#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 3.36 -0.25 1.24 5.65 0.18 -4.96 115.29 120.51 2c80 s HIS 5 Ca 0.00 0.72 -0.05 0.00 0.25 0.00 0.00 55.06 55.98 2c80 s HIS 5 Cb 0.00 -2.64 -0.00 0.00 -1.18 0.00 0.00 32.58 28.75 2c80 s HIS 5 CO 0.00 -0.11 0.01 0.42 -0.65 0.00 0.00 174.74 174.41 2c80 s ILE 6 N 1.66 3.64 -0.23 0.89 1.01 -1.26 -1.12 121.20 125.79 2c80 s ILE 6 Ca 0.22 -0.57 -0.04 0.00 0.00 0.00 0.00 60.65 60.27 2c80 s ILE 6 Cb -0.15 -2.76 -0.00 0.00 0.01 0.00 0.00 42.46 39.55 2c80 s ILE 6 CO 0.09 0.27 -0.03 -0.75 0.00 0.00 0.00 174.94 174.52 2c80 s LYS 7 N 1.49 3.25 -0.23 2.79 2.20 -0.11 0.07 119.74 129.20 2c80 s LYS 7 Ca 0.04 -0.71 -0.16 0.00 -0.36 0.00 0.00 55.97 54.78 2c80 s LYS 7 Cb -0.16 -3.04 -0.04 0.00 -1.51 0.00 0.00 37.83 33.09 2c80 s LYS 7 CO -0.01 -0.26 0.42 0.08 -0.36 0.00 0.00 175.35 175.23 2c80 s VAL 8 N 1.45 5.16 -0.20 4.02 1.01 0.57 -1.19 120.40 131.23 2c80 s VAL 8 Ca 0.05 0.72 -0.04 0.00 0.00 0.00 0.00 61.98 62.70 2c80 s VAL 8 Cb -0.15 -3.75 -0.02 0.00 0.00 0.00 0.00 36.38 32.47 2c80 s VAL 8 CO -0.03 0.19 -0.03 -0.63 0.00 0.00 0.00 175.10 174.60 2c80 s ILE 9 N 1.75 3.66 0.36 2.22 1.01 0.37 -0.01 121.20 130.56 2c80 s ILE 9 Ca 0.19 -0.41 -0.09 0.00 0.00 0.00 0.00 60.65 60.33 2c80 s ILE 9 Cb -0.15 -2.65 0.04 0.00 0.01 0.00 0.00 42.46 39.71 2c80 s ILE 9 CO 0.09 0.44 0.64 0.00 0.00 0.00 0.00 174.94 176.10 2c80 n TYR 10 N 4.36 -1.96 -1.80 3.97 9.36 -0.72 -1.75 117.16 128.62 2c80 n TYR 10 Ca -0.18 -1.92 -0.30 0.00 3.32 0.00 0.00 57.90 58.83 2c80 n TYR 10 Cb 0.52 0.74 0.17 0.00 -0.63 0.00 0.00 39.34 40.13 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 -2.78 1.82 -1.28 2.98 0.40 -1.26 -0.36 117.98 117.49 2c80 s PHE 11 Ca 0.20 0.47 -0.19 0.00 -0.60 0.00 0.00 56.93 56.81 2c80 s PHE 11 Cb -0.03 -3.86 0.04 0.00 0.51 0.00 0.00 43.02 39.68 2c80 s PHE 11 CO 0.14 -2.59 1.80 -1.71 0.70 0.00 0.00 175.22 173.56 2c80 n ASN 12 N -3.79 4.55 -3.65 1.36 5.15 -1.25 -4.56 115.26 113.08 2c80 n ASN 12 Ca 0.13 -2.88 0.01 0.00 -0.60 0.00 0.00 54.58 51.24 2c80 n ASN 12 Cb 0.60 -1.74 -0.00 0.00 -0.53 0.00 0.00 39.78 38.11 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 4.58 -0.34 0.00 8.20 0.00 -1.26 -4.81 107.32 113.68 2c80 s GLY 13 Ca 0.56 0.53 0.00 0.00 0.00 0.00 0.00 44.72 45.81 2c80 s GLY 13 CO 0.08 1.00 0.24 0.54 0.00 0.00 0.00 173.10 174.96 2c80 n ARG 14 N -0.56 0.00 0.00 2.90 1.74 0.50 -4.80 116.66 116.44 2c80 n ARG 14 Ca -0.07 0.44 0.00 0.00 -0.77 0.00 0.00 57.85 57.46 2c80 n ARG 14 Cb 0.62 -1.07 0.00 0.00 -1.02 0.00 0.00 32.46 30.99 2c80 n ARG 14 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2c80 n GLY 15 N 1.30 2.70 0.07 -0.13 0.00 -1.15 -2.05 105.19 105.93 2c80 n GLY 15 Ca 0.00 -0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.07 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 0.23 0.15 1.61 5.12 -1.26 -3.81 116.66 132.70 2c80 n ARG 16 Ca 0.00 0.12 0.12 0.00 -1.93 0.00 0.00 57.85 56.16 2c80 n ARG 16 Cb 0.00 -1.70 0.23 0.00 -1.16 0.00 0.00 32.46 29.83 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 2.60 0.89 0.00 7.54 0.00 -1.72 -3.37 119.26 125.19 2c80 h ALA 17 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2c80 h ALA 17 Cb 0.70 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2c80 h ALA 17 CO 0.00 0.00 -0.22 1.49 0.00 0.00 0.00 179.25 180.52 2c80 h GLU 18 N 0.00 0.00 -0.25 0.00 4.57 -1.55 -1.60 114.58 115.75 2c80 h GLU 18 Ca 0.00 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.08 2c80 h GLU 18 Cb 0.88 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.46 2c80 h GLU 18 CO 0.00 0.22 -0.26 0.66 -1.18 0.00 0.00 179.01 178.45 2c80 h SER 19 N 0.00 0.50 -0.03 1.04 4.64 -1.85 -1.50 113.55 116.35 2c80 h SER 19 Ca -0.00 -0.17 -0.02 0.00 -0.47 0.00 0.00 61.79 61.12 2c80 h SER 19 Cb 0.44 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 2c80 h SER 19 CO 0.03 0.75 -0.08 0.40 -0.87 0.00 0.00 176.83 177.07 2c80 h ILE 20 N 0.43 1.45 -0.08 0.95 2.04 -1.57 -2.30 117.51 118.44 2c80 h ILE 20 Ca 0.06 -1.44 0.02 0.00 1.00 0.00 0.00 64.86 64.50 2c80 h ILE 20 Cb 0.69 2.34 -0.02 0.00 -0.74 0.00 0.00 36.82 39.08 2c80 h ILE 20 CO 0.05 0.39 -0.07 0.03 0.00 0.00 0.00 178.15 178.55 2c80 h ARG 21 N -0.44 -0.08 -0.59 2.37 3.08 -1.32 -2.01 114.38 115.39 2c80 h ARG 21 Ca -0.00 0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 2c80 h ARG 21 Cb 0.67 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.71 2c80 h ARG 21 CO 0.02 -0.05 0.21 0.52 -1.07 0.00 0.00 179.97 179.60 2c80 h MET 22 