#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nfd s GLU 3 N 0.00 0.58 -0.12 -3.48 1.03 -1.26 -5.12 118.70 110.33 1nfd s GLU 3 Ca 0.00 -0.54 0.02 0.00 0.03 0.00 0.00 54.97 54.48 1nfd s GLU 3 Cb 0.00 0.24 -0.00 0.00 -0.80 0.00 0.00 34.13 33.56 1nfd s GLU 3 CO 0.00 -0.15 -0.20 -0.51 -1.33 0.00 0.00 175.26 173.07 1nfd s LEU 4 N -1.76 2.31 -0.01 1.83 1.43 -1.26 -4.65 118.68 116.56 1nfd s LEU 4 Ca -0.10 -0.49 -0.16 0.00 -1.03 0.00 0.00 54.13 52.35 1nfd s LEU 4 Cb -0.04 -1.49 -0.06 0.00 0.03 0.00 0.00 46.19 44.64 1nfd s LEU 4 CO -0.01 0.14 0.45 -0.63 0.23 0.00 0.00 176.35 176.53 1nfd s ILE 5 N 0.45 5.01 -0.15 -0.59 1.09 -0.87 -4.09 121.20 122.06 1nfd s ILE 5 Ca -0.14 0.92 -0.16 0.00 -1.10 0.00 0.00 60.65 60.17 1nfd s ILE 5 Cb -0.17 -3.76 0.04 0.00 -1.06 0.00 0.00 42.46 37.51 1nfd s ILE 5 CO 0.06 0.52 0.45 -1.58 -0.10 0.00 0.00 174.94 174.29 1nfd s GLN 6 N -0.73 0.57 0.13 2.79 0.74 -1.26 -1.15 119.66 120.75 1nfd s GLN 6 Ca 0.25 0.51 -0.31 0.00 0.05 0.00 0.00 55.36 55.86 1nfd s GLN 6 Cb -0.17 0.28 -0.09 0.00 1.10 0.00 0.00 33.01 34.13 1nfd s GLN 6 CO 0.14 -0.09 1.53 -1.25 -0.55 0.00 0.00 175.29 175.06 1nfd s PRO 7 N -0.03 4.24 0.48 1.67 0.04 -1.26 -4.74 135.00 135.41 1nfd s PRO 7 Ca -0.02 2.26 0.26 0.00 0.04 0.00 0.00 61.00 63.54 1nfd s PRO 7 Cb -0.03 -3.26 1.31 0.00 0.04 0.00 0.00 34.50 32.56 1nfd s PRO 7 CO 0.02 -0.58 1.84 1.03 0.04 0.00 0.00 177.00 179.35 1nfd h SER 8 N 7.05 0.20 -1.43 6.66 0.87 -1.95 -3.36 113.55 121.60 1nfd h SER 8 Ca -0.42 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.16 1nfd h SER 8 Cb 1.20 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1nfd h SER 8 CO 0.90 0.06 0.07 -1.54 -0.53 0.00 0.00 176.83 175.79 1nfd n SER 9 N -4.40 -0.53 -3.61 6.23 3.41 -1.26 -2.62 113.62 110.84 1nfd n SER 9 Ca 0.21 -1.36 -0.02 0.00 -0.26 0.00 0.00 58.87 57.44 1nfd n SER 9 Cb 0.92 0.88 -0.01 0.00 -0.26 0.00 0.00 64.21 65.73 1nfd n SER 9 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nfd s ALA 11 N -1.25 -2.08 -0.06 7.33 0.00 0.17 -4.67 121.76 121.20 1nfd s ALA 11 Ca 0.04 1.01 -0.08 0.00 0.00 0.00 0.00 51.96 52.93 1nfd s ALA 11 Cb -0.01 0.21 0.02 0.00 0.00 0.00 0.00 23.12 23.34 1nfd s ALA 11 CO 0.03 -0.85 0.22 -1.54 0.00 0.00 0.00 175.76 173.62 1nfd s SER 12 N -2.62 -0.18 -0.17 0.00 1.04 -1.26 -0.76 113.70 109.74 1nfd s SER 12 Ca 0.11 0.30 -0.12 0.00 0.48 0.00 0.00 55.95 56.73 1nfd s SER 12 Cb 0.01 0.40 0.05 0.00 0.10 0.00 0.00 66.02 66.59 1nfd s SER 12 CO -0.04 -0.17 0.43 0.54 0.98 0.00 0.00 173.24 174.98 1nfd s VAL 13 N -0.29 -0.01 -0.01 5.02 0.11 -0.14 -4.92 120.40 120.16 1nfd s VAL 13 Ca -0.04 0.05 -0.25 0.00 -2.93 0.00 0.00 61.98 58.81 1nfd s VAL 13 Cb -0.03 -0.62 -0.04 0.00 -1.53 0.00 0.00 36.38 34.16 1nfd s VAL 13 CO 0.01 0.02 0.77 -0.89 -3.33 0.00 0.00 175.10 171.68 1nfd s THR 14 N 0.93 4.90 0.26 5.04 2.01 -1.26 -2.02 115.64 125.50 1nfd s THR 14 Ca -0.06 1.62 -0.24 0.00 0.31 0.00 0.00 61.69 63.32 1nfd s THR 14 Cb -0.06 -4.12 -0.16 0.00 0.01 0.00 0.00 72.50 68.18 1nfd s THR 14 CO -0.08 0.28 0.34 0.52 -0.69 0.00 0.00 174.62 174.99 1nfd n VAL 15 N 3.43 1.41 0.00 3.82 0.31 -1.08 -0.82 118.33 125.40 1nfd n VAL 15 Ca -0.00 -0.47 0.00 0.00 -0.01 0.00 0.00 64.34 63.85 1nfd n VAL 15 Cb 0.51 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.44 1nfd n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1nfd n GLY 16 N 2.01 2.42 1.87 2.92 0.00 0.18 -4.92 105.19 109.66 1nfd n GLY 16 Ca 0.15 -0.04 -0.14 0.00 0.00 0.00 0.00 46.02 45.98 1nfd n GLY 16 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1nfd n GLU 17 N 0.00 -0.84 -4.36 1.61 2.13 -0.00 -3.83 120.64 115.34 1nfd n GLU 17 Ca 0.00 -0.99 -0.20 0.00 0.66 0.00 0.00 57.16 56.63 1nfd n GLU 17 Cb 0.00 -0.69 -0.16 0.00 0.27 0.00 0.00 31.44 30.86 1nfd n GLU 17 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 1nfd s THR 18 N -2.37 0.76 0.38 6.31 -1.32 -1.26 0.32 115.64 118.45 1nfd s THR 18 Ca 0.37 -0.33 0.02 0.00 -1.21 0.00 0.00 61.69 60.54 1nfd s THR 18 Cb -0.01 -0.68 0.02 0.00 -1.51 0.00 0.00 72.50 70.31 1nfd s THR 18 CO 0.26 0.24 0.16 0.55 -2.21 0.00 0.00 174.62 173.62 1nfd n VAL 19 N 3.40 0.00 -3.68 5.08 3.14 -1.15 -4.99 118.33 120.13 1nfd n VAL 19 Ca -0.19 -1.63 -0.10 0.00 -2.96 0.00 0.00 64.34 59.46 1nfd n VAL 19 Cb 0.54 0.07 -0.10 0.00 -1.06 0.00 0.00 33.84 33.29 1nfd n VAL 19 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1nfd s LYS 20 N -3.47 0.39 -0.16 1.45 1.02 -1.26 -3.33 119.74 114.38 1nfd s LYS 20 Ca 0.12 0.89 -0.03 0.00 0.02 0.00 0.00 55.97 56.97 1nfd s LYS 20 Cb -0.01 0.10 -0.02 0.00 -0.52 0.00 0.00 37.83 37.38 1nfd s LYS 20 CO 0.08 -0.19 -0.05 0.42 -0.92 0.00 0.00 175.35 174.69 1nfd s ILE 21 N 1.81 3.76 0.29 2.17 1.09 -0.93 -5.00 121.20 124.39 1nfd s ILE 21 Ca -0.07 -0.40 0.07 0.00 -1.10 0.00 0.00 60.65 59.15 1nfd s ILE 21 Cb -0.09 -2.65 -0.03 0.00 -1.06 0.00 0.00 42.46 38.63 1nfd s ILE 21 CO -0.13 0.49 0.31 0.42 -0.10 0.00 0.00 174.94 175.93 1nfd s THR 22 N 0.43 4.26 -0.29 2.92 -4.23 -1.26 -2.16 115.64 115.31 1nfd s THR 22 Ca -0.04 -1.23 0.01 0.00 -1.18 0.00 0.00 61.69 59.24 1nfd s THR 22 Cb -0.14 -3.43 0.15 0.00 1.34 0.00 0.00 72.50 70.41 1nfd s THR 22 CO 0.03 -0.26 0.35 0.00 -0.54 0.00 0.00 174.62 174.21 1nfd s SER 24 N 2.45 6.57 -0.10 0.00 1.04 -0.30 -2.25 113.70 121.11 1nfd s SER 24 Ca 0.10 0.69 0.02 0.00 0.48 0.00 0.00 55.95 57.23 1nfd s SER 24 Cb -0.13 -2.32 0.01 0.00 0.10 0.00 0.00 66.02 63.68 1nfd s SER 24 CO -0.31 -0.28 -0.16 -0.83 0.98 0.00 0.00 173.24 172.64 1nfd s GLY 25 N 1.35 1.06 0.24 7.32 0.00 0.45 -2.05 107.32 115.69 1nfd s GLY 25 Ca 0.25 -0.74 -0.07 0.00 0.00 0.00 0.00 44.72 44.16 1nfd s GLY 25 CO 0.09 0.14 1.90 -1.80 0.00 0.00 0.00 173.10 173.43 1nfd h ASP 26 N 7.28 1.10 -0.19 1.64 3.58 -1.83 -2.50 116.42 125.50 1nfd h ASP 26 Ca -0.30 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.10 1nfd h ASP 26 Cb 1.18 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 41.96 1nfd h ASP 26 CO 0.49 0.82 0.00 0.00 -2.88 0.00 0.00 179.24 177.67 1nfd n GLN 27 N -4.40 2.20 -0.26 0.28 6.02 -1.26 -4.51 117.38 115.45 1nfd n GLN 27 Ca 0.11 -1.78 0.07 0.00 -0.01 0.00 0.00 57.00 55.38 1nfd n GLN 27 Cb 0.04 -1.47 0.19 0.00 1.02 0.00 0.00 30.24 30.02 1nfd n GLN 27 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1nfd h LEU 28 N 3.83 -0.03 -1.52 1.08 3.38 -1.69 0.56 115.31 120.92 1nfd h LEU 28 Ca 0.00 0.16 0.07 0.00 0.09 0.00 0.00 57.88 58.20 1nfd h LEU 28 Cb 0.83 0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1nfd h LEU 28 CO 0.00 -0.07 0.60 1.55 0.09 0.00 0.00 178.44 180.61 1nfd h PRO 29 N 0.24 0.00 0.00 1.13 0.13 -1.78 0.11 132.00 131.83 1nfd h PRO 29 Ca 0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.57 1nfd h PRO 29 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1nfd h PRO 29 CO -0.55 0.00 -1.56 1.63 -0.23 0.00 0.00 178.00 177.29 1nfd n LYS 30 N -3.10 0.54 -4.69 0.86 5.02 0.18 -4.99 118.16 111.97 1nfd n LYS 30 Ca 0.04 -0.12 -0.25 0.00 -2.02 0.00 0.00 58.31 55.97 1nfd n LYS 30 Cb 0.71 -1.31 -0.16 0.00 -0.02 0.00 0.00 35.03 34.25 1nfd n LYS 30 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1nfd s ASN 31 N -3.49 1.92 1.05 4.39 -0.87 0.38 -5.10 114.94 113.22 1nfd s ASN 31 Ca -0.04 -0.32 -0.14 0.00 -1.57 0.00 0.00 52.86 50.78 1nfd s ASN 31 Cb 0.09 -0.69 0.19 0.00 -0.02 0.00 0.00 41.25 40.82 1nfd s ASN 31 CO 0.56 0.09 0.39 0.49 -2.57 0.00 0.00 177.10 176.07 1nfd n PHE 32 N 3.45 -2.50 -3.83 2.20 3.72 -1.26 -4.57 117.46 114.66 1nfd n PHE 32 Ca -0.20 -0.09 -0.12 0.00 -0.05 0.00 0.00 57.45 56.99 1nfd n PHE 32 Cb 0.53 -1.38 -0.12 0.00 -0.94 0.00 0.00 39.48 37.57 1nfd n PHE 32 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1nfd s ALA 33 N -2.08 -0.38 -0.05 4.37 0.00 -1.26 -4.46 121.76 117.90 1nfd s ALA 33 Ca 0.39 0.28 0.04 0.00 0.00 0.00 0.00 51.96 52.66 1nfd s ALA 33 Cb -0.07 -0.15 -0.00 0.00 0.00 0.00 0.00 23.12 22.90 1nfd s ALA 33 CO 0.35 -0.12 -0.17 0.71 0.00 0.00 0.00 175.76 176.53 1nfd s TYR 34 N -0.38 1.70 -0.21 0.00 1.51 -0.20 -1.72 117.35 118.05 1nfd s TYR 34 Ca -0.05 -0.51 -0.06 0.00 -1.01 0.00 0.00 57.07 55.45 1nfd s TYR 34 Cb -0.03 -1.15 -0.03 0.00 -0.11 0.00 0.00 41.96 40.64 1nfd s TYR 34 CO 0.01 -0.18 0.03 -1.58 -1.11 0.00 0.00 175.55 172.71 1nfd s TRP 35 N 0.10 3.08 0.33 2.71 0.52 0.26 0.21 118.94 126.15 1nfd s TRP 35 Ca -0.05 -0.35 0.10 0.00 0.02 0.00 0.00 56.10 55.81 1nfd s TRP 35 Cb -0.12 -2.12 -0.06 0.00 -1.15 0.00 0.00 33.47 30.02 1nfd s TRP 35 CO 0.02 -0.20 -0.06 -0.06 0.02 0.00 0.00 176.95 176.67 1nfd s PHE 36 N 1.04 2.46 -0.01 -1.98 0.40 -0.40 0.30 117.98 119.80 1nfd s PHE 36 Ca 0.03 -0.44 0.01 0.00 -0.60 0.00 0.00 56.93 55.92 1nfd s PHE 36 Cb -0.14 -1.37 0.01 0.00 0.51 0.00 0.00 43.02 42.03 1nfd s PHE 36 CO 0.02 0.56 -0.01 -1.14 0.70 0.00 0.00 175.22 175.35 1nfd s GLN 37 N -3.64 0.20 -0.21 0.44 0.74 0.19 -2.15 119.66 115.23 1nfd s GLN 37 Ca 0.33 -0.03 -0.01 0.00 0.05 0.00 0.00 55.36 55.71 1nfd s GLN 37 Cb 0.00 -0.26 0.06 0.00 1.10 0.00 0.00 33.01 33.91 1nfd s GLN 37 CO 0.18 -0.01 -0.03 -1.14 -0.55 0.00 0.00 175.29 173.74 1nfd s GLN 38 N 0.27 1.31 0.70 1.67 0.74 -0.39 -0.37 119.66 123.58 1nfd s GLN 38 Ca -0.02 -0.75 -0.08 0.00 0.05 0.00 0.00 55.36 54.56 1nfd s GLN 38 Cb -0.05 -2.36 0.05 0.00 1.10 0.00 0.00 33.01 31.76 1nfd s GLN 38 CO -0.01 -0.58 1.02 0.15 -0.55 0.00 0.00 175.29 175.32 1nfd s LYS 39 N 1.57 2.35 0.65 1.67 3.01 -1.25 -0.71 119.74 127.03 1nfd s LYS 39 Ca -0.03 -0.10 0.13 0.00 -1.01 0.00 0.00 55.97 54.95 1nfd s LYS 39 Cb -0.18 -2.15 0.59 0.00 -1.01 0.00 0.00 37.83 35.09 1nfd s LYS 39 CO -0.07 -1.17 1.30 1.03 0.51 0.00 0.00 175.35 176.95 1nfd h SER 40 N -0.59 0.00 0.00 2.83 0.87 -1.96 1.79 113.55 116.50 1nfd h SER 40 Ca -0.45 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.11 1nfd h SER 40 Cb 1.30 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.26 1nfd h SER 40 CO 0.61 0.00 0.00 -0.67 -0.53 0.00 0.00 176.83 176.24 1nfd n ASP 41 N -2.78 0.00 -1.19 6.23 -0.08 -1.26 -4.87 116.55 112.60 1nfd n ASP 41 Ca 0.04 -1.23 -0.14 0.00 -1.51 0.00 0.00 54.79 51.95 1nfd n ASP 41 Cb 0.93 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 44.33 1nfd n ASP 41 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1nfd n LYS 42 N -0.83 -1.53 -3.10 -0.67 5.02 0.61 -4.93 118.16 112.73 1nfd n LYS 42 Ca 0.15 0.92 -0.40 0.00 -2.02 0.00 0.00 58.31 56.96 1nfd n LYS 42 Cb 0.07 -5.23 -0.06 0.00 -0.02 0.00 0.00 35.03 29.79 1nfd n LYS 42 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1nfd s ASN 43 N -2.34 6.67 0.08 4.39 0.02 -1.26 -4.91 114.94 117.59 1nfd s ASN 43 Ca 0.00 0.82 -0.30 0.00 -1.02 0.00 0.00 52.86 52.35 1nfd s ASN 43 Cb 0.00 -2.35 -0.06 0.00 0.02 0.00 0.00 41.25 38.86 1nfd s ASN 43 CO 0.00 -0.31 1.13 -0.63 0.02 0.00 0.00 177.10 177.32 1nfd s ILE 44 N 2.09 4.13 -0.19 0.60 -1.09 -1.26 -3.74 121.20 121.73 1nfd s ILE 44 Ca 0.28 1.60 -0.02 0.00 -2.23 0.00 0.00 60.65 60.29 1nfd s ILE 44 Cb -0.16 -4.03 0.06 0.00 -1.58 0.00 0.00 42.46 36.75 1nfd s ILE 44 CO 0.10 0.17 -0.00 -0.22 -1.23 0.00 0.00 174.94 173.75 1nfd s LEU 45 N 0.67 1.57 -0.47 2.97 2.96 0.50 -4.94 118.68 121.94 1nfd s LEU 45 Ca 0.55 -0.85 -0.28 0.00 -0.22 0.00 0.00 54.13 53.33 1nfd s LEU 45 Cb -0.28 -0.78 -0.01 0.00 0.50 0.00 0.00 46.19 45.62 1nfd s LEU 45 CO 0.30 -0.27 1.67 -0.22 -1.32 0.00 0.00 176.35 176.52 1nfd s LEU 46 N 1.71 3.44 -0.09 -0.68 2.96 -1.26 0.54 118.68 125.30 1nfd s LEU 46 Ca -0.02 0.76 -0.10 0.00 -0.22 0.00 0.00 54.13 54.55 1nfd s LEU 46 Cb -0.17 -3.16 -0.08 0.00 0.50 0.00 0.00 46.19 43.28 1nfd s LEU 46 CO -0.07 -1.84 0.33 -0.07 -1.32 0.00 0.00 176.35 173.38 1nfd h LEU 47 N 14.04 -0.09 -8.71 -0.68 3.38 0.43 -3.46 115.31 120.23 1nfd h LEU 47 Ca -0.29 -0.22 -0.37 0.00 0.09 0.00 0.00 57.88 57.09 1nfd h LEU 47 Cb 1.14 0.02 -0.15 0.00 0.09 0.00 0.00 40.66 41.76 1nfd h LEU 47 CO 1.12 0.50 -0.72 -0.63 0.09 0.00 0.00 178.44 178.79 1nfd s ILE 48 N -2.15 1.35 0.01 1.22 1.01 -0.49 -3.86 121.20 118.30 1nfd s ILE 48 Ca -0.06 -2.06 -0.14 0.00 0.00 0.00 0.00 60.65 58.38 1nfd s ILE 48 Cb -0.00 -1.86 0.02 0.00 0.01 0.00 0.00 42.46 40.63 1nfd s ILE 48 CO 0.21 -0.66 0.31 -0.72 0.00 0.00 0.00 174.94 174.08 1nfd s TYR 49 N -3.07 -0.15 -1.05 3.97 1.13 0.00 -0.57 117.35 117.61 1nfd s TYR 49 Ca 0.17 0.13 -0.05 0.00 -1.41 0.00 0.00 57.07 55.91 1nfd s TYR 49 Cb 0.01 0.10 0.01 0.00 -1.10 0.00 0.00 41.96 40.97 1nfd s TYR 49 CO 0.03 -0.45 0.90 -1.33 -2.51 0.00 0.00 175.55 172.19 1nfd n MET 50 N 0.93 -6.04 -0.66 -3.49 2.81 -1.09 -1.23 117.12 108.34 1nfd n MET 50 Ca -0.20 0.67 0.00 0.00 -1.81 0.00 0.00 57.70 56.36 1nfd n MET 50 Cb 0.58 -5.21 0.00 0.00 -0.71 0.00 0.00 33.22 27.88 1nfd n MET 50 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1nfd n ASP 51 N -2.31 -1.29 0.00 7.83 9.92 -0.70 -4.20 116.55 125.80 1nfd n ASP 51 Ca -0.07 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.19 1nfd n ASP 51 Cb 0.58 -2.43 0.00 0.00 -0.64 0.00 0.00 41.12 38.63 1nfd n ASP 51 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 1nfd n ASN 52 N -0.20 0.00 -4.65 -2.24 0.23 -1.18 -4.16 115.26 103.05 1nfd n ASN 52 Ca 0.00 0.00 -0.38 0.00 -0.53 0.00 0.00 54.58 53.67 1nfd n ASN 52 Cb 0.10 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 37.72 1nfd n ASN 52 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 1nfd s LYS 53 N 0.00 4.12 -0.26 -3.83 1.02 -0.37 -4.53 119.74 115.89 1nfd s LYS 53 Ca 0.00 0.06 -0.13 0.00 0.02 0.00 0.00 55.97 55.92 1nfd s LYS 53 Cb 0.00 -3.56 -0.04 0.00 -0.52 0.00 0.00 37.83 33.71 1nfd s LYS 53 CO 0.00 -0.06 0.29 0.50 -0.92 0.00 0.00 175.35 175.16 1nfd s ARG 54 N 1.41 4.02 0.97 1.68 3.52 -1.26 -0.82 118.95 128.46 1nfd s ARG 54 Ca 0.16 -0.09 -0.11 0.00 -0.13 0.00 0.00 55.73 55.56 1nfd s ARG 54 Cb -0.15 -3.63 0.18 0.00 -1.56 0.00 0.00 34.95 29.79 1nfd s ARG 54 CO 0.08 -0.19 1.13 -1.25 -0.81 0.00 0.00 175.30 174.25 1nfd s PRO 55 N 1.79 0.59 0.40 5.12 0.04 -1.25 -4.97 135.00 136.73 1nfd s PRO 55 Ca 0.12 1.44 -0.24 0.00 0.04 0.00 0.00 61.00 62.36 1nfd s PRO 55 Cb -0.15 -1.69 -0.09 0.00 0.04 0.00 0.00 