#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c80 s HIS 5 N 0.00 3.40 -0.23 1.24 2.46 0.66 -4.96 115.29 117.86 2c80 s HIS 5 Ca 0.00 0.81 -0.03 0.00 0.47 0.00 0.00 55.06 56.31 2c80 s HIS 5 Cb 0.00 -2.65 0.01 0.00 -0.13 0.00 0.00 32.58 29.80 2c80 s HIS 5 CO 0.00 -0.05 -0.06 0.42 -2.47 0.00 0.00 174.74 172.58 2c80 s ILE 6 N 1.43 3.11 -0.22 0.89 1.01 -1.26 -1.02 121.20 125.13 2c80 s ILE 6 Ca 0.25 -0.71 -0.04 0.00 0.00 0.00 0.00 60.65 60.15 2c80 s ILE 6 Cb -0.15 -2.46 -0.00 0.00 0.01 0.00 0.00 42.46 39.85 2c80 s ILE 6 CO 0.10 0.35 -0.05 -0.75 0.00 0.00 0.00 174.94 174.59 2c80 s LYS 7 N 1.41 3.29 -0.27 2.79 2.20 -0.30 0.33 119.74 129.19 2c80 s LYS 7 Ca 0.04 -0.68 -0.14 0.00 -0.36 0.00 0.00 55.97 54.83 2c80 s LYS 7 Cb -0.15 -3.00 -0.04 0.00 -1.51 0.00 0.00 37.83 33.13 2c80 s LYS 7 CO -0.04 -0.23 0.35 0.08 -0.36 0.00 0.00 175.35 175.14 2c80 s VAL 8 N 1.46 5.19 -0.22 4.02 1.01 0.79 -1.23 120.40 131.41 2c80 s VAL 8 Ca 0.05 0.51 -0.05 0.00 0.00 0.00 0.00 61.98 62.49 2c80 s VAL 8 Cb -0.15 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.54 2c80 s VAL 8 CO -0.04 0.17 0.00 -0.63 0.00 0.00 0.00 175.10 174.61 2c80 s ILE 9 N 2.03 3.82 0.13 2.22 1.01 -0.03 -0.07 121.20 130.31 2c80 s ILE 9 Ca 0.14 -0.34 -0.02 0.00 0.00 0.00 0.00 60.65 60.43 2c80 s ILE 9 Cb -0.16 -2.75 0.01 0.00 0.01 0.00 0.00 42.46 39.57 2c80 s ILE 9 CO 0.10 0.40 0.20 0.00 0.00 0.00 0.00 174.94 175.64 2c80 n TYR 10 N 4.69 -0.95 -2.21 3.97 9.36 -0.64 -2.07 117.16 129.31 2c80 n TYR 10 Ca -0.17 -0.80 -0.26 0.00 3.32 0.00 0.00 57.90 59.99 2c80 n TYR 10 Cb 0.51 0.23 0.11 0.00 -0.63 0.00 0.00 39.34 39.56 2c80 n TYR 10 CO 0.00 0.00 0.00 -0.06 0.22 0.00 0.00 176.86 177.02 2c80 s PHE 11 N -4.80 2.22 -1.30 2.98 0.40 -1.26 -0.06 117.98 116.16 2c80 s PHE 11 Ca 0.09 0.24 -0.18 0.00 -0.60 0.00 0.00 56.93 56.49 2c80 s PHE 11 Cb -0.01 -3.42 0.05 0.00 0.51 0.00 0.00 43.02 40.15 2c80 s PHE 11 CO 0.07 -1.85 1.83 -1.71 0.70 0.00 0.00 175.22 174.26 2c80 n ASN 12 N -3.16 4.58 -3.67 1.36 5.15 -1.25 -4.65 115.26 113.62 2c80 n ASN 12 Ca 0.12 -2.88 0.01 0.00 -0.60 0.00 0.00 54.58 51.22 2c80 n ASN 12 Cb 0.60 -1.72 0.00 0.00 -0.53 0.00 0.00 39.78 38.13 2c80 n ASN 12 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2c80 s GLY 13 N 4.29 -0.26 -0.03 8.20 0.00 -1.26 -4.79 107.32 113.47 2c80 s GLY 13 Ca 0.54 0.35 -0.02 0.00 0.00 0.00 0.00 44.72 45.59 2c80 s GLY 13 CO 0.06 2.09 0.20 3.21 0.00 0.00 0.00 173.10 178.66 2c80 h ARG 14 N 2.00 -0.08 0.00 2.90 3.08 -0.37 -3.46 114.38 118.46 2c80 h ARG 14 Ca -0.27 0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.78 2c80 h ARG 14 Cb 1.20 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.27 2c80 h ARG 14 CO 0.30 -0.05 0.00 0.41 -1.07 0.00 0.00 179.97 179.56 2c80 n GLY 15 N 1.40 2.21 0.07 0.04 0.00 -1.19 -1.86 105.19 105.85 2c80 n GLY 15 Ca -0.01 -0.14 0.13 0.00 0.00 0.00 0.00 46.02 46.00 2c80 n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c80 n ARG 16 N 14.00 0.18 0.12 1.61 5.12 -1.26 -3.70 116.66 132.73 2c80 n ARG 16 Ca 0.00 0.13 0.13 0.00 -1.93 0.00 0.00 57.85 56.18 2c80 n ARG 16 Cb 0.00 -1.70 0.28 0.00 -1.16 0.00 0.00 32.46 29.89 2c80 n ARG 16 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2c80 h ALA 17 N 2.68 0.88 -0.16 7.54 0.00 -1.69 -3.37 119.26 125.14 2c80 h ALA 17 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2c80 h ALA 17 Cb 0.66 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2c80 h ALA 17 CO 0.00 0.00 -0.25 1.49 0.00 0.00 0.00 179.25 180.49 2c80 h GLU 18 N 0.00 0.28 -0.73 0.00 4.57 -1.52 -2.15 114.58 115.03 2c80 h GLU 18 Ca 0.00 -0.09 -0.04 0.00 -1.18 0.00 0.00 59.36 58.04 2c80 h GLU 18 Cb 0.81 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.35 2c80 h GLU 18 CO 0.00 0.52 0.29 0.66 -1.18 0.00 0.00 179.01 179.30 2c80 h SER 19 N 0.25 1.01 -0.09 1.04 4.64 -1.85 -0.86 113.55 117.71 2c80 h SER 19 Ca 0.04 -0.17 -0.02 0.00 -0.47 0.00 0.00 61.79 61.17 2c80 h SER 19 Cb 0.58 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2c80 h SER 19 CO 0.04 0.91 -0.01 0.40 -0.87 0.00 0.00 176.83 177.30 2c80 h ILE 20 N 1.05 1.26 0.10 0.95 2.04 -1.68 -1.68 117.51 119.57 2c80 h ILE 20 Ca 0.24 -0.83 0.01 0.00 1.00 0.00 0.00 64.86 65.28 2c80 h ILE 20 Cb 0.21 1.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 2c80 h ILE 20 CO -0.02 0.23 -0.14 0.03 0.00 0.00 0.00 178.15 178.25 2c80 h ARG 21 N -0.14 -0.28 -0.85 2.37 3.08 -1.25 -2.10 114.38 115.22 2c80 h ARG 21 Ca 0.02 0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 2c80 h ARG 21 Cb 0.37 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.44 2c80 h ARG 21 CO 0.01 -0.19 0.49 0.52 -1.07 0.00 0.00 179.97 179.72 2c80 h MET 22 N -0.29 1.16 0.10 0.04 2.86 -1.19 -0.61 114.93 116.99 2c80 h MET 22 Ca 0.02 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 2c80 h MET 22 Cb 0.30 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 2c80 h MET 22 CO -0.07 0.83 -0.10 1.15 1.06 0.00 0.00 176.91 179.79 2c80 h THR 23 N 1.17 0.78 -0.71 2.22 2.02 -1.00 0.11 112.91 117.51 2c80 h THR 23 Ca 0.30 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.43 2c80 h THR 23 Cb -0.01 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 67.15 2c80 h THR 23 CO -0.05 0.00 0.26 -0.07 0.37 0.00 0.00 175.52 176.03 2c80 h LEU 24 N -0.22 1.00 0.10 2.58 3.38 -1.11 -0.06 115.31 120.99 2c80 h LEU 24 Ca 0.01 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 2c80 h LEU 24 Cb 0.21 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2c80 h LEU 24 CO -0.03 0.92 -0.05 0.58 0.09 0.00 0.00 178.44 179.95 2c80 h VAL 25 N 1.02 0.93 -0.96 1.22 2.07 -0.96 0.37 116.25 119.94 2c80 h VAL 25 Ca 0.23 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.67 2c80 h VAL 25 Cb 0.25 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 2c80 h VAL 25 CO -0.01 0.03 0.63 0.00 0.02 0.00 0.00 177.57 178.23 2c80 h ALA 26 N 0.72 1.25 0.00 1.67 0.00 -0.58 -1.74 119.26 120.57 2c80 h ALA 26 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2c80 h ALA 26 Cb 0.15 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.57 2c80 h ALA 26 CO 0.02 0.55 0.00 0.00 0.00 0.00 0.00 179.25 179.82 2c80 n ALA 27 N -2.36 2.04 -2.14 0.00 0.00 -0.05 -4.92 120.51 113.08 2c80 n ALA 27 Ca 0.12 -0.03 -0.03 0.00 0.00 0.00 0.00 53.44 53.50 2c80 n ALA 27 Cb 0.06 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.10 2c80 n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c80 n GLY 28 N 0.82 0.33 3.57 0.00 0.00 0.13 -5.04 105.19 105.00 2c80 n GLY 28 Ca 0.05 -0.74 -0.35 0.00 0.00 0.00 0.00 46.02 44.97 2c80 n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c80 s VAL 29 N -2.26 4.65 0.44 1.61 1.01 0.11 -5.02 120.40 120.93 2c80 s VAL 29 Ca 0.01 -0.07 -0.23 0.00 0.00 0.00 0.00 61.98 61.69 2c80 s VAL 29 Cb -0.00 -3.13 -0.08 0.00 0.00 0.00 0.00 36.38 33.17 2c80 s VAL 29 CO 0.01 0.41 1.12 0.20 0.00 0.00 0.00 175.10 176.84 2c80 s ASN 30 N 0.87 6.37 0.08 3.32 0.01 -1.26 -4.36 114.94 119.98 2c80 s ASN 30 Ca 0.04 2.21 -0.20 0.00 -0.71 0.00 0.00 52.86 54.20 2c80 s ASN 30 Cb -0.14 -2.60 0.05 0.00 0.41 0.00 0.00 41.25 38.97 2c80 s ASN 30 CO 0.03 -0.77 0.47 -0.72 -1.51 0.00 0.00 177.10 174.60 2c80 s TYR 31 N -1.59 -0.34 -0.24 2.20 1.13 -1.26 -4.54 117.35 112.71 2c80 s TYR 31 Ca 0.62 0.24 -0.22 0.00 -1.41 0.00 0.00 57.07 56.30 2c80 s TYR 31 Cb -0.26 0.32 -0.02 0.00 -1.10 0.00 0.00 41.96 40.90 2c80 s TYR 31 CO 0.32 -0.67 0.68 -2.00 -2.51 0.00 0.00 175.55 171.37 2c80 s GLU 32 N -3.01 4.15 -0.76 -3.49 2.12 0.15 -4.98 118.70 112.87 2c80 s GLU 32 Ca -0.02 0.67 -0.17 0.00 0.36 0.00 0.00 54.97 55.80 2c80 s GLU 32 Cb 0.00 -3.64 0.15 0.00 0.26 0.00 0.00 34.13 30.90 2c80 s GLU 32 CO -0.06 -0.41 0.85 0.34 -0.54 0.00 0.00 175.26 175.44 2c80 s ASP 33 N 1.39 6.48 -0.26 -1.70 2.15 -1.26 -0.15 116.67 123.32 2c80 s ASP 33 Ca 0.29 -1.98 -0.17 0.00 0.43 0.00 0.00 52.55 51.12 2c80 s ASP 33 Cb -0.15 -2.30 -0.03 0.00 -0.30 0.00 0.00 42.92 40.13 2c80 s ASP 33 CO 0.09 -0.94 0.46 -0.70 -0.17 0.00 0.00 175.17 173.90 2c80 s GLU 34 N 1.96 4.05 -0.27 4.34 2.12 0.90 -4.98 118.70 126.83 2c80 s GLU 34 Ca 0.20 0.22 -0.07 0.00 0.36 0.00 0.00 54.97 55.68 2c80 s GLU 34 Cb -0.14 -3.65 -0.01 0.00 0.26 0.00 0.00 34.13 30.59 2c80 s GLU 34 CO -0.03 -0.32 0.06 1.03 -0.54 0.00 0.00 175.26 175.47 2c80 s ARG 35 N 2.20 3.35 -0.18 4.30 0.52 -1.26 -1.63 118.95 126.26 2c80 s ARG 35 Ca 0.19 -0.68 -0.18 0.00 -0.52 0.00 0.00 55.73 54.54 2c80 s ARG 35 Cb -0.16 -3.31 -0.04 0.00 0.52 0.00 0.00 34.95 31.96 2c80 s ARG 35 CO 0.09 -0.31 0.49 0.42 0.02 0.00 0.00 175.30 176.01 2c80 s ILE 36 N 1.55 5.14 0.62 1.52 -1.09 0.92 -4.85 121.20 125.01 2c80 s ILE 36 Ca 0.05 0.91 -0.16 0.00 -2.23 0.00 0.00 60.65 59.22 2c80 s ILE 36 Cb -0.16 -3.82 -0.02 0.00 -1.58 0.00 0.00 42.46 36.88 2c80 s ILE 36 CO 0.02 0.22 1.08 -0.55 -1.23 0.00 0.00 174.94 174.49 2c80 s SER 37 N 1.02 5.49 0.53 3.58 0.15 -1.26 -3.94 113.70 119.27 2c80 s SER 37 Ca 0.24 1.91 0.25 0.00 0.70 0.00 0.00 55.95 59.05 2c80 s SER 37 Cb -0.15 -2.54 1.46 0.00 -1.71 0.00 0.00 66.02 63.07 2c80 s SER 37 CO 0.09 -1.37 2.12 -0.26 1.20 0.00 0.00 173.24 175.02 2c80 h PHE 38 N 0.30 0.00 -0.31 3.44 0.05 -1.99 -1.80 116.94 116.63 2c80 h PHE 38 Ca -0.47 0.00 -0.16 0.00 3.82 0.00 0.00 57.97 61.16 2c80 h PHE 38 Cb 1.23 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 39.18 2c80 h PHE 38 CO 0.56 0.09 -0.43 0.37 -0.18 0.00 0.00 178.31 178.72 2c80 h GLN 39 N 0.00 0.80 0.00 1.51 4.15 -2.05 -3.25 115.11 116.27 2c80 h GLN 39 Ca -0.00 -0.44 0.00 0.00 0.77 0.00 0.00 58.65 58.98 2c80 h GLN 39 Cb 0.21 0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.93 2c80 h GLN 39 CO 0.01 1.07 -0.31 -0.25 -1.93 0.00 0.00 178.83 177.42 2c80 n ASP 40 N -4.03 0.51 -0.12 -0.69 10.43 -0.74 -4.34 116.55 117.56 2c80 n ASP 40 Ca -0.02 0.22 -0.05 0.00 2.57 0.00 0.00 54.79 57.50 2c80 n ASP 40 Cb 0.56 -0.18 0.03 0.00 1.84 0.00 0.00 41.12 43.37 2c80 n ASP 40 CO 0.00 0.00 0.00 -0.25 -1.07 0.00 0.00 177.20 175.88 2c80 h TRP 41 N 0.00 0.22 -0.97 1.24 -0.00 -1.42 -2.52 115.95 112.49 2c80 h TRP 41 Ca 0.00 0.02 0.24 0.00 -0.00 0.00 0.00 58.89 59.15 2c80 h TRP 41 Cb 0.62 -0.04 -0.13 0.00 -0.00 0.00 0.00 29.16 29.62 2c80 h TRP 41 CO 0.00 0.07 0.53 -1.35 -0.00 0.00 0.00 178.44 177.70 2c80 h PRO 42 N 0.28 0.50 0.02 2.65 0.11 -1.79 0.29 132.00 134.06 2c80 h PRO 42 Ca 0.19 -0.03 -0.25 0.00 0.11 0.00 0.00 66.00 66.02 2c80 h PRO 42 Cb 0.19 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.16 2c80 h PRO 42 CO -0.21 0.33 -1.25 1.57 -0.21 0.00 0.00 178.00 178.23 2c80 h LYS 43 N 0.51 0.05 -0.23 1.05 2.10 -1.79 -3.34 116.57 114.92 2c80 h LYS 43 Ca 0.62 -0.09 -0.19 0.00 -2.00 0.00 0.00 60.65 59.00 2c80 h LYS 43 Cb 1.20 0.03 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 2c80 h LYS 43 CO -0.50 0.91 -0.59 0.82 -2.00 0.00 0.00 179.45 178.09 2c80 h ILE 44 N 0.01 1.29 -0.82 0.07 1.08 -0.95 -3.36 117.51 114.83 2c80 h ILE 44 Ca -0.11 -1.80 0.16 0.00 -0.39 0.00 0.00 64.86 62.71 2c80 h ILE 44 Cb 1.87 1.74 -0.15 0.00 -3.07 0.00 0.00 36.82 37.21 2c80 h ILE 44 CO 0.13 0.58 -0.24 0.50 -0.69 0.00 0.00 178.15 178.43 2c80 h LYS 45 N 0.58 -0.02 0.00 2.37 3.64 -0.57 0.12 116.57 122.69 2c80 h LYS 45 Ca -0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2c80 h LYS 45 Cb 1.19 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.01 2c80 h LYS 45 CO 0.12 -0.01 -0.04 -1.35 -2.27 0.00 0.00 179.45 175.90 2c80 h PRO 46 N -0.02 0.00 0.00 1.90 0.11 -1.77 -2.53 132.00 129.69 2c80 h PRO 46 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 2c80 h PRO 46 Cb 0.60 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.71 2c80 h PRO 46 CO -0.85 0.04 0.00 0.25 -0.21 0.00 0.00 178.00 177.23 2c80 n THR 47 N -4.08 0.50 -3.17 -1.15 -2.24 0.41 -4.75 114.28 99.81 2c80 n THR 47 Ca -0.03 -0.17 -0.40 0.00 -2.27 0.00 0.00 64.05 61.17 2c80 n THR 47 Cb 0.13 -0.62 -0.07 0.00 -2.10 0.00 0.00 70.33 67.66 2c80 n THR 47 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2c80 s ILE 48 N -3.10 5.01 0.07 2.28 -1.09 -0.95 -5.03 121.20 118.40 2c80 s ILE 48 Ca 0.11 0.91 -0.31 0.00 -2.23 0.00 0.00 60.65 59.13 2c80 s ILE 48 Cb 0.13 -3.90 -0.10 0.00 -1.58 0.00 0.00 42.46 37.01 2c80 s ILE 48 CO 0.56 -0.00 1.91 -2.65 -1.23 0.00 0.00 174.94 173.53 2c80 n PRO 49 N 5.68 2.81 0.00 2.79 -0.02 -1.26 -0.51 135.00 144.49 2c80 n PRO 49 Ca -0.02 1.03 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 2c80 n PRO 49 Cb 0.49 -2.95 0.00 0.00 -0.02 0.00 0.00 33.50 31.02 2c80 n PRO 49 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c80 n GLY 50 N 4.40 2.21 2.50 -1.23 0.00 -1.26 -4.50 105.19 107.30 2c80 n GLY 50 Ca 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.11 2c80 n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c80 n GLY 51 N -2.00 1.08 3.21 -0.02 0.00 0.33 -5.00 105.19 102.80 2c80 n GLY 51 Ca 0.00 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.65 2c80 n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c80 s ARG 52 N -2.65 0.96 0.18 1.61 0.52 -1.26 -4.95 118.95 113.35 2c80 s ARG 52 Ca 0.00 -1.40 0.10 0.00 -0.52 0.00 0.00 55.73 53.91 2c80 s ARG 52 Cb 0.00 -0.43 -0.04 0.00 0.52 0.00 0.00 34.95 35.00 2c80 s ARG 52 CO 0.00 0.03 -0.16 -0.51 0.02 0.00 0.00 175.30 174.68 2c80 s LEU 53 N -3.11 2.75 0.42 2.53 1.43 -1.26 -4.24 118.68 117.19 2c80 s LEU 53 Ca 0.15 -0.68 -0.25 0.00 -1.03 0.00 0.00 54.13 52.31 2c80 s LEU 53 Cb 0.04 -1.47 -0.08 0.00 0.03 0.00 0.00 46.19 44.71 2c80 s LEU 53 CO -0.02 0.12 1.27 -2.84 0.23 0.00 0.00 176.35 175.11 2c80 s PRO 54 N -2.69 3.89 0.01 1.29 0.02 -1.26 -4.99 135.00 131.26 2c80 s PRO 54 Ca 0.23 2.07 0.05 0.00 0.02 0.00 0.00 61.00 63.36 2c80 s PRO 54 Cb -0.09 -2.67 -0.01 0.00 0.02 0.00 0.00 34.50 31.75 2c80 s PRO 54 CO 0.13 -0.53 -0.14 0.00 -0.33 0.00 0.00 177.00 176.13 2c80 s ALA 55 N -1.32 1.17 -0.14 -1.55 0.00 -0.88 -4.19 121.76 114.85 2c80 s ALA 55 Ca 0.59 -0.68 0.02 0.00 0.00 0.00 0.00 51.96 51.89 2c80 s ALA 55 Cb -0.36 -0.26 0.01 0.00 0.00 0.00 0.00 23.12 22.51 2c80 s ALA 55 CO 0.46 0.27 -0.22 0.08 0.00 0.00 0.00 175.76 176.34 2c80 s VAL 56 N -0.50 2.05 -0.26 0.00 1.01 0.46 -0.85 120.40 122.31 2c80 s VAL 56 Ca 0.04 -0.97 -0.06 0.00 0.00 0.00 0.00 61.98 61.00 2c80 s VAL 56 Cb -0.06 -1.81 -0.00 0.00 0.00 0.00 0.00 36.38 34.50 2c80 s VAL 56 CO 0.00 0.55 0.03 -0.75 0.00 0.00 0.00 175.10 174.93 2c80 s LYS 57 N 0.85 3.31 -0.20 2.72 2.20 -0.37 -0.54 119.74 127.72 2c80 s LYS 57 Ca -0.06 -0.69 -0.03 0.00 -0.36 0.00 