N -0.08 0.90 0.19 0.04 2.86 -1.37 0.47 114.93 117.95 2c80 h MET 22 Ca 0.05 -0.18 0.01 0.00 -2.06 0.00 0.00 59.70 57.53 2c80 h MET 22 Cb 0.16 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.64 2c80 h MET 22 CO -0.13 0.79 -0.41 1.15 1.06 0.00 0.00 176.91 179.38 2c80 h THR 23 N 0.83 0.18 -0.66 2.22 2.02 -1.20 0.27 112.91 116.57 2c80 h THR 23 Ca 0.19 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.42 2c80 h THR 23 Cb 0.24 0.18 -0.05 0.00 -1.74 0.00 0.00 68.15 66.78 2c80 h THR 23 CO -0.01 0.00 0.39 -0.07 0.37 0.00 0.00 175.52 176.20 2c80 h LEU 24 N -0.69 0.62 -0.11 2.58 3.38 -1.27 -0.66 115.31 119.17 2c80 h LEU 24 Ca 0.01 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2c80 h LEU 24 Cb 0.69 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2c80 h LEU 24 CO -0.19 0.41 0.06 0.58 0.09 0.00 0.00 178.44 179.39 2c80 h VAL 25 N 0.75 1.07 -0.98 1.22 2.07 -0.64 0.49 116.25 120.23 2c80 h VAL 25 Ca 0.28 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 67.62 2c80 h VAL 25 Cb 0.10 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.82 2c80 h VAL 25 CO -0.14 0.06 0.65 0.00 0.02 0.00 0.00 177.57 178.16 2c80 h ALA 26 N 0.98 1.30 0.00 1.67 0.00 -0.21 -2.04 119.26 120.97 2c80 h ALA 26 Ca 0.04 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2c80 h ALA 26 Cb 0.05 -0.40 0.00 0.00 0.00 0.00 0.00 17.79 17.44 2c80 h ALA 26 CO -0.01 0.65 0.00 0.00 0.00 0.00 0.00 179.25 179.89 2c80 n ALA 27 N -2.39 2.42 -1.30 0.00 0.00 -0.27 -4.91 120.51 114.07 2c80 n ALA 27 Ca 0.11 -0.13 -0.02 0.00 0.00 0.00 0.00 53.44 53.41 2c80 n ALA 27 Cb 0.01 -1.48 -0.01 0.00 0.00 0.00 0.00 19.45 17.98 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 1.32 0.47 3.66 0.00 0.00 -0.43 -5.02 105.19 105.19 2c80 n GLY 28 Ca 0.12 -0.95 -0.39 0.00 0.00 0.00 0.00 46.02 44.80 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 -2.08 5.14 0.35 1.61 1.01 0.16 -5.00 120.40 121.59 2c80 s VAL 29 Ca 0.00 0.83 -0.27 0.00 0.00 0.00 0.00 61.98 62.54 2c80 s VAL 29 Cb 0.00 -3.79 -0.09 0.00 0.00 0.00 0.00 36.38 32.50 2c80 s VAL 29 CO 0.00 0.20 1.15 0.20 0.00 0.00 0.00 175.10 176.65 2c80 s ASN 30 N 1.17 6.83 0.06 3.32 0.01 -1.26 -4.28 114.94 120.79 2c80 s ASN 30 Ca 0.21 2.33 -0.17 0.00 -0.71 0.00 0.00 52.86 54.53 2c80 s ASN 30 Cb -0.15 -2.62 0.03 0.00 0.41 0.00 0.00 41.25 38.92 2c80 s ASN 30 CO 0.09 -0.46 0.39 -0.72 -1.51 0.00 0.00 177.10 174.89 2c80 s TYR 31 N -1.32 -0.22 -0.20 2.20 1.13 -1.26 -4.57 117.35 113.10 2c80 s TYR 31 Ca 0.52 0.10 -0.22 0.00 -1.41 0.00 0.00 57.07 56.06 2c80 s TYR 31 Cb -0.31 0.20 -0.02 0.00 -1.10 0.00 0.00 41.96 40.73 2c80 s TYR 31 CO 0.40 -0.59 0.69 -2.00 -2.51 0.00 0.00 175.55 171.54 2c80 s GLU 32 N -2.82 4.21 -0.60 -3.49 2.12 0.11 -4.99 118.70 113.24 2c80 s GLU 32 Ca -0.03 0.71 -0.17 0.00 0.36 0.00 0.00 54.97 55.85 2c80 s GLU 32 Cb -0.00 -3.59 0.14 0.00 0.26 0.00 0.00 34.13 30.93 2c80 s GLU 32 CO -0.05 -0.30 0.61 0.34 -0.54 0.00 0.00 175.26 175.31 2c80 s ASP 33 N 1.24 6.28 -0.30 -1.70 2.15 -1.26 -0.31 116.67 122.76 2c80 s ASP 33 Ca 0.31 -1.84 -0.14 0.00 0.43 0.00 0.00 52.55 51.31 2c80 s ASP 33 Cb -0.16 -2.24 -0.03 0.00 -0.30 0.00 0.00 42.92 40.20 2c80 s ASP 33 CO 0.10 -0.89 0.34 -0.70 -0.17 0.00 0.00 175.17 173.85 2c80 s GLU 34 N 1.70 3.80 -0.23 4.34 2.12 0.99 -4.98 118.70 126.44 2c80 s GLU 34 Ca 0.08 -0.22 -0.07 0.00 0.36 0.00 0.00 54.97 55.12 2c80 s GLU 34 Cb -0.25 -3.72 -0.03 0.00 0.26 0.00 0.00 34.13 30.39 2c80 s GLU 34 CO 0.02 -0.37 0.05 1.03 -0.54 0.00 0.00 175.26 175.45 2c80 s ARG 35 N 2.00 3.68 -0.22 4.30 0.52 -1.26 -1.75 118.95 126.21 2c80 s ARG 35 Ca 0.12 -0.48 -0.13 0.00 -0.52 0.00 0.00 55.73 54.73 2c80 s ARG 35 Cb -0.16 -3.25 -0.05 0.00 0.52 0.00 0.00 34.95 32.01 2c80 s ARG 35 CO 0.11 -0.10 0.26 0.42 0.02 0.00 0.00 175.30 176.01 2c80 s ILE 36 N 1.35 5.29 0.57 1.52 -1.09 0.51 -4.85 121.20 124.51 2c80 s ILE 36 Ca 0.05 0.40 -0.19 0.00 -2.23 0.00 0.00 60.65 58.68 2c80 s ILE 36 Cb -0.15 -3.59 -0.04 0.00 -1.58 0.00 0.00 42.46 37.09 2c80 s ILE 36 CO 0.03 0.31 1.17 -0.94 -1.23 0.00 0.00 174.94 174.28 2c80 s SER 37 N 1.04 5.41 0.40 3.58 1.04 -1.26 -3.75 113.70 120.16 2c80 s SER 37 Ca 0.12 2.29 0.09 0.00 0.48 0.00 0.00 55.95 58.93 2c80 s SER 37 Cb -0.14 -2.59 0.84 0.00 0.10 0.00 0.00 66.02 64.23 2c80 s SER 37 CO 0.06 -1.44 1.99 -0.26 0.98 0.00 0.00 173.24 174.57 2c80 h PHE 38 N 1.00 0.35 -0.26 5.02 0.05 -2.00 -1.79 116.94 119.32 2c80 h PHE 38 Ca -0.50 -0.02 -0.11 0.00 3.82 0.00 0.00 57.97 61.17 2c80 h PHE 38 Cb 1.28 -0.11 -0.01 0.00 2.00 