34.50 32.61 1nfd s PRO 55 CO 0.09 -2.89 1.05 0.45 0.04 0.00 0.00 177.00 175.74 1nfd s SER 56 N -2.60 6.73 0.00 6.66 0.15 -1.26 -3.36 113.70 120.01 1nfd s SER 56 Ca 0.67 2.03 0.00 0.00 0.70 0.00 0.00 55.95 59.35 1nfd s SER 56 Cb -0.23 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.49 1nfd s SER 56 CO 0.59 -0.51 0.00 0.61 1.20 0.00 0.00 173.24 175.13 1nfd n GLY 57 N 0.29 0.74 3.37 9.45 0.00 -1.26 -5.05 105.19 112.73 1nfd n GLY 57 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 1nfd n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nfd s ILE 58 N -2.35 3.05 0.14 -0.61 1.01 -1.21 -5.08 121.20 116.15 1nfd s ILE 58 Ca 0.00 -0.66 -0.26 0.00 0.00 0.00 0.00 60.65 59.74 1nfd s ILE 58 Cb 0.00 -2.29 -0.15 0.00 0.01 0.00 0.00 42.46 40.03 1nfd s ILE 58 CO 0.00 0.52 0.52 -2.65 0.00 0.00 0.00 174.94 173.33 1nfd n PRO 59 N 3.58 0.00 0.00 2.79 -0.02 -1.26 -4.82 135.00 135.26 1nfd n PRO 59 Ca -0.18 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.44 1nfd n PRO 59 Cb 0.53 -0.93 0.85 0.00 -0.02 0.00 0.00 33.50 33.92 1nfd n PRO 59 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1nfd n GLU 60 N 0.93 0.85 0.00 -0.52 0.28 -1.26 -2.74 120.64 118.18 1nfd n GLU 60 Ca 0.16 0.00 0.15 0.00 -0.16 0.00 0.00 57.16 57.31 1nfd n GLU 60 Cb 0.19 -1.50 0.71 0.00 1.43 0.00 0.00 31.44 32.27 1nfd n GLU 60 CO 0.00 0.00 0.00 2.89 -0.16 0.00 0.00 177.13 179.86 1nfd n ARG 61 N -1.04 0.69 -3.08 3.44 1.85 -1.26 -4.56 116.66 112.70 1nfd n ARG 61 Ca 0.21 -0.15 -0.45 0.00 -1.00 0.00 0.00 57.85 56.46 1nfd n ARG 61 Cb 0.12 -1.50 -0.04 0.00 -1.05 0.00 0.00 32.46 29.99 1nfd n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1nfd s PHE 62 N -2.41 3.10 0.50 2.89 0.08 -1.11 -0.64 117.98 120.39 1nfd s PHE 62 Ca 0.32 -1.16 0.07 0.00 0.12 0.00 0.00 56.93 56.28 1nfd s PHE 62 Cb 0.20 -4.07 0.04 0.00 -0.57 0.00 0.00 43.02 38.63 1nfd s PHE 62 CO 0.45 -1.32 0.69 -1.54 -0.10 0.00 0.00 175.22 173.40 1nfd s SER 63 N 3.43 5.36 -0.41 1.36 1.04 -1.04 -4.85 113.70 118.58 1nfd s SER 63 Ca 0.18 -0.49 0.06 0.00 0.48 0.00 0.00 55.95 56.17 1nfd s SER 63 Cb -0.18 -0.36 0.17 0.00 0.10 0.00 0.00 66.02 65.76 1nfd s SER 63 CO 0.01 -1.05 0.52 -0.83 0.98 0.00 0.00 173.24 172.86 1nfd s GLY 64 N -4.48 -0.54 0.73 7.32 0.00 -1.26 -2.62 107.32 106.48 1nfd s GLY 64 Ca 0.58 -0.61 -0.02 0.00 0.00 0.00 0.00 44.72 44.67 1nfd s GLY 64 CO 0.36 3.15 1.01 -1.35 0.00 0.00 0.00 173.10 176.27 1nfd s SER 65 N 1.36 4.29 -0.30 1.64 1.04 -0.59 -3.14 113.70 118.00 1nfd s SER 65 Ca 0.20 -0.31 -0.09 0.00 0.48 0.00 0.00 55.95 56.22 1nfd s SER 65 Cb -0.08 -0.05 0.18 0.00 0.10 0.00 0.00 66.02 66.17 1nfd s SER 65 CO -0.06 -1.91 0.92 0.28 0.98 0.00 0.00 173.24 173.46 1nfd s THR 66 N -3.18 -0.52 0.01 2.02 -1.32 -1.26 -0.55 115.64 110.83 1nfd s THR 66 Ca 0.67 0.00 0.01 0.00 -1.21 0.00 0.00 61.69 61.15 1nfd s THR 66 Cb -0.05 -0.95 -0.04 0.00 -1.51 0.00 0.00 72.50 69.95 1nfd s THR 66 CO 0.45 0.00 0.07 -0.44 -2.21 0.00 0.00 174.62 172.48 1nfd s SER 67 N 2.93 5.55 0.00 8.08 0.01 0.24 -4.83 113.70 125.67 1nfd s SER 67 Ca 0.07 0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.42 1nfd s SER 67 Cb -0.11 -1.55 0.00 0.00 0.21 0.00 0.00 66.02 64.57 1nfd s SER 67 CO -0.15 0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.36 1nfd n GLY 68 N 1.06 1.23 1.18 3.44 0.00 -1.26 0.17 105.19 111.01 1nfd n GLY 68 Ca -0.12 0.28 0.06 0.00 0.00 0.00 0.00 46.02 46.24 1nfd n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1nfd n THR 69 N 0.00 1.27 -3.65 2.61 -2.24 -1.26 -3.65 114.28 107.36 1nfd n THR 69 Ca 0.00 -0.80 -0.21 0.00 -2.27 0.00 0.00 64.05 60.76 1nfd n THR 69 Cb 0.00 -0.02 -0.18 0.00 -2.10 0.00 0.00 70.33 68.03 1nfd n THR 69 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1nfd s THR 70 N -1.77 -0.12 0.06 4.28 2.01 0.44 0.17 115.64 120.71 1nfd s THR 70 Ca 0.35 0.26 -0.04 0.00 0.31 0.00 0.00 61.69 62.57 1nfd s THR 70 Cb 0.23 -0.28 -0.05 0.00 0.01 0.00 0.00 72.50 72.41 1nfd s THR 70 CO 0.16 0.05 0.27 0.00 -0.69 0.00 0.00 174.62 174.42 1nfd s ALA 71 N 2.17 3.89 0.06 7.40 0.00 -0.95 0.81 121.76 135.13 1nfd s ALA 71 Ca 0.04 -0.67 0.05 0.00 0.00 0.00 0.00 51.96 51.38 1nfd s ALA 71 Cb -0.13 -1.99 -0.03 0.00 0.00 0.00 0.00 23.12 20.97 1nfd s ALA 71 CO -0.05 0.72 -0.13 0.99 0.00 0.00 0.00 175.76 177.29 1nfd s THR 72 N -1.45 1.02 -0.13 0.00 2.01 0.28 -2.21 115.64 115.16 1nfd s THR 72 Ca 0.33 -1.15 -0.02 0.00 0.31 0.00 0.00 61.69 61.16 1nfd s THR 72 Cb -0.13 -0.97 -0.03 0.00 0.01 0.00 0.00 72.50 71.38 1nfd s THR 72 CO 0.22 -0.17 -0.04 -0.22 -0.69 0.00 0.00 174.62 173.72 1nfd s LEU 73 N -1.49 3.24 -0.25 4.42 2.96 -0.92 -1.54 118.68 125.10 1nfd s LEU 73 Ca -0.02 -0.08 0.01 0.00 -0.22 0.00 0.00 54.13 53.82 1nfd s LEU 73 Cb -0.09 -1.76 0.07 0.00 0.50 0.00 0.00 46.19 44.91 1nfd s LEU 73 CO 0.02 0.24 -0.04 -0.89 -1.32 0.00 0.00 176.35 174.35 1nfd s THR 74 N -0.06 1.66 -0.58 3.68 2.01 -1.08 -2.18 115.64 119.09 1nfd s THR 74 Ca 0.01 -1.41 -0.25 0.00 0.31 0.00 0.00 61.69 60.36 1nfd s THR 74 Cb -0.13 -1.95 0.04 0.00 0.01 0.00 0.00 72.50 70.47 1nfd s THR 74 CO 0.03 -0.17 1.01 -0.63 -0.69 0.00 0.00 174.62 174.16 1nfd s ILE 75 N 1.31 4.28 -0.11 1.82 1.01 -1.21 -2.50 121.20 125.80 1nfd s ILE 75 Ca -0.04 0.29 -0.28 0.00 0.00 0.00 0.00 60.65 60.62 1nfd s ILE 75 Cb -0.19 -4.62 -0.02 0.00 0.01 0.00 0.00 42.46 37.65 1nfd s ILE 75 CO -0.07 -1.25 0.93 -0.44 0.00 0.00 0.00 174.94 174.10 1nfd s SER 76 N 3.05 7.16 -0.95 3.58 0.01 0.18 -2.92 113.70 123.80 1nfd s SER 76 Ca 0.31 1.42 -0.04 0.00 1.31 0.00 0.00 55.95 58.95 1nfd s SER 76 Cb -0.12 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.60 1nfd s SER 76 CO 0.18 -0.38 0.82 0.61 0.41 0.00 0.00 173.24 174.88 1nfd n GLY 77 N 3.17 -0.15 1.70 3.44 0.00 -0.71 -4.68 105.19 107.96 1nfd n GLY 77 Ca 0.06 -0.01 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 1nfd n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nfd n ALA 78 N -3.96 -2.02 -2.47 4.61 0.00 0.94 -4.00 120.51 113.60 1nfd n ALA 78 Ca -0.07 0.28 -0.23 0.00 0.00 0.00 0.00 53.44 53.42 1nfd n ALA 78 Cb 0.57 -0.85 -0.06 0.00 0.00 0.00 0.00 19.45 19.12 1nfd n ALA 78 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1nfd s GLN 79 N -0.06 2.42 0.10 0.00 2.00 -1.26 0.48 119.66 123.34 1nfd s GLN 79 Ca 0.43 -1.55 -0.15 0.00 -2.00 0.00 0.00 55.36 52.09 1nfd s GLN 79 Cb -0.60 -2.22 -0.09 0.00 0.80 0.00 0.00 33.01 30.91 1nfd s GLN 79 CO 0.28 0.04 1.41 -1.00 -0.50 0.00 0.00 175.29 175.52 1nfd h PRO 80 N 1.43 0.68 -0.28 1.67 0.13 -1.92 -2.76 132.00 130.95 1nfd h PRO 80 Ca -0.43 -0.36 0.00 0.00 -0.87 0.00 0.00 66.00 64.34 1nfd h PRO 80 Cb 1.25 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1nfd h PRO 80 CO 0.63 0.97 0.00 -0.85 -0.23 0.00 0.00 178.00 178.52 1nfd n GLU 81 N -4.28 0.44 0.00 0.86 0.28 -1.26 -2.29 120.64 114.38 1nfd n GLU 81 Ca -0.04 0.00 0.08 0.00 -0.16 0.00 0.00 57.16 57.04 1nfd n GLU 81 Cb 0.47 -1.14 0.02 0.00 1.43 0.00 0.00 31.44 32.21 1nfd n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1nfd n