0.00 55.97 54.83 2c80 s LYS 57 Cb -0.15 -3.22 -0.01 0.00 -1.51 0.00 0.00 37.83 32.94 2c80 s LYS 57 CO -0.03 -0.30 -0.07 0.42 -0.36 0.00 0.00 175.35 175.02 2c80 s ILE 58 N 1.51 3.27 -0.17 5.43 1.01 0.58 -1.15 121.20 131.68 2c80 s ILE 58 Ca 0.04 -0.54 -0.01 0.00 0.00 0.00 0.00 60.65 60.15 2c80 s ILE 58 Cb -0.16 -2.46 -0.00 0.00 0.01 0.00 0.00 42.46 39.85 2c80 s ILE 58 CO 0.00 0.45 -0.13 -0.89 0.00 0.00 0.00 174.94 174.38 2c80 s THR 59 N 1.22 2.82 0.63 2.92 2.01 -0.19 0.14 115.64 125.18 2c80 s THR 59 Ca 0.02 -0.71 -0.05 0.00 0.31 0.00 0.00 61.69 61.26 2c80 s THR 59 Cb -0.14 -2.21 0.03 0.00 0.01 0.00 0.00 72.50 70.18 2c80 s THR 59 CO -0.02 0.50 0.93 1.51 -0.69 0.00 0.00 174.62 176.85 2c80 s ASP 60 N 1.00 5.23 0.00 3.53 -4.77 -0.63 -0.25 116.67 120.78 2c80 s ASP 60 Ca -0.01 0.52 0.07 0.00 -3.30 0.00 0.00 52.55 49.82 2c80 s ASP 60 Cb -0.15 -1.36 0.41 0.00 -1.09 0.00 0.00 42.92 40.73 2c80 s ASP 60 CO -0.02 -1.29 1.13 -0.46 0.70 0.00 0.00 175.17 175.23 2c80 n ASN 61 N -2.69 0.00 -0.56 2.11 2.04 -1.26 -2.41 115.26 112.49 2c80 n ASN 61 Ca 0.06 -1.48 0.06 0.00 -0.44 0.00 0.00 54.58 52.78 2c80 n ASN 61 Cb 0.59 0.00 0.20 0.00 -2.53 0.00 0.00 39.78 38.04 2c80 n ASN 61 CO 0.00 0.00 0.00 1.41 -0.44 0.00 0.00 177.26 178.23 2c80 n HIS 62 N -0.63 0.04 -0.94 -2.53 8.25 -1.26 -5.00 115.22 113.15 2c80 n HIS 62 Ca 0.05 -1.44 0.00 0.00 -0.26 0.00 0.00 57.72 56.07 2c80 n HIS 62 Cb 0.02 -0.25 0.00 0.00 1.12 0.00 0.00 29.99 30.89 2c80 n HIS 62 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2c80 n GLY 63 N -1.16 0.65 3.73 -1.41 0.00 -1.01 -5.00 105.19 100.99 2c80 n GLY 63 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 2c80 n GLY 63 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2c80 s HIS 64 N -2.80 3.45 -0.25 1.61 3.76 -1.26 -4.86 115.29 114.94 2c80 s HIS 64 Ca 0.00 1.41 -0.01 0.00 -0.15 0.00 0.00 55.06 56.31 2c80 s HIS 64 Cb 0.00 -3.41 0.03 0.00 1.11 0.00 0.00 32.58 30.31 2c80 s HIS 64 CO 0.00 -1.15 -0.06 0.08 -0.85 0.00 0.00 174.74 172.75 2c80 s VAL 65 N 0.18 2.79 -0.25 -0.90 1.01 -1.26 -1.61 120.40 120.36 2c80 s VAL 65 Ca 0.54 -1.12 -0.06 0.00 0.00 0.00 0.00 61.98 61.34 2c80 s VAL 65 Cb -0.32 -2.45 -0.02 0.00 0.00 0.00 0.00 36.38 33.60 2c80 s VAL 65 CO 0.35 0.16 0.04 -0.75 0.00 0.00 0.00 175.10 174.89 2c80 s LYS 66 N 1.29 3.47 -0.10 2.72 2.20 0.12 -4.95 119.74 124.49 2c80 s LYS 66 Ca -0.01 -0.59 -0.13 0.00 -0.36 0.00 0.00 55.97 54.88 2c80 s LYS 66 Cb -0.17 -3.24 -0.05 0.00 -1.51 0.00 0.00 37.83 32.86 2c80 s LYS 66 CO -0.04 -0.24 0.31 -1.58 -0.36 0.00 0.00 175.35 173.44 2c80 s TRP 67 N 1.55 3.58 -0.03 4.03 0.52 -1.26 -0.31 118.94 127.03 2c80 s TRP 67 Ca 0.05 0.73 0.03 0.00 0.02 0.00 0.00 56.10 56.94 2c80 s TRP 67 Cb -0.15 -2.26 -0.00 0.00 -1.15 0.00 0.00 33.47 29.91 2c80 s TRP 67 CO 0.01 0.46 -0.12 -1.64 0.02 0.00 0.00 176.95 175.68 2c80 s MET 68 N -0.32 1.22 0.37 4.98 -1.94 0.30 -4.99 119.30 118.92 2c80 s MET 68 Ca 0.19 -0.43 0.03 0.00 -1.71 0.00 0.00 55.69 53.77 2c80 s MET 68 Cb -0.14 -1.12 -0.04 0.00 2.01 0.00 0.00 34.83 35.54 2c80 s MET 68 CO 0.07 0.20 0.09 0.14 -0.01 0.00 0.00 175.02 175.51 2c80 s VAL 69 N 0.02 0.90 -0.09 -6.03 -7.23 -1.26 -0.41 120.40 106.29 2c80 s VAL 69 Ca -0.01 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.13 2c80 s VAL 69 Cb -0.08 -2.56 0.01 0.00 0.56 0.00 0.00 36.38 34.31 2c80 s VAL 69 CO 0.01 0.00 0.06 1.21 -0.31 0.00 0.00 175.10 176.07 2c80 n GLU 70 N -0.81 -1.65 -0.14 4.82 4.07 -1.26 -4.43 120.64 121.24 2c80 n GLU 70 Ca -0.05 1.57 -0.04 0.00 -0.06 0.00 0.00 57.16 58.58 2c80 n GLU 70 Cb 0.66 -2.66 0.03 0.00 -0.06 0.00 0.00 31.44 29.41 2c80 n GLU 70 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 2c80 h SER 71 N 1.45 -0.48 1.60 4.31 4.64 -1.86 -1.03 113.55 122.17 2c80 h SER 71 Ca -0.14 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2c80 h SER 71 Cb 0.31 0.31 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 2c80 h SER 71 CO 0.02 -0.17 0.00 -0.07 -0.87 0.00 0.00 176.83 175.74 2c80 h LEU 72 N -0.02 0.00 -0.14 5.97 3.38 -1.92 0.10 115.31 122.67 2c80 h LEU 72 Ca 0.22 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.13 2c80 h LEU 72 Cb 0.36 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2c80 h LEU 72 CO -0.49 0.00 -0.15 0.00 0.09 0.00 0.00 178.44 177.89 2c80 h ALA 73 N 2.06 0.21 0.09 1.53 0.00 -1.54 -1.60 119.26 120.01 2c80 h ALA 73 Ca 0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 2c80 h ALA 73 Cb 0.80 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 2c80 h ALA 73 CO 0.00 0.10 -0.06 0.82 0.00 0.00 0.00 179.25 180.11 2c80 h ILE 74 N -0.02 0.87 -0.61 0.00 2.04 -0.97 -1.42 117.51 117.41 2c80 h ILE 74 Ca 0.02 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.89 2c80 h ILE 74 Cb 0.69 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 37.61 2c80 h ILE 74 CO 0.04 0.00 0.40 0.00 0.00 0.00 0.00 178.15 178.59 2c80 h ALA 75 N 0.76 0.77 -0.66 1.87 0.00 -1.04 0.11 119.26 121.08 2c80 h ALA 75 Ca -0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2c80 h ALA 75 Cb 0.13 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2c80 h ALA 75 CO -0.00 0.20 0.41 0.00 0.00 0.00 0.00 179.25 179.85 2c80 h ARG 76 N 0.82 0.90 0.39 0.00 3.08 -1.24 0.35 114.38 118.66 2c80 h ARG 76 Ca 0.23 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.19 2c80 h ARG 76 Cb -0.08 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.76 2c80 h ARG 76 CO -0.05 0.63 -0.36 -0.92 -1.07 0.00 0.00 179.97 178.19 2c80 h TYR 77 N 0.90 -0.98 -0.53 3.04 5.03 -0.76 0.56 116.97 124.23 2c80 h TYR 77 Ca 0.24 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.55 2c80 h TYR 77 Cb -0.04 0.38 -0.03 0.00 1.55 0.00 0.00 36.73 38.59 2c80 h TYR 77 CO -0.02 -0.51 0.30 0.52 -1.32 0.00 0.00 178.16 177.13 2c80 h MET 78 N -0.77 0.73 -0.55 1.82 2.86 -0.75 -1.37 114.93 116.91 2c80 h MET 78 Ca -0.03 -0.08 0.02 0.00 -2.06 0.00 0.00 59.70 57.55 2c80 h MET 78 Cb 0.68 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 32.16 2c80 h MET 78 CO -0.05 0.56 0.35 0.00 1.06 0.00 0.00 176.91 178.83 2c80 h ALA 79 N 1.13 0.71 -0.33 6.32 0.00 -0.29 -2.34 119.26 124.47 2c80 h ALA 79 Ca 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2c80 h ALA 79 Cb 0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2c80 h ALA 79 CO -0.03 0.08 0.21 -0.22 0.00 0.00 0.00 179.25 179.29 2c80 h LYS 80 N 0.69 0.44 -0.62 0.00 3.11 -0.57 0.36 116.57 119.98 2c80 h LYS 80 Ca 0.22 -0.03 0.14 0.00 -2.81 0.00 0.00 60.65 58.16 2c80 h LYS 80 Cb -0.02 -0.10 -0.03 0.00 -1.00 0.00 0.00 32.23 31.08 2c80 h LYS 80 CO -0.08 0.32 0.43 0.87 -2.81 0.00 0.00 179.45 178.18 2c80 h LYS 81 N 0.43 0.23 -0.29 1.90 1.79 -0.98 -2.55 116.57 117.10 2c80 h LYS 81 Ca 0.12 -0.01 -0.12 0.00 -2.18 0.00 0.00 60.65 58.46 2c80 h LYS 81 Cb -0.02 -0.05 -0.07 0.00 -1.58 0.00 0.00 32.23 30.51 2c80 h LYS 81 CO -0.02 0.15 -0.07 0.72 -1.08 0.00 0.00 179.45 179.14 2c80 n HIS 82 N -4.43 0.94 -3.65 -1.35 8.25 -0.89 -4.97 115.22 109.11 2c80 n HIS 82 Ca 0.11 -1.39 -0.23 0.00 -0.26 0.00 0.00 57.72 55.96 2c80 n HIS 82 Cb 0.53 -0.42 0.06 0.00 1.12 0.00 0.00 29.99 31.28 2c80 n HIS 82 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2c80 n HIS 83 N -1.00 -2.38 -1.11 4.41 