0.00 0.00 35.95 39.11 2c80 h PHE 38 CO 0.49 0.33 -0.29 -0.56 -0.18 0.00 0.00 178.31 178.10 2c80 h GLN 39 N 0.35 0.52 0.00 1.51 -0.00 -2.05 -3.05 115.11 112.38 2c80 h GLN 39 Ca 0.08 -0.21 0.00 0.00 -0.00 0.00 0.00 58.65 58.52 2c80 h GLN 39 Cb 0.17 -0.02 0.00 0.00 -0.00 0.00 0.00 27.48 27.63 2c80 h GLN 39 CO -0.00 0.76 -0.14 -0.25 -0.00 0.00 0.00 178.83 179.20 2c80 n ASP 40 N -4.10 0.74 -0.17 0.06 10.43 -0.74 -4.38 116.55 118.39 2c80 n ASP 40 Ca -0.01 0.46 -0.04 0.00 2.57 0.00 0.00 54.79 57.77 2c80 n ASP 40 Cb 0.44 -0.56 0.05 0.00 1.84 0.00 0.00 41.12 42.88 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 0.47 -0.90 1.24 -0.00 -1.26 -2.58 115.95 112.91 2c80 h TRP 41 Ca 0.00 0.02 0.20 0.00 -0.00 0.00 0.00 58.89 59.11 2c80 h TRP 41 Cb 0.72 -0.14 -0.07 0.00 -0.00 0.00 0.00 29.16 29.67 2c80 h TRP 41 CO 0.00 0.23 0.60 -1.35 -0.00 0.00 0.00 178.44 177.92 2c80 h PRO 42 N 0.50 0.40 0.04 2.65 0.11 -1.78 0.55 132.00 134.48 2c80 h PRO 42 Ca 0.22 -0.02 -0.26 0.00 0.11 0.00 0.00 66.00 66.05 2c80 h PRO 42 Cb 0.12 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 31.12 2c80 h PRO 42 CO -0.15 0.27 -1.35 1.57 -0.21 0.00 0.00 178.00 178.13 2c80 h LYS 43 N 0.41 0.08 -0.19 1.05 2.10 -1.79 -3.35 116.57 114.88 2c80 h LYS 43 Ca 0.47 -0.14 -0.19 0.00 -2.00 0.00 0.00 60.65 58.78 2c80 h LYS 43 Cb 1.16 0.05 0.01 0.00 -0.90 0.00 0.00 32.23 32.55 2c80 h LYS 43 CO -0.18 0.91 -0.64 0.82 -2.00 0.00 0.00 179.45 178.36 2c80 h ILE 44 N 0.02 1.29 -0.78 0.07 1.08 -0.99 -3.38 117.51 114.82 2c80 h ILE 44 Ca -0.15 -1.85 0.16 0.00 -0.39 0.00 0.00 64.86 62.62 2c80 h ILE 44 Cb 1.91 1.91 -0.15 0.00 -3.07 0.00 0.00 36.82 37.42 2c80 h ILE 44 CO 0.13 0.59 -0.19 0.50 -0.69 0.00 0.00 178.15 178.48 2c80 h LYS 45 N 0.49 0.00 0.00 2.37 3.64 -0.05 0.10 116.57 123.12 2c80 h LYS 45 Ca -0.03 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2c80 h LYS 45 Cb 1.27 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 2c80 h LYS 45 CO 0.14 0.00 0.00 -1.35 -2.27 0.00 0.00 179.45 175.97 2c80 h PRO 46 N 0.00 0.00 -0.00 1.90 0.11 -1.77 -2.51 132.00 129.72 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 0.58 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.69 2c80 h PRO 46 CO -0.81 0.00 -0.17 0.25 -0.21 0.00 0.00 178.00 177.06 2c80 n THR 47 N -2.85 0.00 -3.51 -1.15 -2.24 0.02 -4.80 114.28 99.75 2c80 n THR 47 Ca 0.00 -0.03 -0.38 0.00 -2.27 0.00 0.00 64.05 61.38 2c80 n THR 47 Cb 0.23 -0.13 -0.09 0.00 -2.10 0.00 0.00 70.33 68.24 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 -2.76 5.27 0.03 2.28 -1.09 -0.95 -5.04 121.20 118.94 2c80 s ILE 48 Ca 0.20 0.44 -0.30 0.00 -2.23 0.00 0.00 60.65 58.76 2c80 s ILE 48 Cb 0.19 -3.62 -0.09 0.00 -1.58 0.00 0.00 42.46 37.37 2c80 s ILE 48 CO 0.55 0.27 1.94 -2.84 -1.23 0.00 0.00 174.94 173.62 2c80 s PRO 49 N 1.37 4.15 0.00 2.79 0.02 -1.26 -0.61 135.00 141.46 2c80 s PRO 49 Ca 0.13 2.57 0.00 0.00 0.02 0.00 0.00 61.00 63.72 2c80 s PRO 49 Cb -0.15 -4.15 0.00 0.00 0.02 0.00 0.00 34.50 30.23 2c80 s PRO 49 CO 0.07 -0.94 0.00 0.41 -0.33 0.00 0.00 177.00 176.21 2c80 n GLY 50 N 4.50 1.38 2.58 0.52 0.00 -1.26 -4.49 105.19 108.43 2c80 n GLY 50 Ca 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 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 1.74 3.13 -0.02 0.00 0.22 -4.98 105.19 103.28 2c80 n GLY 51 Ca 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.88 0.71 0.22 1.61 0.52 -1.26 -4.95 118.95 111.92 2c80 s ARG 52 Ca 0.00 -1.09 0.09 0.00 -0.52 0.00 0.00 55.73 54.21 2c80 s ARG 52 Cb 0.00 -0.26 -0.04 0.00 0.52 0.00 0.00 34.95 35.16 2c80 s ARG 52 CO 0.00 0.02 -0.06 -0.51 0.02 0.00 0.00 175.30 174.77 2c80 s LEU 53 N -2.42 3.06 0.48 2.53 1.43 -1.26 -4.29 118.68 118.22 2c80 s LEU 53 Ca 0.03 -0.61 -0.21 0.00 -1.03 0.00 0.00 54.13 52.31 2c80 s LEU 53 Cb -0.01 -1.68 -0.07 0.00 0.03 0.00 0.00 46.19 44.45 2c80 s LEU 53 CO -0.02 0.06 1.11 -2.16 0.23 0.00 0.00 176.35 175.57 2c80 s PRO 54 N -3.18 3.69 0.02 1.29 0.04 -1.26 -5.00 135.00 130.61 2c80 s PRO 54 Ca 0.28 1.59 0.04 0.00 0.04 0.00 0.00 61.00 62.95 2c80 s PRO 54 Cb -0.08 -2.22 -0.02 0.00 0.04 0.00 0.00 34.50 32.23 2c80 s PRO 54 CO 0.17 -0.56 -0.13 0.00 0.04 0.00 0.00 177.00 176.51 2c80 s ALA 55 N -1.74 1.12 -0.16 8.56 0.00 -0.72 -4.19 121.76 124.64 2c80 s ALA 55 Ca 0.67 -0.73 0.01 0.00 0.00 0.00 0.00 51.96 51.91 2c80 s ALA 55 Cb -0.23 -0.20 0.02 0.00 0.00 0.00 0.00 23.12 22.70 2c80 s ALA 55 CO 0.28 0.23 -0.19 0.08 0.00 0.00 0.00 175.76 176.16 2c80 s VAL 56 N -0.69 1.91 -0.24 0.00 1.01 0.47 -0.47 120.40 122.39 2c80 s VAL 56 Ca 0.02 -0.85 -0.07 0.00 0.00 0.00 0.00 61.98 61.07 2c80 s VAL 56 Cb -0.07 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 2c80 s VAL 56 CO 0.01 0.52 0.07 -0.75 0.00 0.00 0.00 175.10 174.95 2c80 s LYS 57 N 1.22 3.74 -0.19 2.72 2.20 -0.33 -0.70 119.74 128.40 2c80 s LYS 57 Ca 0.02 -0.44 -0.00 0.00 -0.36 0.00 0.00 55.97 55.19 2c80 s LYS 57 Cb -0.14 -3.31 0.01 0.00 -1.51 0.00 0.00 37.83 32.89 2c80 s LYS 57 CO -0.10 -0.09 -0.17 0.42 -0.36 0.00 0.00 175.35 175.06 2c80 s ILE 58 N 1.35 2.35 -0.19 5.43 1.01 0.62 -0.93 121.20 130.84 2c80 s ILE 58 Ca 0.05 -0.84 -0.01 0.00 0.00 0.00 0.00 60.65 59.85 2c80 s ILE 58 Cb -0.15 -2.01 0.00 0.00 0.01 0.00 0.00 42.46 40.32 2c80 s ILE 58 CO 0.04 0.51 -0.13 -0.89 0.00 0.00 0.00 174.94 174.47 2c80 s THR 59 N 1.31 2.73 0.82 2.92 2.01 -0.27 -0.36 115.64 124.80 2c80 s THR 59 Ca 0.05 -0.72 -0.05 0.00 0.31 0.00 0.00 61.69 61.27 2c80 s THR 59 Cb -0.13 -2.19 0.17 0.00 0.01 0.00 0.00 72.50 70.35 2c80 s THR 59 CO -0.10 0.49 1.12 1.51 -0.69 0.00 0.00 174.62 176.95 2c80 s ASP 60 N 1.20 3.78 0.00 3.53 1.47 -0.95 0.48 116.67 126.18 2c80 s ASP 60 Ca 0.02 -0.29 0.13 0.00 1.18 0.00 0.00 52.55 53.59 2c80 s ASP 60 Cb -0.14 0.10 0.77 0.00 -0.34 0.00 0.00 42.92 43.31 2c80 s ASP 60 CO -0.05 -2.26 1.46 -0.46 0.68 0.00 0.00 175.17 174.54 2c80 n ASN 61 N -3.19 0.00 -0.43 2.11 6.94 -1.26 -2.80 115.26 116.63 2c80 n ASN 61 Ca 0.17 -1.51 0.07 0.00 -0.02 0.00 0.00 54.58 53.29 2c80 n ASN 61 Cb 0.60 0.00 0.16 0.00 -2.36 0.00 0.00 39.78 38.19 2c80 n ASN 61 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 2c80 n HIS 62 N -0.71 0.00 -0.99 -2.53 8.25 -1.26 -5.00 115.22 112.99 2c80 n HIS 62 Ca 0.10 -1.19 0.00 0.00 -0.26 0.00 0.00 57.72 56.36 2c80 n HIS 62 Cb 0.04 -0.20 0.00 0.00 1.12 0.00 0.00 29.99 30.96 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 -1.12 0.78 3.70 -1.41 0.00 -1.12 -5.00 105.19 101.02 2c80 n GLY 63 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.17 3.25 -0.25 1.61 3.76 -1.26 -4.89 115.29 114.35 2c80 s HIS 64 Ca 0.00 1.14 -0.06 0.00 -0.15 0.00 0.00 55.06 55.99 2c80 s HIS 64 Cb 0.00 -3.51 -0.01 0.00 1.11 0.00 0.00 32.58 30.18 2c80 s HIS 64 CO 0.00 -1.68 0.03 0.08 -0.85 0.00 0.00 174.74 172.32 2c80 s VAL 65 N 1.52 3.81 -0.23 -0.90 1.01 -1.26 -2.24 120.40 122.11 2c80 s VAL 65 Ca 0.60 -0.49 -0.03 0.00 0.00 0.00 0.00 61.98 62.06 2c80 s VAL 65 Cb -0.30 -2.83 0.00 0.00 0.00 0.00 0.00 36.38 33.25 2c80 s VAL 65 CO 0.28 0.28 -0.04 -0.75 0.00 0.00 0.00 175.10 174.86 2c80 s LYS 66 N 1.52 3.20 -0.14 2.72 2.20 0.51 -4.96 119.74 124.78 2c80 s LYS 66 Ca 0.05 -0.74 -0.11 0.00 -0.36 0.00 0.00 55.97 54.80 2c80 s LYS 66 Cb -0.16 -3.02 -0.05 0.00 -1.51 0.00 0.00 37.83 33.10 2c80 s LYS 66 CO 0.00 -0.27 0.23 -1.58 -0.36 0.00 0.00 175.35 173.38 2c80 s TRP 67 N 1.43 3.52 -0.03 4.03 0.52 -1.26 -0.28 118.94 126.87 2c80 s TRP 67 Ca 0.04 0.57 0.04 0.00 0.02 0.00 0.00 56.10 56.77 2c80 s TRP 67 Cb -0.15 -2.20 -0.00 0.00 -1.15 0.00 0.00 33.47 29.97 2c80 s TRP 67 CO -0.04 0.42 -0.14 -1.64 0.02 0.00 0.00 176.95 175.58 2c80 s MET 68 N -0.11 1.36 0.39 4.98 -1.94 0.12 -4.99 119.30 119.11 2c80 s MET 68 Ca 0.15 -0.48 0.04 0.00 -1.71 0.00 0.00 55.69 53.69 2c80 s MET 68 Cb -0.13 -1.23 -0.04 0.00 2.01 0.00 0.00 34.83 35.44 2c80 s MET 68 CO 0.04 0.21 0.07 0.14 -0.01 0.00 0.00 175.02 175.47 2c80 s VAL 69 N 0.02 1.05 -0.12 -6.03 -7.23 -1.26 -0.39 120.40 106.44 2c80 s VAL 69 Ca -0.02 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.11 2c80 s VAL 69 Cb -0.09 -2.56 0.02 0.00 0.56 0.00 0.00 36.38 34.30 2c80 s VAL 69 CO 0.01 0.00 0.08 1.21 -0.31 0.00 0.00 175.10 176.09 2c80 n GLU 70 N -0.88 -2.12 -0.12 4.82 4.07 -1.26 -4.44 120.64 120.71 2c80 n GLU 70 Ca -0.06 1.87 -0.05 0.00 -0.06 0.00 0.00 57.16 58.86 2c80 n GLU 70 Cb 0.66 -3.11 0.01 0.00 -0.06 0.00 0.00 31.44 28.95 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 1.86 -0.68 1.76 4.31 4.64 -1.86 -0.75 113.55 122.83 2c80 h SER 71 Ca -0.18 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2c80 h SER 71 Cb 0.41 0.37 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 2c80 h SER 71 CO 0.02 -0.23 0.00 -0.07 -0.87 0.00 0.00 176.83 175.68 2c80 h LEU 72 N -0.12 0.00 -0.26 5.97 3.38 -1.92 0.19 115.31 122.55 2c80 h LEU 72 Ca 0.20 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.12 2c80 h LEU 72 Cb 0.43 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2c80 h LEU 72 CO -0.49 0.00 -0.06 0.00 0.09 0.00 0.00 178.44 177.98 2c80 h ALA 73 N 2.00 0.35 