ASP 82 N 0.01 1.81 -4.57 -1.84 8.00 -1.04 -4.92 116.55 114.00 1nfd n ASP 82 Ca 0.00 -1.41 -0.41 0.00 0.71 0.00 0.00 54.79 53.69 1nfd n ASP 82 Cb 0.07 0.32 -0.03 0.00 -0.02 0.00 0.00 41.12 41.47 1nfd n ASP 82 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1nfd s GLU 83 N -1.67 3.11 0.17 -1.24 2.12 -0.97 -4.87 118.70 115.34 1nfd s GLU 83 Ca 0.15 0.72 -0.09 0.00 0.36 0.00 0.00 54.97 56.11 1nfd s GLU 83 Cb 0.13 -4.22 0.03 0.00 0.26 0.00 0.00 34.13 30.33 1nfd s GLU 83 CO 0.33 -2.15 0.46 0.00 -0.54 0.00 0.00 175.26 173.35 1nfd n ALA 84 N 10.68 -1.09 -1.98 6.30 0.00 -1.25 -4.73 120.51 128.44 1nfd n ALA 84 Ca 0.17 -0.63 -0.33 0.00 0.00 0.00 0.00 53.44 52.65 1nfd n ALA 84 Cb 0.49 0.46 -0.07 0.00 0.00 0.00 0.00 19.45 20.34 1nfd n ALA 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nfd s ALA 85 N -1.56 3.19 -0.07 0.00 0.00 0.11 -3.66 121.76 119.76 1nfd s ALA 85 Ca 0.10 0.22 -0.00 0.00 0.00 0.00 0.00 51.96 52.27 1nfd s ALA 85 Cb -0.02 -2.95 0.02 0.00 0.00 0.00 0.00 23.12 20.17 1nfd s ALA 85 CO 0.05 0.23 -0.04 0.71 0.00 0.00 0.00 175.76 176.72 1nfd s TYR 86 N -2.07 0.94 -0.06 0.00 2.02 -1.06 -1.26 117.35 115.85 1nfd s TYR 86 Ca 0.58 -0.34 0.05 0.00 -0.37 0.00 0.00 57.07 56.99 1nfd s TYR 86 Cb -0.10 -0.89 -0.01 0.00 -0.40 0.00 0.00 41.96 40.57 1nfd s TYR 86 CO 0.15 -0.34 -0.22 0.71 -1.57 0.00 0.00 175.55 174.28 1nfd s TYR 87 N 1.56 2.22 -0.03 2.71 2.02 -0.91 -0.20 117.35 124.71 1nfd s TYR 87 Ca -0.00 -0.71 -0.02 0.00 -0.37 0.00 0.00 57.07 55.97 1nfd s TYR 87 Cb -0.13 -1.47 -0.04 0.00 -0.40 0.00 0.00 41.96 39.92 1nfd s TYR 87 CO -0.04 -0.24 0.11 0.00 -1.57 0.00 0.00 175.55 173.81 1nfd s LEU 89 N -1.57 2.27 0.33 0.00 2.96 0.13 -1.18 118.68 121.62 1nfd s LEU 89 Ca 0.22 -0.69 -0.17 0.00 -0.22 0.00 0.00 54.13 53.26 1nfd s LEU 89 Cb -0.12 -1.16 0.06 0.00 0.50 0.00 0.00 46.19 45.47 1nfd s LEU 89 CO 0.12 0.18 0.87 -0.55 -1.32 0.00 0.00 176.35 175.64 1nfd s SER 90 N -1.78 0.01 0.26 3.68 0.15 -0.12 -1.03 113.70 114.87 1nfd s SER 90 Ca 0.12 -1.02 0.04 0.00 0.70 0.00 0.00 55.95 55.78 1nfd s SER 90 Cb -0.10 0.75 -0.06 0.00 -1.71 0.00 0.00 66.02 64.91 1nfd s SER 90 CO 0.05 -1.50 0.02 -0.94 1.20 0.00 0.00 173.24 172.07 1nfd s SER 91 N -3.18 1.97 0.24 5.45 1.04 -1.25 0.92 113.70 118.90 1nfd s SER 91 Ca 0.17 -1.27 -0.22 0.00 0.48 0.00 0.00 55.95 55.12 1nfd s SER 91 Cb -0.04 -0.01 0.03 0.00 0.10 0.00 0.00 66.02 66.10 1nfd s SER 91 CO 0.10 -0.54 0.70 -0.72 0.98 0.00 0.00 173.24 173.76 1nfd s TYR 92 N -3.39 -0.27 0.00 5.02 1.13 0.51 -4.75 117.35 115.60 1nfd s TYR 92 Ca 0.31 -0.12 0.00 0.00 -1.41 0.00 0.00 57.07 55.85 1nfd s TYR 92 Cb 0.06 0.67 0.00 0.00 -1.10 0.00 0.00 41.96 41.59 1nfd s TYR 92 CO 0.11 -1.12 0.00 0.41 -2.51 0.00 0.00 175.55 172.44 1nfd n GLY 93 N -0.44 -2.12 1.79 5.49 0.00 -1.26 0.12 105.19 108.77 1nfd n GLY 93 Ca -0.07 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.45 1nfd n GLY 93 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nfd n ASP 94 N -1.83 0.48 -2.73 1.61 8.00 -1.26 -4.50 116.55 116.32 1nfd n ASP 94 Ca 0.00 -0.98 -0.07 0.00 0.71 0.00 0.00 54.79 54.45 1nfd n ASP 94 Cb 0.00 -0.10 0.07 0.00 -0.02 0.00 0.00 41.12 41.07 1nfd n ASP 94 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1nfd n ASN 95 N 1.79 -2.44 -4.78 -2.24 4.13 -1.15 -5.25 115.26 105.32 1nfd n ASN 95 Ca 0.00 -3.09 -0.37 0.00 1.68 0.00 0.00 54.58 52.79 1nfd n ASN 95 Cb 0.05 1.66 -0.06 0.00 -1.54 0.00 0.00 39.78 39.89 1nfd n ASN 95 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 1nfd s ASP 95 N -1.30 7.23 0.49 6.41 1.11 0.32 -4.64 116.67 126.29 1nfd s ASP 95 Ca 0.28 1.93 -0.13 0.00 0.18 0.00 0.00 52.55 54.81 1nfd s ASP 95 Cb 0.24 -2.59 -0.07 0.00 1.07 0.00 0.00 42.92 41.58 1nfd s ASP 95 CO -0.18 -0.15 0.90 -0.76 1.18 0.00 0.00 175.17 176.17 1nfd s LEU 96 N -2.05 3.65 -0.27 1.23 1.43 -1.26 -0.36 118.68 121.05 1nfd s LEU 96 Ca 0.50 1.36 -0.21 0.00 -1.03 0.00 0.00 54.13 54.76 1nfd s LEU 96 Cb -0.21 -4.30 0.07 0.00 0.03 0.00 0.00 46.19 41.78 1nfd s LEU 96 CO 0.27 -0.55 0.69 0.54 0.23 0.00 0.00 176.35 177.53 1nfd s VAL 97 N -2.60 -0.00 0.20 -1.59 0.11 0.26 -4.90 120.40 111.88 1nfd s VAL 97 Ca 0.55 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.64 1nfd s VAL 97 Cb -0.10 -0.98 -0.03 0.00 -1.53 0.00 0.00 36.38 33.74 1nfd s VAL 97 CO 0.35 0.00 0.33 -0.36 -3.33 0.00 0.00 175.10 172.09 1nfd s PHE 98 N 0.88 3.47 0.00 1.54 0.08 -1.26 -0.94 117.98 121.75 1nfd s PHE 98 Ca -0.04 0.06 0.00 0.00 0.12 0.00 0.00 56.93 57.07 1nfd s PHE 98 Cb -0.05 -1.63 0.00 0.00 -0.57 0.00 0.00 43.02 40.77 1nfd s PHE 98 CO -0.07 0.47 0.00 0.41 -0.10 0.00 0.00 175.22 175.92 1nfd n GLY 99 N -0.99 -0.08 1.10 4.36 0.00 -0.33 -4.51 105.19 104.75 1nfd n GLY 99 Ca -0.08 -1.53 0.09 0.00 0.00 0.00 0.00 46.02 44.50 1nfd n GLY 99 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1nfd n SER 100 N 0.00 3.75 -0.53 1.61 2.88 -1.26 -4.90 113.62 115.17 1nfd n SER 100 Ca 0.00 -2.17 0.00 0.00 -1.33 0.00 0.00 58.87 55.37 1nfd n SER 100 Cb 0.00 -0.42 0.00 0.00 -0.75 0.00 0.00 64.21 63.04 1nfd n SER 100 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1nfd n GLY 101 N 0.95 -3.29 2.96 0.46 0.00 -1.26 -4.98 105.19 100.04 1nfd n GLY 101 Ca 0.20 -1.12 -0.29 0.00 0.00 0.00 0.00 46.02 44.81 1nfd n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nfd s THR 102 N -4.10 1.35 -0.59 2.61 2.01 0.72 -4.50 115.64 113.14 1nfd s THR 102 Ca 0.00 -0.62 -0.24 0.00 0.31 0.00 0.00 61.69 61.14 1nfd s THR 102 Cb 0.00 -1.38 0.05 0.00 0.01 0.00 0.00 72.50 71.18 1nfd s THR 102 CO 0.00 0.30 0.95 -1.58 -0.69 0.00 0.00 174.62 173.60 1nfd s GLN 103 N 1.56 3.25 -0.11 4.92 2.00 -1.08 -2.57 119.66 127.63 1nfd s GLN 103 Ca 0.03 -0.45 -0.06 0.00 -2.00 0.00 0.00 55.36 52.87 1nfd s GLN 103 Cb -0.14 -4.11 -0.04 0.00 0.80 0.00 0.00 33.01 29.52 1nfd s GLN 103 CO -0.09 -1.60 0.11 -1.17 -0.50 0.00 0.00 175.29 172.05 1nfd s LEU 104 N 4.00 4.22 -0.01 3.68 0.20 -1.24 0.46 118.68 129.99 1nfd s LEU 104 Ca 0.27 0.40 0.08 0.00 0.69 0.00 0.00 54.13 55.57 1nfd s LEU 104 Cb -0.14 -2.02 -0.02 0.00 -0.43 0.00 0.00 46.19 43.58 1nfd s LEU 104 CO 0.16 0.40 -0.24 -0.89 -0.29 0.00 0.00 176.35 175.49 1nfd s THR 105 N -0.98 2.22 -0.43 3.68 2.01 0.06 -3.85 115.64 118.34 1nfd s THR 105 Ca 0.15 -1.13 -0.08 0.00 0.31 0.00 0.00 61.69 60.94 1nfd s THR 105 Cb -0.12 -1.81 0.10 0.00 0.01 0.00 0.00 72.50 70.68 1nfd s THR 105 CO 0.04 0.52 0.27 -0.69 -0.69 0.00 0.00 174.62 174.07 1nfd s VAL 106 N -0.68 4.00 0.17 3.82 1.01 -1.26 -0.96 120.40 126.51 1nfd s VAL 106 Ca 0.11 -1.64 -0.30 0.00 0.00 0.00 0.00 61.98 60.15 1nfd s VAL 106 Cb -0.10 -3.55 -0.08 0.00 0.00 0.00 0.00 36.38 32.64 1nfd s VAL 106 CO 0.00 -0.61 1.33 -0.76 0.00 0.00 0.00 175.10 175.07 1nfd s LEU 106 N 1.35 4.40 -0.18 3.92 1.43 -0.85 -4.82 118.68 123.92 1nfd s LEU 106 Ca 0.04 2.38 -0.16 0.00 -1.03 0.00 0.00 54.13 55.36 1nfd s LEU 106 Cb -0.24 -3.60 -0.07 0.00 0.03 0.00 0.00 46.19 42.31 1nfd s LEU 106 CO -0.00 -0.57 -0.30 0.54 0.23 0.00 0.00 176.35 176.25 1nfd n ARG 107 N 3.03 