8.25 -0.65 -4.91 115.22 117.83 2c80 n HIS 83 Ca 0.29 0.94 0.08 0.00 -0.26 0.00 0.00 57.72 58.77 2c80 n HIS 83 Cb 0.96 -4.68 0.19 0.00 1.12 0.00 0.00 29.99 27.58 2c80 n HIS 83 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2c80 n MET 84 N -4.56 1.92 -0.05 -0.41 2.81 0.12 -4.60 117.12 112.34 2c80 n MET 84 Ca -0.12 -2.77 0.04 0.00 -1.81 0.00 0.00 57.70 53.03 2c80 n MET 84 Cb 0.61 -1.65 0.06 0.00 -0.71 0.00 0.00 33.22 31.52 2c80 n MET 84 CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 2c80 n MET 85 N -1.07 2.47 0.00 0.03 2.00 -1.25 -0.88 117.12 118.42 2c80 n MET 85 Ca 0.19 -1.90 0.00 0.00 0.00 0.00 0.00 57.70 55.99 2c80 n MET 85 Cb 0.76 -1.20 0.00 0.00 0.00 0.00 0.00 33.22 32.79 2c80 n MET 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2c80 n GLY 86 N -0.72 2.85 0.09 3.03 0.00 -1.26 -3.95 105.19 105.24 2c80 n GLY 86 Ca 0.06 -1.64 0.11 0.00 0.00 0.00 0.00 46.02 44.55 2c80 n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c80 n GLY 87 N 0.69 -1.37 3.33 -0.02 0.00 -1.26 -4.79 105.19 101.77 2c80 n GLY 87 Ca 0.00 -0.29 -0.17 0.00 0.00 0.00 0.00 46.02 45.56 2c80 n GLY 87 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2c80 s THR 88 N -3.39 0.81 0.32 2.61 -4.23 -1.26 -5.03 115.64 105.48 2c80 s THR 88 Ca -0.02 -2.01 0.03 0.00 -1.18 0.00 0.00 61.69 58.51 2c80 s THR 88 Cb 0.10 -2.51 0.29 0.00 1.34 0.00 0.00 72.50 71.72 2c80 s THR 88 CO 0.82 -0.15 1.92 -0.33 -0.54 0.00 0.00 174.62 176.33 2c80 h GLU 89 N 2.41 0.88 -0.24 3.99 5.08 -1.97 0.16 114.58 124.89 2c80 h GLU 89 Ca -0.38 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 57.87 2c80 h GLU 89 Cb 1.23 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 2c80 h GLU 89 CO 0.63 0.58 -0.07 0.93 -1.00 0.00 0.00 179.01 180.08 2c80 h GLU 90 N 0.91 0.47 -0.70 2.33 3.07 -1.99 -1.34 114.58 117.32 2c80 h GLU 90 Ca 0.38 -0.19 -0.04 0.00 -0.50 0.00 0.00 59.36 59.01 2c80 h GLU 90 Cb 0.29 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.15 2c80 h GLU 90 CO -0.15 0.71 0.27 0.93 -1.40 0.00 0.00 179.01 179.37 2c80 h GLU 91 N 0.20 1.06 -0.50 2.33 5.08 -1.87 -2.45 114.58 118.43 2c80 h GLU 91 Ca 0.06 -0.20 0.07 0.00 -1.00 0.00 0.00 59.36 58.29 2c80 h GLU 91 Cb 0.55 -0.17 -0.06 0.00 0.50 0.00 0.00 28.75 29.57 2c80 h GLU 91 CO 0.03 0.88 0.15 -0.92 -1.00 0.00 0.00 179.01 178.15 2c80 h TYR 92 N 1.01 0.26 -0.37 4.33 3.20 -0.58 -0.29 116.97 124.52 2c80 h TYR 92 Ca 0.23 0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.16 2c80 h TYR 92 Cb 0.23 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.43 2c80 h TYR 92 CO 0.02 0.06 0.17 -0.92 -1.64 0.00 0.00 178.16 175.85 2c80 h TYR 93 N 0.31 0.32 -0.40 -3.82 5.03 -1.09 -1.52 116.97 115.80 2c80 h TYR 93 Ca 0.24 0.02 -0.11 0.00 2.58 0.00 0.00 58.73 61.46 2c80 h TYR 93 Cb 0.29 -0.09 -0.01 0.00 1.55 0.00 0.00 36.73 38.46 2c80 h TYR 93 CO -0.19 0.16 -0.20 -0.91 -1.32 0.00 0.00 178.16 175.71 2c80 h ASN 94 N 0.36 0.78 0.09 -2.11 2.35 -1.02 0.47 115.58 116.50 2c80 h ASN 94 Ca 0.16 -0.27 0.02 0.00 -0.55 0.00 0.00 56.30 55.66 2c80 h ASN 94 Cb 0.08 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.20 2c80 h ASN 94 CO -0.12 0.97 -0.27 0.58 -1.65 0.00 0.00 177.43 176.93 2c80 h VAL 95 N 0.68 0.40 -0.61 2.81 2.07 -0.97 -2.37 116.25 118.26 2c80 h VAL 95 Ca 0.10 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.57 2c80 h VAL 95 Cb 0.70 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 2c80 h VAL 95 CO 0.05 0.00 0.20 -0.33 0.02 0.00 0.00 177.57 177.51 2c80 h GLU 96 N -0.47 0.92 -0.27 1.57 4.39 -0.86 -1.87 114.58 117.99 2c80 h GLU 96 Ca 0.04 -0.17 0.03 0.00 0.34 0.00 0.00 59.36 59.59 2c80 h GLU 96 Cb 0.51 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.98 2c80 h GLU 96 CO -0.17 0.78 0.10 -0.22 -1.16 0.00 0.00 179.01 178.35 2c80 h LYS 97 N 0.89 0.23 -0.37 2.33 3.64 0.03 -0.41 116.57 122.91 2c80 h LYS 97 Ca 0.20 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.46 2c80 h LYS 97 Cb 0.24 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 2c80 h LYS 97 CO -0.01 0.15 -0.20 1.25 -2.27 0.00 0.00 179.45 178.36 2c80 h LEU 98 N 0.23 0.72 -0.62 5.20 5.85 -1.25 -1.68 115.31 123.77 2c80 h LEU 98 Ca 0.12 -0.25 -0.03 0.00 0.84 0.00 0.00 57.88 58.56 2c80 h LEU 98 Cb 0.07 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 2c80 h LEU 98 CO -0.11 0.91 0.28 0.40 -0.34 0.00 0.00 178.44 179.59 2c80 h ILE 99 N 0.63 1.22 -0.44 4.05 2.04 -1.14 -0.61 117.51 123.26 2c80 h ILE 99 Ca 0.09 -0.65 -0.01 0.00 1.00 0.00 0.00 64.86 65.29 2c80 h ILE 99 Cb 0.69 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 2c80 h ILE 99 CO 0.05 0.26 0.23 1.23 0.00 0.00 0.00 178.15 179.92 2c80 h GLY 100 N 0.85 0.67 1.13 5.37 0.00 -0.89 0.76 103.07 110.96 2c80 h GLY 100 Ca 0.21 -0.32 -0.09 0.00 0.00 0.00 0.00 47.33 47.13 2c80 h GLY 100 CO -0.02 0.30 0.03 1.46 0.00 0.00 0.00 176.54 178.31 2c80 h GLN 101 N 0.57 1.05 -0.21 4.80 4.20 -1.20 -1.78 115.11 122.54 2c80 h GLN 101 Ca 0.15 -0.31 -0.16 0.00 0.06 0.00 0.00 58.65 58.39 2c80 h GLN 101 Cb 0.09 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 2c80 h GLN 101 CO -0.02 1.01 -0.53 0.00 -0.67 0.00 0.00 178.83 178.61 2c80 h ALA 102 N 1.05 0.66 -0.26 3.87 0.00 -0.96 -2.81 119.26 120.82 2c80 h ALA 102 Ca 0.18 -0.51 -0.09 0.00 0.00 0.00 0.00 54.91 54.49 2c80 h ALA 102 Cb 0.52 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2c80 h ALA 102 CO 0.02 0.68 -0.24 0.93 0.00 0.00 0.00 179.25 180.65 2c80 h GLU 103 N 0.48 0.49 -0.52 0.00 4.39 -0.74 -0.47 114.58 118.20 2c80 h GLU 103 Ca 0.01 -0.18 0.05 0.00 0.34 0.00 0.00 59.36 59.58 2c80 h GLU 103 Cb 1.09 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 29.66 2c80 h GLU 103 CO 0.10 0.69 0.26 -0.44 -1.16 0.00 0.00 179.01 178.47 2c80 h ASP 104 N 0.43 0.38 -0.53 1.42 3.45 -1.22 -1.13 116.42 119.21 2c80 h ASP 104 Ca 0.06 0.03 -0.04 0.00 0.43 0.00 0.00 57.03 57.51 2c80 h ASP 104 Cb 0.66 -0.04 -0.02 0.00 -0.56 0.00 0.00 39.33 39.36 2c80 h ASP 104 CO 0.05 0.26 0.16 0.25 -1.57 0.00 0.00 179.24 178.38 2c80 h LEU 105 N 0.51 0.78 -0.89 1.55 5.85 -1.23 -2.26 115.31 119.63 2c80 h LEU 105 Ca 0.23 -0.21 0.06 0.00 0.84 0.00 0.00 57.88 58.80 2c80 h LEU 105 Cb 0.14 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 40.90 2c80 h LEU 105 CO -0.16 0.79 0.56 -0.08 -0.34 0.00 0.00 178.44 179.21 2c80 h GLU 106 N 0.74 0.99 0.00 1.25 4.57 -0.73 -1.93 114.58 119.47 2c80 h GLU 106 Ca 0.17 -0.06 -0.03 0.00 -1.18 0.00 0.00 59.36 58.26 2c80 h GLU 106 Cb 0.29 -0.22 -0.00 0.00 -0.16 0.00 0.00 28.75 28.66 2c80 h GLU 106 CO -0.00 0.65 -0.15 0.45 -1.18 0.00 0.00 179.01 178.78 2c80 h HIS 107 N 1.02 0.00 -0.18 0.92 3.86 -0.94 -1.06 115.15 118.76 2c80 h HIS 107 Ca 0.39 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.54 2c80 h HIS 107 Cb 0.17 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.64 2c80 h HIS 107 CO -0.03 0.15 -0.12 0.93 0.86 0.00 0.00 177.93 179.73 2c80 h GLU 108 N 0.00 0.40 -0.36 2.45 4.39 -0.78 -3.21 114.58 117.47 2c80 h GLU 108 Ca -0.00 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.51 2c80 h GLU 108 Cb 0.71 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.33 2c80 h GLU 108 CO 0.02 0.72 0.24 -0.92 -1.16 0.00 0.00 179.01 177.91 2c80 h TYR 109 N 0.08 