0.16 1.53 0.00 -1.64 -1.22 119.26 120.45 2c80 h ALA 73 Ca 0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 2c80 h ALA 73 Cb 0.88 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2c80 h ALA 73 CO 0.00 0.16 -0.07 0.82 0.00 0.00 0.00 179.25 180.15 2c80 h ILE 74 N 0.24 0.90 -0.53 0.00 2.04 -0.79 -1.62 117.51 117.76 2c80 h ILE 74 Ca 0.07 -0.24 0.06 0.00 1.00 0.00 0.00 64.86 65.75 2c80 h ILE 74 Cb 0.53 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.60 2c80 h ILE 74 CO 0.02 0.06 0.23 0.00 0.00 0.00 0.00 178.15 178.46 2c80 h ALA 75 N 0.51 0.67 -0.62 1.87 0.00 -0.69 -1.21 119.26 119.79 2c80 h ALA 75 Ca -0.02 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2c80 h ALA 75 Cb 0.25 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2c80 h ALA 75 CO 0.04 -0.15 0.34 0.00 0.00 0.00 0.00 179.25 179.47 2c80 h ARG 76 N 0.44 0.86 0.07 0.00 3.08 -1.15 0.20 114.38 117.87 2c80 h ARG 76 Ca 0.25 -0.10 0.02 0.00 0.07 0.00 0.00 59.98 60.22 2c80 h ARG 76 Cb 0.23 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 2c80 h ARG 76 CO -0.22 0.65 -0.19 -0.92 -1.07 0.00 0.00 179.97 178.23 2c80 h TYR 77 N 0.84 -0.50 -0.42 3.04 5.03 -0.90 0.47 116.97 124.54 2c80 h TYR 77 Ca 0.22 0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.49 2c80 h TYR 77 Cb 0.04 0.21 -0.02 0.00 1.55 0.00 0.00 36.73 38.52 2c80 h TYR 77 CO -0.01 -0.28 0.06 0.52 -1.32 0.00 0.00 178.16 177.13 2c80 h MET 78 N -0.34 0.71 -0.58 1.82 2.86 -1.03 -2.04 114.93 116.33 2c80 h MET 78 Ca 0.04 -0.20 0.05 0.00 -2.06 0.00 0.00 59.70 57.53 2c80 h MET 78 Cb 0.38 -0.08 -0.05 0.00 0.06 0.00 0.00 31.60 31.92 2c80 h MET 78 CO -0.13 0.75 0.32 0.00 1.06 0.00 0.00 176.91 178.91 2c80 h ALA 79 N 0.93 0.76 -0.43 6.32 0.00 -0.54 -2.37 119.26 123.92 2c80 h ALA 79 Ca 0.13 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2c80 h ALA 79 Cb 0.39 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2c80 h ALA 79 CO 0.01 -0.01 0.21 -0.22 0.00 0.00 0.00 179.25 179.24 2c80 h LYS 80 N 0.61 0.62 -0.76 0.00 3.64 -0.77 0.42 116.57 120.33 2c80 h LYS 80 Ca 0.25 -0.09 0.16 0.00 -1.27 0.00 0.00 60.65 59.70 2c80 h LYS 80 Cb 0.13 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 31.79 2c80 h LYS 80 CO -0.16 0.54 0.51 0.87 -2.27 0.00 0.00 179.45 178.94 2c80 h LYS 81 N 0.56 0.34 -0.29 1.90 1.57 -1.06 -2.63 116.57 116.97 2c80 h LYS 81 Ca 0.15 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.85 2c80 h LYS 81 Cb 0.12 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 2c80 h LYS 81 CO -0.02 0.23 -0.00 0.72 -0.57 0.00 0.00 179.45 179.81 2c80 n HIS 82 N -4.46 0.99 -3.58 -1.35 8.25 -0.92 -4.97 115.22 109.18 2c80 n HIS 82 Ca 0.15 -1.09 -0.22 0.00 -0.26 0.00 0.00 57.72 56.30 2c80 n HIS 82 Cb 0.58 -0.37 0.08 0.00 1.12 0.00 0.00 29.99 31.40 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 -0.72 -2.55 -1.25 4.41 8.25 -0.62 -4.91 115.22 117.83 2c80 n HIS 83 Ca 0.25 0.97 0.06 0.00 -0.26 0.00 0.00 57.72 58.75 2c80 n HIS 83 Cb 0.94 -4.93 0.19 0.00 1.12 0.00 0.00 29.99 27.31 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 -4.64 1.74 -0.03 -0.41 2.81 0.14 -4.59 117.12 112.13 2c80 n MET 84 Ca -0.11 -2.91 0.04 0.00 -1.81 0.00 0.00 57.70 52.92 2c80 n MET 84 Cb 0.60 -1.64 0.06 0.00 -0.71 0.00 0.00 33.22 31.53 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 -1.14 2.21 0.00 0.03 2.81 -1.25 -0.61 117.12 119.16 2c80 n MET 85 Ca 0.20 -1.95 0.00 0.00 -1.81 0.00 0.00 57.70 54.14 2c80 n MET 85 Cb 0.76 -1.21 0.00 0.00 -0.71 0.00 0.00 33.22 32.06 2c80 n MET 85 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2c80 n GLY 86 N -0.90 2.48 0.02 3.03 0.00 -1.26 -3.89 105.19 104.66 2c80 n GLY 86 Ca 0.07 -1.68 0.11 0.00 0.00 0.00 0.00 46.02 44.52 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 1.36 -1.12 3.25 -0.02 0.00 -1.26 -4.79 105.19 102.60 2c80 n GLY 87 Ca 0.00 -0.47 -0.14 0.00 0.00 0.00 0.00 46.02 45.41 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 -3.15 0.33 0.35 2.61 -4.23 -1.26 -5.04 115.64 105.24 2c80 s THR 88 Ca 0.04 -1.99 0.07 0.00 -1.18 0.00 0.00 61.69 58.63 2c80 s THR 88 Cb 0.15 -2.48 0.14 0.00 1.34 0.00 0.00 72.50 71.65 2c80 s THR 88 CO 0.82 -0.10 1.86 -0.33 -0.54 0.00 0.00 174.62 176.34 2c80 h GLU 89 N 2.55 0.37 -0.25 3.99 5.08 -1.97 -0.50 114.58 123.86 2c80 h GLU 89 Ca -0.37 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 57.84 2c80 h GLU 89 Cb 1.24 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 2c80 h GLU 89 CO 0.58 0.49 -0.05 1.49 -1.00 0.00 0.00 179.01 180.52 2c80 h