0.52 0.00 1.70 5.12 -1.26 -2.62 116.66 123.15 1nfd n ARG 107 Ca 0.08 0.29 0.00 0.00 -1.93 0.00 0.00 57.85 56.29 1nfd n ARG 107 Cb 0.43 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.23 1nfd n ARG 107 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1nfd n GLY 108 N 1.47 0.94 3.47 -0.13 0.00 -1.26 -4.91 105.19 104.77 1nfd n GLY 108 Ca -0.18 -0.20 -0.19 0.00 0.00 0.00 0.00 46.02 45.45 1nfd n GLY 108 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1nfd n PRO 109 N 0.00 0.06 -1.32 1.61 -0.04 -1.26 -4.83 135.00 129.22 1nfd n PRO 109 Ca 0.00 -1.27 -0.52 0.00 -0.04 0.00 0.00 63.50 61.67 1nfd n PRO 109 Cb 0.00 -3.15 -0.07 0.00 -0.04 0.00 0.00 33.50 30.23 1nfd n PRO 109 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1nfd n LYS 110 N 7.48 0.00 -4.24 0.54 2.85 -1.26 -4.91 118.16 118.63 1nfd n LYS 110 Ca 0.36 0.00 -0.17 0.00 -1.05 0.00 0.00 58.31 57.45 1nfd n LYS 110 Cb 0.45 -1.23 -0.14 0.00 -0.65 0.00 0.00 35.03 33.46 1nfd n LYS 110 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1nfd s SER 111 N 1.01 0.97 0.25 -5.58 0.15 -1.13 -5.00 113.70 104.37 1nfd s SER 111 Ca 0.80 -0.27 0.07 0.00 0.70 0.00 0.00 55.95 57.25 1nfd s SER 111 Cb -1.12 -0.07 -0.04 0.00 -1.71 0.00 0.00 66.02 63.08 1nfd s SER 111 CO 0.55 0.02 0.16 -0.44 1.20 0.00 0.00 173.24 174.73 1nfd s SER 112 N -0.61 5.37 1.17 5.45 0.01 -1.26 -2.65 113.70 121.18 1nfd s SER 112 Ca -0.00 -0.31 -0.17 0.00 1.31 0.00 0.00 55.95 56.79 1nfd s SER 112 Cb -0.05 -1.32 0.27 0.00 0.21 0.00 0.00 66.02 65.13 1nfd s SER 112 CO 0.00 -0.03 1.07 -2.16 0.41 0.00 0.00 173.24 172.53 1nfd s PRO 113 N -3.78 -0.96 -0.42 12.44 0.04 -1.25 -4.12 135.00 136.96 1nfd s PRO 113 Ca 0.32 0.24 0.06 0.00 0.04 0.00 0.00 61.00 61.66 1nfd s PRO 113 Cb -0.08 -1.60 0.21 0.00 0.04 0.00 0.00 34.50 33.07 1nfd s PRO 113 CO 0.24 -3.60 0.48 1.63 0.04 0.00 0.00 177.00 175.79 1nfd n LYS 114 N -4.74 0.45 -1.06 4.56 5.02 0.17 -4.91 118.16 117.65 1nfd n LYS 114 Ca 0.09 -2.97 -0.34 0.00 -2.02 0.00 0.00 58.31 53.07 1nfd n LYS 114 Cb 0.58 -1.47 0.12 0.00 -0.02 0.00 0.00 35.03 34.24 1nfd n LYS 114 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1nfd n VAL 115 N 2.25 1.57 -3.19 -0.18 0.31 -1.26 -2.25 118.33 115.58 1nfd n VAL 115 Ca 0.24 -0.23 0.04 0.00 -0.01 0.00 0.00 64.34 64.39 1nfd n VAL 115 Cb 0.52 -1.02 -0.02 0.00 -0.91 0.00 0.00 33.84 32.41 1nfd n VAL 115 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1nfd s THR 116 N -2.15 -0.60 0.59 2.52 2.01 0.23 -4.90 115.64 113.33 1nfd s THR 116 Ca 0.69 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 62.65 1nfd s THR 116 Cb -0.29 -1.00 0.02 0.00 0.01 0.00 0.00 72.50 71.25 1nfd s THR 116 CO 0.55 0.00 0.87 -0.69 -0.69 0.00 0.00 174.62 174.66 1nfd s VAL 117 N 2.87 3.24 -0.26 3.82 1.01 -1.26 -0.13 120.40 129.69 1nfd s VAL 117 Ca 0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 1nfd s VAL 117 Cb -0.12 -3.28 0.14 0.00 0.00 0.00 0.00 36.38 33.12 1nfd s VAL 117 CO -0.15 -0.26 0.35 -0.36 0.00 0.00 0.00 175.10 174.67 1nfd s PHE 118 N -2.94 -0.71 0.86 5.22 0.08 -0.20 -4.91 117.98 115.38 1nfd s PHE 118 Ca 0.55 0.39 -0.12 0.00 0.12 0.00 0.00 56.93 57.88 1nfd s PHE 118 Cb -0.10 -0.19 0.11 0.00 -0.57 0.00 0.00 43.02 42.27 1nfd s PHE 118 CO 0.43 -0.81 1.18 -1.25 -0.10 0.00 0.00 175.22 174.66 1nfd s PRO 119 N 2.47 1.33 0.23 0.24 0.04 -1.26 -2.93 135.00 135.12 1nfd s PRO 119 Ca 0.10 1.67 -0.32 0.00 0.04 0.00 0.00 61.00 62.50 1nfd s PRO 119 Cb -0.14 -1.75 -0.12 0.00 0.04 0.00 0.00 34.50 32.53 1nfd s PRO 119 CO -0.23 -2.42 1.69 -2.30 0.04 0.00 0.00 177.00 173.78 1nfd n PRO 120 N -3.74 2.75 -1.10 0.56 -0.02 -1.26 -4.88 135.00 127.32 1nfd n PRO 120 Ca 0.13 0.99 -0.34 0.00 -2.02 0.00 0.00 63.50 62.26 1nfd n PRO 120 Cb 0.51 -2.82 0.12 0.00 -0.02 0.00 0.00 33.50 31.29 1nfd n PRO 120 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1nfd n SER 121 N 3.52 0.54 -0.20 2.55 2.88 -1.26 -4.81 113.62 116.85 1nfd n SER 121 Ca 0.14 0.57 -0.10 0.00 -1.33 0.00 0.00 58.87 58.15 1nfd n SER 121 Cb 0.35 -1.45 0.02 0.00 -0.75 0.00 0.00 64.21 62.38 1nfd n SER 121 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1nfd h PRO 122 N -0.90 1.07 -0.02 -1.46 0.11 -1.97 -0.85 132.00 127.96 1nfd h PRO 122 Ca -0.46 -0.37 -0.16 0.00 0.11 0.00 0.00 66.00 65.12 1nfd h PRO 122 Cb 1.30 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 1nfd h PRO 122 CO 0.45 1.07 -0.70 1.05 -0.21 0.00 0.00 178.00 179.66 1nfd h GLU 123 N 0.96 0.13 -0.24 1.05 9.09 -1.98 -2.24 114.58 121.34 1nfd h GLU 123 Ca 0.16 -0.11 -0.01 0.00 0.05 0.00 0.00 59.36 59.44 1nfd h GLU 123 Cb 0.63 0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 27.74 1nfd h GLU 123 CO 0.04 0.78 0.10 1.49 0.05 0.00 0.00 179.01 181.47 1nfd h GLU 124 N 0.09 0.37 0.00 1.06 4.22 -1.79 -0.14 114.58 118.38 1nfd h GLU 124 Ca -0.02 -0.07 -0.01 0.00 0.08 0.00 0.00 59.36 59.35 1nfd h GLU 124 Cb 1.24 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 1nfd h GLU 124 CO 0.10 0.41 -0.05 -0.07 -2.18 0.00 0.00 179.01 177.22 1nfd h LEU 125 N 0.24 0.00 -0.52 1.64 3.38 -1.03 0.79 115.31 119.81 1nfd h LEU 125 Ca 0.08 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.10 1nfd h LEU 125 Cb 0.18 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 1nfd h LEU 125 CO -0.01 0.05 0.26 0.03 0.09 0.00 0.00 178.44 178.86 1nfd h ARG 126 N 0.00 0.49 0.00 1.13 3.08 -0.41 0.96 114.38 119.63 1nfd h ARG 126 Ca -0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1nfd h ARG 126 Cb 0.12 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1nfd h ARG 126 CO 0.01 0.32 0.00 0.25 -1.07 0.00 0.00 179.97 179.48 1nfd n THR 127 N -4.88 0.11 -2.60 2.04 -2.24 0.23 -4.83 114.28 102.10 1nfd n THR 127 Ca 0.05 0.03 -0.12 0.00 -2.27 0.00 0.00 64.05 61.73 1nfd n THR 127 Cb 0.14 -0.70 0.02 0.00 -2.10 0.00 0.00 70.33 67.68 1nfd n THR 127 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1nfd n ASN 128 N -1.08 -4.03 -4.15 3.42 5.15 0.33 -5.03 115.26 109.87 1nfd n ASN 128 Ca 0.14 -0.13 -0.26 0.00 -0.60 0.00 0.00 54.58 53.72 1nfd n ASN 128 Cb 0.10 -2.98 -0.16 0.00 -0.53 0.00 0.00 39.78 36.21 1nfd n ASN 128 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1nfd s LYS 129 N -5.08 1.71 -0.62 1.20 -0.14 -0.95 -3.23 119.74 112.63 1nfd s LYS 129 Ca 0.14 -0.62 0.05 0.00 -1.36 0.00 0.00 55.97 54.17 1nfd s LYS 129 Cb -0.06 -1.53 0.17 0.00 -1.68 0.00 0.00 37.83 34.73 1nfd s LYS 129 CO 0.17 0.28 0.46 0.00 -0.76 0.00 0.00 175.35 175.51 1nfd n ALA 130 N 3.01 3.28 -2.68 5.17 0.00 0.14 -3.16 120.51 126.26 1nfd n ALA 130 Ca -0.17 -4.14 -0.42 0.00 0.00 0.00 0.00 53.44 48.72 1nfd n ALA 130 Cb 0.53 -0.95 -0.03 0.00 0.00 0.00 0.00 19.45 19.00 1nfd n ALA 130 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1nfd s THR 131 N -1.07 4.85 -0.48 0.00 2.01 -1.26 -1.03 115.64 118.66 1nfd s THR 131 Ca 0.28 1.81 -0.12 0.00 0.31 0.00 0.00 61.69 63.97 1nfd s THR 131 Cb -0.01 -4.21 0.11 0.00 0.01 0.00 0.00 72.50 68.40 1nfd s THR 131 CO -0.18 0.04 0.38 -0.76 -0.69 0.00 0.00 174.62 173.42 1nfd s LEU 