#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rfd s ILE 2 N 0.00 4.54 -0.20 0.53 1.01 -1.26 -5.01 121.20 120.81 1rfd s ILE 2 Ca 0.00 1.95 -0.13 0.00 0.00 0.00 0.00 60.65 62.47 1rfd s ILE 2 Cb 0.00 -4.25 -0.04 0.00 0.01 0.00 0.00 42.46 38.18 1rfd s ILE 2 CO 0.00 0.22 0.29 -0.69 0.00 0.00 0.00 174.94 174.76 1rfd s VAL 3 N 0.52 5.29 -0.24 2.92 1.01 -1.26 -4.80 120.40 123.84 1rfd s VAL 3 Ca 0.51 0.49 -0.07 0.00 0.00 0.00 0.00 61.98 62.90 1rfd s VAL 3 Cb -0.24 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 1rfd s VAL 3 CO 0.29 0.33 0.07 -0.04 0.00 0.00 0.00 175.10 175.76 1rfd s MET 4 N 0.92 3.69 -0.17 2.72 -1.94 -1.26 -0.53 119.30 122.73 1rfd s MET 4 Ca 0.15 -0.46 -0.02 0.00 -1.71 0.00 0.00 55.69 53.65 1rfd s MET 4 Cb -0.14 -3.32 -0.01 0.00 2.01 0.00 0.00 34.83 33.38 1rfd s MET 4 CO 0.05 -0.14 -0.10 0.99 -0.01 0.00 0.00 175.02 175.81 1rfd s THR 5 N 1.49 3.14 -0.43 2.05 2.01 0.12 -4.22 115.64 119.80 1rfd s THR 5 Ca 0.06 -0.60 0.04 0.00 0.31 0.00 0.00 61.69 61.49 1rfd s THR 5 Cb -0.15 -2.36 0.12 0.00 0.01 0.00 0.00 72.50 70.11 1rfd s THR 5 CO 0.04 0.49 0.16 -1.10 -0.69 0.00 0.00 174.62 173.52 1rfd s GLN 6 N 0.81 1.66 0.14 4.92 -0.21 -1.26 -1.11 119.66 124.62 1rfd s GLN 6 Ca -0.03 -2.19 -0.26 0.00 0.02 0.00 0.00 55.36 52.89 1rfd s GLN 6 Cb -0.15 -3.15 -0.01 0.00 1.00 0.00 0.00 33.01 30.70 1rfd s GLN 6 CO 0.01 -1.03 1.59 0.00 -2.12 0.00 0.00 175.29 173.74 1rfd h ALA 7 N 7.07 -0.40 -2.27 6.09 0.00 -1.93 -3.41 119.26 124.42 1rfd h ALA 7 Ca -0.06 0.04 -0.55 0.00 0.00 0.00 0.00 54.91 54.34 1rfd h ALA 7 Cb 0.95 0.73 -0.02 0.00 0.00 0.00 0.00 17.79 19.46 1rfd h ALA 7 CO 0.59 -0.83 0.91 0.00 0.00 0.00 0.00 179.25 179.93 1rfd s ALA 8 N -5.94 3.61 -0.45 0.00 0.00 -1.26 -4.89 121.76 112.82 1rfd s ALA 8 Ca -0.15 0.74 0.26 0.00 0.00 0.00 0.00 51.96 52.81 1rfd s ALA 8 Cb 0.11 -3.64 0.81 0.00 0.00 0.00 0.00 23.12 20.40 1rfd s ALA 8 CO 0.66 -1.11 1.75 -1.00 0.00 0.00 0.00 175.76 176.06 1rfd h PRO 9 N 8.36 0.00 -2.53 0.00 0.13 -1.81 -3.39 132.00 132.77 1rfd h PRO 9 Ca -0.34 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 64.86 1rfd h PRO 9 Cb 1.15 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.14 1rfd h PRO 9 CO 0.94 0.00 0.40 -1.54 -0.23 0.00 0.00 178.00 177.56 1rfd s SER 10 N -5.17 -0.43 -0.05 1.44 1.04 -1.26 -1.36 113.70 107.91 1rfd s SER 10 Ca 0.07 -0.02 -0.02 0.00 0.48 0.00 0.00 55.95 56.45 1rfd s SER 10 Cb 0.09 0.46 0.04 0.00 0.10 0.00 0.00 66.02 66.71 1rfd s SER 10 CO 0.57 -0.75 0.10 0.54 0.98 0.00 0.00 173.24 174.68 1rfd s VAL 11 N -3.34 -0.13 0.21 5.02 0.11 0.36 -4.86 120.40 117.76 1rfd s VAL 11 Ca 0.04 0.31 -0.29 0.00 -2.93 0.00 0.00 61.98 59.11 1rfd s VAL 11 Cb -0.01 -0.20 -0.08 0.00 -1.53 0.00 0.00 36.38 34.56 1rfd s VAL 11 CO -0.10 0.13 0.92 -2.16 -3.33 0.00 0.00 175.10 170.56 1rfd s PRO 12 N 1.76 4.79 -0.02 1.54 0.04 -1.26 -1.12 135.00 140.74 1rfd s PRO 12 Ca -0.02 1.44 -0.17 0.00 0.04 0.00 0.00 61.00 62.29 1rfd s PRO 12 Cb -0.12 -3.30 0.03 0.00 0.04 0.00 0.00 34.50 31.15 1rfd s PRO 12 CO -0.04 0.47 0.37 0.14 0.04 0.00 0.00 177.00 177.98 1rfd s VAL 13 N -0.96 0.05 -0.10 -0.36 -7.23 0.52 -4.92 120.40 107.39 1rfd s VAL 13 Ca 0.41 -0.39 -0.13 0.00 -1.81 0.00 0.00 61.98 60.07 1rfd s VAL 13 Cb -0.25 -0.67 -0.05 0.00 0.56 0.00 0.00 36.38 35.97 1rfd s VAL 13 CO 0.31 -0.21 0.29 -0.89 -0.31 0.00 0.00 175.10 174.29 1rfd s THR 14 N -1.27 5.27 0.24 5.32 2.01 -1.26 -0.39 115.64 125.56 1rfd s THR 14 Ca -0.13 0.56 -0.31 0.00 0.31 0.00 0.00 61.69 62.12 1rfd s THR 14 Cb -0.04 -3.60 -0.13 0.00 0.01 0.00 0.00 72.50 68.73 1rfd s THR 14 CO 0.05 0.50 1.46 -2.65 -0.69 0.00 0.00 174.62 173.29 1rfd n PRO 15 N 2.67 2.15 0.00 4.92 -0.02 -1.26 -2.07 135.00 141.39 1rfd n PRO 15 Ca -0.14 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1rfd n PRO 15 Cb 0.53 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1rfd n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rfd n GLY 16 N 2.31 3.24 3.97 -1.23 0.00 0.12 -4.92 105.19 108.68 1rfd n GLY 16 Ca 0.12 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 1rfd n GLY 16 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1rfd s GLU 17 N -0.79 3.31 0.33 1.61 -1.05 -0.88 -4.52 118.70 116.71 1rfd s GLU 17 Ca 0.00 -0.73 -0.19 0.00 -0.15 0.00 0.00 54.97 53.90 1rfd s GLU 17 Cb 0.00 -2.79 -0.09 0.00 -0.44 0.00 0.00 34.13 30.81 1rfd s GLU 17 CO 0.00 0.19 0.81 -1.54 0.95 0.00 0.00 175.26 175.67 1rfd s SER 18 N -4.08 6.95 0.08 0.83 1.04 -1.23 -1.36 113.70 115.93 1rfd s SER 18 Ca 0.40 1.48 -0.14 0.00 0.48 0.00 0.00 55.95 58.17 1rfd s SER 18 Cb -0.09 -2.45 0.02 0.00 0.10 0.00 0.00 66.02 63.60 1rfd s SER 18 CO 0.32 -0.17 0.33 0.54 0.98 0.00 0.00 173.24 175.24 1rfd s VAL 19 N -1.88 0.09 0.03 5.02 0.11 -0.57 -4.98 120.40 118.21 1rfd s VAL 19 Ca 0.53 -0.71 0.02 0.00 -2.93 0.00 0.00 61.98 58.89 1rfd s VAL 19 Cb -0.12 -1.10 -0.02 0.00 -1.53 0.00 0.00 36.38 33.61 1rfd s VAL 19 CO 0.18 -0.39 -0.06 -0.94 -3.33 0.00 0.00 175.10 170.56 1rfd s SER 20 N -2.46 0.66 -0.02 3.54 1.04 -1.26 -0.13 113.70 115.07 1rfd s SER 20 Ca -0.00 -0.45 0.06 0.00 0.48 0.00 0.00 55.95 56.04 1rfd s SER 20 Cb 0.01 0.03 -0.01 0.00 0.10 0.00 0.00 66.02 66.15 1rfd s SER 20 CO -0.08 -0.18 -0.21 -0.63 0.98 0.00 0.00 173.24 173.12 1rfd s ILE 21 N -1.16 1.70 0.27 -1.02 1.01 0.10 -4.97 121.20 117.13 1rfd s ILE 21 Ca -0.09 -0.91 0.09 0.00 0.00 0.00 0.00 60.65 59.74 1rfd s ILE 21 Cb -0.08 -1.42 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 1rfd s ILE 21 CO 0.00 0.48 0.01 -0.94 0.00 0.00 0.00 174.94 174.49 1rfd s SER 22 N -0.40 4.61 -0.06 3.58 1.04 -1.26 -0.28 113.70 120.92 1rfd s SER 22 Ca 0.06 -0.62 -0.17 0.00 0.48 0.00 0.00 55.95 55.69 1rfd s SER 22 Cb -0.09 -0.88 0.04 0.00 0.10 0.00 0.00 66.02 65.18 1rfd s SER 22 CO -0.00 -0.01 0.40 0.00 0.98 0.00 0.00 173.24 174.61 1rfd s ARG 24 N -0.87 0.50 0.17 0.00 1.70 -0.26 -0.40 118.95 119.79 1rfd s ARG 24 Ca -0.09 -0.84 0.09 0.00 -0.47 0.00 0.00 55.73 54.41 1rfd s ARG 24 Cb -0.04 -0.08 -0.04 0.00 -0.57 0.00 0.00 34.95 34.22 1rfd s ARG 24 CO 0.04 -0.01 -0.09 -1.54 -1.08 0.00 0.00 175.30 172.62 1rfd s SER 25 N -1.90 4.28 0.00 -2.89 1.04 -0.63 0.14 113.70 113.74 1rfd s SER 25 Ca -0.07 -0.56 0.27 0.00 0.48 0.00 0.00 55.95 56.08 1rfd s SER 25 Cb -0.06 -0.74 1.31 0.00 0.10 0.00 0.00 66.02 66.63 1rfd s SER 25 CO -0.02 0.11 1.92 -1.54 0.98 0.00 0.00 173.24 174.69 1rfd n SER 26 N 0.10 0.00 -3.87 7.02 3.41 0.31 -4.81 113.62 115.77 1rfd n SER 26 Ca -0.11 0.09 -0.11 0.00 -0.26 0.00 0.00 58.87 58.49 1rfd n SER 26 Cb 0.55 -0.36 -0.09 0.00 -0.26 0.00 0.00 64.21 64.05 1rfd n SER 26 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1rfd s LYS 27 N -2.71 0.58 0.00 4.33 2.20 -1.26 -4.94 119.74 117.93 1rfd s LYS 27 Ca 0.22 -0.55 0.00 0.00 -0.36 0.00 0.00 55.97 55.28 1rfd s LYS 27 Cb 0.18 0.24 0.00 0.00 -1.51 0.00 0.00 37.83 36.74 1rfd s LYS 27 CO 0.44 -0.15 0.00 0.45 -0.36 0.00 0.00 175.35 175.73 1rfd n SER 27 N 1.05 -0.06 -0.72 1.43 2.88 -1.26 -4.65 113.62 112.28 1rfd n SER 27 Ca -0.21 -0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.33 1rfd n SER 27 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 1rfd n SER 27 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1rfd n LEU 27 N 0.00 -3.60 -4.94 2.46 7.94 -1.26 -5.00 117.00 112.59 1rfd n LEU 27 Ca 0.00 1.19 -0.24 0.00 -1.11 0.00 0.00 56.01 55.85 1rfd n LEU 27 Cb 0.00 -0.65 0.01 0.00 0.53 0.00 0.00 43.42 43.30 1rfd n LEU 27 CO 0.00 -0.28 0.29 -2.28 -1.11 0.00 0.00 177.39 174.01 1rfd s HIS 27 N -1.23 3.32 0.35 1.96 5.65 0.74 -4.99 115.29 121.08 1rfd s HIS 27 Ca 0.00 0.33 0.08 0.00 0.25 0.00 0.00 55.06 55.72 1rfd s HIS 27 Cb 0.00 -2.24 0.78 0.00 -1.18 0.00 0.00 32.58 29.94 1rfd s HIS 27 CO 0.00 -0.27 1.88 0.77 -0.65 0.00 0.00 174.74 176.47 1rfd h SER 27 N 0.43 0.69 0.00 9.88 0.02 -2.02 -1.77 113.55 120.78 1rfd h SER 27 Ca -0.47 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 1rfd h SER 27 Cb 1.24 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.68 1rfd h SER 27 CO 0.59 0.36 0.00 -0.46 -1.14 0.00 0.00 176.83 176.18 1rfd n ASN 28 N -4.56 0.07 0.00 3.07 0.23 -1.26 -4.87 115.26 107.95 1rfd n ASN 28 Ca 0.17 -1.70 0.00 0.00 -0.53 0.00 0.00 54.58 52.52 1rfd n ASN 28 Cb 0.43 -0.04 0.00 0.00 -2.08 0.00 0.00 39.78 38.09 1rfd n ASN 28 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1rfd n GLY 29 N 0.33 1.61 3.89 4.83 0.00 -0.67 -5.05 105.19 110.14 1rfd n GLY 29 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1rfd n GLY 29 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1rfd s TYR 30 N -2.77 3.47 -0.35 1.61 4.12 -1.26 -4.84 117.35 117.33 1rfd s TYR 30 Ca 0.00 0.59 -0.08 0.00 0.02 0.00 0.00 57.07 57.60 1rfd s TYR 30 Cb 0.00 -2.04 0.03 0.00 -1.52 0.00 0.00 41.96 38.44 1rfd s TYR 30 CO 0.00 0.41 0.14 0.99 0.02 0.00 0.00 175.55 177.12 1rfd s THR 31 N -1.68 4.08 -1.25 -0.71 2.01 -1.26 -0.19 115.64 116.64 1rfd s THR 31 Ca 0.42 -1.02 -0.13 0.00 0.31 0.00 0.00 61.69 61.27 1rfd s THR 31 Cb -0.12 -3.30 0.15 0.00 0.01 0.00 0.00 72.50 69.25 1rfd s THR 31 CO 0.24 -0.20 1.63 -1.22 -0.69 0.00 0.00 174.62 174.39 1rfd n TYR 32 N 4.88 4.28 -4.31 4.92 4.02 -1.26 -4.22 117.16 125.47 1rfd n TYR 32 Ca -0.12 -3.12 -0.25 0.00 -0.01 0.00 0.00 57.90 54.40 1rfd n TYR 32 Cb 0.45 -2.18 -0.17 0.00 -0.02 0.00 0.00 39.34 37.43 1rfd n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1rfd s LEU 33 N 1.34 1.45 0.19 7.72 2.96 -1.26 -1.34 118.68 129.74 1rfd s LEU 33 Ca 0.43 -0.27 0.08 0.00 -0.22 0.00 0.00 54.13 54.15 1rfd s LEU 33 Cb 0.02 -0.78 -0.04 0.00 0.50 0.00 0.00 46.19 45.89 1rfd s LEU 33 CO 0.01 -0.03 -0.17 -1.00 -1.32 0.00 0.00 176.35 173.84 1rfd s HIS 34 N 1.04 1.81 -0.05 5.38 3.76 -0.50 -0.72 115.29 126.01 1rfd s HIS 34 Ca -0.08 -0.50 0.06 0.00 -0.15 0.00 0.00 55.06 54.39 1rfd s HIS 34 Cb -0.15 -0.86 -0.01 0.00 1.11 0.00 0.00 32.58 32.67 1rfd s HIS 34 CO -0.01 0.37 -0.24 -1.58 -0.85 0.00 0.00 174.74 172.44 1rfd s TRP 35 N -2.46 2.46 0.16 1.40 0.52 -0.14 -0.53 118.94 120.35 1rfd s TRP 35 Ca 0.19 -0.61 0.08 0.00 0.02 0.00 0.00 56.10 55.79 1rfd s TRP 35 Cb -0.04 -1.59 -0.04 0.00 -1.15 0.00 0.00 33.47 30.65 1rfd s TRP 35 CO 0.07 -0.14 -0.18 -0.06 0.02 0.00 0.00 176.95 176.67 1rfd s PHE 36 N -0.28 1.76 -0.08 -1.98 0.40 0.10 -1.23 117.98 116.66 1rfd s PHE 36 Ca 0.00 -0.48 0.04 0.00 -0.60 0.00 0.00 56.93 55.89 1rfd s PHE 36 Cb -0.13 -0.88 -0.01 0.00 0.51 0.00 0.00 43.02 42.51 1rfd s PHE 36 CO 0.03 0.30 -0.20 -1.17 0.70 0.00 0.00 175.22 174.88 1rfd s LEU 37 N -2.65 2.36 -0.28 -0.37 2.96 0.23 -0.47 118.68 120.46 1rfd s LEU 37 Ca 0.15 -0.41 0.01 0.00 -0.22 0.00 0.00 54.13 53.66 1rfd s LEU 37 Cb -0.05 -1.47 0.08 0.00 0.50 0.00 0.00 46.19 45.24 1rfd s LEU 37 CO 0.06 0.23 0.01 -1.58 -1.32 0.00 0.00 176.35 173.75 1rfd s GLN 38 N -0.05 1.40 0.69 1.98 0.74 0.39 -0.40 119.66 124.42 1rfd s GLN 38 Ca -0.05 -1.29 -0.11 0.00 0.05 0.00 0.00 55.36 53.96 1rfd s GLN 38 Cb -0.14 -2.65 0.01 0.00 1.10 0.00 0.00 33.01 31.32 1rfd s GLN 38 CO 0.04 -0.79 1.06 1.03 -0.55 0.00 0.00 175.29 176.09 1rfd s ARG 39 N 1.28 2.96 -0.09 1.67 0.52 -1.26 -1.55 118.95 122.48 1rfd s ARG 39 Ca 0.02 0.97 -0.37 0.00 -0.52 0.00 0.00 55.73 55.84 1rfd s ARG 39 Cb -0.19 -1.99 -0.14 0.00 0.52 0.00 0.00 34.95 33.15 1rfd s ARG 39 CO -0.11 -1.08 1.68 -2.30 0.02 0.00 0.00 175.30 173.51 1rfd n PRO 40 N -3.06 1.59 -1.29 3.54 -0.02 -1.26 -1.85 135.00 132.65 1rfd n PRO 40 Ca 0.08 0.58 -0.10 0.00 -2.02 0.00 0.00 63.50 62.04 1rfd n PRO 40 Cb 0.53 -2.31 -0.04 0.00 -0.02 0.00 0.00 33.50 31.66 1rfd n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rfd n GLY 41 N 3.82 1.07 3.68 -1.23 0.00 -1.26 -5.00 105.19 106.27 1rfd n GLY 41 Ca 0.22 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 1rfd n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rfd s GLN 42 N -2.64 2.05 0.61 1.61 -0.21 -0.77 -5.13 119.66 115.18 1rfd s GLN 42 Ca 0.00 -2.22 -0.10 0.00 0.02 0.00 0.00 55.36 53.06 1rfd s GLN 42 Cb 0.00 -1.60 -0.03 0.00 1.00 0.00 0.00 33.01 32.38 1rfd s GLN 42 CO 0.00 -0.17 0.99 -1.54 -2.12 0.00 0.00 175.29 172.44 1rfd s SER 43 N -3.78 6.04 0.82 5.90 1.04 -1.26 -4.63 113.70 117.83 1rfd s SER 43 Ca 0.24 1.22 -0.12 0.00 0.48 0.00 0.00 55.95 57.77 1rfd s SER 43 Cb 0.07 -2.27 0.09 0.00 0.10 0.00 0.00 66.02 64.01 1rfd s SER 43 CO 0.12 -0.92 1.15 -2.84 0.98 0.00 0.00 173.24 171.73 1rfd s PRO 44 N -5.12 1.66 -0.04 4.02 0.02 -1.26 -4.53 135.00 129.76 1rfd s PRO 44 Ca 0.54 1.52 -0.04 0.00 0.02 0.00 0.00 61.00 63.04 1rfd s PRO 44 Cb -0.11 -1.80 0.01 0.00 0.02 0.00 0.00 34.50 32.62 1rfd s PRO 44 CO 0.51 -2.15 0.11 1.14 -0.33 0.00 0.00 177.00 176.28 1rfd s GLN 45 N -4.49 0.14 0.24 5.54 -2.07 0.47 -4.96 119.66 114.53 1rfd s GLN 45 Ca 0.68 0.13 -0.30 0.00 -1.82 0.00 0.00 55.36 54.05 1rfd s GLN 45 Cb -0.23 0.07 -0.10 0.00 -1.09 0.00 0.00 33.01 31.66 1rfd s GLN 45 CO 0.53 -0.02 1.43 -1.17 -1.32 0.00 0.00 175.29 174.75 1rfd s LEU 46 N 0.01 4.39 -0.05 2.60 2.96 -1.26 -0.60 118.68 126.73 1rfd s LEU 46 Ca -0.00 2.63 -0.04 0.00 -0.22 0.00 0.00 54.13 56.50 1rfd s LEU 46 Cb -0.01 -3.62 -0.03 0.00 0.50 0.00 0.00 46.19 43.03 1rfd s LEU 46 CO 0.00 -0.69 -0.09 0.18 -1.32 0.00 0.00 176.35 174.43 1rfd n LEU 47 N 2.42 0.67 -3.83 -0.68 4.77 -0.37 -4.76 117.00 115.22 1rfd n LEU 47 Ca 0.07 0.11 -0.16 0.00 -0.03 0.00 0.00 56.01 56.00 1rfd n LEU 47 Cb 0.40 -0.26 -0.16 0.00 -2.33 0.00 0.00 43.42 41.08 1rfd n LEU 47 CO 0.60 -0.00 -0.37 -0.63 -1.33 0.00 0.00 177.39 175.66 1rfd s ILE 48 N -2.15 0.12 0.10 -0.08 1.01 -1.06 -1.28 121.20 117.86 1rfd s ILE 48 Ca -0.10 0.08 0.06 0.00 0.00 0.00 0.00 60.65 60.69 1rfd s ILE 48 Cb 0.03 -0.20 -0.04 0.00 0.01 0.00 0.00 42.46 42.26 1rfd s ILE 48 CO 0.12 0.11 -0.06 -0.72 0.00 0.00 0.00 174.94 174.39 1rfd s TYR 49 N 0.79 2.83 -1.20 3.97 1.13 0.23 -0.96 117.35 124.14 1rfd s TYR 49 Ca -0.08 -0.11 -0.16 0.00 -1.41 0.00 0.00 57.07 55.31 1rfd s TYR 49 Cb -0.11 -1.47 -0.00 0.00 -1.10 0.00 0.00 41.96 39.28 1rfd s TYR 49 CO -0.02 0.45 0.71 0.54 -2.51 0.00 0.00 175.55 174.73 1rfd n ARG 50 N 0.62 -1.78 0.00 -3.49 1.74 -0.73 -2.00 116.66 111.02 1rfd n ARG 50 Ca -0.12 0.44 0.00 0.00 -0.77 0.00 0.00 57.85 57.40 1rfd n ARG 50 Cb 0.52 -4.20 0.00 0.00 -1.02 0.00 0.00 32.46 27.77 1rfd n ARG 50 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1rfd n VAL 51 N -4.27 0.00 -1.39 1.55 0.31 0.10 -4.12 118.33 110.51 1rfd n VAL 51 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1rfd n VAL 51 Cb 0.61 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.54 1rfd n VAL 51 