GLU 90 N 0.35 0.47 -0.75 2.33 4.57 -1.99 -1.48 114.58 118.07 2c80 h GLU 90 Ca 0.07 -0.18 -0.04 0.00 -1.18 0.00 0.00 59.36 58.03 2c80 h GLU 90 Cb 0.42 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.95 2c80 h GLU 90 CO 0.02 0.69 0.31 0.93 -1.18 0.00 0.00 179.01 179.78 2c80 h GLU 91 N 0.22 1.12 -0.15 1.92 5.08 -1.88 -1.87 114.58 119.02 2c80 h GLU 91 Ca 0.06 -0.20 0.04 0.00 -1.00 0.00 0.00 59.36 58.26 2c80 h GLU 91 Cb 0.51 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.53 2c80 h GLU 91 CO 0.02 0.91 -0.11 -0.92 -1.00 0.00 0.00 179.01 177.92 2c80 h TYR 92 N 1.08 -0.27 -0.52 4.33 3.20 -1.00 0.99 116.97 124.78 2c80 h TYR 92 Ca 0.25 0.02 0.10 0.00 3.14 0.00 0.00 58.73 62.24 2c80 h TYR 92 Cb 0.21 0.14 -0.08 0.00 1.54 0.00 0.00 36.73 38.54 2c80 h TYR 92 CO 0.02 -0.17 0.06 -0.92 -1.64 0.00 0.00 178.16 175.52 2c80 h TYR 93 N -0.12 0.09 -0.16 -3.82 5.03 -1.11 -0.53 116.97 116.36 2c80 h TYR 93 Ca 0.09 0.03 -0.10 0.00 2.58 0.00 0.00 58.73 61.33 2c80 h TYR 93 Cb 0.25 0.04 -0.01 0.00 1.55 0.00 0.00 36.73 38.56 2c80 h TYR 93 CO -0.24 -0.06 -0.35 -0.91 -1.32 0.00 0.00 178.16 175.28 2c80 h ASN 94 N 0.19 0.33 0.21 -2.11 2.35 -0.77 0.43 115.58 116.21 2c80 h ASN 94 Ca 0.27 -0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.88 2c80 h ASN 94 Cb 0.39 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.67 2c80 h ASN 94 CO -0.38 0.67 -0.10 0.58 -1.65 0.00 0.00 177.43 176.54 2c80 h VAL 95 N 0.28 0.84 -0.37 2.81 2.07 -0.44 -2.53 116.25 118.91 2c80 h VAL 95 Ca 0.03 -0.27 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 2c80 h VAL 95 Cb 0.75 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 2c80 h VAL 95 CO 0.06 0.06 0.05 -0.33 0.02 0.00 0.00 177.57 177.43 2c80 h GLU 96 N -0.42 0.56 -0.40 1.57 4.39 -0.79 -1.20 114.58 118.29 2c80 h GLU 96 Ca -0.03 -0.11 -0.01 0.00 0.34 0.00 0.00 59.36 59.56 2c80 h GLU 96 Cb 0.32 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.86 2c80 h GLU 96 CO 0.05 0.55 0.23 -0.22 -1.16 0.00 0.00 179.01 178.45 2c80 h LYS 97 N 0.54 0.56 -0.36 2.33 3.64 -0.09 -0.94 116.57 122.26 2c80 h LYS 97 Ca 0.12 -0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.29 2c80 h LYS 97 Cb 0.27 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 2c80 h LYS 97 CO 0.00 0.44 -0.37 1.25 -2.27 0.00 0.00 179.45 178.51 2c80 h LEU 98 N 0.52 0.90 -0.43 5.20 5.85 -1.13 -1.73 115.31 124.49 2c80 h LEU 98 Ca 0.14 -0.40 -0.00 0.00 0.84 0.00 0.00 57.88 58.46 2c80 h LEU 98 Cb 0.04 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 2c80 h LEU 98 CO -0.02 1.16 0.25 0.40 -0.34 0.00 0.00 178.44 179.89 2c80 h ILE 99 N 0.70 1.14 -0.63 4.05 2.04 -1.13 -0.47 117.51 123.21 2c80 h ILE 99 Ca 0.06 -0.33 0.01 0.00 1.00 0.00 0.00 64.86 65.59 2c80 h ILE 99 Cb 0.94 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.58 2c80 h ILE 99 CO 0.09 0.14 0.41 1.23 0.00 0.00 0.00 178.15 180.03 2c80 h GLY 100 N 0.56 0.88 1.05 5.37 0.00 -1.04 0.33 103.07 110.22 2c80 h GLY 100 Ca 0.15 -0.33 -0.11 0.00 0.00 0.00 0.00 47.33 47.05 2c80 h GLY 100 CO -0.03 0.32 -0.13 1.46 0.00 0.00 0.00 176.54 178.17 2c80 h GLN 101 N 0.85 0.91 -0.50 4.80 4.20 -1.20 -2.17 115.11 122.01 2c80 h GLN 101 Ca 0.23 -0.36 -0.12 0.00 0.06 0.00 0.00 58.65 58.46 2c80 h GLN 101 Cb -0.10 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.62 2c80 h GLN 101 CO -0.05 1.01 -0.16 0.00 -0.67 0.00 0.00 178.83 178.96 2c80 h ALA 102 N 0.88 0.77 -0.05 3.87 0.00 -0.85 -2.70 119.26 121.17 2c80 h ALA 102 Ca 0.12 -0.37 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 2c80 h ALA 102 Cb 0.68 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2c80 h ALA 102 CO 0.05 0.66 -0.27 0.93 0.00 0.00 0.00 179.25 180.62 2c80 h GLU 103 N 0.85 0.09 -0.28 0.00 4.39 -0.90 -0.68 114.58 118.06 2c80 h GLU 103 Ca 0.12 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.80 2c80 h GLU 103 Cb 0.72 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.35 2c80 h GLU 103 CO 0.06 0.35 0.18 -0.44 -1.16 0.00 0.00 179.01 178.00 2c80 h ASP 104 N 0.08 0.33 -0.65 1.42 3.45 -1.15 -1.85 116.42 118.05 2c80 h ASP 104 Ca 0.01 -0.03 -0.02 0.00 0.43 0.00 0.00 57.03 57.42 2c80 h ASP 104 Cb 0.52 -0.08 -0.03 0.00 -0.56 0.00 0.00 39.33 39.18 2c80 h ASP 104 CO 0.04 0.26 0.33 0.25 -1.57 0.00 0.00 179.24 178.55 2c80 h LEU 105 N 0.37 0.83 -0.91 1.55 5.85 -1.15 -2.08 115.31 119.78 2c80 h LEU 105 Ca 0.10 -0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.75 2c80 h LEU 105 Cb -0.01 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 40.75 2c80 