0.00 0.00 46.19 41.82 1tld s LEU 123 CO 0.30 -0.37 1.14 -2.16 0.23 0.00 0.00 176.35 175.49 1tld s PRO 124 N -3.59 2.69 -0.14 1.29 0.04 -1.26 -4.78 135.00 129.25 1tld s PRO 124 Ca 0.54 1.51 0.17 0.00 0.04 0.00 0.00 61.00 63.26 1tld s PRO 124 Cb -0.10 -1.93 -0.24 0.00 0.04 0.00 0.00 34.50 32.27 1tld s PRO 124 CO 0.26 -1.36 0.27 0.25 0.04 0.00 0.00 177.00 176.46 1tld n THR 125 N -2.36 1.41 -4.17 1.26 -2.24 -1.26 -4.96 114.28 101.96 1tld n THR 125 Ca 0.11 -0.83 -0.16 0.00 -2.27 0.00 0.00 64.05 60.90 1tld n THR 125 Cb 0.51 -0.61 -0.11 0.00 -2.10 0.00 0.00 70.33 68.02 1tld n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1tld s SER 127 N -5.64 1.56 0.57 3.42 1.04 -1.26 -5.14 113.70 108.24 1tld s SER 127 Ca -0.08 -0.71 -0.17 0.00 0.48 0.00 0.00 55.95 55.46 1tld s SER 127 Cb 0.07 -0.02 -0.05 0.00 0.10 0.00 0.00 66.02 66.12 1tld s SER 127 CO 0.83 -0.17 1.08 0.00 0.98 0.00 0.00 173.24 175.96 1tld s ALA 129 N -2.18 3.13 0.38 0.00 0.00 -1.26 -5.08 121.76 116.75 1tld s ALA 129 Ca 0.67 0.22 0.07 0.00 0.00 0.00 0.00 51.96 52.93 1tld s ALA 129 Cb -0.19 -3.02 -0.00 0.00 0.00 0.00 0.00 23.12 19.91 1tld s ALA 129 CO 0.32 0.08 0.49 -1.54 0.00 0.00 0.00 175.76 175.11 1tld s SER 130 N -2.48 5.69 0.28 0.00 1.04 -1.26 -5.00 113.70 111.96 1tld s SER 130 Ca 0.59 -0.37 -0.30 0.00 0.48 0.00 0.00 55.95 56.35 1tld s SER 130 Cb -0.10 -0.88 -0.13 0.00 0.10 0.00 0.00 66.02 65.01 1tld s SER 130 CO 0.20 -0.60 1.34 0.00 0.98 0.00 0.00 173.24 175.15 1tld n ALA 132 N -1.71 1.08 -0.24 5.32 0.00 -1.26 -1.80 120.51 121.90 1tld n ALA 132 Ca 0.04 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.87 1tld n ALA 132 Cb 0.59 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.79 1tld n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tld n GLY 133 N 1.58 1.21 3.72 0.00 0.00 0.96 -4.96 105.19 107.69 1tld n GLY 133 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1tld n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tld s THR 134 N -2.77 2.71 -0.02 2.61 2.01 -0.75 -4.66 115.64 114.78 1tld s THR 134 Ca 0.00 0.52 -0.24 0.00 0.31 0.00 0.00 61.69 62.28 1tld s THR 134 Cb 0.00 -3.33 -0.04 0.00 0.01 0.00 0.00 72.50 69.13 1tld s THR 134 CO 0.00 0.05 0.72 -1.58 -0.69 0.00 0.00 174.62 173.12 1tld s GLN 135 N 0.95 4.45 0.30 4.92 0.74 -1.26 -0.35 119.66 129.41 1tld s GLN 135 Ca 0.68 0.95 0.05 0.00 0.05 0.00 0.00 55.36 57.09 1tld s GLN 135 Cb -0.43 -3.40 -0.06 0.00 1.10 0.00 0.00 33.01 30.22 1tld s GLN 135 CO 0.33 0.18 0.01 0.00 -0.55 0.00 0.00 175.29 175.25 1tld s LEU 137 N -3.47 2.70 -0.11 0.00 2.96 0.57 -0.93 118.68 120.41 1tld s LEU 137 Ca 0.33 -0.47 -0.02 0.00 -0.22 0.00 0.00 54.13 53.74 1tld s LEU 137 Cb 0.07 -1.67 -0.03 0.00 0.50 0.00 0.00 46.19 45.06 1tld s LEU 137 CO 0.14 -0.02 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.50 1tld s ILE 138 N 1.43 4.12 0.05 6.68 1.01 0.03 -1.06 121.20 133.46 1tld s ILE 138 Ca 0.05 -0.30 -0.04 0.00 0.00 0.00 0.00 60.65 60.36 1tld s ILE 138 Cb -0.14 -2.76 -0.02 0.00 0.01 0.00 0.00 42.46 39.55 1tld s ILE 138 CO -0.06 0.56 0.05 -0.94 0.00 0.00 0.00 174.94 174.56 1tld s SER 139 N -0.41 0.30 0.00 3.58 1.04 -1.21 -0.84 113.70 116.16 1tld s SER 139 Ca 0.07 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 55.76 1tld s SER 139 Cb -0.12 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.23 1tld s SER 139 CO 0.02 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.28 1tld n GLY 140 N 0.41 0.47 1.15 7.32 0.00 -0.51 -4.45 105.19 109.57 1tld n GLY 140 Ca -0.17 -0.91 0.02 0.00 0.00 0.00 0.00 46.02 44.97 1tld n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1tld n TRP 141 N -0.21 1.24 -1.93 1.61 8.01 -1.26 -1.92 117.44 122.97 1tld n TRP 141 Ca 0.00 -1.16 -0.30 0.00 -1.31 0.00 0.00 57.50 54.74 1tld n TRP 141 Cb 0.00 -0.43 0.16 0.00 -2.01 0.00 0.00 31.31 29.03 1tld n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1tld s GLY 142 N -1.98 1.73 0.23 6.99 0.00 -1.25 -4.39 107.32 108.65 1tld s GLY 142 Ca 0.45 -1.07 -0.30 0.00 0.00 0.00 0.00 44.72 43.79 1tld s GLY 142 CO 0.07 -0.37 1.09 -2.01 0.00 0.00 0.00 173.10 171.88 1tld n ASN 143 N -3.64 1.34 -0.88 1.64 5.15 0.15 -2.84 115.26 116.18 1tld n ASN 143 Ca 0.13 1.16 0.10 0.00 -0.60 0.00 0.00 54.58 55.37 1tld n ASN 143 Cb 0.60 -1.25 0.13 0.00 -0.53 0.00 0.00 39.78 38.73 1tld n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1tld n THR 144 N 0.93 0.28 -4.94 -0.44 -2.24 -0.46 -1.07 114.28 106.34 1tld n THR 144 Ca 0.12 -0.64 -0.33 0.00 -2.27 0.00 0.00 64.05 60.94 1tld n THR 144 Cb 0.28 1.15 -0.14 0.00 -2.10 0.00 0.00 70.33 69.52 1tld n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1tld s LYS 145 N -1.45 2.61 0.10 -0.78 -0.14 -1.26 -4.42 119.74 114.40 1tld s LYS 145 Ca 0.28 -0.73 -0.01 0.00 -1.36 0.00 0.00 55.97 54.15 1tld s LYS 145 Cb 0.18 -2.37 -0.24 0.00 -1.68 0.00 0.00 37.83 33.72 1tld s LYS 145 CO 0.25 0.54 1.20 0.77 -0.76 0.00 0.00 175.35 177.35 1tld h SER 146 N 5.62 0.30 -3.30 2.83 0.02 -1.93 -3.39 113.55 113.70 1tld h SER 146 Ca -0.42 -0.31 -0.60 0.00 -0.84 0.00 0.00 61.79 59.62 1tld h SER 146 Cb 1.16 -0.10 -0.40 0.00 0.14 0.00 0.00 62.40 63.20 1tld h SER 146 CO 0.51 1.23 -0.75 -0.55 -1.14 0.00 0.00 176.83 176.13 1tld s SER 147 N -7.01 3.89 0.00 3.07 0.15 -1.26 -4.68 113.70 107.85 1tld s SER 147 Ca -0.03 -2.08 0.00 0.00 0.70 0.00 0.00 55.95 54.55 1tld s SER 147 Cb 0.08 -0.96 0.00 0.00 -1.71 0.00 0.00 66.02 63.43 1tld s SER 147 CO 0.86 -0.35 0.00 0.61 1.20 0.00 0.00 173.24 175.56 1tld n GLY 148 N 4.27 0.56 3.00 9.45 0.00 -1.26 -5.07 105.19 116.15 1tld n GLY 148 Ca 0.03 -2.14 -0.23 0.00 0.00 0.00 0.00 46.02 43.68 1tld n GLY 148 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1tld s THR 149 N -0.67 1.00 -0.29 2.61 -1.32 -1.26 -4.67 115.64 111.04 1tld s THR 149 Ca 0.00 -0.41 -0.00 0.00 -1.21 0.00 0.00 61.69 60.06 1tld s THR 149 Cb 0.00 -0.92 0.18 0.00 -1.51 0.00 0.00 72.50 70.25 1tld s THR 149 CO 0.00 0.32 0.55 -0.55 -2.21 0.00 0.00 174.62 172.73 1tld s SER 150 N 0.62 -1.04 -0.10 8.08 0.15 -1.26 -4.97 113.70 115.17 1tld s SER 150 Ca -0.12 0.63 -0.17 0.00 0.70 0.00 0.00 55.95 56.99 1tld s SER 150 Cb -0.15 1.91 -0.05 0.00 -1.71 0.00 0.00 66.02 66.03 1tld s SER 150 CO 0.03 -0.28 0.43 -0.31 1.20 0.00 0.00 173.24 174.31 1tld s TYR 151 N 2.78 3.55 0.67 3.44 2.02 -1.26 -1.36 117.35 127.19 1tld s TYR 151 Ca 0.18 0.86 -0.11 0.00 -0.37 0.00 0.00 57.07 57.63 1tld s TYR 151 Cb -0.14 -2.46 -0.01 0.00 -0.40 0.00 0.00 41.96 38.94 1tld s TYR 151 CO -0.21 0.27 1.06 -1.25 -1.57 0.00 0.00 175.55 173.85 1tld s PRO 152 N 0.26 3.19 -0.09 -1.71 0.04 -1.26 -5.01 135.00 130.42 1tld s PRO 152 Ca 0.24 0.72 -0.11 0.00 0.04 0.00 0.00 61.00 61.89 1tld s PRO 152 Cb -0.15 -2.04 -0.28 0.00 0.04 0.00 0.00 34.50 32.07 1tld s PRO 152 CO 0.10 -0.86 0.52 -0.44 0.04 0.00 0.00 177.00 176.36 1tld h ASP 153 N -0.53 0.47 -2.77 6.66 3.32 -1.94 -3.47 116.42 118.16 1tld h ASP 153 Ca -0.44 -0.91 -0.58 0.00 0.02 0.00 0.00 57.03 55.12 1tld h ASP 153 Cb 1.21 -0.15 -0.07 0.00 0.22 0.00 0.00 39.33 40.54 1tld h ASP 153 CO 0.61 1.77 -0.57 0.68 -1.72 0.00 0.00 179.24 180.01 1tld s VAL 154 N -2.54 4.51 0.23 -1.35 -7.23 -1.26 -0.37 120.40 112.39 1tld s VAL 154 Ca -0.20 -1.03 -0.30 0.00 -1.81 0.00 0.00 61.98 58.64 1tld s VAL 154 Cb 0.06 -3.28 -0.10 0.00 0.56 0.00 0.00 36.38 33.62 1tld s VAL 154 CO 0.79 -0.08 1.42 -0.22 -0.31 0.00 0.00 175.10 176.71 1tld s LEU 155 N -3.01 4.39 0.04 1.32 2.96 -1.17 -4.87 118.68 118.34 1tld s LEU 155 Ca 0.31 2.60 0.03 0.00 -0.22 0.00 0.00 54.13 56.84 1tld s LEU 155 Cb -0.10 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 1tld s LEU 155 CO 0.23 -0.67 0.00 -0.54 -1.32 0.00 0.00 176.35 174.05 1tld s LYS 156 N -0.17 2.70 0.10 1.98 -0.14 -0.81 -1.83 119.74 121.58 1tld s LYS 156 Ca 0.60 -0.70 0.08 0.00 -1.36 0.00 0.00 55.97 54.59 1tld s LYS 156 Cb -0.41 -2.62 -0.03 0.00 -1.68 0.00 0.00 37.83 33.09 1tld s LYS 156 CO 0.41 0.59 -0.20 0.00 -0.76 0.00 0.00 175.35 175.39 1tld s LEU 158 N -1.95 0.13 -0.25 0.00 2.96 -0.02 -0.24 118.68 119.31 1tld s LEU 158 Ca 0.06 0.78 -0.12 0.00 -0.22 0.00 0.00 54.13 54.64 1tld s LEU 158 Cb -0.10 1.18 -0.05 0.00 0.50 0.00 0.00 46.19 47.73 1tld s LEU 158 CO 0.04 -0.18 0.21 -0.54 -1.32 0.00 0.00 176.35 174.56 1tld s LYS 159 N 1.20 4.04 0.02 1.98 1.02 -1.26 -0.79 119.74 125.95 1tld s LYS 159 Ca -0.08 -0.22 0.00 0.00 0.02 0.00 0.00 55.97 55.70 1tld s LYS 159 Cb -0.08 -3.59 -0.02 0.00 -0.52 0.00 0.00 37.83 33.63 1tld s LYS 159 CO -0.10 -0.05 -0.03 0.00 -0.92 0.00 0.00 175.35 174.25 1tld s ALA 160 N 1.38 0.14 0.38 5.17 0.00 -0.10 -4.96 121.76 123.77 1tld s ALA 160 Ca 0.09 -0.46 -0.05 0.00 0.00 0.00 0.00 51.96 51.54 1tld s ALA 160 Cb -0.15 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.03 1tld s ALA 160 CO 0.07 -0.10 0.66 -1.25 0.00 0.00 0.00 175.76 175.14 1tld s PRO 161 N -1.10 3.59 -0.04 0.00 0.04 -1.26 -0.19 135.00 136.05 1tld s PRO 161 Ca -0.11 0.07 -0.30 0.00 0.04 0.00 0.00 61.00 60.70 1tld s PRO 161 Cb -0.07 -2.52 -0.04 0.00 0.04 0.00 0.00 34.50 31.91 1tld s PRO 161 CO -0.01 0.02 1.27 0.42 0.04 0.00 0.00 177.00 178.74 1tld s ILE 162 N -2.39 4.09 0.83 0.56 1.01 0.53 -0.93 121.20 124.89 1tld s ILE 162 Ca 0.45 1.42 -0.12 0.00 0.00 0.00 0.00 60.65 62.41 1tld s ILE 162 Cb -0.10 -3.92 0.09 0.00 0.01 0.00 0.00 42.46 38.54 1tld s ILE 162 CO 0.36 -0.01 1.13 -0.76 0.00 0.00 0.00 174.94 175.67 1tld s LEU 163 N 2.34 2.41 0.61 2.97 1.43 -0.27 -0.03 118.68 128.13 1tld s LEU 163 Ca 0.58 1.01 -0.15 0.00 -1.03 0.00 0.00 54.13 54.54 1tld s LEU 163 Cb -0.27 -3.51 -0.03 0.00 0.03 0.00 0.00 46.19 42.41 1tld s LEU 163 CO 0.23 -2.07 1.06 -0.94 0.23 0.00 0.00 176.35 174.87 1tld s SER 164 N -4.21 5.69 0.41 2.29 1.04 -1.26 -4.64 113.70 113.02 1tld s SER 164 Ca 0.62 1.83 0.09 0.00 0.48 0.00 0.00 55.95 58.96 1tld s SER 164 Cb -0.13 -2.53 0.89 0.00 0.10 0.00 0.00 66.02 64.34 1tld s SER 164 CO 0.52 -1.23 2.02 0.44 0.98 0.00 0.00 173.24 175.97 1tld h ASP 165 N 0.34 0.47 0.11 7.02 3.32 -1.96 -0.16 116.42 125.56 1tld h ASP 165 Ca -0.47 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.57 1tld h ASP 165 Cb 1.22 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.67 1tld h ASP 165 CO 0.57 0.32 -0.05 0.28 -1.72 0.00 0.00 179.24 178.64 1tld h SER 166 N 0.55 -0.13 0.39 6.45 0.02 -1.99 0.14 113.55 118.98 1tld h SER 166 Ca 0.21 -0.15 -0.08 0.00 -0.84 0.00 0.00 61.79 60.93 1tld h SER 166 Cb 0.15 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 1tld h SER 166 CO -0.05 0.08 -0.37 0.28 -1.14 0.00 0.00 176.83 175.62 1tld h SER 167 N -0.33 0.00 -0.19 3.07 0.02 -1.83 0.71 113.55 115.00 1tld h SER 167 Ca -0.02 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.89 1tld h SER 167 Cb 0.27 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 1tld h SER 167 CO 0.03 0.37 -0.05 0.00 -1.14 0.00 0.00 176.83 176.04 1tld h LYS 169 N 0.08 0.59 -0.13 0.00 1.57 -0.93 -1.36 116.57 116.39 1tld h LYS 169 Ca 0.05 -0.23 -0.08 0.00 -1.87 0.00 0.00 60.65 58.51 1tld h LYS 169 Cb 0.49 