132 N 1.91 5.74 -0.27 4.42 1.02 -1.25 -3.99 118.68 126.26 1nfd s LEU 132 Ca 0.43 -1.75 -0.25 0.00 0.02 0.00 0.00 54.13 52.58 1nfd s LEU 132 Cb -0.18 -2.08 0.00 0.00 0.02 0.00 0.00 46.19 43.95 1nfd s LEU 132 CO 0.16 -0.71 0.87 -0.69 0.02 0.00 0.00 176.35 176.00 1nfd s VAL 133 N 1.47 4.77 -0.28 -1.59 1.01 -1.15 -2.02 120.40 122.60 1nfd s VAL 133 Ca 0.04 1.54 -0.02 0.00 0.00 0.00 0.00 61.98 63.55 1nfd s VAL 133 Cb -0.27 -4.18 0.04 0.00 0.00 0.00 0.00 36.38 31.97 1nfd s VAL 133 CO 0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 175.10 174.91 1nfd s LEU 135 N 1.29 3.60 -0.24 0.00 1.43 0.81 -0.96 118.68 124.62 1nfd s LEU 135 Ca -0.03 -0.01 -0.02 0.00 -1.03 0.00 0.00 54.13 53.05 1nfd s LEU 135 Cb -0.18 -1.90 0.02 0.00 0.03 0.00 0.00 46.19 44.16 1nfd s LEU 135 CO -0.02 0.16 -0.07 0.54 0.23 0.00 0.00 176.35 177.19 1nfd s VAL 136 N 0.44 2.85 0.22 -1.59 0.11 -0.72 0.77 120.40 122.48 1nfd s VAL 136 Ca 0.01 -0.96 0.09 0.00 -2.93 0.00 0.00 61.98 58.18 1nfd s VAL 136 Cb -0.13 -2.41 -0.05 0.00 -1.53 0.00 0.00 36.38 32.26 1nfd s VAL 136 CO 0.01 0.25 -0.16 0.21 -3.33 0.00 0.00 175.10 172.08 1nfd s ASN 137 N 1.34 2.84 -0.55 3.54 3.04 -0.96 -0.72 114.94 123.47 1nfd s ASN 137 Ca 0.01 -1.02 -0.12 0.00 0.04 0.00 0.00 52.86 51.77 1nfd s ASN 137 Cb -0.16 -0.18 0.02 0.00 -1.54 0.00 0.00 41.25 39.39 1nfd s ASN 137 CO -0.05 -0.11 0.64 0.47 -3.04 0.00 0.00 177.10 175.01 1nfd n ASP 138 N -0.41 -7.57 -3.60 -4.21 8.00 0.59 0.43 116.55 109.78 1nfd n ASP 138 Ca -0.07 0.22 -0.17 0.00 0.71 0.00 0.00 54.79 55.48 1nfd n ASP 138 Cb 0.60 -4.90 -0.08 0.00 -0.02 0.00 0.00 41.12 36.72 1nfd n ASP 138 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1nfd s PHE 139 N -2.65 1.50 -0.29 1.24 -0.71 -1.16 -3.85 117.98 112.06 1nfd s PHE 139 Ca 0.17 -1.53 -0.19 0.00 -1.04 0.00 0.00 56.93 54.34 1nfd s PHE 139 Cb -0.04 -0.60 0.17 0.00 -1.21 0.00 0.00 43.02 41.34 1nfd s PHE 139 CO 0.78 -0.83 1.17 -0.47 -1.34 0.00 0.00 175.22 174.52 1nfd s TYR 140 N -3.62 -0.30 -0.04 3.49 5.04 -1.09 -1.93 117.35 118.91 1nfd s TYR 140 Ca 0.39 0.63 -0.06 0.00 -2.44 0.00 0.00 57.07 55.59 1nfd s TYR 140 Cb 0.03 0.29 -0.02 0.00 0.35 0.00 0.00 41.96 42.61 1nfd s TYR 140 CO 0.22 -0.15 -0.12 -0.35 -1.34 0.00 0.00 175.55 173.82 1nfd n PRO 141 N 2.82 0.18 -1.16 4.97 -0.04 -1.26 -2.83 135.00 137.67 1nfd n PRO 141 Ca -0.15 0.07 -0.46 0.00 -0.04 0.00 0.00 63.50 62.92 1nfd n PRO 141 Cb 0.57 -0.73 -0.06 0.00 -0.04 0.00 0.00 33.50 33.23 1nfd n PRO 141 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nfd n GLY 142 N 2.12 -0.17 3.61 0.55 0.00 -1.26 -4.83 105.19 105.20 1nfd n GLY 142 Ca -0.05 0.60 -0.49 0.00 0.00 0.00 0.00 46.02 46.08 1nfd n GLY 142 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1nfd n SER 143 N 1.36 1.86 -4.38 1.61 3.41 -1.26 -3.52 113.62 112.70 1nfd n SER 143 Ca 0.16 1.12 -0.40 0.00 -0.26 0.00 0.00 58.87 59.49 1nfd n SER 143 Cb 0.05 -1.25 -0.11 0.00 -0.26 0.00 0.00 64.21 62.63 1nfd n SER 143 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nfd s ALA 144 N 0.28 3.28 0.34 7.33 0.00 -1.26 -4.31 121.76 127.42 1nfd s ALA 144 Ca 0.79 -1.70 -0.28 0.00 0.00 0.00 0.00 51.96 50.77 1nfd s ALA 144 Cb -0.85 -2.58 -0.10 0.00 0.00 0.00 0.00 23.12 19.58 1nfd s ALA 144 CO 0.47 -1.35 1.30 0.95 0.00 0.00 0.00 175.76 177.13 1nfd s THR 145 N 1.56 2.73 -0.26 0.00 -4.23 -1.25 -4.61 115.64 109.59 1nfd s THR 145 Ca 0.02 0.72 -0.07 0.00 -1.18 0.00 0.00 61.69 61.19 1nfd s THR 145 Cb -0.19 -3.45 -0.02 0.00 1.34 0.00 0.00 72.50 70.18 1nfd s THR 145 CO 0.07 0.16 0.06 -0.69 -0.54 0.00 0.00 174.62 173.68 1nfd s VAL 146 N -1.17 4.16 0.05 2.29 1.01 -1.26 -2.06 120.40 123.42 1nfd s VAL 146 Ca 0.50 -0.31 0.08 0.00 0.00 0.00 0.00 61.98 62.26 1nfd s VAL 146 Cb -0.39 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 1nfd s VAL 146 CO 0.52 0.29 -0.21 -0.89 0.00 0.00 0.00 175.10 174.81 1nfd s THR 147 N 1.58 2.54 -0.12 3.92 2.01 -0.58 -4.91 115.64 120.08 1nfd s THR 147 Ca 0.06 -1.28 -0.06 0.00 0.31 0.00 0.00 61.69 60.71 1nfd s THR 147 Cb -0.15 -2.04 -0.04 0.00 0.01 0.00 0.00 72.50 70.27 1nfd s THR 147 CO 0.03 0.34 0.11 0.26 -0.69 0.00 0.00 174.62 174.66 1nfd s TRP 148 N -0.89 3.48 0.06 4.92 0.52 -1.25 -0.85 118.94 124.92 1nfd s TRP 148 Ca 0.14 0.42 0.09 0.00 0.02 0.00 0.00 56.10 56.77 1nfd s TRP 148 Cb -0.10 -1.93 -0.03 0.00 -1.15 0.00 0.00 33.47 30.26 1nfd s TRP 148 CO 0.04 0.63 -0.25 0.15 0.02 0.00 0.00 176.95 177.54 1nfd s LYS 149 N -0.85 1.62 -0.32 4.98 -0.14 -0.45 0.43 119.74 125.02 1nfd s LYS 149 Ca 0.14 -1.11 -0.00 0.00 -1.36 0.00 0.00 55.97 53.63 1nfd s LYS 149 Cb -0.12 -1.84 0.13 0.00 -1.68 0.00 0.00 37.83 34.33 1nfd s LYS 149 CO 0.03 0.47 0.27 0.00 -0.76 0.00 0.00 175.35 175.36 1nfd s ALA 150 N -0.86 0.02 -0.55 5.17 0.00 0.37 0.11 121.76 126.02 1nfd s ALA 150 Ca 0.11 -0.94 -0.02 0.00 0.00 0.00 0.00 51.96 51.11 1nfd s ALA 150 Cb -0.10 -1.75 -0.02 0.00 0.00 0.00 0.00 23.12 21.25 1nfd s ALA 150 CO 0.03 -1.89 0.47 -1.71 0.00 0.00 0.00 175.76 172.66 1nfd n ASN 151 N 4.78 -3.44 0.00 0.00 2.85 -1.19 -3.50 115.26 114.76 1nfd n ASN 151 Ca 0.03 -0.34 0.00 0.00 -0.11 0.00 0.00 54.58 54.17 1nfd n ASN 151 Cb 0.43 -2.83 0.00 0.00 1.24 0.00 0.00 39.78 38.63 1nfd n ASN 151 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1nfd n GLY 152 N -1.25 1.00 3.83 8.20 0.00 -1.26 -4.94 105.19 110.77 1nfd n GLY 152 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 1nfd n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nfd s ALA 153 N 0.00 3.63 0.57 4.61 0.00 -1.23 -5.02 121.76 124.33 1nfd s ALA 153 Ca 0.00 -0.12 -0.16 0.00 0.00 0.00 0.00 51.96 51.67 1nfd s ALA 153 Cb 0.00 -2.50 -0.05 0.00 0.00 0.00 0.00 23.12 20.58 1nfd s ALA 153 CO 0.00 0.45 1.05 0.99 0.00 0.00 0.00 175.76 178.25 1nfd s THR 154 N -1.21 3.88 0.19 0.00 2.01 -1.26 0.14 115.64 119.39 1nfd s THR 154 Ca 0.30 0.92 0.05 0.00 0.31 0.00 0.00 61.69 63.27 1nfd s THR 154 Cb -0.17 -3.42 -0.04 0.00 0.01 0.00 0.00 72.50 68.88 1nfd s THR 154 CO 0.17 -0.50 0.17 -0.63 -0.69 0.00 0.00 174.62 173.15 1nfd s ILE 155 N -2.42 4.57 0.00 1.82 1.09 0.17 -4.76 121.20 121.66 1nfd s ILE 155 Ca 0.63 -1.14 0.11 0.00 -1.10 0.00 0.00 60.65 59.15 1nfd s ILE 155 Cb -0.15 -3.38 0.17 0.00 -1.06 0.00 0.00 42.46 38.04 1nfd s ILE 155 CO 0.35 -0.19 1.04 0.59 -0.10 0.00 0.00 174.94 176.63 1nfd n ASN 156 N -0.65 0.36 -4.12 3.58 5.03 -1.26 -4.50 115.26 113.69 1nfd n ASN 156 Ca -0.08 -1.94 -0.26 0.00 0.87 0.00 0.00 54.58 53.17 1nfd n ASN 156 Cb 0.56 -0.20 -0.16 0.00 -1.02 0.00 0.00 39.78 38.95 1nfd n ASN 156 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1nfd s ASP 157 N -1.35 2.11 -1.39 6.41 1.11 -1.26 -4.79 116.67 117.52 1nfd s ASP 157 Ca 0.14 -0.35 -0.05 0.00 0.18 0.00 0.00 52.55 52.47 1nfd s ASP 157 Cb 0.16 -0.64 0.01 0.00 1.07 0.00 0.00 42.92 43.51 1nfd s ASP 157 CO -0.07 0.14 0.72 0.61 1.18 0.00 0.00 175.17 177.75 1nfd n GLY 158 N 3.24 -0.43 3.57 0.21 0.00 -1.26 -4.83 105.19 105.68 1nfd n GLY 158 Ca -0.19 0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 1nfd