h LEU 105 CO -0.02 0.72 0.58 -0.08 -0.34 0.00 0.00 178.44 179.30 2c80 h GLU 106 N 0.89 1.07 0.00 1.25 4.57 -0.98 -1.95 114.58 119.44 2c80 h GLU 106 Ca 0.22 -0.06 -0.07 0.00 -1.18 0.00 0.00 59.36 58.27 2c80 h GLU 106 Cb 0.09 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 28.43 2c80 h GLU 106 CO -0.03 0.71 -0.33 0.45 -1.18 0.00 0.00 179.01 178.63 2c80 h HIS 107 N 1.10 0.00 -0.32 0.92 3.86 -0.88 -0.05 115.15 119.79 2c80 h HIS 107 Ca 0.37 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.56 2c80 h HIS 107 Cb 0.06 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.52 2c80 h HIS 107 CO -0.02 0.33 0.09 0.93 0.86 0.00 0.00 177.93 180.13 2c80 h GLU 108 N 0.00 0.49 -0.83 2.45 4.39 -0.88 -3.13 114.58 117.07 2c80 h GLU 108 Ca -0.00 -0.11 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 2c80 h GLU 108 Cb 0.90 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.44 2c80 h GLU 108 CO 0.04 0.54 0.49 -0.92 -1.16 0.00 0.00 179.01 178.00 2c80 h TYR 109 N 0.35 1.10 -0.46 4.33 3.20 -0.82 -2.84 116.97 121.83 2c80 h TYR 109 Ca 0.10 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.06 2c80 h TYR 109 Cb 0.26 -0.36 -0.02 0.00 1.54 0.00 0.00 36.73 38.14 2c80 h TYR 109 CO 0.01 0.74 0.32 1.88 -1.64 0.00 0.00 178.16 179.47 2c80 h TYR 110 N 1.15 0.20 0.00 -3.82 0.99 -0.97 -1.98 116.97 112.54 2c80 h TYR 110 Ca 0.30 0.01 0.00 0.00 2.00 0.00 0.00 58.73 61.03 2c80 h TYR 110 Cb -0.03 -0.06 0.00 0.00 1.00 0.00 0.00 36.73 37.64 2c80 h TYR 110 CO 0.01 0.10 0.01 0.87 -0.00 0.00 0.00 178.16 179.14 2c80 h LYS 111 N 0.19 0.00 0.00 4.88 1.57 -1.50 -2.19 116.57 119.52 2c80 h LYS 111 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 2c80 h LYS 111 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.91 2c80 h LYS 111 CO -0.03 0.00 -0.32 0.25 -0.57 0.00 0.00 179.45 178.78 2c80 n THR 112 N -3.00 0.17 -3.08 -0.16 -2.24 -0.74 -4.93 114.28 100.30 2c80 n THR 112 Ca -0.03 -0.11 -0.29 0.00 -2.27 0.00 0.00 64.05 61.35 2c80 n THR 112 Cb 0.07 -0.17 -0.03 0.00 -2.10 0.00 0.00 70.33 68.10 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 -3.52 3.94 -2.03 3.22 1.43 -0.83 -4.09 118.68 116.79 2c80 s LEU 113 Ca 0.11 0.94 0.00 0.00 -1.03 0.00 0.00 54.13 54.14 2c80 s LEU 113 Cb 0.16 -3.79 0.00 0.00 0.03 0.00 0.00 46.19 42.59 2c80 s LEU 113 CO 0.64 -0.31 0.00 0.23 0.23 0.00 0.00 176.35 177.15 2c80 n MET 114 N -1.14 -1.56 -4.57 1.70 2.81 -1.26 -4.96 117.12 108.14 2c80 n MET 114 Ca 0.00 1.14 -0.34 0.00 -1.81 0.00 0.00 57.70 56.69 2c80 n MET 114 Cb 0.54 -5.64 -0.12 0.00 -0.71 0.00 0.00 33.22 27.29 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 -4.31 3.10 0.28 0.03 -0.14 -1.26 -5.09 119.74 112.36 2c80 s LYS 115 Ca 0.00 -0.55 -0.26 0.00 -1.36 0.00 0.00 55.97 53.80 2c80 s LYS 115 Cb 0.00 -2.69 -0.16 0.00 -1.68 0.00 0.00 37.83 33.30 2c80 s LYS 115 CO 0.00 0.49 0.42 -2.30 -0.76 0.00 0.00 175.35 173.20 2c80 n PRO 116 N 2.76 0.13 -0.00 -1.68 -0.02 -1.26 -4.57 135.00 130.36 2c80 n PRO 116 Ca -0.18 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 2c80 n PRO 116 Cb 0.53 -1.09 0.00 0.00 -0.02 0.00 0.00 33.50 32.92 2c80 n PRO 116 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2c80 n GLU 117 N 1.05 0.16 0.00 -0.52 4.71 -1.26 -1.29 120.64 123.50 2c80 n GLU 117 Ca 0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.30 2c80 n GLU 117 Cb 0.31 -1.42 0.00 0.00 -1.01 0.00 0.00 31.44 29.32 2c80 n GLU 117 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37 2c80 n GLU 118 N 0.95 0.00 0.00 3.49 0.28 -1.26 -4.53 120.64 119.57 2c80 n GLU 118 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2c80 n GLU 118 Cb 0.08 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.95 2c80 n GLU 118 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 2c80 n GLU 119 N 0.00 0.00 -0.36 3.44 4.07 -1.26 -3.88 120.64 122.65 2c80 n GLU 119 Ca 0.00 0.00 -0.03 0.00 -0.06 0.00 0.00 57.16 57.07 2c80 n GLU 119 Cb 0.00 0.00 0.10 0.00 -0.06 0.00 0.00 31.44 31.48 2c80 n GLU 119 CO 0.00 0.00 0.00 -0.22 -0.06 0.00 0.00 177.13 176.85 2c80 h LYS 120 N 0.00 1.28 -0.04 5.31 3.64 -1.43 -2.91 116.57 122.42 2c80 h LYS 120 Ca 0.00 -0.11 -0.18 0.00 -1.27 0.00 0.00 60.65 59.10 2c80 h LYS 120 Cb 0.00 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.54 2c80 h LYS 120 CO 0.00 0.88 -0.75 1.96 -2.27 0.00 0.00 179.45 179.28 2c80 h GLN 121 N 1.31 0.26 -0.06 1.90 1.08 -1.82 -1.64 115.11 116.14 2c80 h GLN 121 Ca 0.34 -0.23 -0.17 0.00 -1.45 0.00 0.00 58.65 57.15 2c80 h GLN 121 Cb -0.08 