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1rfd n SER 52 N 1.35 0.00 -4.57 4.52 3.41 -1.23 -3.36 113.62 113.74 1rfd n SER 52 Ca 0.00 -1.28 -0.40 0.00 -0.26 0.00 0.00 58.87 56.93 1rfd n SER 52 Cb 0.00 -0.06 -0.10 0.00 -0.26 0.00 0.00 64.21 63.79 1rfd n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1rfd s ASN 53 N -0.28 6.14 0.14 4.04 0.01 -0.85 -4.62 114.94 119.52 1rfd s ASN 53 Ca 0.00 -0.09 -0.30 0.00 -0.71 0.00 0.00 52.86 51.75 1rfd s ASN 53 Cb 0.00 -2.17 -0.07 0.00 0.41 0.00 0.00 41.25 39.41 1rfd s ASN 53 CO 0.00 -0.22 1.24 -0.76 -1.51 0.00 0.00 177.10 175.85 1rfd s LEU 54 N 1.92 4.41 0.87 0.60 1.02 -1.26 -0.60 118.68 125.64 1rfd s LEU 54 Ca 0.10 2.21 -0.12 0.00 0.02 0.00 0.00 54.13 56.35 1rfd s LEU 54 Cb -0.16 -3.60 0.11 0.00 0.02 0.00 0.00 46.19 42.56 1rfd s LEU 54 CO 0.11 -0.46 1.10 0.00 0.02 0.00 0.00 176.35 177.11 1rfd s ALA 55 N 0.45 1.75 0.41 4.21 0.00 -0.41 -4.91 121.76 123.26 1rfd s ALA 55 Ca 0.57 -0.18 -0.25 0.00 0.00 0.00 0.00 51.96 52.10 1rfd s ALA 55 Cb -0.33 -3.14 -0.08 0.00 0.00 0.00 0.00 23.12 19.57 1rfd s ALA 55 CO 0.34 -2.18 1.20 -1.54 0.00 0.00 0.00 175.76 173.59 1rfd s SER 56 N -3.64 6.40 0.00 0.00 1.04 -1.26 -2.42 113.70 113.82 1rfd s SER 56 Ca 0.63 2.42 0.00 0.00 0.48 0.00 0.00 55.95 59.48 1rfd s SER 56 Cb -0.16 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.34 1rfd s SER 56 CO 0.56 -0.76 0.00 0.61 0.98 0.00 0.00 173.24 174.62 1rfd n GLY 57 N 0.63 2.31 3.71 7.32 0.00 -1.26 -5.01 105.19 112.90 1rfd n GLY 57 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1rfd n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rfd s VAL 58 N -2.80 4.90 0.50 1.61 1.01 -1.02 -5.00 120.40 119.61 1rfd s VAL 58 Ca 0.00 1.94 -0.22 0.00 0.00 0.00 0.00 61.98 63.70 1rfd s VAL 58 Cb 0.00 -4.27 -0.08 0.00 0.00 0.00 0.00 36.38 32.04 1rfd s VAL 58 CO 0.00 0.18 1.06 -2.65 0.00 0.00 0.00 175.10 173.68 1rfd n PRO 59 N 3.88 1.29 0.23 2.72 -0.02 -1.26 -4.90 135.00 136.94 1rfd n PRO 59 Ca 0.05 0.47 0.16 0.00 -2.02 0.00 0.00 63.50 62.16 1rfd n PRO 59 Cb 0.51 -2.19 0.83 0.00 -0.02 0.00 0.00 33.50 32.63 1rfd n PRO 59 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1rfd h ASP 60 N 1.20 0.00 0.29 2.55 3.32 -2.00 -2.86 116.42 118.92 1rfd h ASP 60 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1rfd h ASP 60 Cb 1.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.89 1rfd h ASP 60 CO 0.55 0.00 0.00 -2.11 -1.72 0.00 0.00 179.24 175.96 1rfd n ARG 61 N -3.90 0.17 -3.27 3.56 1.85 -1.26 -4.67 116.66 109.13 1rfd n ARG 61 Ca 0.00 0.56 -0.35 0.00 -1.00 0.00 0.00 57.85 57.06 1rfd n ARG 61 Cb 0.25 -1.94 -0.06 0.00 -1.05 0.00 0.00 32.46 29.67 1rfd n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1rfd s PHE 62 N -3.47 3.60 0.14 2.89 0.08 -1.08 -0.96 117.98 119.18 1rfd s PHE 62 Ca 0.00 1.16 -0.15 0.00 0.12 0.00 0.00 56.93 58.06 1rfd s PHE 62 Cb 0.07 -2.45 0.03 0.00 -0.57 0.00 0.00 43.02 40.10 1rfd s PHE 62 CO 0.28 0.38 0.40 -1.54 -0.10 0.00 0.00 175.22 174.63 1rfd s SER 63 N -1.74 -0.19 0.04 1.36 1.04 -0.60 -4.99 113.70 108.62 1rfd s SER 63 Ca 0.40 -0.43 -0.03 0.00 0.48 0.00 0.00 55.95 56.38 1rfd s SER 63 Cb -0.15 0.48 -0.02 0.00 0.10 0.00 0.00 66.02 66.43 1rfd s SER 63 CO 0.20 -0.89 0.03 -0.83 0.98 0.00 0.00 173.24 172.73 1rfd s GLY 64 N -2.84 0.26 0.30 7.32 0.00 -1.26 -1.16 107.32 109.95 1rfd s GLY 64 Ca 0.06 -0.71 -0.08 0.00 0.00 0.00 0.00 44.72 43.99 1rfd s GLY 64 CO -0.09 -0.83 0.48 -1.35 0.00 0.00 0.00 173.10 171.31 1rfd s SER 65 N -2.13 0.39 0.00 1.64 1.04 -0.63 -4.39 113.70 109.62 1rfd s SER 65 Ca -0.05 -1.23 0.00 0.00 0.48 0.00 0.00 55.95 55.15 1rfd s SER 65 Cb -0.01 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.73 1rfd s SER 65 CO -0.05 -1.23 0.00 0.61 0.98 0.00 0.00 173.24 173.55 1rfd n GLY 66 N -0.47 2.98 3.42 7.32 0.00 -1.26 -1.52 105.19 115.66 1rfd n GLY 66 Ca -0.01 -1.97 -0.15 0.00 0.00 0.00 0.00 46.02 43.89 1rfd n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rfd s SER 67 N 0.00 -0.50 0.21 1.61 1.04 -0.95 -4.98 113.70 110.13 1rfd s SER 67 Ca 0.00 0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.72 1rfd s SER 67 Cb 0.00 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.63 1rfd s SER 67 CO 0.00 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.12 1rfd n GLY 68 N 0.48 0.26 0.00 7.32 0.00 -1.26 -2.52 105.19 109.46 1rfd n GLY 68 Ca -0.18 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.45 1rfd n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rfd n THR 69 N 0.00 0.37 -4.50 2.61 -2.24 -1.26 -4.36 114.28 104.89 1rfd n THR 69 Ca 0.00 -0.67 -0.24 0.00 -2.27 0.00 0.00 64.05 60.87 1rfd n THR 69 Cb 0.00 0.83 -0.16 0.00 -2.10 0.00 0.00 70.33 68.89 1rfd n THR 69 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rfd s ALA 70 N -0.37 1.14 0.08 6.98 0.00 -1.05 -1.60 121.76 126.94 1rfd s ALA 70 Ca 0.00 -0.34 0.04 0.00 0.00 0.00 0.00 51.96 51.66 1rfd s ALA 70 Cb 0.00 -0.53 -0.03 0.00 0.00 0.00 0.00 23.12 22.56 1rfd s ALA 70 CO 0.00 0.09 -0.10 -0.06 0.00 0.00 0.00 175.76 175.69 1rfd s PHE 71 N 0.70 0.99 -0.02 0.00 0.40 0.46 -2.25 117.98 118.27 1rfd s PHE 71 Ca -0.14 -0.60 0.02 0.00 -0.60 0.00 0.00 56.93 55.61 1rfd s PHE 71 Cb -0.15 -0.56 0.01 0.00 0.51 0.00 0.00 43.02 42.82 1rfd s PHE 71 CO 0.03 -0.02 -0.06 0.99 0.70 0.00 0.00 175.22 176.87 1rfd s THR 72 N -2.05 0.54 -0.16 0.64 2.01 -0.58 -1.10 115.64 114.94 1rfd s THR 72 Ca 0.01 -0.23 -0.04 0.00 0.31 0.00 0.00 61.69 61.74 1rfd s THR 72 Cb -0.05 -0.50 -0.03 0.00 0.01 0.00 0.00 72.50 71.93 1rfd s THR 72 CO 0.00 0.18 -0.03 -0.22 -0.69 0.00 0.00 174.62 173.86 1rfd s LEU 73 N 0.27 3.27 0.06 4.42 2.96 0.61 -1.61 118.68 128.66 1rfd s LEU 73 Ca -0.03 -0.13 0.07 0.00 -0.22 0.00 0.00 54.13 53.83 1rfd s LEU 73 Cb -0.08 -1.79 -0.03 0.00 0.50 0.00 0.00 46.19 44.79 1rfd s LEU 73 CO -0.00 0.16 -0.21 -0.13 -1.32 0.00 0.00 176.35 174.86 1rfd s ARG 74 N 0.40 1.32 -0.15 1.98 0.52 -0.31 0.02 118.95 122.73 1rfd s ARG 74 Ca -0.03 -1.00 -0.02 0.00 -0.52 0.00 0.00 55.73 54.16 1rfd s ARG 74 Cb -0.14 -1.47 -0.02 0.00 0.52 0.00 0.00 34.95 33.84 1rfd s ARG 74 CO 0.03 0.37 -0.09 -0.06 0.02 0.00 0.00 175.30 175.56 1rfd s PHE 75 N -0.89 2.89 0.10 -0.53 0.40 0.82 -1.55 117.98 119.22 1rfd s PHE 75 Ca 0.07 -0.63 -0.05 0.00 -0.60 0.00 0.00 56.93 55.73 1rfd s PHE 75 Cb -0.09 -1.92 -0.18 0.00 0.51 0.00 0.00 43.02 41.34 1rfd s PHE 75 CO 0.02 -0.24 1.23 0.66 0.70 0.00 0.00 175.22 177.59 1rfd h SER 76 N 6.98 0.50 -2.37 1.36 4.64 -1.33 -1.52 113.55 121.81 1rfd h SER 76 Ca -0.30 -0.46 -0.20 0.00 -0.47 0.00 0.00 61.79 60.37 1rfd h SER 76 Cb 1.20 -0.16 -0.31 0.00 -0.31 0.00 0.00 62.40 62.82 1rfd h SER 76 CO 0.58 1.29 -0.51 -0.13 -0.87 0.00 0.00 176.83 177.20 1rfd s ARG 77 N -3.00 0.26 0.35 4.77 0.52 -1.26 -3.56 118.95 117.03 1rfd s ARG 77 Ca -0.05 0.59 -0.22 0.00 -0.52 0.00 0.00 55.73 55.53 1rfd s ARG 77 Cb 0.08 -0.41 -0.10 0.00 0.52 0.00 0.00 34.95 35.04 1rfd s ARG 77 CO 0.88 -0.50 0.89 0.08 0.02 0.00 0.00 175.30 176.67 1rfd s VAL 78 N 2.47 4.38 0.17 3.52 1.01 -0.46 -4.78 120.40 126.71 1rfd s VAL 78 Ca 0.06 1.52 0.11 0.00 0.00 0.00 0.00 61.98 63.67 1rfd s VAL 78 Cb -0.14 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 1rfd s VAL 78 CO -0.13 -0.07 -0.23 -1.61 0.00 0.00 0.00 175.10 173.07 1rfd s GLU 79 N -2.59 