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 1tld h LYS 169 CO 0.02 0.79 -0.30 0.66 -0.57 0.00 0.00 179.45 180.05 1tld h SER 170 N 0.51 0.24 0.15 0.86 4.64 -0.80 -2.31 113.55 116.84 1tld h SER 170 Ca 0.07 -0.08 -0.16 0.00 -0.47 0.00 0.00 61.79 61.15 1tld h SER 170 Cb 0.71 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.73 1tld h SER 170 CO 0.05 0.54 -0.61 0.00 -0.87 0.00 0.00 176.83 175.95 1tld h ALA 171 N 1.48 0.70 -2.07 5.18 0.00 -0.57 -3.38 119.26 120.60 1tld h ALA 171 Ca 0.03 -0.54 -0.55 0.00 0.00 0.00 0.00 54.91 53.84 1tld h ALA 171 Cb 0.65 -0.08 -0.40 0.00 0.00 0.00 0.00 17.79 17.96 1tld h ALA 171 CO 0.05 0.71 -0.98 0.66 0.00 0.00 0.00 179.25 179.69 1tld n TYR 172 N -3.91 1.00 -1.71 0.00 4.02 -0.56 -4.94 117.16 111.05 1tld n TYR 172 Ca -0.03 -3.78 -0.43 0.00 -0.01 0.00 0.00 57.90 53.64 1tld n TYR 172 Cb 0.63 -0.42 -0.03 0.00 -0.02 0.00 0.00 39.34 39.51 1tld n TYR 172 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1tld n PRO 173 N 0.88 2.56 -0.77 -0.72 -0.04 -0.88 -1.94 135.00 134.09 1tld n PRO 173 Ca 0.25 0.92 0.00 0.00 -0.04 0.00 0.00 63.50 64.63 1tld n PRO 173 Cb 0.52 -2.71 0.00 0.00 -0.04 0.00 0.00 33.50 31.27 1tld n PRO 173 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1tld n GLY 174 N 3.04 0.85 0.46 0.55 0.00 -1.26 -4.84 105.19 103.99 1tld n GLY 174 Ca 0.13 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.20 1tld n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1tld n GLN 175 N -2.00 0.91 -3.86 1.61 6.02 -0.82 -4.97 117.38 114.28 1tld n GLN 175 Ca 0.00 -1.30 -0.35 0.00 -0.01 0.00 0.00 57.00 55.34 1tld n GLN 175 Cb 0.00 -1.22 -0.14 0.00 1.02 0.00 0.00 30.24 29.91 1tld n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1tld s ILE 176 N -0.91 3.61 0.57 5.09 -1.09 -1.25 -5.02 121.20 122.19 1tld s ILE 176 Ca 0.14 -0.44 0.09 0.00 -2.23 0.00 0.00 60.65 58.21 1tld s ILE 176 Cb 0.09 -2.67 0.08 0.00 -1.58 0.00 0.00 42.46 38.38 1tld s ILE 176 CO 0.14 0.38 0.78 0.42 -1.23 0.00 0.00 174.94 175.43 1tld s THR 177 N 1.51 2.23 -0.41 2.92 -4.23 -1.26 -4.98 115.64 111.41 1tld s THR 177 Ca 0.06 -0.98 0.20 0.00 -1.18 0.00 0.00 61.69 59.79 1tld s THR 177 Cb -0.15 -2.25 0.20 0.00 1.34 0.00 0.00 72.50 71.64 1tld s THR 177 CO -0.01 0.00 1.60 -1.54 -0.54 0.00 0.00 174.62 174.13 1tld n SER 178 N -2.24 0.51 -1.62 3.99 3.41 -1.26 -2.22 113.62 114.19 1tld n SER 178 Ca 0.15 0.69 0.09 0.00 -0.26 0.00 0.00 58.87 59.54 1tld n SER 178 Cb 0.61 -0.78 0.36 0.00 -0.26 0.00 0.00 64.21 64.15 1tld n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1tld n ASN 179 N -2.14 4.91 -4.22 4.04 3.02 -1.26 -4.92 115.26 114.69 1tld n ASN 179 Ca 0.00 -2.53 -0.15 0.00 -0.03 0.00 0.00 54.58 51.87 1tld n ASN 179 Cb 0.10 -0.59 -0.10 0.00 -0.61 0.00 0.00 39.78 38.57 1tld n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1tld s MET 180 N -2.00 0.96 0.11 3.52 -1.94 -0.94 -1.21 119.30 117.79 1tld s MET 180 Ca 0.52 -1.30 -0.11 0.00 -1.71 0.00 0.00 55.69 53.08 1tld s MET 180 Cb 0.34 -0.60 0.01 0.00 2.01 0.00 0.00 34.83 36.59 1tld s MET 180 CO 0.23 0.09 0.28 -0.59 -0.01 0.00 0.00 175.02 175.02 1tld s PHE 181 N -2.83 0.06 -0.05 -0.03 -0.12 -0.19 -4.79 117.98 110.03 1tld s PHE 181 Ca 0.11 -0.44 -0.04 0.00 -0.05 0.00 0.00 56.93 56.51 1tld s PHE 181 Cb -0.00 0.06 -0.04 0.00 -0.63 0.00 0.00 43.02 42.40 1tld s PHE 181 CO 0.00 -0.63 0.15 0.00 -0.05 0.00 0.00 175.22 174.69 1tld s ALA 183 N -1.19 -0.50 0.00 0.00 0.00 -0.79 -1.11 121.76 118.17 1tld s ALA 183 Ca 0.22 0.28 0.00 0.00 0.00 0.00 0.00 51.96 52.46 1tld s ALA 183 Cb -0.12 -0.11 0.00 0.00 0.00 0.00 0.00 23.12 22.89 1tld s ALA 183 CO 0.12 -0.17 0.00 0.41 0.00 0.00 0.00 175.76 176.12 