0.45 -0.18 4.33 3.20 -0.91 -2.72 116.97 121.23 2c80 h TYR 109 Ca 0.04 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.90 2c80 h TYR 109 Cb 0.62 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.72 2c80 h TYR 109 CO 0.07 0.29 0.01 1.88 -1.64 0.00 0.00 178.16 178.77 2c80 h TYR 110 N 0.49 0.25 -0.18 -3.82 0.99 -1.21 -2.77 116.97 110.72 2c80 h TYR 110 Ca 0.13 -0.01 0.05 0.00 2.00 0.00 0.00 58.73 60.91 2c80 h TYR 110 Cb -0.05 -0.08 -0.01 0.00 1.00 0.00 0.00 36.73 37.59 2c80 h TYR 110 CO 0.00 0.26 0.20 0.87 -0.00 0.00 0.00 178.16 179.49 2c80 h LYS 111 N 0.25 0.00 0.00 4.88 1.57 -1.53 -1.86 116.57 119.88 2c80 h LYS 111 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2c80 h LYS 111 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 2c80 h LYS 111 CO 0.00 0.00 -0.34 0.25 -0.57 0.00 0.00 179.45 178.80 2c80 n THR 112 N -3.83 0.26 -2.90 -0.16 -2.24 -1.04 -4.91 114.28 99.45 2c80 n THR 112 Ca 0.02 -0.16 -0.31 0.00 -2.27 0.00 0.00 64.05 61.33 2c80 n THR 112 Cb 0.32 -0.22 -0.04 0.00 -2.10 0.00 0.00 70.33 68.30 2c80 n THR 112 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2c80 s LEU 113 N -3.77 3.88 -1.88 3.22 1.43 -0.70 -4.04 118.68 116.81 2c80 s LEU 113 Ca 0.10 1.22 0.00 0.00 -1.03 0.00 0.00 54.13 54.42 2c80 s LEU 113 Cb 0.15 -4.09 0.00 0.00 0.03 0.00 0.00 46.19 42.29 2c80 s LEU 113 CO 0.65 -0.36 0.00 0.23 0.23 0.00 0.00 176.35 177.10 2c80 n MET 114 N -1.04 -1.63 -5.00 1.70 2.81 -1.26 -4.99 117.12 107.71 2c80 n MET 114 Ca 0.03 1.06 -0.31 0.00 -1.81 0.00 0.00 57.70 56.67 2c80 n MET 114 Cb 0.54 -5.62 -0.14 0.00 -0.71 0.00 0.00 33.22 27.28 2c80 n MET 114 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2c80 s LYS 115 N -4.59 2.14 0.48 0.03 3.01 -1.26 -5.12 119.74 114.43 2c80 s LYS 115 Ca 0.00 -0.92 -0.23 0.00 -1.01 0.00 0.00 55.97 53.81 2c80 s LYS 115 Cb 0.00 -2.14 -0.07 0.00 -1.01 0.00 0.00 37.83 34.61 2c80 s LYS 115 CO 0.00 0.56 1.24 -2.14 0.51 0.00 0.00 175.35 175.53 2c80 s PRO 116 N -0.94 3.58 0.06 -1.68 0.02 -1.26 -4.65 135.00 130.14 2c80 s PRO 116 Ca 0.12 1.97 -0.12 0.00 0.02 0.00 0.00 61.00 62.99 2c80 s PRO 116 Cb -0.10 -2.40 -0.03 0.00 0.02 0.00 0.00 34.50 31.99 2c80 s PRO 116 CO 0.01 -0.75 0.90 -1.91 -0.33 0.00 0.00 177.00 174.93 2c80 n GLU 117 N -0.58 -0.17 0.00 5.54 4.07 -1.26 -1.64 120.64 126.60 2c80 n GLU 117 Ca 0.08 0.89 0.00 0.00 -0.06 0.00 0.00 57.16 58.07 2c80 n GLU 117 Cb 0.46 -1.32 0.00 0.00 -0.06 0.00 0.00 31.44 30.52 2c80 n GLU 117 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22 2c80 n GLU 118 N -3.91 0.00 0.17 5.31 0.28 -1.26 -1.84 120.64 119.39 2c80 n GLU 118 Ca 0.01 0.07 0.12 0.00 -0.16 0.00 0.00 57.16 57.20 2c80 n GLU 118 Cb 0.10 -0.12 0.27 0.00 1.43 0.00 0.00 31.44 33.13 2c80 n GLU 118 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 177.13 178.02 2c80 h GLU 119 N 0.00 0.00 -0.61 3.44 4.11 -1.68 -2.89 114.58 116.96 2c80 h GLU 119 Ca 0.00 0.00 0.06 0.00 0.07 0.00 0.00 59.36 59.49 2c80 h GLU 119 Cb 0.00 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.19 2c80 h GLU 119 CO 0.00 0.00 0.31 -0.22 0.07 0.00 0.00 179.01 179.17 2c80 h LYS 120 N 0.00 0.55 -0.41 1.06 3.64 -0.57 -1.19 116.57 119.66 2c80 h LYS 120 Ca 0.00 -0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 59.22 2c80 h LYS 120 Cb 0.88 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.57 2c80 h LYS 120 CO 0.00 0.36 -0.27 0.37 -2.27 0.00 0.00 179.45 177.65 2c80 h GLN 121 N 0.57 0.85 -0.61 1.90 -0.00 -1.18 -0.10 115.11 116.55 2c80 h GLN 121 Ca 0.28 -0.38 -0.02 0.00 -0.00 0.00 0.00 58.65 58.53 2c80 h GLN 121 Cb 0.22 -0.02 -0.03 0.00 0.00 0.00 0.00 27.48 27.65 2c80 h GLN 121 CO -0.20 1.02 0.31 0.87 0.00 0.00 0.00 178.83 180.82 2c80 h LYS 122 N 0.73 0.87 -0.34 1.69 1.57 -1.45 -2.07 116.57 117.58 2c80 h LYS 122 Ca 0.09 -0.12 -0.09 0.00 -1.87 0.00 0.00 60.65 58.66 2c80 h LYS 122 Cb 0.81 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.95 2c80 h LYS 122 CO 0.07 0.69 -0.14 0.82 -0.57 0.00 0.00 179.45 180.32 2c80 h ILE 123 N 0.83 1.29 -0.25 1.86 2.04 -1.08 -1.75 117.51 120.45 2c80 h ILE 123 Ca 0.21 -1.23 0.06 0.00 1.00 0.00 0.00 64.86 64.90 2c80 h ILE 123 Cb 0.09 1.38 -0.07 0.00 -0.74 0.00 0.00 36.82 37.48 2c80 h ILE 123 CO -0.03 0.40 -0.18 0.40 0.00 0.00 0.00 178.15 178.74 2c80 h ILE 124 N 0.46 0.50 -0.69 -0.67 2.04 -0.92 -0.53 117.51 117.70 2c80 h ILE 124 Ca 0.08 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.97 2c80 h ILE 124 Cb 0.66 0.50 -0.05 0.00 -0.74 0.00 0.00 36.82 37.19 2c80 h ILE 124 CO 0.04 0.00 0.43 0.11 0.00 0.00 0.00 178.15 178.73 2c80 h LYS 125 N -0.17 0.80 0.17 2.37 1.57 -1.29 -0.88 116.57 119.15 2c80 h LYS 125 Ca 0.14 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.88 2c80 h LYS 125 Cb 0.38 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 2c80 h LYS 125 CO -0.36 0.53 -0.25 0.93 -0.57 0.00 0.00 179.45 179.74 2c80 h GLU 126 N 0.83 -0.47 -0.20 3.15 5.08 -0.70 -1.65 114.58 120.62 2c80 h GLU 126 Ca 0.28 0.03 -0.18 0.00 -1.00 0.00 0.00 59.36 58.49 2c80 h GLU 126 Cb 0.05 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 2c80 h GLU 126 CO -0.12 -0.31 -0.61 -0.84 -1.00 0.00 0.00 179.01 176.13 2c80 h ILE 127 N -0.49 1.31 0.00 3.13 3.07 -0.83 -1.90 117.51 121.80 2c80 h ILE 127 Ca 0.01 -1.85 -0.05 0.00 1.55 0.00 0.00 64.86 64.52 2c80 h ILE 127 Cb 0.48 1.81 -0.01 0.00 -0.27 0.00 0.00 36.82 38.83 2c80 h ILE 127 CO -0.10 0.58 -0.23 -0.07 -1.05 0.00 0.00 178.15 177.28 2c80 h LEU 128 N 0.50 0.00 0.00 0.16 3.38 -1.19 -1.34 115.31 116.82 2c80 h LEU 128 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2c80 h LEU 128 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2c80 h LEU 128 CO 0.12 0.23 -0.50 0.59 0.09 0.00 0.00 178.44 178.97 2c80 n ASN 129 N -3.82 0.51 0.00 -0.43 4.13 -0.62 -4.50 115.26 110.53 2c80 n ASN 129 Ca -0.02 -0.07 0.00 0.00 1.68 0.00 0.00 54.58 56.17 2c80 n ASN 129 Cb 0.33 0.16 0.00 0.00 -1.54 0.00 0.00 39.78 38.73 2c80 n ASN 129 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2c80 n GLY 130 N 1.45 1.00 0.12 7.41 0.00 -0.73 -4.98 105.19 109.46 2c80 n GLY 130 Ca 0.05 -0.01 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 2c80 n GLY 130 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c80 h LYS 131 N 0.00 0.08 0.55 1.61 1.79 -1.68 -3.27 116.57 115.65 2c80 h LYS 131 Ca 0.00 -0.07 -0.02 0.00 -2.18 0.00 0.00 60.65 58.38 2c80 h LYS 131 Cb 0.00 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 30.65 2c80 h LYS 131 CO 0.00 0.80 -0.48 0.28 -1.08 0.00 0.00 179.45 178.96 2c80 h VAL 132 N 0.05 0.05 -0.73 0.50 2.07 -1.58 0.27 116.25 116.88 2c80 h VAL 132 Ca -0.02 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.55 2c80 h VAL 132 Cb 1.34 0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 2c80 h VAL 132 CO 0.11 0.00 0.48 1.55 0.02 0.00 0.00 177.57 179.73 2c80 h PRO 133 N -1.02 0.79 -0.46 1.57 0.13 -1.78 0.46 132.00 131.70 2c80 h PRO 133 Ca -0.07 -0.05 0.05 0.00 -0.87 0.00 0.00 66.00 65.07 2c80 h PRO 133 Cb 0.87 -0.18 -0.05 0.00 0.13 0.00 0.00 31.00 31.77 2c80 h PRO 133 CO -0.03 0.53 0.19 0.28 -0.23 0.00 0.00 178.00 178.74 2c80 h VAL 134 N 0.82 0.89 -0.09 1.56 2.07 -1.55 -1.40 116.25 118.55 2c80 h VAL 134 Ca 0.31 -0.13 -0.20 0.00 0.82 0.00 