1.58 0.37 2.72 2.02 -1.26 0.11 118.70 121.65 1rfd s GLU 79 Ca 0.54 -1.44 0.11 0.00 0.02 0.00 0.00 54.97 54.21 1rfd s GLU 79 Cb -0.14 -1.91 0.89 0.00 0.10 0.00 0.00 34.13 33.07 1rfd s GLU 79 CO 0.18 0.42 1.87 0.00 0.02 0.00 0.00 175.26 177.76 1rfd h ALA 80 N 3.34 1.92 0.00 5.21 0.00 -1.94 0.11 119.26 127.91 1rfd h ALA 80 Ca -0.48 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1rfd h ALA 80 Cb 1.20 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1rfd h ALA 80 CO 0.47 -0.16 0.00 0.39 0.00 0.00 0.00 179.25 179.94 1rfd n GLU 81 N -4.55 0.16 0.00 0.00 4.71 -1.17 -2.75 120.64 117.04 1rfd n GLU 81 Ca 0.17 0.56 0.10 0.00 -0.01 0.00 0.00 57.16 57.98 1rfd n GLU 81 Cb 0.51 -1.92 0.57 0.00 -1.01 0.00 0.00 31.44 29.58 1rfd n GLU 81 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1rfd n ASP 82 N -2.24 0.00 -4.67 1.62 8.00 0.40 -4.86 116.55 114.79 1rfd n ASP 82 Ca -0.00 -0.84 -0.45 0.00 0.71 0.00 0.00 54.79 54.21 1rfd n ASP 82 Cb 0.10 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.17 1rfd n ASP 82 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1rfd n VAL 83 N -0.91 0.73 -1.07 2.53 0.24 -1.11 -4.83 118.33 113.90 1rfd n VAL 83 Ca 0.14 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 62.26 1rfd n VAL 83 Cb 0.07 -1.50 0.00 0.00 -1.47 0.00 0.00 33.84 30.93 1rfd n VAL 83 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rfd n GLY 84 N 2.44 -2.23 3.44 7.63 0.00 -1.25 -4.56 105.19 110.67 1rfd n GLY 84 Ca 0.13 -1.35 -0.34 0.00 0.00 0.00 0.00 46.02 44.46 1rfd n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rfd s VAL 85 N -2.21 3.72 -0.21 1.61 1.01 -0.60 -1.26 120.40 122.46 1rfd s VAL 85 Ca 0.00 -0.41 -0.08 0.00 0.00 0.00 0.00 61.98 61.50 1rfd s VAL 85 Cb 0.00 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 1rfd s VAL 85 CO 0.00 0.47 0.08 -0.31 0.00 0.00 0.00 175.10 175.34 1rfd s TYR 86 N 0.66 3.20 -0.00 5.22 1.51 -0.32 -0.46 117.35 127.16 1rfd s TYR 86 Ca -0.02 -0.07 0.06 0.00 -1.01 0.00 0.00 57.07 56.03 1rfd s TYR 86 Cb -0.14 -2.16 -0.03 0.00 -0.11 0.00 0.00 41.96 39.51 1rfd s TYR 86 CO 0.02 -0.04 -0.18 0.71 -1.11 0.00 0.00 175.55 174.96 1rfd s TYR 87 N 0.91 2.58 0.22 2.71 1.51 0.38 -1.28 117.35 124.38 1rfd s TYR 87 Ca 0.04 -0.24 0.06 0.00 -1.01 0.00 0.00 57.07 55.91 1rfd s TYR 87 Cb -0.14 -1.54 -0.03 0.00 -0.11 0.00 0.00 41.96 40.14 1rfd s TYR 87 CO 0.03 0.18 0.23 0.00 -1.11 0.00 0.00 175.55 174.88 1rfd s MET 89 N -3.63 0.41 -0.17 0.00 1.75 0.30 -0.59 119.30 117.39 1rfd s MET 89 Ca 0.33 0.35 -0.08 0.00 -1.25 0.00 0.00 55.69 55.03 1rfd s MET 89 Cb -0.09 0.20 -0.05 0.00 2.84 0.00 0.00 34.83 37.73 1rfd s MET 89 CO 0.26 -0.06 0.12 1.14 -0.65 0.00 0.00 175.02 175.83 1rfd s GLN 90 N -0.05 3.87 -0.24 4.11 1.03 -0.02 -1.41 119.66 126.95 1rfd s GLN 90 Ca -0.02 -0.21 0.11 0.00 0.04 0.00 0.00 55.36 55.28 1rfd s GLN 90 Cb -0.03 -3.30 0.45 0.00 0.03 0.00 0.00 33.01 30.16 1rfd s GLN 90 CO 0.01 0.48 1.20 1.58 -2.54 0.00 0.00 175.29 176.01 1rfd n HIS 91 N 2.94 1.43 -0.12 9.60 -0.00 -0.45 -3.10 115.22 125.52 1rfd n HIS 91 Ca -0.18 -1.84 -0.26 0.00 0.46 0.00 0.00 57.72 55.90 1rfd n HIS 91 Cb 0.53 -0.29 -0.11 0.00 -0.12 0.00 0.00 29.99 30.00 1rfd n HIS 91 CO 0.00 0.00 0.00 -0.11 0.46 0.00 0.00 176.34 176.69 1rfd n LEU 92 N -0.80 2.08 -4.22 0.27 7.94 -1.26 -4.86 117.00 116.15 1rfd n LEU 92 Ca 0.30 0.30 -0.17 0.00 -1.11 0.00 0.00 56.01 55.34 1rfd n LEU 92 Cb 0.86 -0.89 -0.11 0.00 0.53 0.00 0.00 43.42 43.81 1rfd n LEU 92 CO 0.18 0.55 -0.44 -1.61 -1.11 0.00 0.00 177.39 174.96 1rfd s GLU 93 N -2.47 0.97 0.20 1.96 2.02 -1.26 -5.10 118.70 115.02 1rfd s GLU 93 Ca -0.35 -1.22 -0.29 0.00 0.02 0.00 0.00 54.97 53.14 1rfd s GLU 93 Cb 0.11 -0.78 -0.08 0.00 0.10 0.00 0.00 34.13 33.48 1rfd s GLU 93 CO 0.55 0.14 0.89 0.71 0.02 0.00 0.00 175.26 177.58 1rfd s TYR 94 N -2.27 3.93 0.22 1.61 1.51 -1.26 -2.84 117.35 118.26 1rfd s TYR 94 Ca 0.08 1.81 -0.24 0.00 -1.01 0.00 0.00 57.07 57.71 1rfd s TYR 94 Cb -0.04 -2.93 -0.08 0.00 -0.11 0.00 0.00 41.96 38.79 1rfd s TYR 94 CO 0.02 0.43 0.80 -1.25 -1.11 0.00 0.00 175.55 174.45 1rfd s PRO 95 N -0.96 4.49 0.44 -1.71 0.04 -1.26 -4.92 135.00 131.11 1rfd s PRO 95 Ca 0.40 1.12 -0.26 0.00 0.04 0.00 0.00 61.00 62.31 1rfd s PRO 95 Cb -0.25 -3.05 -0.09 0.00 0.04 0.00 0.00 34.50 31.16 1rfd s PRO 95 CO 0.30 0.46 1.42 -0.06 0.04 0.00 0.00 177.00 179.16 1rfd s PHE 96 N -1.36 2.50 0.03 0.56 2.99 -1.13 -4.72 117.98 116.85 1rfd s PHE 96 Ca 0.41 1.26 0.02 0.00 0.00 0.00 0.00 56.93 58.62 1rfd s PHE 96 Cb -0.20 -3.91 -0.02 0.00 0.00 0.00 0.00 43.02 38.89 1rfd s PHE 96 CO 0.24 -2.87 -0.06 0.95 -0.00 0.00 0.00 175.22 173.48 1rfd s THR 97 N -1.20 0.43 0.15 0.64 -4.23 -1.18 -5.01 115.64 105.24 1rfd s THR 97 Ca 0.60 -0.83 0.07 0.00 -1.18 0.00 0.00 61.69 60.34 1rfd s THR 97 Cb -0.44 -0.48 -0.04 0.00 1.34 0.00 0.00 72.50 72.89 1rfd s THR 97 CO 0.56 -0.28 -0.03 -0.36 -0.54 0.00 0.00 174.62 173.98 1rfd s PHE 98 N -1.07 2.83 0.98 3.99 0.08 -1.26 -0.84 117.98 122.70 1rfd s PHE 98 Ca -0.08 -0.13 -0.15 0.00 0.12 0.00 0.00 56.93 56.70 1rfd s PHE 98 Cb -0.08 -1.41 0.18 0.00 -0.57 0.00 0.00 43.02 41.14 1rfd s PHE 98 CO 0.00 0.49 1.17 0.20 -0.10 0.00 0.00 175.22 176.98 1rfd s GLY 99 N -2.68 1.62 0.00 4.36 0.00 0.24 -4.60 107.32 106.26 1rfd s GLY 99 Ca 0.26 -0.76 0.30 0.00 0.00 0.00 0.00 44.72 44.51 1rfd s GLY 99 CO 0.17 -0.09 1.98 -1.14 0.00 0.00 0.00 173.10 174.03 1rfd n SER 100 N -3.98 0.02 0.00 1.64 3.41 -1.26 -4.76 113.62 108.69 1rfd n SER 100 Ca 0.10 0.18 0.00 0.00 -0.26 0.00 0.00 58.87 58.89 1rfd n SER 100 Cb 0.59 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 64.16 1rfd n SER 100 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rfd n GLY 101 N 1.40 0.49 2.77 5.00 0.00 -1.26 -5.01 105.19 108.57 1rfd n GLY 101 Ca 0.10 -1.66 -0.25 0.00 0.00 0.00 0.00 46.02 44.21 1rfd n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rfd s THR 102 N -2.85 0.47 -0.03 2.61 2.01 -0.40 -4.58 115.64 112.87 1rfd s THR 102 Ca 0.00 -0.14 -0.26 0.00 0.31 0.00 0.00 61.69 61.60 1rfd s THR 102 Cb 0.00 -0.74 -0.04 0.00 0.01 0.00 0.00 72.50 71.74 1rfd s THR 102 CO 0.00 0.11 0.82 -0.75 -0.69 0.00 0.00 174.62 174.11 1rfd s LYS 103 N 1.92 4.49 -0.24 4.92 2.20 -0.46 -1.17 119.74 131.40 1rfd s LYS 103 Ca 0.03 1.12 -0.18 0.00 -0.36 0.00 0.00 55.97 56.57 1rfd s LYS 103 Cb -0.14 -3.45 -0.03 0.00 -1.51 0.00 0.00 37.83 32.71 1rfd s LYS 103 CO -0.06 0.03 0.52 -1.17 -0.36 0.00 0.00 175.35 174.31 1rfd s LEU 104 N 0.83 4.09 -0.16 5.43 0.20 -0.39 -0.49 118.68 128.20 1rfd s LEU 104 Ca 0.44 0.60 -0.03 0.00 0.69 0.00 0.00 54.13 55.82 1rfd s LEU 104 Cb -0.19 -2.69 -0.02 0.00 -0.43 0.00 0.00 46.19 42.85 1rfd s LEU 104 CO 0.23 -0.25 -0.05 -0.70 -0.29 0.00 0.00 176.35 175.29 1rfd s GLU 105 N 2.05 3.60 -0.14 1.98 2.12 -0.27 -3.81 118.70 124.22 1rfd s GLU 105 Ca 0.23 -0.55 -0.21 0.00 0.36 0.00 0.00 54.97 54.79 1rfd s GLU 105 Cb -0.16 -2.89 -0.03 0.00 0.26 0.00 0.00 34.13 31.32 1rfd s GLU 105 CO 0.09 0.19 0.61 0.42 -0.54 0.00 0.00 175.26 176.04 1rfd s ILE 106 N 0.48 5.07 0.09 -3.70 -1.09 -1.26 -0.35 121.20 120.43 1rfd s ILE 106 Ca -0.04 1.20 -0.22 0.00 -2.23 0.00 0.00 60.65 59.35 1rfd s ILE 106 Cb -0.15 -3.94 -0.07 0.00 -1.58 0.00 0.00 42.46 36.73 1rfd s ILE 106 CO 0.03 0.20 0.67 -0.54 -1.23 0.00 0.00 174.94 174.07 1rfd s LYS 107 N 1.28 4.38 0.34 2.79 1.02 0.48 -4.86 119.74 125.17 1rfd s LYS 107 Ca 0.30 0.92 -0.06 0.00 0.02 0.00 0.00 55.97 57.15 1rfd s LYS 107 Cb -0.16 -3.28 0.03 0.00 -0.52 0.00 0.00 37.83 33.90 1rfd s LYS 107 CO 0.12 0.53 0.56 2.89 -0.92 0.00 0.00 175.35 178.53 1rfd n ARG 108 N 1.96 0.80 -2.19 1.68 1.85 -1.26 -4.46 116.66 115.04 1rfd n ARG 108 Ca -0.07 -2.37 -0.36 0.00 -1.00 0.00 0.00 57.85 54.04 1rfd n ARG 108 Cb 0.50 2.51 0.00 0.00 -1.05 0.00 0.00 32.46 34.42 1rfd n ARG 108 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1rfd s ALA 109 N -2.41 2.80 0.67 2.89 0.00 -1.26 -4.96 121.76 119.48 1rfd s ALA 109 Ca 0.22 0.93 -0.17 0.00 0.00 0.00 0.00 51.96 52.94 1rfd s ALA 109 Cb -0.02 -3.40 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 1rfd s ALA 109 CO 0.16 -0.82 0.92 -0.25 0.00 0.00 0.00 175.76 175.78 1rfd n ASP 110 N -0.98 0.45 -3.67 0.00 8.00 -1.26 -4.78 116.55 114.31 1rfd n ASP 110 Ca 0.10 0.72 -0.10 0.00 0.71 0.00 0.00 54.79 56.22 1rfd n ASP 110 Cb 0.49 -1.38 -0.10 0.00 -0.02 0.00 0.00 41.12 40.11 1rfd n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1rfd s ALA 111 N -1.68 -1.02 0.47 2.24 0.00 0.66 -4.88 121.76 117.55 1rfd s ALA 111 Ca 0.74 1.41 -0.22 0.00 0.00 0.00 0.00 51.96 53.90 1rfd s ALA 111 Cb -0.38 -1.15 -0.07 0.00 0.00 0.00 0.00 23.12 21.52 1rfd s ALA 111 CO 0.49 -0.59 1.12 0.00 0.00 0.00 0.00 175.76 176.78 1rfd s ALA 112 N 2.21 2.91 0.52 0.00 0.00 -1.26 -0.91 121.76 125.24 1rfd s ALA 112 Ca -0.04 0.82 -0.17 0.00 0.00 0.00 0.00 51.96 52.57 1rfd s ALA 112 Cb -0.11 -3.34 -0.07 0.00 0.00 0.00 0.00 23.12 19.60 1rfd s ALA 112 CO -0.12 -0.55 1.01 -1.25 0.00 0.00 0.00 175.76 174.85 1rfd s PRO 113 N -2.88 3.77 -0.36 0.00 0.04 -1.26 -4.55 135.00 129.75 1rfd s PRO 113 Ca 0.65 1.12 -0.18 0.00 0.04 0.00 0.00 61.00 62.63 1rfd s PRO 113 Cb -0.24 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.19 1rfd s PRO 113 CO 0.29 -0.43 0.50 0.99 0.04 0.00 0.00 177.00 178.40 1rfd s THR 114 N -2.42 5.02 -0.19 1.26 2.01 -0.59 -4.86 115.64 115.87 1rfd s THR 114 Ca 0.62 0.23 -0.08 0.00 0.31 0.00 0.00 61.69 62.76 1rfd s THR 114 Cb -0.13 -3.98 -0.04 0.00 0.01 0.00 0.00 72.50 68.36 1rfd s THR 114 CO 0.29 -0.26 0.09 -0.69 -0.69 0.00 0.00 174.62 173.36 1rfd s VAL 115 N 2.37 4.98 -0.05 3.82 1.01 -1.26 -0.99 120.40 130.29 1rfd s VAL 115 Ca 0.18 0.04 0.02 0.00 0.00 0.00 0.00 61.98 62.22 1rfd s VAL 115 Cb -0.16 -3.26 0.01 0.00 0.00 0.00 0.00 36.38 32.97 1rfd s VAL 115 CO 0.14 0.45 -0.10 -0.44 0.00 0.00 0.00 175.10 175.14 1rfd s SER 116 N 0.42 1.49 0.02 3.32 0.01 -0.37 -4.99 113.70 113.60 1rfd s SER 116 Ca 0.05 -0.24 0.05 0.00 1.31 0.00 0.00 55.95 57.12 1rfd s SER 116 Cb -0.12 -0.57 -0.03 0.00 0.21 0.00 0.00 66.02 65.51 1rfd s SER 116 CO -0.00 0.04 -0.12 -0.51 0.41 0.00 0.00 173.24 173.06 1rfd s ILE 117 N 0.47 3.24 -0.12 1.44 2.07 -1.26 -0.84 121.20 126.20 1rfd s ILE 117 Ca -0.09 -0.97 -0.01 0.00 -1.41 0.00 0.00 60.65 58.18 1rfd s ILE 117 Cb -0.13 -2.39 0.03 0.00 0.13 0.00 0.00 42.46 40.10 1rfd s ILE 117 CO 0.02 0.37 -0.06 -0.36 -1.91 0.00 0.00 174.94 173.00 1rfd s PHE 118 N -0.96 1.42 0.80 3.50 0.40 0.12 -5.00 117.98 118.26 1rfd s PHE 118 Ca 0.16 -0.73 -0.12 0.00 -0.60 0.00 0.00 56.93 55.64 1rfd s PHE 118 Cb -0.11 -1.20 0.08 0.00 0.51 0.00 0.00 43.02 42.30 1rfd s PHE 118 CO 0.06 -0.51 1.13 -2.14 0.70 0.00 0.00 175.22 174.46 1rfd s PRO 119 N 1.73 1.88 0.35 0.24 0.02 -1.26 -2.16 135.00 135.81 1rfd s PRO 119 Ca 0.04 1.41 -0.27 0.00 0.02 0.00 0.00 61.00 62.21 1rfd s PRO 119 Cb -0.13 -1.84 -0.12 0.00 0.02 0.00 0.00 34.50 32.43 1rfd s PRO 119 CO -0.08 -1.96 1.13 -2.30 -0.33 0.00 0.00 177.00 173.46 1rfd n PRO 120 N -3.52 1.68 -2.41 5.54 -0.02 -1.25 -4.84 135.00 130.18 1rfd n PRO 120 Ca 0.11 0.59 -0.34 0.00 -2.02 0.00 0.00 63.50 61.84 1rfd n PRO 120 Cb 0.52 -2.12 -0.02 0.00 -0.02 0.00 0.00 33.50 31.86 1rfd n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1rfd s SER 121 N -0.52 6.18 0.31 2.55 1.04 -1.26 -4.89 113.70 117.11 1rfd s SER 121 Ca 0.59 1.91 0.03 0.00 0.48 0.00 0.00 55.95 58.96 1rfd s SER 121 Cb -0.60 -2.55 0.62 0.00 0.10 0.00 0.00 66.02 63.58 1rfd s SER 121 CO 0.60 -0.90 1.88 0.77 0.98 0.00 0.00 173.24 176.57 1rfd h SER 122 N 1.27 0.84 -0.89 7.02 4.64 -1.99 0.12 113.55 124.56 1rfd h SER 122 Ca -0.49 0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 60.85 1rfd h SER 122 Cb 1.22 -0.15 -0.04 0.00 -0.31 0.00 0.00 62.40 63.12 1rfd h SER 122 CO 0.59 0.49 0.53 -0.08 -0.87 0.00 0.00 176.83 177.48 1rfd h GLU 123 N 0.93 1.22 -0.23 4.77 4.81 -1.99 -2.21 114.58 121.86 1rfd h GLU 123 Ca 0.44 -0.12 -0.15 0.00 -0.13 0.00 0.00 59.36 59.40 1rfd h GLU 123 Cb 0.42 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 1rfd h GLU 123 CO -0.20 0.86 -0.47 0.37 -0.73 0.00 0.00 179.01 178.85 1rfd h GLN 124 N 1.23 0.61 -0.45 1.92 4.15 -1.32 -3.17 115.11 118.07 1rfd h GLN 124 Ca 0.32 -0.34 -0.07 0.00 0.77 0.00 0.00 58.65 59.33 1rfd h GLN 124 Cb -0.03 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.66 1rfd h GLN 124 CO -0.06 0.95 0.00 -0.07 -1.93 0.00 0.00 178.83 177.72 1rfd h LEU 125 N 0.49 0.70 -1.64 -2.39 3.38 -0.85 -1.89 115.31 113.11 1rfd h LEU 125 Ca 0.03 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1rfd h LEU 125 Cb 1.00 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 1rfd h LEU 125 CO 0.09 0.77 -0.09 0.71 0.09 0.00 0.00 178.44 180.01 1rfd h THR 126 N 0.69 0.29 -0.32 0.22 1.35 -1.41 -1.61 112.91 112.12 1rfd h THR 126 Ca 0.14 -0.63 0.00 0.00 -0.55 0.00 0.00 66.41 65.37 1rfd h THR 126 Cb 0.42 1.49 0.00 0.00 -1.73 0.00 0.00 68.15 68.33 1rfd h THR 126 CO 0.02 0.09 0.00 -1.20 -0.25 0.00 0.00 175.52 174.18 1rfd n SER 127 N -3.31 2.22 0.00 5.36 7.64 -0.78 -4.94 113.62 119.81 1rfd n SER 127 Ca -0.01 -1.88 0.00 0.00 1.01 0.00 0.00 58.87 57.99 1rfd n SER 127 Cb 0.30 -0.21 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 1rfd n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rfd n GLY 128 N 1.21 0.51 3.57 0.23 0.00 -0.61 -5.05 105.19 105.06 1rfd n GLY 128 Ca 0.16 -0.19 -0.24 0.00 0.00 0.00 0.00 46.02 45.75 1rfd n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rfd s GLY 129 N -2.18 1.81 -0.47 -0.02 0.00 -0.78 -2.06 107.32 103.63 1rfd s GLY 129 Ca 0.00 -1.79 0.06 0.00 0.00 0.00 0.00 44.72 42.99 1rfd s GLY 129 CO 0.00 -1.85 0.64 0.00 0.00 0.00 0.00 173.10 171.89 1rfd n ALA 130 N -0.80 -0.10 -2.71 3.20 0.00 -0.96 -3.35 120.51 115.79 1rfd n ALA 130 Ca -0.05 -1.89 -0.38 0.00 0.00 0.00 0.00 53.44 51.11 1rfd n ALA 130 Cb 0.60 -1.20 -0.06 0.00 0.00 0.00 0.00 19.45 18.79 1rfd n ALA 130 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1rfd s SER 131 N -0.04 6.67 -0.21 0.00 0.01 -1.26 -2.51 113.70 116.36 1rfd s SER 131 Ca 0.32 0.80 -0.08 0.00 1.31 0.00 0.00 55.95 58.30 1rfd s SER 131 Cb 0.07 -2.29 -0.04 0.00 0.21 0.00 0.00 66.02 63.97 1rfd s SER 131 CO -0.13 -0.05 0.07 -0.69 0.41 0.00 0.00 173.24 172.85 1rfd s VAL 132 N 0.88 4.71 -0.05 3.43 1.01 -0.20 -3.79 120.40 126.37 1rfd s VAL 132 Ca 0.26 -0.05 0.01 0.00 0.00 0.00 0.00 61.98 62.20 1rfd s VAL 132 Cb -0.15 -3.15 -0.03 0.00 0.00 0.00 0.00 36.38 33.05 1rfd s VAL 132 CO 0.10 0.41 -0.06 -0.69 0.00 0.00 0.00 175.10 174.86 1rfd s VAL 133 N 0.77 3.73 -0.08 2.92 1.01 -0.92 -0.57 120.40 127.26 1rfd s VAL 133 Ca 0.04 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.50 1rfd s VAL 133 Cb -0.13 -2.54 0.02 0.00 0.00 0.00 0.00 36.38 33.72 1rfd s VAL 133 CO 0.02 0.56 -0.08 0.00 0.00 0.00 0.00 175.10 175.60 1rfd s PHE 135 N 1.24 3.06 -0.39 0.00 0.08 -0.02 -0.75 117.98 121.20 1rfd s PHE 135 Ca -0.04 -0.08 0.03 0.00 0.12 0.00 0.00 56.93 56.96 1rfd s PHE 135 Cb -0.14 -1.88 0.11 0.00 -0.57 0.00 0.00 43.02 40.55 1rfd s PHE 135 CO -0.03 0.18 0.12 -0.51 -0.10 0.00 0.00 175.22 174.89 1rfd s LEU 136 N -0.18 4.23 0.05 -0.37 1.02 0.01 -1.24 118.68 122.20 1rfd s LEU 136 Ca 0.04 -2.36 0.02 0.00 0.02 0.00 0.00 54.13 51.85 1rfd s LEU 136 Cb -0.13 -1.51 -0.04 0.00 0.02 0.00 0.00 46.19 44.54 1rfd s LEU 136 CO 0.02 -0.34 0.06 0.20 0.02 0.00 0.00 176.35 176.32 1rfd s ASN 137 N 0.63 5.46 -1.19 2.29 0.02 -0.16 -0.70 114.94 121.28 1rfd s ASN 137 Ca 0.13 0.01 -0.13 0.00 -1.02 0.00 0.00 52.86 51.85 1rfd s ASN 137 Cb -0.21 -1.47 -0.01 0.00 0.02 0.00 0.00 41.25 39.58 1rfd s ASN 137 CO -0.07 0.21 0.74 0.59 0.02 0.00 0.00 177.10 178.59 1rfd n ASN 138 N 0.79 -4.09 -4.72 -1.22 3.02 -0.79 -1.55 115.26 106.71 1rfd n ASN 138 Ca -0.11 -0.96 -0.24 0.00 -0.03 0.00 0.00 54.58 53.24 1rfd n ASN 138 Cb 0.52 -3.61 -0.07 0.00 -0.61 0.00 0.00 39.78 36.00 1rfd n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1rfd s PHE 139 N -3.56 2.62 -0.28 3.10 -0.12 0.23 -4.66 117.98 115.31 1rfd s PHE 139 Ca 0.33 -0.52 -0.22 0.00 -0.05 0.00 0.00 56.93 56.47 1rfd s PHE 139 Cb -0.11 -1.83 0.09 0.00 -0.63 0.00 0.00 43.02 40.54 1rfd s PHE 139 CO 0.85 0.26 0.79 -0.47 -0.05 0.00 0.00 175.22 176.59 1rfd s TYR 140 N -2.55 -0.77 1.13 3.49 6.14 -0.08 -0.51 117.35 124.20 1rfd s TYR 140 Ca 0.40 1.77 -0.15 0.00 0.64 0.00 0.00 57.07 59.72 1rfd s TYR 140 Cb 0.02 0.37 0.25 0.00 0.42 0.00 0.00 41.96 43.02 1rfd s TYR 140 CO 0.22 -0.38 1.07 -1.25 0.64 0.00 0.00 175.55 175.85 1rfd s PRO 141 N 0.69 -0.61 0.55 4.97 0.04 -1.26 -0.25 135.00 139.13 1rfd s PRO 141 Ca -0.02 0.39 0.29 0.00 0.04 0.00 0.00 61.00 61.70 1rfd s PRO 141 Cb -0.05 -1.63 1.58 0.00 0.04 0.00 0.00 34.50 34.44 1rfd s PRO 141 CO -0.06 -3.40 2.12 -0.56 0.04 0.00 0.00 177.00 175.14 1rfd h GLN 142 N -2.37 0.00 -6.42 4.56 3.07 -1.97 -3.44 115.11 108.54 1rfd h GLN 142 Ca -0.53 0.00 -0.54 0.00 0.09 0.00 0.00 58.65 57.67 1rfd h GLN 142 Cb 1.33 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 28.85 1rfd h GLN 142 CO 0.48 0.09 0.16 -0.51 0.09 0.00 0.00 178.83 179.15 1rfd s ASP 143 N -6.06 7.31 0.02 0.06 1.01 -1.26 -5.01 116.67 112.73 1rfd s ASP 143 Ca -0.03 1.55 -0.20 0.00 0.71 0.00 0.00 52.55 54.58 1rfd s ASP 143 Cb 0.13 -2.48 0.04 0.00 1.01 0.00 0.00 42.92 41.62 1rfd s ASP 143 CO 0.56 0.13 0.45 -0.51 0.21 0.00 0.00 175.17 176.02 1rfd s ILE 144 N -0.69 0.04 -0.02 0.77 2.07 -1.26 -4.61 121.20 117.49 1rfd s ILE 144 Ca 0.37 -0.35 0.06 0.00 -1.41 0.00 0.00 60.65 59.32 1rfd s ILE 144 Cb -0.22 -0.89 -0.02 0.00 0.13 0.00 0.00 42.46 41.47 1rfd s ILE 144 CO 0.25 -0.19 -0.21 -0.89 -1.91 0.00 0.00 174.94 171.99 1rfd s THR 145 N -1.99 1.66 -0.10 4.00 2.01 -0.55 -4.98 115.64 115.69 1rfd s THR 145 Ca -0.08 -0.90 0.03 0.00 0.31 0.00 0.00 61.69 61.05 1rfd s THR 145 Cb -0.02 -1.38 0.01 0.00 0.01 0.00 0.00 72.50 71.12 1rfd s THR 145 CO 0.01 0.47 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.54 1rfd s VAL 146 N -0.45 1.69 -0.06 3.82 1.01 -1.26 -0.94 120.40 124.21 1rfd s VAL 146 Ca 0.07 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 61.30 1rfd s VAL 146 Cb -0.09 -1.50 -0.00 0.00 0.00 0.00 0.00 36.38 34.80 1rfd s VAL 146 CO -0.00 0.48 -0.19 -0.55 0.00 0.00 0.00 175.10 174.83 1rfd s SER 147 N 0.61 2.43 -0.14 3.32 0.15 0.82 -4.98 113.70 115.91 1rfd s SER 147 Ca -0.14 -0.41 -0.09 0.00 0.70 0.00 0.00 55.95 56.01 1rfd s SER 147 Cb -0.16 -0.85 -0.04 0.00 -1.71 0.00 0.00 66.02 63.25 1rfd s SER 147 CO 0.04 0.15 0.17 0.26 1.20 0.00 0.00 173.24 175.06 1rfd s TRP 148 N 0.18 3.55 -0.13 3.44 0.52 -1.26 -1.06 118.94 124.18 1rfd s TRP 148 Ca -0.09 0.52 -0.00 0.00 0.02 0.00 0.00 56.10 56.55 1rfd s TRP 148 Cb -0.14 -2.07 0.03 0.00 -1.15 0.00 0.00 33.47 30.14 1rfd s TRP 148 CO 0.04 0.56 -0.09 0.15 0.02 0.00 0.00 176.95 177.63 1rfd s LYS 149 N -0.51 1.68 -0.49 4.98 1.02 -0.63 -0.77 119.74 125.02 1rfd s LYS 149 Ca 0.14 -0.37 -0.10 0.00 0.02 0.00 0.00 55.97 55.67 1rfd s LYS 149 Cb -0.12 -1.77 0.13 0.00 -0.52 0.00 0.00 37.83 35.54 1rfd s LYS 149 CO 0.03 -0.29 0.37 0.42 -0.92 0.00 0.00 175.35 174.97 1rfd s ILE 150 N 1.65 4.31 -1.02 2.17 1.01 0.07 -0.72 121.20 128.66 1rfd s ILE 150 Ca 0.04 -1.83 -0.00 0.00 0.00 0.00 0.00 60.65 58.86 1rfd s ILE 150 Cb -0.13 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.51 1rfd s ILE 150 CO -0.09 -0.80 0.85 0.47 0.00 0.00 0.00 174.94 175.38 1rfd n ASP 151 N 4.85 -2.11 0.00 3.58 8.00 0.87 -3.00 116.55 128.74 1rfd n ASP 151 Ca -0.07 -0.52 0.00 0.00 0.71 0.00 0.00 54.79 54.91 1rfd n ASP 151 Cb 0.41 -4.42 0.00 0.00 -0.02 0.00 0.00 41.12 37.09 1rfd n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rfd n GLY 152 N -1.12 1.30 3.71 0.44 0.00 -1.26 -4.97 105.19 103.29 1rfd n GLY 152 Ca -0.24 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 1rfd n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rfd s ALA 153 N -0.07 3.45 0.36 4.61 0.00 -1.16 -4.89 121.76 124.06 1rfd s ALA 153 Ca 0.00 0.89 -0.27 0.00 0.00 0.00 0.00 51.96 52.58 1rfd s ALA 153 Cb 0.00 -3.48 -0.09 0.00 0.00 0.00 0.00 23.12 19.55 1rfd s ALA 153 CO 0.00 -0.53 1.23 -2.00 0.00 0.00 0.00 175.76 174.47 1rfd s GLU 154 N 1.25 4.21 -0.01 0.00 2.12 -1.26 -0.75 118.70 124.25 1rfd s GLU 154 Ca 0.60 2.03 0.08 0.00 0.36 0.00 0.00 54.97 58.03 1rfd s GLU 154 Cb -0.31 -2.89 -0.02 0.00 0.26 0.00 0.00 34.13 31.17 1rfd s GLU 154 CO 0.29 -0.24 -0.24 0.50 -0.54 0.00 0.00 175.26 175.02 1rfd s ARG 155 N -2.01 1.92 0.00 4.30 6.06 0.05 -4.89 118.95 124.37 1rfd s ARG 155 Ca 0.53 -0.89 0.00 0.00 -2.50 0.00 0.00 55.73 52.87 1rfd s ARG 155 Cb -0.35 -1.88 0.00 0.00 0.06 0.00 0.00 34.95 32.78 1rfd s ARG 155 CO 0.46 0.51 0.00 0.43 -2.50 0.00 0.00 175.30 174.20 1rfd n SER 156 N 2.40 2.79 -4.80 -2.12 7.64 -1.26 -4.15 113.62 114.12 1rfd n SER 156 Ca -0.16 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.37 1rfd n SER 156 Cb 0.52 0.24 -0.06 0.00 -1.01 0.00 0.00 64.21 63.89 1rfd n SER 156 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1rfd s SER 157 N -2.43 6.93 -0.49 6.43 0.01 -1.26 -3.71 113.70 119.18 1rfd s SER 157 Ca 0.00 1.82 0.00 0.00 1.31 0.00 0.00 55.95 59.08 1rfd s SER 157 Cb 0.00 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.67 1rfd s SER 157 CO 0.00 -0.36 0.00 0.61 0.41 0.00 0.00 173.24 173.90 1rfd n GLY 158 N -0.11 0.59 3.47 3.44 0.00 -1.26 -4.85 105.19 106.46 1rfd n GLY 158 Ca 0.06 -0.79 -0.35 0.00 0.00 0.00 0.00 46.02 44.93 1rfd n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rfd s VAL 159 N -2.20 4.04 -0.20 1.61 1.01 -1.24 -0.37 120.40 123.05 1rfd s VAL 159 Ca 0.00 -0.28 -0.04 0.00 0.00 0.00 0.00 61.98 61.65 1rfd s VAL 159 Cb 0.00 -2.83 -0.02 0.00 0.00 0.00 0.00 36.38 33.53 1rfd s VAL 159 CO 0.00 0.43 -0.02 -0.76 0.00 0.00 0.00 175.10 174.75 1rfd s LEU 160 N 0.93 3.13 -0.04 3.92 1.43 0.19 -4.96 118.68 123.28 1rfd s LEU 160 Ca 0.02 -0.26 0.06 