1tld n GLY 184 N 2.12 0.40 2.79 0.00 0.00 -0.10 -2.66 105.19 107.73 1tld n GLY 184 Ca -0.18 -1.83 -0.22 0.00 0.00 0.00 0.00 46.02 43.78 1tld n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1tld s TYR 184 N -1.56 0.66 -0.42 1.61 1.51 -1.26 -4.34 117.35 113.56 1tld s TYR 184 Ca 0.00 -0.17 0.26 0.00 -1.01 0.00 0.00 57.07 56.15 1tld s TYR 184 Cb 0.00 -0.76 0.73 0.00 -0.11 0.00 0.00 41.96 41.82 1tld s TYR 184 CO 0.00 -0.30 1.74 -0.07 -1.11 0.00 0.00 175.55 175.81 1tld h LEU 185 N 8.11 0.00 0.00 -1.29 3.38 -1.95 -2.22 115.31 121.34 1tld h LEU 185 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1tld h LEU 185 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1tld h LEU 185 CO 0.30 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 178.21 1tld n GLU 186 N -2.78 0.08 0.00 1.13 4.71 -1.26 -0.27 120.64 122.25 1tld n GLU 186 Ca 0.04 0.16 0.00 0.00 -0.01 0.00 0.00 57.16 57.34 1tld n GLU 186 Cb 0.43 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.36 1tld n GLU 186 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1tld n GLY 187 N 0.41 -1.03 2.31 0.62 0.00 -0.84 -4.60 105.19 102.06 1tld n GLY 187 Ca 0.06 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1tld n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tld n GLY 188 N -1.08 3.01 2.84 -0.02 0.00 0.56 -4.93 105.19 105.58 1tld n GLY 188 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1tld n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tld s LYS 188 N -0.40 1.17 0.39 1.61 1.02 -1.26 -3.49 119.74 118.78 1tld s LYS 188 Ca 0.00 -0.45 -0.14 0.00 0.02 0.00 0.00 55.97 55.41 1tld s LYS 188 Cb 0.00 -1.93 0.05 0.00 -0.52 0.00 0.00 37.83 35.43 1tld s LYS 188 CO 0.00 -0.47 0.76 0.34 -0.92 0.00 0.00 175.35 175.06 1tld s ASP 189 N 1.71 0.14 0.56 2.83 3.68 -0.65 -4.36 116.67 120.58 1tld s ASP 189 Ca 0.00 -1.22 -0.04 0.00 2.13 0.00 0.00 52.55 53.42 1tld s ASP 189 Cb -0.15 0.84 0.01 0.00 -1.45 0.00 0.00 42.92 42.17 1tld s ASP 189 CO -0.07 -1.67 0.84 -0.94 0.13 0.00 0.00 175.17 173.46 1tld s SER 190 N -3.10 5.54 0.28 -0.34 1.04 -1.26 -0.59 113.70 115.26 1tld s SER 190 Ca 0.17 0.50 -0.04 0.00 0.48 0.00 0.00 55.95 57.06 1tld s SER 190 Cb -0.05 -1.51 0.02 0.00 0.10 0.00 0.00 66.02 64.58 1tld s SER 190 CO 0.13 -1.04 0.44 0.00 0.98 0.00 0.00 173.24 173.75 1tld n GLN 192 N -0.43 0.93 0.00 0.00 6.02 -1.26 -0.36 117.38 122.27 1tld n GLN 192 Ca -0.02 0.34 0.00 0.00 -0.01 0.00 0.00 57.00 57.31 1tld n GLN 192 Cb 0.45 -1.96 0.00 0.00 1.02 0.00 0.00 30.24 29.75 1tld n GLN 192 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1tld n GLY 193 N 2.83 2.84 0.20 1.08 0.00 -1.26 -0.67 105.19 110.21 1tld n GLY 193 Ca 0.21 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.34 1tld n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1tld h ASP 194 N 0.00 0.00 -1.92 1.61 3.45 -1.01 -3.33 116.42 115.21 1tld h ASP 194 Ca 0.00 0.00 -0.63 0.00 0.43 0.00 0.00 57.03 56.83 1tld h ASP 194 Cb 0.00 0.00 0.12 0.00 -0.56 0.00 0.00 39.33 38.89 1tld h ASP 194 CO 0.00 0.06 -0.18 -1.20 -1.57 0.00 0.00 179.24 176.34 1tld n SER 195 N -3.08 0.07 0.00 6.45 7.64 -1.25 -1.79 113.62 121.65 1tld n SER 195 Ca 0.03 1.12 0.00 0.00 1.01 0.00 0.00 58.87 61.04 1tld n SER 195 Cb 0.56 -1.14 0.00 0.00 -1.01 0.00 0.00 64.21 62.61 1tld n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tld n GLY 196 N 1.58 3.19 3.89 0.23 0.00 0.09 0.17 105.19 114.34 1tld n GLY 196 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 1tld n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tld s GLY 197 N -1.88 1.67 0.42 -0.02 0.00 -0.74 -3.32 107.32 103.44 1tld s GLY 197 Ca 0.00 -0.88 -0.23 0.00 0.00 0.00 