0.00 66.70 67.49 2c80 h VAL 134 Cb 0.17 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 2c80 h VAL 134 CO -0.10 0.07 -0.78 -0.07 0.02 0.00 0.00 177.57 176.72 2c80 h LEU 135 N 0.38 0.65 -0.82 2.57 3.38 -0.11 -2.68 115.31 118.68 2c80 h LEU 135 Ca 0.21 -0.44 -0.05 0.00 0.09 0.00 0.00 57.88 57.70 2c80 h LEU 135 Cb 0.18 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 2c80 h LEU 135 CO -0.19 1.21 0.31 -0.07 0.09 0.00 0.00 178.44 179.78 2c80 h LEU 136 N 0.36 1.09 -0.32 1.67 3.38 -0.76 -0.26 115.31 120.47 2c80 h LEU 136 Ca -0.05 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 2c80 h LEU 136 Cb 1.38 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 2c80 h LEU 136 CO 0.14 0.97 0.10 -0.78 0.09 0.00 0.00 178.44 178.96 2c80 h ASP 137 N 1.15 0.47 -0.80 -0.43 -0.00 -1.26 -0.86 116.42 114.69 2c80 h ASP 137 Ca 0.26 -0.21 0.07 0.00 -0.00 0.00 0.00 57.03 57.15 2c80 h ASP 137 Cb 0.22 -0.12 -0.06 0.00 -0.00 0.00 0.00 39.33 39.37 2c80 h ASP 137 CO -0.02 0.55 0.48 0.40 -0.00 0.00 0.00 179.24 180.65 2c80 h ILE 138 N 0.36 0.99 -0.67 2.25 2.04 -1.22 0.43 117.51 121.69 2c80 h ILE 138 Ca 0.10 -0.29 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 2c80 h ILE 138 Cb 0.25 0.06 -0.03 0.00 -0.74 0.00 0.00 36.82 36.36 2c80 h ILE 138 CO -0.00 0.16 0.33 0.40 0.00 0.00 0.00 178.15 179.04 2c80 h ILE 139 N 0.86 1.22 -0.79 -0.67 2.04 -0.87 -1.73 117.51 117.57 2c80 h ILE 139 Ca 0.36 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.60 2c80 h ILE 139 Cb 0.22 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 36.64 2c80 h ILE 139 CO -0.19 0.26 0.47 0.00 0.00 0.00 0.00 178.15 178.69 2c80 h GLU 141 N 1.09 0.84 -0.35 0.00 4.39 -0.64 -0.88 114.58 119.04 2c80 h GLU 141 Ca 0.28 -0.28 0.04 0.00 0.34 0.00 0.00 59.36 59.74 2c80 h GLU 141 Cb -0.03 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.51 2c80 h GLU 141 CO -0.05 0.90 0.13 0.77 -1.16 0.00 0.00 179.01 179.60 2c80 h SER 142 N 0.69 0.16 -0.71 1.42 0.02 -0.84 -2.53 113.55 111.76 2c80 h SER 142 Ca 0.13 0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 61.07 2c80 h SER 142 Cb 0.53 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.05 2c80 h SER 142 CO 0.03 0.13 0.26 -0.07 -1.14 0.00 0.00 176.83 176.04 2c80 h LEU 143 N 0.29 0.99 -1.26 5.07 3.38 -0.97 -2.79 115.31 120.03 2c80 h LEU 143 Ca 0.16 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 57.96 2c80 h LEU 143 Cb 0.12 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 2c80 h LEU 143 CO -0.15 0.91 0.50 0.50 0.09 0.00 0.00 178.44 180.30 2c80 h LYS 144 N 1.02 0.98 0.00 1.13 3.64 -1.01 -2.39 116.57 119.95 2c80 h LYS 144 Ca 0.23 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 2c80 h LYS 144 Cb 0.24 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2c80 h LYS 144 CO -0.02 0.65 0.00 0.00 -2.27 0.00 0.00 179.45 177.81 2c80 n ALA 145 N -2.42 2.30 -1.77 5.00 0.00 -0.97 -4.85 120.51 117.80 2c80 n ALA 145 Ca 0.09 -0.13 -0.37 0.00 0.00 0.00 0.00 53.44 53.03 2c80 n ALA 145 Cb 0.05 -1.38 -0.01 0.00 0.00 0.00 0.00 19.45 18.11 2c80 n ALA 145 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2c80 s SER 146 N -2.25 6.13 0.00 0.00 0.15 -0.90 -4.94 113.70 111.89 2c80 s SER 146 Ca 0.30 2.31 0.28 0.00 0.70 0.00 0.00 55.95 59.54 2c80 s SER 146 Cb 0.16 -2.60 1.04 0.00 -1.71 0.00 0.00 66.02 62.91 2c80 s SER 146 CO 0.31 -0.95 1.74 0.35 1.20 0.00 0.00 173.24 175.89 2c80 n THR 147 N -0.54 0.00 -3.80 6.45 -2.24 -1.26 -4.94 114.28 107.96 2c80 n THR 147 Ca 0.08 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2c80 n THR 147 Cb 0.48 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 2c80 n THR 147 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c80 n GLY 148 N 1.29 4.57 0.20 3.38 0.00 -1.24 -4.87 105.19 108.53 2c80 n GLY 148 Ca 0.14 -1.86 0.04 0.00 0.00 0.00 0.00 46.02 44.33 2c80 n GLY 148 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c80 h LYS 149 N 0.00 0.00 0.00 1.61 1.79 -1.85 -3.45 116.57 114.67 2c80 h LYS 149 Ca 0.00 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 2c80 h LYS 149 Cb 0.00 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2c80 h LYS 149 CO 0.00 0.32 -0.00 1.28 -1.08 0.00 0.00 179.45 179.97 2c80 n LEU 150 N -4.08 0.00 -0.15 2.94 4.77 -0.73 -4.81 117.00 114.93 2c80 n LEU 150 Ca -0.02 -0.06 -0.05 0.00 -0.03 0.00 0.00 56.01 55.85 2c80 n LEU 150 Cb 0.37 -0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.50 2c80 n LEU 150 CO 0.38 -0.34 1.00 0.00 -1.33 0.00 0.00 177.39 177.10 2c80 h ALA 151 N 0.66 0.60 -3.12 -1.18 0.00 -1.89 -3.39 119.26 110.95 2c80 h ALA 151 Ca -0.01 0.03 -0.49 0.00 0.00 0.00 0.00 54.91 54.44 2c80 h ALA 151 Cb 0.03 -0.05 -0.41 0.00 0.00 0.00 0.00 17.79 17.36 2c80 h ALA 151 CO 0.01 -0.13 -0.76 0.08 0.00 0.00 0.00 179.25 178.46 2c80 s VAL 152 N -6.14 0.15 0.00 0.00 1.01 -1.26 -4.52 120.40 109.64 2c80 s VAL 152 Ca -0.13 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.49 2c80 s VAL 152 Cb 0.13 -0.78 0.00 0.00 0.00 0.00 0.00 36.38 35.74 2c80 s VAL 152 CO 0.73 -0.28 0.00 0.61 0.00 0.00 0.00 175.10 176.16 2c80 n GLY 153 N 5.19 0.39 0.00 4.51 0.00 -1.26 -4.37 105.19 109.65 2c80 n GLY 153 Ca -0.08 -0.84 0.04 0.00 0.00 0.00 0.00 46.02 45.14 2c80 n GLY 153 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2c80 n ASP 154 N -0.98 0.88 -4.88 1.61 8.00 -1.26 -1.78 116.55 118.14 2c80 n ASP 154 Ca 0.00 -0.57 -0.27 0.00 0.71 0.00 0.00 54.79 54.67 2c80 n ASP 154 Cb 0.00 1.07 -0.04 0.00 -0.02 0.00 0.00 41.12 42.13 2c80 n ASP 154 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2c80 s LYS 155 N -1.93 3.20 0.22 -1.24 -0.14 -1.26 -4.75 119.74 113.84 2c80 s LYS 155 Ca 0.02 -0.70 -0.30 0.00 -1.36 0.00 0.00 55.97 53.62 2c80 s LYS 155 Cb 0.06 -2.83 -0.10 0.00 -1.68 0.00 0.00 37.83 33.28 2c80 s LYS 155 CO 0.34 0.51 1.47 0.08 -0.76 0.00 0.00 175.35 176.99 2c80 s VAL 156 N -1.72 2.70 0.33 3.17 1.01 -1.26 -4.77 120.40 119.87 2c80 s VAL 156 Ca 0.33 0.56 0.05 0.00 0.00 0.00 0.00 61.98 62.92 2c80 s VAL 156 Cb -0.11 -3.36 -0.07 0.00 0.00 0.00 0.00 36.38 32.85 2c80 s VAL 156 CO 0.26 0.07 0.03 0.42 0.00 0.00 0.00 175.10 175.88 2c80 s THR 157 N 0.37 1.41 0.53 3.92 -4.23 -1.26 -4.53 115.64 111.85 2c80 s THR 157 Ca 0.62 -2.02 0.20 0.00 -1.18 0.00 0.00 61.69 59.31 2c80 s THR 157 Cb -0.42 -2.77 0.31 0.00 1.34 0.00 0.00 72.50 70.96 2c80 s THR 157 CO 0.39 -0.06 2.13 0.25 -0.54 0.00 0.00 174.62 176.80 2c80 h LEU 158 N 2.09 0.00 -1.08 4.79 5.85 -1.40 -2.35 115.31 123.20 2c80 h LEU 158 Ca -0.41 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.30 2c80 h LEU 158 Cb 1.24 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.23 2c80 h LEU 158 CO 0.71 0.00 0.50 0.00 -0.34 0.00 0.00 178.44 179.32 2c80 h ALA 159 N 1.94 1.31 -0.80 1.25 0.00 -1.84 -0.33 119.26 120.79 2c80 h ALA 159 Ca 0.05 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.92 2c80 h ALA 159 Cb 0.21 -0.34 -0.06 0.00 0.00 0.00 0.00 17.79 17.60 2c80 h ALA 159 CO -0.00 0.59 0.50 -0.44 0.00 0.00 0.00 179.25 179.90 2c80 h ASP 160 N 1.15 0.79 0.09 0.00 3.32 -1.81 -1.94 116.42 118.02 2c80 h ASP 160 Ca 0.30 0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.25 2c80 h ASP 160 Cb -0.05 -0.15 0.01 0.00 0.22 0.00 0.00 39.33 39.36 