0.00 -1.03 0.00 0.00 54.13 52.92 1rfd s LEU 160 Cb -0.14 -1.79 -0.02 0.00 0.03 0.00 0.00 46.19 44.27 1rfd s LEU 160 CO 0.02 0.05 -0.22 0.20 0.23 0.00 0.00 176.35 176.63 1rfd s ASN 161 N 1.06 3.33 -0.01 2.29 0.01 -1.26 -0.57 114.94 119.79 1rfd s ASN 161 Ca 0.02 -0.41 -0.01 0.00 -0.71 0.00 0.00 52.86 51.75 1rfd s ASN 161 Cb -0.14 -0.62 -0.00 0.00 0.41 0.00 0.00 41.25 40.90 1rfd s ASN 161 CO 0.01 0.31 0.03 -0.55 -1.51 0.00 0.00 177.10 175.38 1rfd s SER 162 N -0.51 0.03 -0.02 -1.22 0.15 -0.39 -5.00 113.70 106.74 1rfd s SER 162 Ca 0.07 -0.07 0.03 0.00 0.70 0.00 0.00 55.95 56.68 1rfd s SER 162 Cb -0.11 0.09 -0.01 0.00 -1.71 0.00 0.00 66.02 64.28 1rfd s SER 162 CO 0.01 -0.10 -0.11 0.26 1.20 0.00 0.00 173.24 174.50 1rfd s TRP 163 N -0.39 1.06 0.64 3.44 0.51 -1.26 0.04 118.94 122.98 1rfd s TRP 163 Ca -0.04 -0.22 -0.08 0.00 -2.12 0.00 0.00 56.10 53.63 1rfd s TRP 163 Cb -0.03 -0.70 0.01 0.00 -0.81 0.00 0.00 33.47 31.94 1rfd s TRP 163 CO -0.00 -0.05 0.98 0.95 -0.51 0.00 0.00 176.95 178.32 1rfd s THR 164 N -0.14 3.57 0.81 2.01 -4.23 -0.52 -5.02 115.64 112.13 1rfd s THR 164 Ca 0.02 0.18 -0.12 0.00 -1.18 0.00 0.00 61.69 60.59 1rfd s THR 164 Cb -0.06 -3.45 0.09 0.00 1.34 0.00 0.00 72.50 70.41 1rfd s THR 164 CO -0.00 -0.52 1.18 -1.81 -0.54 0.00 0.00 174.62 172.93 1rfd s ASP 165 N -4.33 4.44 0.24 3.99 1.01 -1.26 -4.58 116.67 116.18 1rfd s ASP 165 Ca 0.56 0.74 -0.31 0.00 0.71 0.00 0.00 52.55 54.24 1rfd s ASP 165 Cb -0.11 -1.21 -0.11 0.00 1.01 0.00 0.00 42.92 42.50 1rfd s ASP 165 CO 0.48 -1.94 1.59 -1.58 0.21 0.00 0.00 175.17 173.93 1rfd s GLN 166 N -5.58 4.17 0.27 8.23 0.74 -1.26 -4.76 119.66 121.47 1rfd s GLN 166 Ca 0.63 2.49 -0.30 0.00 0.05 0.00 0.00 55.36 58.22 1rfd s GLN 166 Cb -0.11 -3.08 -0.10 0.00 1.10 0.00 0.00 33.01 30.82 1rfd s GLN 166 CO 0.49 -0.61 1.47 0.34 -0.55 0.00 0.00 175.29 176.43 1rfd s ASP 167 N 0.74 6.58 0.07 6.67 2.15 -0.10 -4.91 116.67 127.88 1rfd s ASP 167 Ca 0.66 2.75 0.26 0.00 0.43 0.00 0.00 52.55 56.65 1rfd s ASP 167 Cb -0.46 -2.63 1.04 0.00 -0.30 0.00 0.00 42.92 40.57 1rfd s ASP 167 CO 0.40 -0.75 1.82 -1.54 -0.17 0.00 0.00 175.17 174.94 1rfd n SER 168 N 2.17 0.27 -0.12 -0.34 3.41 -1.26 -1.49 113.62 116.26 1rfd n SER 168 Ca 0.07 0.53 -0.24 0.00 -0.26 0.00 0.00 58.87 58.97 1rfd n SER 168 Cb 0.40 -0.60 -0.09 0.00 -0.26 0.00 0.00 64.21 63.66 1rfd n SER 168 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1rfd n SER 169 N -1.75 1.74 -0.52 4.04 7.64 -1.26 -3.03 113.62 120.47 1rfd n SER 169 Ca 0.06 0.23 0.06 0.00 1.01 0.00 0.00 58.87 60.23 1rfd n SER 169 Cb 0.34 -0.65 0.08 0.00 -1.01 0.00 0.00 64.21 62.97 1rfd n SER 169 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1rfd n ASP 170 N -3.93 2.22 -1.80 6.43 5.68 -1.26 -4.94 116.55 118.94 1rfd n ASP 170 Ca -0.45 -1.61 -0.20 0.00 -0.50 0.00 0.00 54.79 52.03 1rfd n ASP 170 Cb 0.84 -0.06 -0.06 0.00 -1.14 0.00 0.00 41.12 40.70 1rfd n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1rfd n SER 171 N 0.63 -5.35 -4.87 -1.12 7.64 -0.56 -4.97 113.62 105.03 1rfd n SER 171 Ca 0.08 0.36 -0.21 0.00 1.01 0.00 0.00 58.87 60.11 1rfd n SER 171 Cb 0.33 -4.66 0.07 0.00 -1.01 0.00 0.00 64.21 58.93 1rfd n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1rfd s THR 172 N -2.77 2.38 0.20 0.44 -4.23 -1.26 -4.65 115.64 105.75 1rfd s THR 172 Ca 0.00 -0.75 0.10 0.00 -1.18 0.00 0.00 61.69 59.86 1rfd s THR 172 Cb 0.00 -2.63 -0.04 0.00 1.34 0.00 0.00 72.50 71.16 1rfd s THR 172 CO 0.00 0.00 -0.19 -0.31 -0.54 0.00 0.00 174.62 173.58 1rfd s TYR 173 N -2.84 2.01 0.03 3.99 2.02 0.34 -0.92 117.35 121.98 1rfd s TYR 173 Ca 0.62 -0.43 -0.01 0.00 -0.37 0.00 0.00 57.07 56.88 1rfd s TYR 173 Cb -0.07 -0.97 -0.02 0.00 -0.40 0.00 0.00 41.96 40.50 1rfd s TYR 173 CO 0.40 0.45 -0.02 -1.12 -1.57 0.00 0.00 175.55 173.69 1rfd s SER 174 N -2.91 0.31 0.00 2.29 0.01 -1.26 -0.60 113.70 111.54 1rfd s SER 174 Ca 0.21 -0.65 -0.02 0.00 1.31 0.00 0.00 55.95 56.80 1rfd s SER 174 Cb -0.05 0.14 -0.01 0.00 0.21 0.00 0.00 66.02 66.31 1rfd s SER 174 CO 0.09 -0.41 0.03 -0.32 0.41 0.00 0.00 173.24 173.05 1rfd s MET 175 N -2.28 0.28 -0.08 12.44 1.75 0.12 -1.43 119.30 130.09 1rfd s MET 175 Ca -0.08 -0.37 0.04 0.00 -1.25 0.00 0.00 55.69 54.03 1rfd s MET 175 Cb -0.04 0.11 -0.01 0.00 2.84 0.00 0.00 34.83 37.73 1rfd s MET 175 CO -0.04 -0.05 -0.21 0.45 -0.65 0.00 0.00 175.02 174.52 1rfd s SER 176 N -1.03 3.39 -0.08 1.11 0.15 0.11 -0.81 113.70 116.54 1rfd s SER 176 Ca -0.11 -0.45 -0.00 0.00 0.70 0.00 0.00 55.95 56.09 1rfd s SER 176 Cb -0.07 -1.15 0.02 0.00 -1.71 0.00 0.00 66.02 63.11 1rfd s SER 176 CO -0.00 0.22 -0.05 -0.55 1.20 0.00 0.00 173.24 174.06 1rfd s SER 177 N 0.01 1.77 -0.17 5.45 0.15 0.07 -1.26 113.70 119.72 1rfd s SER 177 Ca -0.07 -0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.38 1rfd s SER 177 Cb -0.15 -0.64 0.00 0.00 -1.71 0.00 0.00 66.02 63.52 1rfd s SER 177 CO 0.05 -0.12 -0.16 -0.89 1.20 0.00 0.00 173.24 173.32 1rfd s THR 178 N 1.61 2.56 -0.32 6.45 2.01 0.26 -0.72 115.64 127.49 1rfd s THR 178 Ca 0.01 -0.79 -0.18 0.00 0.31 0.00 0.00 61.69 61.04 1rfd s THR 178 Cb -0.13 -2.09 -0.01 0.00 0.01 0.00 0.00 72.50 70.28 1rfd s THR 178 CO -0.05 0.51 0.49 -0.22 -0.69 0.00 0.00 174.62 174.66 1rfd s LEU 179 N 1.00 4.25 -0.21 4.42 2.96 0.27 -0.64 118.68 130.72 1rfd s LEU 179 Ca -0.02 0.12 -0.08 0.00 -0.22 0.00 0.00 54.13 53.94 1rfd s LEU 179 Cb -0.15 -2.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.93 1rfd s LEU 179 CO -0.03 -0.39 0.08 0.42 -1.32 0.00 0.00 176.35 175.10 1rfd s THR 180 N 2.32 4.75 0.27 3.68 -4.23 0.50 -1.04 115.64 121.89 1rfd s THR 180 Ca 0.18 -0.04 0.03 0.00 -1.18 0.00 0.00 61.69 60.69 1rfd s THR 180 Cb -0.16 -3.18 -0.06 0.00 1.34 0.00 0.00 72.50 70.45 1rfd s THR 180 CO 0.12 0.40 0.05 -0.76 -0.54 0.00 0.00 174.62 173.89 1rfd s LEU 181 N 0.86 2.04 0.46 4.79 1.43 -1.04 -4.79 118.68 122.43 1rfd s LEU 181 Ca 0.04 -1.32 -0.04 0.00 -1.03 0.00 0.00 54.13 51.78 1rfd s LEU 181 Cb -0.14 -0.24 -0.04 0.00 0.03 0.00 0.00 46.19 45.81 1rfd s LEU 181 CO 0.03 -0.60 0.74 0.42 0.23 0.00 0.00 176.35 177.16 1rfd s THR 182 N -3.46 4.94 0.26 5.49 -4.23 -1.26 -2.27 115.64 115.12 1rfd s THR 182 Ca 0.34 0.09 -0.04 0.00 -1.18 0.00 0.00 61.69 60.90 1rfd s THR 182 Cb 0.07 -3.86 0.27 0.00 1.34 0.00 0.00 72.50 70.32 1rfd s THR 182 CO 0.13 -0.80 1.92 0.50 -0.54 0.00 0.00 174.62 175.83 1rfd h LYS 183 N 0.33 1.24 0.36 3.99 3.64 -1.64 -1.51 116.57 122.98 1rfd h LYS 183 Ca -0.47 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 58.82 1rfd h LYS 183 Cb 1.21 -0.28 -0.01 0.00 -0.41 0.00 0.00 32.23 32.74 1rfd h LYS 183 CO 0.62 0.82 -0.26 -0.44 -2.27 0.00 0.00 179.45 177.91 1rfd h ASP 184 N 1.28 -0.68 -0.58 4.20 3.32 -1.93 -1.80 116.42 120.23 1rfd h ASP 184 Ca 0.39 0.05 0.12 0.00 0.02 0.00 0.00 57.03 57.60 1rfd h ASP 184 Cb -0.03 0.21 -0.09 0.00 0.22 0.00 0.00 39.33 39.64 1rfd h ASP 184 CO -0.11 -0.40 0.03 -0.33 -1.72 0.00 0.00 179.24 176.70 1rfd h GLU 185 N -0.62 0.14 -0.95 3.56 5.08 -1.88 -1.41 114.58 118.50 1rfd h GLU 185 Ca -0.03 -0.01 0.16 0.00 -1.00 0.00 0.00 59.36 58.48 1rfd h GLU 185 Cb 0.53 -0.03 -0.10 0.00 0.50 0.00 0.00 28.75 29.65 1rfd h GLU 185 CO 0.01 0.09 0.56 -0.92 -1.00 0.00 0.00 179.01 177.75 1rfd h TYR 186 N 0.14 0.99 -0.05 4.33 3.20 -0.70 -2.24 116.97 122.64 1rfd h TYR 186 Ca 0.30 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.21 1rfd h TYR 186 Cb 0.47 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.45 1rfd h TYR 186 CO -0.33 0.27 0.00 0.39 -1.64 0.00 0.00 178.16 176.85 1rfd n GLU 187 N -4.77 1.25 0.06 1.82 1.02 -0.54 -3.37 120.64 116.11 1rfd n GLU 187 Ca 0.20 -0.37 0.12 0.00 -0.02 0.00 0.00 57.16 57.09 1rfd n GLU 187 Cb 0.48 -1.33 0.13 0.00 -0.02 0.00 0.00 31.44 30.70 1rfd n GLU 187 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1rfd h ARG 188 N 0.75 0.00 -5.27 3.49 3.08 -1.37 -3.47 114.38 111.59 1rfd h ARG 188 Ca 0.00 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.42 1rfd h ARG 188 Cb 0.16 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.08 1rfd h ARG 188 CO 0.00 0.00 -0.54 -1.01 -1.07 0.00 0.00 179.97 177.35 1rfd s HIS 189 N -3.19 2.00 0.00 3.04 3.76 -1.22 -5.10 115.29 114.59 1rfd s HIS 189 Ca 0.05 -0.95 0.00 0.00 -0.15 0.00 0.00 55.06 54.01 1rfd s HIS 189 Cb 0.13 -1.54 0.00 0.00 1.11 0.00 0.00 32.58 32.28 1rfd s HIS 189 CO 0.74 0.17 0.00 0.45 -0.85 0.00 0.00 174.74 175.24 1rfd n SER 190 N -1.16 1.94 -4.58 1.40 2.88 -1.26 -4.78 113.62 108.05 1rfd n SER 190 Ca -0.12 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.05 1rfd n SER 190 Cb 0.67 0.05 -0.11 0.00 -0.75 0.00 0.00 64.21 64.07 1rfd n SER 190 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1rfd s SER 191 N -3.13 5.74 -0.15 -3.46 0.15 -1.26 -0.43 113.70 111.15 1rfd s SER 191 Ca 0.00 -0.01 -0.00 0.00 0.70 0.00 0.00 55.95 56.64 1rfd s SER 191 Cb 0.00 -2.03 -0.01 0.00 -1.71 0.00 0.00 66.02 62.27 1rfd s SER 191 CO 0.00 0.04 -0.14 -0.31 1.20 0.00 0.00 173.24 174.03 1rfd s TYR 192 N 1.22 2.81 -0.05 3.44 1.51 -0.81 -0.09 117.35 125.38 1rfd s TYR 192 Ca 0.06 -0.91 0.03 0.00 -1.01 0.00 0.00 57.07 55.24 1rfd s TYR 192 Cb -0.14 -1.90 0.00 0.00 -0.11 0.00 0.00 41.96 39.82 1rfd s TYR 192 CO 0.05 -0.40 -0.14 0.99 -1.11 0.00 0.00 175.55 174.94 1rfd s THR 193 N 0.74 1.21 -0.32 -0.71 2.01 0.11 -1.98 115.64 116.69 1rfd s THR 193 Ca -0.06 -0.57 -0.07 0.00 0.31 0.00 0.00 61.69 61.31 1rfd s THR 193 Cb -0.15 -1.06 0.03 0.00 0.01 0.00 0.00 72.50 71.32 1rfd s THR 193 CO 0.01 0.36 0.09 0.00 -0.69 0.00 0.00 174.62 174.40 1rfd s GLU 195 N 1.44 3.40 -0.11 0.00 2.12 -0.22 -1.98 118.70 123.34 1rfd s GLU 195 Ca 0.00 -0.63 0.02 0.00 0.36 0.00 0.00 54.97 54.72 1rfd s GLU 195 Cb -0.18 -2.94 -0.01 0.00 0.26 0.00 0.00 34.13 31.26 1rfd s GLU 195 CO 0.03 -0.10 -0.18 0.00 -0.54 0.00 0.00 175.26 174.47 1rfd s ALA 196 N 1.21 2.43 -0.18 6.30 0.00 -0.46 -0.13 121.76 130.93 1rfd s ALA 196 Ca 0.02 -0.93 -0.03 0.00 0.00 0.00 0.00 51.96 51.02 1rfd s ALA 196 Cb -0.14 -1.04 -0.02 0.00 0.00 0.00 0.00 23.12 21.92 1rfd s ALA 196 CO -0.02 0.28 -0.05 0.99 0.00 0.00 0.00 175.76 176.96 1rfd s THR 197 N 0.31 3.63 0.03 0.00 2.01 -0.12 -0.05 115.64 121.46 1rfd s THR 197 Ca -0.14 -0.43 -0.03 0.00 0.31 0.00 0.00 61.69 61.40 1rfd s THR 197 Cb -0.17 -2.61 -0.02 0.00 0.01 0.00 0.00 72.50 69.72 1rfd s THR 197 CO 0.07 0.47 0.04 -2.28 -0.69 0.00 0.00 174.62 172.23 1rfd s HIS 198 N 0.78 0.27 0.52 4.92 2.46 -1.26 -1.49 115.29 121.49 1rfd s HIS 198 Ca -0.02 -0.60 0.22 0.00 0.47 0.00 0.00 55.06 55.13 1rfd s HIS 198 Cb -0.15 -0.20 1.34 0.00 -0.13 0.00 0.00 32.58 33.45 1rfd s HIS 198 CO 0.02 -0.32 2.03 1.57 -2.47 0.00 0.00 174.74 175.56 1rfd h LYS 199 N 3.82 0.03 0.00 2.88 5.09 -1.94 -1.73 116.57 124.72 1rfd h LYS 199 Ca -0.33 -0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.41 1rfd h LYS 199 Cb 1.18 -0.01 0.00 0.00 0.10 0.00 0.00 32.23 33.51 1rfd h LYS 199 CO 0.51 0.02 0.00 1.79 -2.09 0.00 0.00 179.45 179.68 1rfd h THR 200 N 0.03 0.00 -3.82 0.07 1.35 -1.92 -3.42 112.91 105.20 1rfd h THR 200 Ca 0.20 -0.10 -0.49 0.00 -0.55 0.00 0.00 66.41 65.47 1rfd h THR 200 Cb 0.77 0.75 -0.31 0.00 -1.73 0.00 0.00 68.15 67.63 1rfd h THR 200 CO -0.01 0.00 -0.81 -0.55 -0.25 0.00 0.00 175.52 173.90 1rfd s SER 201 N -4.36 1.63 0.11 5.36 0.15 -0.65 -5.00 113.70 110.94 1rfd s SER 201 Ca -0.01 -0.26 -0.15 0.00 0.70 0.00 0.00 55.95 56.23 1rfd s SER 201 Cb 0.08 -0.47 -0.05 0.00 -1.71 0.00 0.00 66.02 63.87 1rfd s SER 201 CO 0.30 0.10 1.49 0.71 1.20 0.00 0.00 173.24 177.04 1rfd h THR 202 N 5.38 1.29 -2.39 6.45 1.35 -1.83 -3.41 112.91 119.74 1rfd h THR 202 Ca -0.33 -1.23 -0.51 0.00 -0.55 0.00 0.00 66.41 63.79 1rfd h THR 202 Cb 1.17 1.37 -0.03 0.00 -1.73 0.00 0.00 68.15 68.93 1rfd h THR 202 CO 0.48 0.40 -0.47 -0.94 -0.25 0.00 0.00 175.52 174.74 1rfd s SER 203 N -6.36 6.13 0.54 5.36 1.04 -1.26 -5.04 113.70 114.11 1rfd s SER 203 Ca -0.13 0.04 -0.21 0.00 0.48 0.00 0.00 55.95 56.13 1rfd s SER 203 Cb 0.09 -1.77 -0.05 0.00 0.10 0.00 0.00 66.02 64.39 1rfd s SER 203 CO 0.81 -0.00 1.32 -2.84 0.98 0.00 0.00 173.24 173.50 1rfd s PRO 204 N -3.58 3.19 -0.41 4.02 0.02 -1.26 -4.85 135.00 132.13 1rfd s PRO 204 Ca 0.34 2.13 -0.21 0.00 0.02 0.00 0.00 61.00 63.28 1rfd s PRO 204 Cb -0.10 -2.23 0.02 0.00 0.02 0.00 0.00 34.50 32.20 1rfd s PRO 204 CO 0.28 -1.12 0.66 0.42 -0.33 0.00 0.00 177.00 176.91 1rfd s ILE 205 N -1.36 4.82 -0.13 2.83 -1.09 0.92 -4.89 121.20 122.30 1rfd s ILE 205 Ca 0.71 0.35 -0.05 0.00 -2.23 0.00 0.00 60.65 59.43 1rfd s ILE 205 Cb -0.38 -4.17 -0.04 0.00 -1.58 0.00 0.00 42.46 36.29 1rfd s ILE 205 CO 0.44 -0.50 0.05 -0.89 -1.23 0.00 0.00 174.94 172.81 1rfd s THR 206 N 2.85 4.72 -0.03 2.92 2.01 -1.26 -1.35 115.64 125.50 1rfd s THR 206 Ca 0.24 -0.08 0.01 0.00 0.31 0.00 0.00 61.69 62.18 1rfd s THR 206 Cb -0.14 -3.06 0.02 0.00 0.01 0.00 0.00 72.50 69.33 1rfd s THR 206 CO 0.18 0.55 -0.02 -0.54 -0.69 0.00 0.00 174.62 174.10 1rfd s LYS 207 N -0.38 0.45 0.26 4.92 -0.14 -0.84 -5.01 119.74 119.00 1rfd s LYS 207 Ca 0.09 -0.03 -0.16 0.00 -1.36 0.00 0.00 55.97 54.51 1rfd s LYS 207 Cb -0.12 -0.54 0.00 0.00 -1.68 0.00 0.00 37.83 35.50 1rfd s LYS 207 CO 0.02 -0.06 0.56 -1.54 -0.76 0.00 0.00 175.35 173.57 1rfd s SER 208 N 0.71 -0.15 0.24 2.83 1.04 -1.26 0.01 113.70 117.12 1rfd s SER 208 Ca -0.08 -0.82 -0.17 0.00 0.48 0.00 0.00 55.95 55.36 1rfd s SER 208 Cb -0.11 0.64 0.01 0.00 0.10 0.00 0.00 66.02 66.66 1rfd s SER 208 CO -0.01 -1.21 0.57 0.72 0.98 0.00 0.00 173.24 174.29 1rfd s PHE 209 N -3.98 0.03 -0.12 5.02 -0.12 -0.84 -5.01 117.98 112.96 1rfd s PHE 209 Ca 0.18 -0.42 0.01 0.00 -0.05 0.00 0.00 56.93 56.66 1rfd s PHE 209 Cb -0.03 0.42 -0.01 0.00 -0.63 0.00 0.00 43.02 42.78 1rfd s PHE 209 CO 0.08 -1.05 -0.17 -0.80 -0.05 0.00 0.00 175.22 173.24 1rfd s ASN 210 N -2.94 3.65 0.32 1.98 0.01 -1.26 -1.93 114.94 114.78 1rfd s ASN 210 Ca 0.14 -0.42 0.08 0.00 -0.71 0.00 0.00 52.86 51.95 1rfd s ASN 210 Cb -0.02 -1.54 0.79 0.00 0.41 0.00 0.00 41.25 40.89 1rfd s ASN 210 CO 0.04 0.16 1.80 -0.09 -1.51 0.00 0.00 177.10 177.50 1rfd h ARG 211 N 6.76 0.70 -1.95 -0.60 2.43 -1.05 -2.28 114.38 118.40 1rfd h ARG 211 Ca -0.24 -0.04 -0.41 0.00 -0.81 0.00 0.00 59.98 58.48 1rfd h ARG 211 Cb 1.22 -0.16 -0.15 0.00 -0.42 0.00 0.00 29.97 30.47 1rfd h ARG 211 CO 0.53 0.46 0.22 0.41 -1.51 0.00 0.00 179.97 180.08 1rfd n GLY 212 N -1.37 4.00 0.00 2.80 0.00 -1.26 -5.12 105.19 104.24 1rfd n GLY 212 Ca 0.22 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.62 1rfd n GLY 212 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50