0.00 44.72 43.61 1tld s GLY 197 CO 0.00 -0.25 1.04 2.56 0.00 0.00 0.00 173.10 176.45 1tld s PRO 198 N -5.68 4.11 -0.33 2.90 0.04 -1.26 -0.91 135.00 133.87 1tld s PRO 198 Ca 0.67 1.46 0.00 0.00 0.04 0.00 0.00 61.00 63.18 1tld s PRO 198 Cb -0.08 -2.44 0.10 0.00 0.04 0.00 0.00 34.50 32.12 1tld s PRO 198 CO 0.51 -0.18 0.10 0.08 0.04 0.00 0.00 177.00 177.55 1tld s VAL 199 N -1.75 1.23 -0.19 -0.36 1.01 -0.43 -3.31 120.40 116.60 1tld s VAL 199 Ca 0.60 -1.71 -0.06 0.00 0.00 0.00 0.00 61.98 60.81 1tld s VAL 199 Cb -0.20 -1.92 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 1tld s VAL 199 CO 0.25 -0.68 0.03 -0.69 0.00 0.00 0.00 175.10 174.02 1tld s VAL 200 N 1.35 4.44 -0.07 2.92 1.01 -0.22 -1.04 120.40 128.79 1tld s VAL 200 Ca 0.11 -0.15 -0.01 0.00 0.00 0.00 0.00 61.98 61.93 1tld s VAL 200 Cb -0.18 -3.00 0.03 0.00 0.00 0.00 0.00 36.38 33.22 1tld s VAL 200 CO -0.19 0.45 -0.01 0.00 0.00 0.00 0.00 175.10 175.35 1tld n SER 202 N 4.89 -0.79 -0.47 0.00 7.64 -1.26 -1.32 113.62 122.31 1tld n SER 202 Ca -0.12 -0.99 -0.06 0.00 1.01 0.00 0.00 58.87 58.71 1tld n SER 202 Cb 0.50 -3.10 -0.03 0.00 -1.01 0.00 0.00 64.21 60.57 1tld n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tld n GLY 203 N -1.90 0.77 3.27 0.23 0.00 -1.26 -5.01 105.19 101.29 1tld n GLY 203 Ca -0.26 -0.26 -0.25 0.00 0.00 0.00 0.00 46.02 45.25 1tld n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tld s LYS 204 N -2.09 1.28 -0.78 1.61 -0.14 -0.44 -4.16 119.74 115.03 1tld s LYS 204 Ca 0.00 -1.05 -0.26 0.00 -1.36 0.00 0.00 55.97 53.30 1tld s LYS 204 Cb 0.00 -1.48 0.03 0.00 -1.68 0.00 0.00 37.83 34.70 1tld s LYS 204 CO 0.00 0.36 1.40 -1.17 -0.76 0.00 0.00 175.35 175.18 1tld s LEU 209 N -1.52 3.23 -0.03 3.17 2.96 -0.05 -0.78 118.68 125.66 1tld s LEU 209 Ca 0.07 -0.54 0.18 0.00 -0.22 0.00 0.00 54.13 53.62 1tld s LEU 209 Cb -0.09 -2.56 -0.21 0.00 0.50 0.00 0.00 46.19 43.83 1tld s LEU 209 CO 0.03 -1.87 0.54 0.00 -1.32 0.00 0.00 176.35 173.73 1tld n GLN 210 N 9.26 0.65 -4.16 1.98 1.13 -0.21 -4.19 117.38 121.84 1tld n GLN 210 Ca 0.11 0.08 -0.11 0.00 -1.94 0.00 0.00 57.00 55.15 1tld n GLN 210 Cb 0.50 -1.67 -0.10 0.00 0.11 0.00 0.00 30.24 29.07 1tld n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1tld s GLY 211 N -4.94 0.75 -0.07 1.08 0.00 -0.90 -1.53 107.32 101.71 1tld s GLY 211 Ca -0.06 -1.32 0.04 0.00 0.00 0.00 0.00 44.72 43.39 1tld s GLY 211 CO 0.84 -1.42 -0.21 -0.42 0.00 0.00 0.00 173.10 171.88 1tld s ILE 212 N -3.50 1.81 -0.05 0.90 1.01 -0.88 -1.31 121.20 119.18 1tld s ILE 212 Ca 0.11 -0.90 -0.32 0.00 0.00 0.00 0.00 60.65 59.54 1tld s ILE 212 Cb 0.04 -1.56 -0.10 0.00 0.01 0.00 0.00 42.46 40.86 1tld s ILE 212 CO -0.04 0.51 1.97 0.52 0.00 0.00 0.00 174.94 177.89 1tld n VAL 213 N 3.36 0.65 0.00 2.92 0.31 -0.09 -0.85 118.33 124.64 1tld n VAL 213 Ca -0.19 -0.16 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 1tld n VAL 213 Cb 0.53 -2.16 0.00 0.00 -0.91 0.00 0.00 33.84 31.29 1tld n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1tld n SER 214 N 7.68 0.00 -3.25 4.52 2.88 -1.01 -0.73 113.62 123.70 1tld n SER 214 Ca 0.23 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.65 1tld n SER 214 Cb 0.36 -0.05 -0.01 0.00 -0.75 0.00 0.00 64.21 63.76 1tld n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1tld s TRP 215 N -0.53 0.51 0.00 0.66 1.48 -0.66 -4.93 118.94 115.46 1tld s TRP 215 Ca 0.00 -0.95 0.00 0.00 -1.06 0.00 0.00 56.10 54.09 1tld s TRP 215 Cb 0.00 0.38 0.00 0.00 -1.16 0.00 0.00 33.47 32.69 1tld s TRP 215 CO 0.00 -1.30 0.00 0.41 -4.06 0.00 0.00 176.95 172.00 1tld n GLY 216 N -0.52 -0.90 3.33 3.67 0.00 -1.26 -0.55 105.19 108.96 1tld n GLY 216 