n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nfd s VAL 159 N -3.18 3.35 -0.14 1.61 0.11 -1.26 -1.87 120.40 119.01 1nfd s VAL 159 Ca 0.36 -1.28 -0.13 0.00 -2.93 0.00 0.00 61.98 58.00 1nfd s VAL 159 Cb -0.16 -2.57 0.04 0.00 -1.53 0.00 0.00 36.38 32.17 1nfd s VAL 159 CO 0.44 0.11 0.38 -0.54 -3.33 0.00 0.00 175.10 172.16 1nfd s LYS 160 N -2.21 0.44 0.32 1.54 -0.14 -1.09 -4.98 119.74 113.62 1nfd s LYS 160 Ca 0.21 0.55 0.03 0.00 -1.36 0.00 0.00 55.97 55.40 1nfd s LYS 160 Cb -0.11 0.20 -0.04 0.00 -1.68 0.00 0.00 37.83 36.20 1nfd s LYS 160 CO 0.14 -0.06 0.15 0.95 -0.76 0.00 0.00 175.35 175.77 1nfd s THR 161 N 0.28 0.41 -0.05 2.17 -4.23 -1.26 0.15 115.64 113.11 1nfd s THR 161 Ca -0.01 -2.00 -0.17 0.00 -1.18 0.00 0.00 61.69 58.34 1nfd s THR 161 Cb -0.03 -2.51 0.03 0.00 1.34 0.00 0.00 72.50 71.33 1nfd s THR 161 CO -0.00 0.00 0.38 0.42 -0.54 0.00 0.00 174.62 174.88 1nfd s THR 162 N -3.55 0.04 -0.30 3.99 -4.23 -0.76 -4.94 115.64 105.90 1nfd s THR 162 Ca 0.34 -0.30 0.07 0.00 -1.18 0.00 0.00 61.69 60.63 1nfd s THR 162 Cb 0.05 -0.66 0.45 0.00 1.34 0.00 0.00 72.50 73.69 1nfd s THR 162 CO 0.17 -0.16 1.26 1.17 -0.54 0.00 0.00 174.62 176.52 1nfd n LYS 163 N 1.60 3.05 -0.41 3.99 3.00 -1.26 -2.96 118.16 125.16 1nfd n LYS 163 Ca -0.19 -3.89 -0.29 0.00 -0.00 0.00 0.00 58.31 53.94 1nfd n LYS 163 Cb 0.56 -2.12 0.26 0.00 0.00 0.00 0.00 35.03 33.74 1nfd n LYS 163 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 1nfd n PRO 164 N -0.83 -3.30 -3.40 1.64 -0.04 -1.18 -4.89 135.00 122.99 1nfd n PRO 164 Ca 0.39 -0.96 0.02 0.00 -0.04 0.00 0.00 63.50 62.91 1nfd n PRO 164 Cb 0.90 -1.98 -0.03 0.00 -0.04 0.00 0.00 33.50 32.35 1nfd n PRO 164 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1nfd s SER 165 N -2.53 -1.18 0.00 3.54 0.15 -1.26 -3.12 113.70 109.30 1nfd s SER 165 Ca 0.65 1.17 0.00 0.00 0.70 0.00 0.00 55.95 58.47 1nfd s SER 165 Cb -0.19 2.16 0.00 0.00 -1.71 0.00 0.00 66.02 66.29 1nfd s SER 165 CO 0.61 -0.22 0.00 1.17 1.20 0.00 0.00 173.24 176.00 1nfd n LYS 166 N 5.41 0.00 -3.57 5.44 4.81 -1.06 -4.99 118.16 124.20 1nfd n LYS 166 Ca -0.07 0.00 -0.34 0.00 -0.87 0.00 0.00 58.31 57.03 1nfd n LYS 166 Cb 0.50 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.58 1nfd n LYS 166 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1nfd n GLN 167 N 0.00 -1.76 0.00 1.64 -0.06 -1.26 -2.81 117.38 113.13 1nfd n GLN 167 Ca 0.00 1.17 0.00 0.00 -2.00 0.00 0.00 57.00 56.17 1nfd n GLN 167 Cb 0.00 -2.01 0.00 0.00 -4.06 0.00 0.00 30.24 24.17 1nfd n GLN 167 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1nfd n GLY 170 N -0.66 0.00 1.25 1.69 0.00 -1.26 -2.26 105.19 103.96 1nfd n GLY 170 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1nfd n GLY 170 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1nfd n GLN 171 N 0.00 0.00 0.00 1.61 7.27 -1.22 -5.10 117.38 119.94 1nfd n GLN 171 Ca 0.00 0.42 0.00 0.00 0.07 0.00 0.00 57.00 57.49 1nfd n GLN 171 Cb 0.00 -1.25 0.00 0.00 2.41 0.00 0.00 30.24 31.40 1nfd n GLN 171 CO 0.00 0.00 0.00 -1.71 0.07 0.00 0.00 177.06 175.42 1nfd n ASN 172 N -0.60 0.00 -4.87 1.69 2.85 -0.96 -4.97 115.26 108.40 1nfd n ASN 172 Ca 0.00 0.00 -0.32 0.00 -0.11 0.00 0.00 54.58 54.15 1nfd n ASN 172 Cb 0.18 0.00 -0.05 0.00 1.24 0.00 0.00 39.78 41.15 1nfd n ASN 172 CO 0.00 0.00 0.00 -0.31 -2.11 0.00 0.00 177.26 174.84 1nfd s TYR 173 N 0.00 3.43 -0.01 1.20 2.02 -0.81 -2.56 117.35 120.62 1nfd s TYR 173 Ca 0.00 0.90 -0.00 0.00 -0.37 0.00 0.00 57.07 57.60 1nfd s TYR 173 Cb 0.00 -2.29 0.02 0.00 -0.40 0.00 0.00 41.96 39.29 1nfd s TYR 173 CO 0.00 0.22 0.02 -1.64 -1.57 0.00 0.00 175.55 172.58 1nfd s MET 174 N -2.97 -0.02 -0.20 -0.62 -1.94 -1.18 -0.30 119.30 112.07 1nfd s MET 174 Ca 0.48 0.12 0.00 0.00 -1.71 0.00 0.00 55.69 54.58 1nfd s MET 174 Cb -0.11 -0.15 0.05 0.00 2.01 0.00 0.00 34.83 36.63 1nfd s MET 174 CO 0.22 -0.10 -0.07 0.99 -0.01 0.00 0.00 175.02 176.05 1nfd s THR 175 N 0.64 1.42 -0.39 2.05 2.01 0.10 -3.10 115.64 118.36 1nfd s THR 175 Ca -0.05 -0.97 -0.15 0.00 0.31 0.00 0.00 61.69 60.82 1nfd s THR 175 Cb -0.08 -1.61 0.01 0.00 0.01 0.00 0.00 72.50 70.83 1nfd s THR 175 CO -0.02 0.05 0.32 -0.55 -0.69 0.00 0.00 174.62 173.72 1nfd s SER 176 N 1.47 6.12 0.47 3.53 0.15 -1.16 -1.76 113.70 122.53 1nfd s SER 176 Ca -0.02 -0.73 0.07 0.00 0.70 0.00 0.00 55.95 55.97 1nfd s SER 176 Cb -0.17 -2.17 0.03 0.00 -1.71 0.00 0.00 66.02 62.00 1nfd s SER 176 CO -0.07 -0.42 0.65 -0.55 1.20 0.00 0.00 173.24 174.04 1nfd s SER 177 N 1.71 5.48 0.08 5.45 0.15 -0.13 -1.82 113.70 124.62 1nfd s SER 177 Ca 0.07 -0.41 -0.13 0.00 0.70 0.00 0.00 55.95 56.18 1nfd s SER 177 Cb -0.18 -0.54 0.02 0.00 -1.71 0.00 0.00 66.02 63.60 1nfd s SER 177 CO 0.11 -0.94 0.30 -0.31 1.20 0.00 0.00 173.24 173.60 1nfd s TYR 178 N -2.49 -0.06 -0.32 3.44 2.02 0.40 -2.72 117.35 117.62 1nfd s TYR 178 Ca 0.57 -0.22 0.17 0.00 -0.37 0.00 0.00 57.07 57.21 1nfd s TYR 178 Cb -0.09 0.10 0.45 0.00 -0.40 0.00 0.00 41.96 42.02 1nfd s TYR 178 CO 0.35 -0.58 1.14 -0.11 -1.57 0.00 0.00 175.55 174.79 1nfd n LEU 179 N 0.14 0.45 -3.66 -1.29 7.94 -0.86 -2.68 117.00 117.05 1nfd n LEU 179 Ca -0.17 -3.43 -0.52 0.00 -1.11 0.00 0.00 56.01 50.78 1nfd n LEU 179 Cb 0.62 0.32 -0.09 0.00 0.53 0.00 0.00 43.42 44.80 1nfd n LEU 179 CO 0.20 1.52 1.13 -1.20 -1.11 0.00 0.00 177.39 177.93 1nfd n SER 180 N -0.48 0.82 -4.20 1.96 7.64 -0.78 -3.95 113.62 114.63 1nfd n SER 180 Ca 0.03 0.79 -0.12 0.00 1.01 0.00 0.00 58.87 60.57 1nfd n SER 180 Cb 0.83 -0.72 -0.10 0.00 -1.01 0.00 0.00 64.21 63.21 1nfd n SER 180 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1nfd s LEU 181 N 3.45 2.51 0.02 -3.43 2.96 -0.20 -4.64 118.68 119.34 1nfd s LEU 181 Ca 0.90 -0.99 -0.26 0.00 -0.22 0.00 0.00 54.13 53.56 1nfd s LEU 181 Cb -1.21 -0.19 -0.05 0.00 0.50 0.00 0.00 46.19 45.24 1nfd s LEU 181 CO 0.61 -0.40 0.81 0.42 -1.32 0.00 0.00 176.35 176.47 1nfd s THR 182 N -3.38 4.81 0.44 3.68 -4.23 -1.26 0.24 115.64 115.93 1nfd s THR 182 Ca 0.13 1.72 0.33 0.00 -1.18 0.00 0.00 61.69 62.69 1nfd s THR 182 Cb 0.03 -4.16 0.51 0.00 1.34 0.00 0.00 72.50 70.23 1nfd s THR 182 CO -0.02 0.29 1.51 0.00 -0.54 0.00 0.00 174.62 175.86 1nfd n ALA 183 N 3.25 1.38 -0.04 3.99 0.00 -1.20 0.11 120.51 128.00 1nfd n ALA 183 Ca -0.00 0.82 -0.15 0.00 0.00 0.00 0.00 53.44 54.10 1nfd n ALA 183 Cb 0.50 -1.04 -0.08 0.00 0.00 0.00 0.00 19.45 18.84 1nfd n ALA 183 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1nfd h ASP 184 N 0.00 0.64 -0.60 0.00 5.19 -1.91 0.69 116.42 120.42 1nfd h ASP 184 Ca 0.86 -0.61 -0.06 0.00 -0.62 0.00 0.00 57.03 56.60 1nfd h ASP 184 Cb 2.85 -0.19 -0.03 0.00 0.18 0.00 0.00 39.33 42.15 1nfd h ASP 184 CO -0.40 1.14 0.15 1.56 -3.12 0.00 0.00 179.24 178.56 1nfd h GLN 185 N 0.17 0.99 0.34 3.56 4.20 0.42 -0.81 115.11 123.99 1nfd h GLN 185 Ca -0.02 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.45 1nfd h GLN 185 Cb 1.09 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.72 1nfd h GLN 185 CO 0.10 0.89 -0.32 2.35 -0.67 0.00 0.00 178.83 181.17 1nfd