2c80 h ASP 160 CO -0.06 0.52 -0.52 -0.07 -1.72 0.00 0.00 179.24 177.39 2c80 h LEU 161 N 0.92 0.31 -0.74 1.55 3.38 -1.47 -2.96 115.31 116.30 2c80 h LEU 161 Ca 0.34 -0.96 0.07 0.00 0.09 0.00 0.00 57.88 57.43 2c80 h LEU 161 Cb 0.13 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.71 2c80 h LEU 161 CO -0.16 1.24 0.41 0.58 0.09 0.00 0.00 178.44 180.61 2c80 h VAL 162 N -0.58 0.94 -0.32 1.22 2.07 -1.12 -2.84 116.25 115.62 2c80 h VAL 162 Ca -0.09 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 2c80 h VAL 162 Cb 1.40 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 2c80 h VAL 162 CO 0.10 0.13 0.16 0.25 0.02 0.00 0.00 177.57 178.23 2c80 h LEU 163 N 0.73 0.41 -1.00 2.57 5.85 -1.37 -2.74 115.31 119.77 2c80 h LEU 163 Ca 0.34 -0.12 -0.11 0.00 0.84 0.00 0.00 57.88 58.84 2c80 h LEU 163 Cb 0.26 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 2c80 h LEU 163 CO -0.21 0.41 -0.49 0.16 -0.34 0.00 0.00 178.44 177.97 2c80 h ILE 164 N 0.39 1.35 -0.40 4.05 3.07 -1.44 -1.98 117.51 122.55 2c80 h ILE 164 Ca 0.11 -1.69 -0.15 0.00 1.55 0.00 0.00 64.86 64.68 2c80 h ILE 164 Cb 0.10 1.90 -0.01 0.00 -0.27 0.00 0.00 36.82 38.54 2c80 h ILE 164 CO -0.02 0.48 -0.33 0.00 -1.05 0.00 0.00 178.15 177.24 2c80 h ALA 165 N 1.49 0.58 -0.00 0.16 0.00 -1.43 -2.40 119.26 117.66 2c80 h ALA 165 Ca -0.00 -0.43 -0.17 0.00 0.00 0.00 0.00 54.91 54.30 2c80 h ALA 165 Cb 0.88 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2c80 h ALA 165 CO 0.06 0.65 -0.78 -0.24 0.00 0.00 0.00 179.25 178.94 2c80 h VAL 166 N 0.76 1.53 -0.58 0.00 3.04 -1.36 -2.66 116.25 116.99 2c80 h VAL 166 Ca 0.07 -2.60 -0.06 0.00 -1.01 0.00 0.00 66.70 63.11 2c80 h VAL 166 Cb 0.92 2.41 -0.03 0.00 -2.01 0.00 0.00 31.29 32.59 2c80 h VAL 166 CO 0.09 0.75 0.13 0.40 -1.01 0.00 0.00 177.57 177.92 2c80 h ILE 167 N 0.03 1.24 -0.30 3.17 1.08 -1.36 -1.36 117.51 120.02 2c80 h ILE 167 Ca -0.01 -0.87 -0.02 0.00 -0.39 0.00 0.00 64.86 63.57 2c80 h ILE 167 Cb 1.37 0.66 -0.02 0.00 -3.07 0.00 0.00 36.82 35.77 2c80 h ILE 167 CO 0.11 0.33 0.11 0.44 -0.69 0.00 0.00 178.15 178.45 2c80 h ASP 168 N 0.86 0.37 0.07 1.72 3.45 -1.17 0.00 116.42 121.72 2c80 h ASP 168 Ca 0.18 -0.03 -0.18 0.00 0.43 0.00 0.00 57.03 57.44 2c80 h ASP 168 Cb 0.33 -0.09 -0.00 0.00 -0.56 0.00 0.00 39.33 39.00 2c80 h ASP 168 CO 0.00 0.35 -0.63 0.45 -1.57 0.00 0.00 179.24 177.83 2c80 h HIS 169 N 0.41 0.70 -0.31 4.55 3.86 -1.08 -2.11 115.15 121.17 2c80 h HIS 169 Ca 0.10 -0.28 -0.04 0.00 -1.16 0.00 0.00 60.37 59.00 2c80 h HIS 169 Cb 0.10 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.43 2c80 h HIS 169 CO 0.00 1.03 0.04 0.28 0.86 0.00 0.00 177.93 180.14 2c80 h VAL 170 N 0.40 1.24 0.00 2.45 2.07 -0.56 -2.72 116.25 119.12 2c80 h VAL 170 Ca -0.01 -0.84 -0.06 0.00 0.82 0.00 0.00 66.70 66.62 2c80 h VAL 170 Cb 1.20 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 2c80 h VAL 170 CO 0.12 0.27 -0.26 0.71 0.02 0.00 0.00 177.57 178.43 2c80 h THR 171 N 0.34 0.88 -0.74 2.57 1.35 -1.05 -1.81 112.91 114.45 2c80 h THR 171 Ca 0.09 -1.02 0.06 0.00 -0.55 0.00 0.00 66.41 64.99 2c80 h THR 171 Cb 0.36 1.61 -0.05 0.00 -1.73 0.00 0.00 68.15 68.34 2c80 h THR 171 CO 0.01 0.26 0.49 0.44 -0.25 0.00 0.00 175.52 176.47 2c80 h ASP 172 N 0.00 0.71 0.63 5.36 3.45 -1.07 -2.08 116.42 123.41 2c80 h ASP 172 Ca -0.00 0.00 -0.19 0.00 0.43 0.00 0.00 57.03 57.27 2c80 h ASP 172 Cb 0.59 -0.15 -0.01 0.00 -0.56 0.00 0.00 39.33 39.19 2c80 h ASP 172 CO 0.03 0.46 -0.87 -0.07 -1.57 0.00 0.00 179.24 177.22 2c80 h LEU 173 N 0.81 0.21 -6.00 1.55 3.38 -1.17 -3.44 115.31 110.66 2c80 h LEU 173 Ca 0.32 -0.17 0.08 0.00 0.09 0.00 0.00 57.88 58.19 2c80 h LEU 173 Cb 0.22 -0.07 -0.21 0.00 0.09 0.00 0.00 40.66 40.69 2c80 h LEU 173 CO -0.10 0.98 -0.29 -0.62 0.09 0.00 0.00 178.44 178.50 2c80 s ASP 174 N -6.90 -1.43 0.35 -0.43 -1.08 -0.97 -5.06 116.67 101.15 2c80 s ASP 174 Ca -0.02 0.59 0.09 0.00 -0.52 0.00 0.00 52.55 52.69 2c80 s ASP 174 Cb 0.10 2.08 0.84 0.00 -1.46 0.00 0.00 42.92 44.47 2c80 s ASP 174 CO 0.82 -0.26 1.85 0.07 0.52 0.00 0.00 175.17 178.17 2c80 h LYS 175 N 7.99 0.65 -0.52 4.34 2.10 -1.67 -2.84 116.57 126.63 2c80 h LYS 175 Ca -0.14 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.47 2c80 h LYS 175 Cb 1.17 -0.15 0.00 0.00 -0.90 0.00 0.00 32.23 32.35 2c80 h LYS 175 CO 0.20 0.43 0.00 0.39 -2.00 0.00 0.00 179.45 178.47 2c80 n GLU 176 N -4.59 3.36 -0.30 0.07 -0.58 -1.26 -4.64 120.64 112.69 2c80 n GLU 176 Ca 0.19 -2.69 0.01 0.00 -0.42 0.00 0.00 57.16 54.25 2c80 n GLU 176 Cb 0.52 -1.73 0.20 0.00 -0.57 0.00 0.00 31.44 29.86 2c80 n GLU 176 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 2c80 h PHE 177 N 3.23 1.09 -0.02 -0.32 3.57 -1.86 -1.64 116.94 121.00 2c80 h PHE 177 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2c80 h PHE 177 Cb 1.27 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 39.64 2c80 h PHE 177 CO 0.59 0.65 -0.11 1.28 -2.23 0.00 0.00 178.31 178.48 2c80 n LEU 178 N -4.43 1.71 -4.68 0.59 4.32 -1.26 -4.83 117.00 108.41 2c80 n LEU 178 Ca 0.11 -0.56 -0.42 0.00 -0.02 0.00 0.00 56.01 55.13 2c80 n LEU 178 Cb 0.08 -0.03 -0.03 0.00 -1.62 0.00 0.00 43.42 41.82 2c80 n LEU 178 CO 0.35 0.29 1.42 -0.89 -1.22 0.00 0.00 177.39 177.34 2c80 s THR 179 N -2.18 3.00 0.00 -5.08 2.01 -0.62 -1.35 115.64 111.42 2c80 s THR 179 Ca 0.31 0.34 0.00 0.00 0.31 0.00 0.00 61.69 62.65 2c80 s THR 179 Cb 0.20 -3.22 0.00 0.00 0.01 0.00 0.00 72.50 69.49 2c80 s THR 179 CO 0.40 -0.01 0.00 0.61 -0.69 0.00 0.00 174.62 174.93 2c80 n GLY 180 N 4.17 1.43 3.58 4.40 0.00 -1.26 -4.99 105.19 112.52 2c80 n GLY 180 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 2c80 n GLY 180 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c80 s LYS 181 N -0.02 1.92 -1.17 1.61 1.02 -0.46 -4.91 119.74 117.73 2c80 s LYS 181 Ca 0.00 -2.14 -0.27 0.00 0.02 0.00 0.00 55.97 53.58 2c80 s LYS 181 Cb 0.00 -1.14 0.02 0.00 -0.52 0.00 0.00 37.83 36.19 2c80 s LYS 181 CO 0.00 -0.27 0.75 0.66 -0.92 0.00 0.00 175.35 175.57 2c80 n TYR 182 N -0.94 -1.69 0.03 3.18 4.02 -1.26 -4.84 117.16 115.66 2c80 n TYR 182 Ca -0.08 0.28 0.17 0.00 -0.01 0.00 0.00 57.90 58.27 2c80 n TYR 182 Cb 0.66 -3.14 0.65 0.00 -0.02 0.00 0.00 39.34 37.50 2c80 n TYR 182 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2c80 h PRO 183 N -2.20 0.06 -0.25 -0.72 0.13 -1.92 -1.98 132.00 125.12 2c80 h PRO 183 Ca -0.68 -0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.36 2c80 h PRO 183 Cb 1.38 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.48 2c80 h PRO 183 CO 0.49 0.04 -0.20 0.93 -0.23 0.00 0.00 178.00 179.04 2c80 h GLU 184 N 0.06 0.44 -0.07 0.86 3.07 -1.92 -1.50 114.58 115.52 2c80 h GLU 184 Ca 0.22 -0.15 -0.18 0.00 -0.50 0.00 0.00 59.36 58.75 2c80 h GLU 184 Cb 0.78 -0.04 0.01 0.00 -0.84 0.00 0.00 28.75 28.67 2c80 h GLU 184 CO -0.01 0.62 -0.67 0.82 -1.40 0.00 0.00 179.01 178.37 2c80 h ILE 185 N 0.40 1.35 0.00 3.13 2.04 -1.71 -0.94 117.51 121.78 2c80 h ILE 185 Ca 0.07 -1.98 -0.00 0.00 1.00 0.00 0.00 64.86 63.95 2c80 h ILE 185 Cb 0.58 2.27 0.00 0.00 -0.74 0.00 0.00 36.82 38.93 2c80 h ILE 185 CO 0.04 0.60 -0.00 0.45 0.00 0.00 0.00 178.15 179.24 2c80 h HIS 186 N 0.20 -0.01 -0.24 1.37 3.86 -1.51 -2.30 115.15 116.52 2c80 h HIS 186 Ca -0.06 -0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.12 2c80 h HIS 186 Cb 1.33 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.78 2c80 h HIS 186 CO 0.11 0.04 0.02 -0.22 0.86 0.00 0.00 177.93 178.74 2c80 h LYS 187 N -0.05 0.35 -0.08 2.45 1.63 -1.29 -2.56 116.57 117.03 2c80 h LYS 187 Ca -0.00 -0.05 -0.00 0.00 -0.85 0.00 0.00 60.65 59.74 2c80 h LYS 187 Cb 0.04 -0.06 -0.00 0.00 -0.60 0.00 0.00 32.23 31.61 2c80 h LYS 187 CO 0.00 0.36 0.04 1.25 -3.45 0.00 0.00 179.45 177.64 2c80 h HIS 188 N 0.34 0.12 -0.77 1.91 2.76 -0.97 -1.94 115.15 116.60 2c80 h HIS 188 Ca 0.08 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.22 2c80 h HIS 188 Cb 0.20 -0.04 -0.04 0.00 1.55 0.00 0.00 27.41 29.08 2c80 h HIS 188 CO 0.00 0.22 0.39 -0.09 -1.30 0.00 0.00 177.93 177.15 2c80 h ARG 189 N -0.01 1.09 -0.32 5.26 2.43 -1.10 -0.28 114.38 121.46 2c80 h ARG 189 Ca 0.03 -0.14 -0.14 0.00 -0.81 0.00 0.00 59.98 58.91 2c80 h ARG 189 Cb 0.15 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 29.49 2c80 h ARG 189 CO -0.00 0.83 -0.36 1.05 -1.51 0.00 0.00 179.97 179.98 2c80 h GLU 190 N 1.09 0.80 -0.54 0.20 4.11 -1.42 -1.63 114.58 117.19 2c80 h GLU 190 Ca 0.27 -0.44 -0.05 0.00 0.07 0.00 0.00 59.36 59.21 2c80 h GLU 190 Cb 0.08 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2c80 h GLU 190 CO -0.04 1.07 0.12 -0.91 0.07 0.00 0.00 179.01 179.32 2c80 h ASN 191 N 0.57 0.78 -0.31 3.06 2.35 -1.17 -1.21 115.58 119.66 2c80 h ASN 191 Ca 0.04 -0.15 -0.08 0.00 -0.55 0.00 0.00 56.30 55.57 2c80 h ASN 191 Cb 0.94 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 39.10 2c80 h ASN 191 CO 0.09 0.78 -0.10 0.25 -1.65 0.00 0.00 177.43 176.79 2c80 h LEU 192 N 0.80 0.62 -0.95 1.61 5.85 -0.97 -0.53 115.31 121.74 2c80 h LEU 192 Ca 0.17 -0.38 -0.09 0.00 0.84 0.00 0.00 57.88 58.42 2c80 h LEU 192 Cb 0.31 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 2c80 h LEU 192 CO 0.00 0.86 -0.24 -0.07 -0.34 0.00 0.00 178.44 178.66 2c80 h LEU 193 N 0.38 0.49 -0.38 2.25 3.38 -1.20 -1.31 115.31 118.91 2c80 h LEU 193 Ca 0.07 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 2c80 h LEU 193 Cb 0.61 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2c80 h LEU 193 CO 0.04 0.73 0.05 0.00 0.09 0.00 0.00 178.44 179.34 2c80 h ALA 194 N 1.32 0.50 0.00 1.53 0.00 -1.13 -3.12 119.26 118.36 2c80 h ALA 194 Ca 0.07 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 2c80 h ALA 194 Cb 0.65 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2c80 h ALA 194 CO 0.05 0.22 -0.12 0.77 0.00 0.00 0.00 179.25 180.17 2c80 h SER 195 N 0.47 0.00 -2.68 0.00 0.02 -0.94 -3.39 113.55 107.03 2c80 h SER 195 Ca 0.11 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.46 2c80 h SER 195 Cb 0.38 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 62.53 2c80 h SER 195 CO 0.01 0.12 -0.82 -0.55 -1.14 0.00 0.00 176.83 174.46 2c80 s SER 196 N -6.01 2.77 0.40 3.07 0.15 -0.51 -4.96 113.70 108.61 2c80 s SER 196 Ca 0.02 -3.31 0.18 0.00 0.70 0.00 0.00 55.95 53.54 2c80 s SER 196 Cb 0.09 -0.89 1.09 0.00 -1.71 0.00 0.00 66.02 64.60 2c80 s SER 196 CO 0.61 -0.15 1.78 -0.65 1.20 0.00 0.00 173.24 176.04 2c80 h PRO 197 N 5.63 0.39 -0.10 5.44 0.11 -1.77 -0.76 132.00 140.94 2c80 h PRO 197 Ca 0.21 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 66.30 2c80 h PRO 197 Cb 0.86 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.87 2c80 h PRO 197 CO 0.50 0.26 0.05 0.00 -0.21 0.00 0.00 178.00 178.59 2c80 h ARG 198 N 0.40 0.10 -0.33 1.05 3.08 -1.91 -0.67 114.38 116.11 2c80 h ARG 198 Ca 0.57 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.57 2c80 h ARG 198 Cb 1.45 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.46 2c80 h ARG 198 CO -0.28 0.07 0.03 1.25 -1.07 0.00 0.00 179.97 179.97 2c80 h LEU 199 N 0.10 0.55 -0.62 3.04 5.85 -1.57 -1.17 115.31 121.49 2c80 h LEU 199 Ca 0.04 -0.28 0.08 0.00 0.84 0.00 0.00 57.88 58.56 2c80 h LEU 199 Cb 0.01 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 40.83 2c80 h LEU 199 CO -0.03 0.70 0.28 0.00 -0.34 0.00 0.00 178.44 179.05 2c80 h ALA 200 N 0.87 0.82 -0.54 1.25 0.00 -1.07 0.21 119.26 120.80 2c80 h ALA 200 Ca 0.10 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 2c80 h ALA 200 Cb 0.40 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2c80 h ALA 200 CO 0.01 -0.11 -0.04 -0.22 0.00 0.00 0.00 179.25 178.89 2c80 h LYS 201 N 0.50 0.98 -0.07 0.00 3.64 -1.03 -1.85 116.57 118.75 2c80 h LYS 201 Ca 0.30 -0.33 0.03 0.00 -1.27 0.00 0.00 60.65 59.38 2c80 h LYS 201 Cb 0.31 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 2c80 h LYS 201 CO -0.26 1.00 -0.11 -0.92 -2.27 0.00 0.00 179.45 176.89 2c80 h TYR 202 N 0.86 -0.28 -0.67 1.91 5.03 -0.46 -1.55 116.97 121.80 2c80 h TYR 202 Ca 0.15 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.46 2c80 h TYR 202 Cb 0.59 0.14 -0.03 0.00 1.55 0.00 0.00 36.73 38.97 2c80 h TYR 202 CO 0.04 -0.17 0.35 -0.07 -1.32 0.00 0.00 178.16 176.99 2c80 h LEU 203 N -0.16 0.83 -1.29 2.82 3.38 -0.93 -1.86 115.31 118.10 2c80 h LEU 203 Ca 0.06 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2c80 h LEU 203 Cb 0.25 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 2c80 h LEU 203 CO -0.16 0.68 0.28 0.28 0.09 0.00 0.00 178.44 179.61 2c80 h SER 204 N 0.93 0.68 1.03 -0.43 0.02 -0.94 -3.29 113.55 111.57 2c80 h SER 204 Ca 0.23 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2c80 h SER 204 Cb 0.05 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.42 2c80 h SER 204 CO -0.04 0.57 -0.78 0.44 -1.14 0.00 0.00 176.83 175.89 2c80 h ASP 205 N 0.77 0.00 -3.38 3.07 3.32 -0.48 -3.43 116.42 116.29 2c80 h ASP 205 Ca 0.19 -0.08 -0.58 0.00 0.02 0.00 0.00 57.03 56.58 2c80 h ASP 205 Cb 0.06 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.53 2c80 h ASP 205 CO -0.03 0.04 -0.03 0.00 -1.72 0.00 0.00 179.24 177.51 2c80 s ARG 206 N -3.28 4.30 0.00 3.56 1.70 -0.95 -4.98 118.95 119.31 2c80 s ARG 206 Ca 0.03 0.55 0.00 0.00 -0.47 0.00 0.00 55.73 55.84 2c80 s ARG 206 Cb 0.11 -3.49 0.00 0.00 -0.57 0.00 0.00 34.95 30.99 2c80 s ARG 206 CO 0.76 0.00 0.00 0.00 -1.08 0.00 0.00 175.30 174.98 2c80 n ALA 207 N 4.18 -0.18 -1.66 7.88 0.00 -1.26 -4.90 120.51 124.57 2c80 n ALA 207 Ca -0.04 0.00 -0.46 0.00 0.00 0.00 0.00 53.44 52.94 2c80 n ALA 207 Cb 0.51 -0.02 -0.03 0.00 0.00 0.00 0.00 19.45 19.90 2c80 n ALA 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c80 n ALA 208 N -0.17 0.99 -2.58 0.00 0.00 -1.26 -5.01 120.51 112.48 2c80 n ALA 208 Ca 0.00 0.43 -0.15 0.00 0.00 0.00 0.00 53.44 53.72 2c80 n ALA 208 Cb 0.08 -2.28 -0.11 0.00 0.00 0.00 0.00 19.45 17.14 2c80 n ALA 208 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2c80 s THR 209 N 0.31 0.96 -0.62 0.00 -4.23 -1.26 -5.06 115.64 105.74 2c80 s THR 209 Ca 0.73 -1.51 0.25 0.00 -1.18 0.00 0.00 61.69 59.99 2c80 s THR 209 Cb -0.69 -1.22 0.28 0.00 1.34 0.00 0.00 72.50 72.21 2c80 s THR 209 CO 0.45 -0.46 1.76 1.55 -0.54 0.00 0.00 174.62 177.39 2c80 h PRO 210 N 3.82 0.00 0.00 3.99 0.13 -1.95 -3.48 132.00 134.52 2c80 h PRO 210 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 2c80 h PRO 210 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2c80 h PRO 210 CO 0.49 0.00 0.00 1.97 -0.23 0.00 0.00 178.00 180.23