Ca -0.03 -1.01 -0.45 0.00 0.00 0.00 0.00 46.02 44.52 1tld n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1tld s SER 217 N 0.00 6.16 0.72 1.61 0.15 -1.26 -4.91 113.70 116.16 1tld s SER 217 Ca 0.00 -1.63 0.00 0.00 0.70 0.00 0.00 55.95 55.02 1tld s SER 217 Cb 0.00 -2.19 0.00 0.00 -1.71 0.00 0.00 66.02 62.12 1tld s SER 217 CO 0.00 -0.78 0.00 0.61 1.20 0.00 0.00 173.24 174.27 1tld n GLY 219 N 5.22 0.55 2.94 9.45 0.00 -1.26 -4.66 105.19 117.43 1tld n GLY 219 Ca -0.13 -0.79 -0.13 0.00 0.00 0.00 0.00 46.02 44.96 1tld n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tld n ALA 221 N 3.77 -0.37 -1.82 0.00 0.00 -1.26 -4.58 120.51 116.25 1tld n ALA 221 Ca -0.21 0.29 -0.33 0.00 0.00 0.00 0.00 53.44 53.19 1tld n ALA 221 Cb 0.54 -2.04 -0.06 0.00 0.00 0.00 0.00 19.45 17.89 1tld n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1tld s GLN 221 N -3.99 4.16 0.32 0.00 1.11 -1.26 -0.33 119.66 119.67 1tld s GLN 221 Ca 0.00 1.08 -0.28 0.00 0.01 0.00 0.00 55.36 56.17 1tld s GLN 221 Cb 0.00 -2.17 -0.10 0.00 -1.01 0.00 0.00 33.01 29.74 1tld s GLN 221 CO 0.00 -0.09 1.19 -1.59 0.01 0.00 0.00 175.29 174.81 1tld s LYS 222 N -3.39 4.41 -1.63 2.91 -2.85 -1.26 -2.73 119.74 115.20 1tld s LYS 222 Ca 0.61 1.96 0.00 0.00 -1.00 0.00 0.00 55.97 57.54 1tld s LYS 222 Cb -0.09 -3.04 0.00 0.00 -2.06 0.00 0.00 37.83 32.64 1tld s LYS 222 CO 0.17 -0.04 0.00 0.09 0.10 0.00 0.00 175.35 175.67 1tld n ASN 223 N 0.81 -5.05 -3.57 0.03 4.13 0.63 -4.92 115.26 107.33 1tld n ASN 223 Ca 0.00 0.38 -0.27 0.00 1.68 0.00 0.00 54.58 56.37 1tld n ASN 223 Cb 0.44 -4.20 -0.10 0.00 -1.54 0.00 0.00 39.78 34.38 1tld n ASN 223 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1tld n LYS 224 N -1.66 1.25 -1.27 3.52 4.76 -1.11 -4.77 118.16 118.89 1tld n LYS 224 Ca -0.15 -3.92 -0.29 0.00 -2.87 0.00 0.00 58.31 51.08 1tld n LYS 224 Cb 0.59 -1.94 0.15 0.00 -1.84 0.00 0.00 35.03 31.99 1tld n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1tld s PRO 225 N -1.08 0.96 0.59 1.97 0.04 -1.26 -4.42 135.00 131.79 1tld s PRO 225 Ca 0.31 0.60 -0.16 0.00 0.04 0.00 0.00 61.00 61.79 1tld s PRO 225 Cb 0.04 -1.79 -0.04 0.00 0.04 0.00 0.00 34.50 32.75 1tld s PRO 225 CO -0.15 -2.39 1.06 0.20 0.04 0.00 0.00 177.00 175.76 1tld s GLY 226 N -3.57 2.13 -0.08 0.56 0.00 -1.09 -4.60 107.32 100.68 1tld s GLY 226 Ca 0.64 0.40 0.04 0.00 0.00 0.00 0.00 44.72 45.80 1tld s GLY 226 CO 0.56 0.71 -0.21 0.14 0.00 0.00 0.00 173.10 174.31 1tld s VAL 227 N -2.44 2.38 0.02 1.40 1.01 0.29 -1.89 120.40 121.16 1tld s VAL 227 Ca 0.64 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.74 1tld s VAL 227 Cb -0.16 -1.92 -0.02 0.00 0.00 0.00 0.00 36.38 34.29 1tld s VAL 227 CO 0.37 0.56 -0.16 -0.31 0.00 0.00 0.00 175.10 175.55 1tld s TYR 228 N 0.01 1.46 0.06 5.22 2.02 0.39 -1.65 117.35 124.85 1tld s TYR 228 Ca -0.07 -0.32 -0.31 0.00 -0.37 0.00 0.00 57.07 56.00 1tld s TYR 228 Cb -0.15 -0.90 -0.06 0.00 -0.40 0.00 0.00 41.96 40.45 1tld s TYR 228 CO 0.05 0.02 1.28 0.99 -1.57 0.00 0.00 175.55 176.32 1tld s THR 229 N -0.62 3.80 -1.03 -0.71 2.01 -0.03 -1.02 115.64 118.04 1tld s THR 229 Ca 0.05 1.27 -0.19 0.00 0.31 0.00 0.00 61.69 63.13 1tld s THR 229 Cb -0.07 -3.81 0.11 0.00 0.01 0.00 0.00 72.50 68.73 1tld s THR 229 CO 0.01 0.08 1.32 -0.75 -0.69 0.00 0.00 174.62 174.59 1tld s LYS 230 N 1.32 3.70 0.44 4.92 2.20 -0.35 -2.08 119.74 129.90 1tld s LYS 230 Ca 0.61 -1.71 0.15 0.00 -0.36 0.00 0.00 55.97 54.66 1tld s LYS 230 Cb -0.31 -5.13 1.07 0.00 -1.51 0.00 0.00 37.83 31.95 1tld s LYS 230 CO 0.29 -1.95 1.97 0.28 -0.36 0.00 0.00 175.35 175.58 1tld h VAL 231 N 5.92 0.86 -0.15 4.02 2.07 -1.57 -1.81 116.25 125.59 1tld h