h TRP 186 N 0.95 -0.88 -0.73 2.96 -0.00 -0.10 -2.60 115.95 115.55 1nfd h TRP 186 Ca 0.20 0.00 0.13 0.00 -0.00 0.00 0.00 58.89 59.23 1nfd h TRP 186 Cb 0.34 0.34 -0.09 0.00 -0.00 0.00 0.00 29.16 29.75 1nfd h TRP 186 CO 0.02 -0.43 0.28 0.87 -0.00 0.00 0.00 178.44 179.19 1nfd h LYS 187 N -0.65 0.43 -1.15 2.65 1.57 -0.74 -0.38 116.57 118.29 1nfd h LYS 187 Ca -0.04 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1nfd h LYS 187 Cb 0.56 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1nfd h LYS 187 CO -0.03 0.28 0.00 0.43 -0.57 0.00 0.00 179.45 179.56 1nfd n SER 188 N -5.00 3.12 -4.11 0.86 7.64 -0.32 -4.76 113.62 111.06 1nfd n SER 188 Ca 0.13 -1.96 -0.32 0.00 1.01 0.00 0.00 58.87 57.73 1nfd n SER 188 Cb 0.38 -0.55 -0.16 0.00 -1.01 0.00 0.00 64.21 62.88 1nfd n SER 188 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1nfd s HIS 189 N 0.05 2.62 0.01 1.43 3.76 -0.15 -4.96 115.29 118.05 1nfd s HIS 189 Ca 0.00 -1.50 -0.06 0.00 -0.15 0.00 0.00 55.06 53.35 1nfd s HIS 189 Cb 0.00 -1.83 -0.29 0.00 1.11 0.00 0.00 32.58 31.57 1nfd s HIS 189 CO 0.00 -0.74 0.88 -0.91 -0.85 0.00 0.00 174.74 173.11 1nfd h ASN 190 N 7.84 0.50 -2.30 1.40 2.35 -1.86 -3.45 115.58 120.05 1nfd h ASN 190 Ca -0.42 -0.65 -0.36 0.00 -0.55 0.00 0.00 56.30 54.32 1nfd h ASN 190 Cb 1.15 -0.16 -0.35 0.00 0.05 0.00 0.00 38.32 39.01 1nfd h ASN 190 CO 0.60 1.53 -0.66 -0.13 -1.65 0.00 0.00 177.43 177.13 1nfd s ARG 191 N -2.61 0.28 -0.33 0.81 0.52 -1.26 -3.50 118.95 112.86 1nfd s ARG 191 Ca -0.10 -0.15 -0.13 0.00 -0.52 0.00 0.00 55.73 54.84 1nfd s ARG 191 Cb 0.06 -0.81 -0.02 0.00 0.52 0.00 0.00 34.95 34.69 1nfd s ARG 191 CO 0.87 -0.97 0.23 0.08 0.02 0.00 0.00 175.30 175.53 1nfd s VAL 192 N 2.32 5.29 0.16 3.52 1.01 -1.15 -3.16 120.40 128.38 1nfd s VAL 192 Ca 0.09 -0.12 0.10 0.00 0.00 0.00 0.00 61.98 62.05 1nfd s VAL 192 Cb -0.14 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1nfd s VAL 192 CO -0.31 0.05 -0.19 -0.55 0.00 0.00 0.00 175.10 174.10 1nfd s SER 193 N 1.73 3.75 -0.23 3.32 0.15 0.12 -1.93 113.70 120.60 1nfd s SER 193 Ca 0.07 -0.70 -0.01 0.00 0.70 0.00 0.00 55.95 56.00 1nfd s SER 193 Cb -0.17 -0.44 0.07 0.00 -1.71 0.00 0.00 66.02 63.76 1nfd s SER 193 CO 0.11 0.14 0.01 0.00 1.20 0.00 0.00 173.24 174.70 1nfd s GLN 195 N 1.64 3.34 -0.21 0.00 -0.21 -0.03 -2.78 119.66 121.42 1nfd s GLN 195 Ca -0.01 -0.65 -0.11 0.00 0.02 0.00 0.00 55.36 54.62 1nfd s GLN 195 Cb -0.18 -3.01 -0.05 0.00 1.00 0.00 0.00 33.01 30.77 1nfd s GLN 195 CO -0.10 -0.21 0.16 0.08 -2.12 0.00 0.00 175.29 173.10 1nfd s VAL 196 N 1.47 5.38 -0.75 1.09 1.01 -1.26 -1.52 120.40 125.83 1nfd s VAL 196 Ca 0.06 0.23 -0.05 0.00 0.00 0.00 0.00 61.98 62.22 1nfd s VAL 196 Cb -0.14 -3.50 0.19 0.00 0.00 0.00 0.00 36.38 32.93 1nfd s VAL 196 CO -0.03 0.41 0.60 -0.89 0.00 0.00 0.00 175.10 175.19 1nfd s THR 197 N 0.58 4.27 0.58 3.92 2.01 -0.87 -1.89 115.64 124.24 1nfd s THR 197 Ca 0.09 -3.14 -0.20 0.00 0.31 0.00 0.00 61.69 58.75 1nfd s THR 197 Cb -0.12 -3.71 -0.04 0.00 0.01 0.00 0.00 72.50 68.65 1nfd s THR 197 CO 0.00 -0.97 1.25 -2.28 -0.69 0.00 0.00 174.62 171.94 1nfd s HIS 198 N -0.41 2.36 0.79 4.92 2.46 -1.25 -3.74 115.29 120.42 1nfd s HIS 198 Ca 0.20 1.48 -0.12 0.00 0.47 0.00 0.00 55.06 57.10 1nfd s HIS 198 Cb -0.15 -3.58 0.07 0.00 -0.13 0.00 0.00 32.58 28.80 1nfd s HIS 198 CO -0.07 -2.42 1.13 -1.83 -2.47 0.00 0.00 174.74 169.08 1nfd s GLU 199 N -3.20 1.93 0.00 2.88 -1.05 -1.23 -2.91 118.70 115.13 1nfd s GLU 199 Ca 0.76 1.40 0.00 0.00 -0.15 0.00 0.00 54.97 56.98 1nfd s GLU 199 Cb -0.34 -1.84 0.00 0.00 -0.44 0.00 0.00 34.13 31.51 1nfd s GLU 199 CO 0.37 -1.92 0.00 0.41 0.95 0.00 0.00 175.26 175.07 1nfd n GLY 200 N -0.45 2.71 2.94 -3.83 0.00 -1.26 -4.87 105.19 100.42 1nfd n GLY 200 Ca 0.11 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.02 1nfd n GLY 200 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nfd s GLU 203 N -0.02 0.20 0.00 1.61 2.02 -1.14 -4.98 118.70 116.39 1nfd s GLU 203 Ca 0.00 -0.34 0.00 0.00 0.02 0.00 0.00 54.97 54.65 1nfd s GLU 203 Cb 0.00 0.01 0.00 0.00 0.10 0.00 0.00 34.13 34.24 1nfd s GLU 203 CO 0.00 -0.01 0.29 2.41 0.02 0.00 0.00 175.26 177.97 1nfd n THR 204 N 2.29 0.17 -0.44 3.63 -1.04 -1.26 -4.13 114.28 113.50 1nfd n THR 204 Ca -0.18 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.66 1nfd n THR 204 Cb 0.57 -0.41 -0.02 0.00 -1.82 0.00 0.00 70.33 68.65 1nfd n THR 204 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1nfd n VAL 205 N 0.51 0.00 -3.32 12.58 0.31 -1.25 -4.86 118.33 122.30 1nfd n VAL 205 Ca 0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 64.08 1nfd n VAL 205 Cb 0.14 -0.02 -0.08 0.00 -0.91 0.00 0.00 33.84 32.98 1nfd n VAL 205 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 1nfd n GLU 206 N 0.51 1.13 -0.07 5.55 0.28 -1.23 -3.36 120.64 123.45 1nfd n GLU 206 Ca 0.06 -3.63 -0.06 0.00 -0.16 0.00 0.00 57.16 53.37 1nfd n GLU 206 Cb 0.02 -1.59 -0.02 0.00 1.43 0.00 0.00 31.44 31.28 1nfd n GLU 206 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1nfd n LYS 207 N 1.51 0.00 -0.39 3.44 4.01 -0.79 -4.66 118.16 121.28 1nfd n LYS 207 Ca 0.24 -0.56 0.00 0.00 -0.51 0.00 0.00 58.31 57.48 1nfd n LYS 207 Cb 0.48 -2.06 0.00 0.00 -0.51 0.00 0.00 35.03 32.95 1nfd n LYS 207 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 1nfd n SER 208 N 5.51 0.00 -3.96 4.39 7.64 -1.26 -4.25 113.62 121.69 1nfd n SER 208 Ca 0.06 -0.59 -0.40 0.00 1.01 0.00 0.00 58.87 58.95 1nfd n SER 208 Cb 0.06 -0.05 -0.04 0.00 -1.01 0.00 0.00 64.21 63.17 1nfd n SER 208 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1nfd n LEU 209 N 2.62 4.50 -4.57 -3.43 7.94 -1.12 -4.85 117.00 118.10 1nfd n LEU 209 Ca 0.00 -3.31 -0.41 0.00 -1.11 0.00 0.00 56.01 51.18 1nfd n LEU 209 Cb 0.00 -1.43 -0.02 0.00 0.53 0.00 0.00 43.42 42.50 1nfd n LEU 209 CO 0.05 -0.34 1.62 -0.55 -1.11 0.00 0.00 177.39 177.05 1nfd s SER 210 N 4.89 6.50 -1.08 1.96 0.15 -1.26 -2.24 113.70 122.62 1nfd s SER 210 Ca 0.57 -1.70 -0.25 0.00 0.70 0.00 0.00 55.95 55.27 1nfd s SER 210 Cb 0.10 -2.57 -0.15 0.00 -1.71 0.00 0.00 66.02 61.69 1nfd s SER 210 CO 0.08 -1.51 2.06 -2.84 1.20 0.00 0.00 173.24 172.23 1nfd s PRO 211 N 4.90 1.82 0.00 5.44 0.02 -0.81 -4.91 135.00 141.45 1nfd s PRO 211 Ca 0.50 -0.61 0.00 0.00 0.02 0.00 0.00 61.00 60.91 1nfd s PRO 211 Cb 0.01 -5.07 0.00 0.00 0.02 0.00 0.00 34.50 29.46 1nfd s PRO 211 CO -0.04 -4.66 0.00 0.00 -0.33 0.00 0.00 177.00 171.97 1nfd n ALA 212 N 17.14 0.00 -2.71 -1.55 0.00 -1.26 -2.95 120.51 129.18 1nfd n ALA 212 Ca 0.43 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.61 1nfd n ALA 212 Cb 0.46 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.90 1nfd n ALA 212 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1nfd n GLU 213 N 0.00 3.25 -1.83 0.00 4.07 -1.23 -4.51 120.64 120.40 1nfd n GLU 213 Ca 0.00 -4.63 -0.35 0.00 -0.06 0.00 0.00 57.16 52.12 1nfd n GLU 213 Cb 0.00 -2.21 0.05 0.00 -0.06 0.00 0.00 31.44 29.22 1nfd n GLU 213 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07