VAL 231 Ca 0.22 -0.13 0.04 0.00 0.82 0.00 0.00 66.70 67.66 1tld h VAL 231 Cb 0.98 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 1tld h VAL 231 CO 1.26 0.07 0.33 0.00 0.02 0.00 0.00 177.57 179.24 1tld n ASN 233 N -3.28 0.56 -0.31 0.00 3.02 -0.68 -3.65 115.26 110.91 1tld n ASN 233 Ca 0.01 0.59 0.04 0.00 -0.03 0.00 0.00 54.58 55.19 1tld n ASN 233 Cb 0.43 -0.72 0.03 0.00 -0.61 0.00 0.00 39.78 38.91 1tld n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1tld n TYR 234 N -2.06 0.00 -0.28 3.10 4.01 0.75 -4.79 117.16 117.89 1tld n TYR 234 Ca 0.04 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.80 1tld n TYR 234 Cb 0.32 0.00 0.14 0.00 -0.31 0.00 0.00 39.34 39.49 1tld n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1tld h VAL 235 N 1.54 0.95 -0.71 -0.72 2.07 -1.60 0.17 116.25 117.96 1tld h VAL 235 Ca 0.00 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 1tld h VAL 235 Cb 0.33 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.15 1tld h VAL 235 CO 0.00 0.15 0.37 0.28 0.02 0.00 0.00 177.57 178.38 1tld h SER 236 N 0.80 0.90 -0.31 0.57 0.02 -1.88 -0.31 113.55 113.33 1tld h SER 236 Ca 0.37 -0.11 -0.04 0.00 -0.84 0.00 0.00 61.79 61.17 1tld h SER 236 Cb 0.28 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.58 1tld h SER 236 CO -0.22 0.75 0.04 -0.25 -1.14 0.00 0.00 176.83 176.02 1tld h TRP 237 N 0.98 0.56 -0.32 3.45 7.01 -1.62 0.11 115.95 126.12 1tld h TRP 237 Ca 0.25 -0.08 0.03 0.00 2.11 0.00 0.00 58.89 61.20 1tld h TRP 237 Cb 0.07 -0.15 -0.03 0.00 -2.10 0.00 0.00 29.16 26.94 1tld h TRP 237 CO 0.00 0.62 0.12 0.82 -2.79 0.00 0.00 178.44 177.21 1tld h ILE 238 N 0.34 0.92 -0.20 2.65 2.04 -0.38 -0.52 117.51 122.37 1tld h ILE 238 Ca 0.09 -0.09 -0.16 0.00 1.00 0.00 0.00 64.86 65.70 1tld h ILE 238 Cb 0.37 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 1tld h ILE 238 CO 0.01 0.05 -0.55 0.11 0.00 0.00 0.00 178.15 177.76 1tld h LYS 239 N 0.26 0.59 -0.29 2.37 1.57 -0.75 -1.03 116.57 119.29 1tld h LYS 239 Ca 0.14 -0.38 -0.12 0.00 -1.87 0.00 0.00 60.65 58.43 1tld h LYS 239 Cb 0.10 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1tld h LYS 239 CO -0.14 0.99 -0.30 1.96 -0.57 0.00 0.00 179.45 181.39 1tld h GLN 240 N 0.45 0.61 -0.11 3.15 4.20 -0.60 -1.46 115.11 121.35 1tld h GLN 240 Ca 0.01 -0.27 -0.06 0.00 0.06 0.00 0.00 58.65 58.39 1tld h GLN 240 Cb 1.11 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.87 1tld h GLN 240 CO 0.11 0.84 -0.16 1.15 -0.67 0.00 0.00 178.83 180.10 1tld h THR 241 N 0.52 1.37 -0.29 -0.54 2.02 -0.90 -2.74 112.91 112.35 1tld h THR 241 Ca 0.06 -1.38 -0.05 0.00 0.77 0.00 0.00 66.41 65.81 1tld h THR 241 Cb 0.78 2.02 -0.02 0.00 -1.74 0.00 0.00 68.15 69.19 1tld h THR 241 CO 0.06 0.40 -0.04 0.40 0.37 0.00 0.00 175.52 176.71 1tld h ILE 242 N -0.11 1.19 0.00 3.11 2.04 -1.14 -2.31 117.51 120.30 1tld h ILE 242 Ca 0.01 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 65.07 1tld h ILE 242 Cb 0.72 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.82 1tld h ILE 242 CO 0.04 0.27 0.00 0.00 0.00 0.00 0.00 178.15 178.46 1tld h ALA 243 N 1.53 1.00 -0.06 1.87 0.00 -1.10 -2.12 119.26 120.37 1tld h ALA 243 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1tld h ALA 243 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1tld h ALA 243 CO 0.01 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.13 1tld n SER 244 N -2.78 2.59 0.00 0.00 3.41 -0.93 -5.11 113.62 110.79 1tld n SER 244 Ca 0.02 -1.78 0.00 0.00 -0.26 0.00 0.00 58.87 56.85 1tld n SER 244 Cb 0.32 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 1tld n SER 244 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47