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.39 2c80 h GLN 121 CO -0.07 0.90 -0.69 0.87 -0.95 0.00 0.00 178.83 178.89 2c80 h LYS 122 N 0.17 0.28 -0.06 1.46 1.79 -1.65 -2.18 116.57 116.39 2c80 h LYS 122 Ca -0.03 -0.22 -0.02 0.00 -2.18 0.00 0.00 60.65 58.20 2c80 h LYS 122 Cb 1.32 0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 32.01 2c80 h LYS 122 CO 0.12 0.86 -0.04 0.82 -1.08 0.00 0.00 179.45 180.13 2c80 h ILE 123 N 0.20 1.35 -0.51 1.86 1.08 -1.41 -1.38 117.51 118.68 2c80 h ILE 123 Ca -0.02 -1.11 0.10 0.00 -0.39 0.00 0.00 64.86 63.45 2c80 h ILE 123 Cb 1.24 1.97 -0.10 0.00 -3.07 0.00 0.00 36.82 36.85 2c80 h ILE 123 CO 0.11 0.30 -0.15 0.40 -0.69 0.00 0.00 178.15 178.12 2c80 h ILE 124 N -0.28 0.44 -0.74 -0.67 2.04 -1.28 0.11 117.51 117.13 2c80 h ILE 124 Ca 0.01 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.82 2c80 h ILE 124 Cb 0.51 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 2c80 h ILE 124 CO 0.01 0.00 0.25 0.11 0.00 0.00 0.00 178.15 178.52 2c80 h LYS 125 N -0.03 1.14 0.05 2.37 1.57 -1.37 -0.80 116.57 119.50 2c80 h LYS 125 Ca 0.25 -0.23 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2c80 h LYS 125 Cb 0.41 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 2c80 h LYS 125 CO -0.55 0.95 -0.04 1.49 -0.57 0.00 0.00 179.45 180.74 2c80 h GLU 126 N 1.10 -0.08 -0.01 3.15 4.81 -0.17 -2.53 114.58 120.84 2c80 h GLU 126 Ca 0.24 0.01 -0.22 0.00 -0.13 0.00 0.00 59.36 59.26 2c80 h GLU 126 Cb 0.28 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.68 2c80 h GLU 126 CO -0.01 -0.06 -0.92 -0.84 -0.73 0.00 0.00 179.01 176.45 2c80 h ILE 127 N -0.09 1.41 0.00 2.32 3.07 -0.83 -1.57 117.51 121.82 2c80 h ILE 127 Ca 0.00 -2.43 -0.05 0.00 1.55 0.00 0.00 64.86 63.93 2c80 h ILE 127 Cb 0.08 2.39 -0.01 0.00 -0.27 0.00 0.00 36.82 39.02 2c80 h ILE 127 CO -0.01 0.73 -0.22 -0.07 -1.05 0.00 0.00 178.15 177.53 2c80 h LEU 128 N 0.23 0.00 0.00 0.16 3.38 -1.21 -0.85 115.31 117.02 2c80 h LEU 128 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2c80 h LEU 128 Cb 1.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.30 2c80 h LEU 128 CO 0.16 0.22 -0.68 0.59 0.09 0.00 0.00 178.44 178.82 2c80 n ASN 129 N -3.42 0.61 0.00 -0.43 4.13 -0.95 -4.46 115.26 110.74 2c80 n ASN 129 Ca -0.00 -0.33 0.00 0.00 1.68 0.00 0.00 54.58 55.92 2c80 n ASN 129 Cb 0.41 0.45 0.00 0.00 -1.54 0.00 0.00 39.78 39.10 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 1.47 0.77 0.11 7.41 0.00 -0.60 -4.96 105.19 109.39 2c80 n GLY 130 Ca 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.04 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 0.00 0.35 1.61 1.57 -1.68 -3.31 116.57 115.11 2c80 h LYS 131 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2c80 h LYS 131 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 2c80 h LYS 131 CO 0.00 0.72 -0.34 0.28 -0.57 0.00 0.00 179.45 179.54 2c80 h VAL 132 N 0.00 0.30 -0.51 0.50 2.07 -1.48 -0.39 116.25 116.74 2c80 h VAL 132 Ca -0.01 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 2c80 h VAL 132 Cb 1.35 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 2c80 h VAL 132 CO 0.09 0.00 0.23 1.55 0.02 0.00 0.00 177.57 179.46 2c80 h PRO 133 N -0.71 0.72 -0.40 1.57 0.13 -1.78 -0.39 132.00 131.14 2c80 h PRO 133 Ca -0.02 -0.09 0.07 0.00 -0.87 0.00 0.00 66.00 65.09 2c80 h PRO 133 Cb 0.64 -0.14 -0.06 0.00 0.13 0.00 0.00 31.00 31.57 2c80 h PRO 133 CO -0.06 0.58 0.01 0.28 -0.23 0.00 0.00 178.00 178.58 2c80 h VAL 134 N 0.72 0.71 -0.09 1.56 2.07 -1.57 -1.82 116.25 117.83 2c80 h VAL 134 Ca 0.18 -0.04 -0.22 0.00 0.82 0.00 0.00 66.70 67.44 2c80 h VAL 134 Cb 0.11 0.58 0.01 0.00 -1.52 0.00 0.00 31.29 30.46 2c80 h VAL 134 CO -0.02 0.02 -0.83 -0.07 0.02 0.00 0.00 177.57 176.69 2c80 h LEU 135 N 0.12 0.78 -0.95 2.57 3.38 -0.60 -2.47 115.31 118.14 2c80 h LEU 135 Ca 0.20 -0.54 0.01 0.00 0.09 0.00 0.00 57.88 57.63 2c80 h LEU 135 Cb 0.28 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.75 2c80 h LEU 135 CO -0.32 1.33 0.62 -0.07 0.09 0.00 0.00 178.44 180.09 2c80 h LEU 136 N 0.42 1.10 -0.29 1.67 3.38 -1.01 0.15 115.31 120.73 2c80 h LEU 136 Ca -0.06 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 2c80 h LEU 136 Cb 1.45 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 2c80 h LEU 136 CO 0.16 0.81 -0.04 -0.78 0.09 0.00 0.00 178.44 178.68 2c80 h ASP 137 N 1.30 0.54 -0.80 -0.43 -0.00 -1.32 -0.26 116.42 115.44 2c80 h ASP 137 Ca 0.35 -0.34 0.08 0.00 -0.00 0.00 0.00 57.03 57.12 2c80 h ASP 137 Cb -0.14 -0.15 -0.07 0.00 -0.00 0.00 0.00 39.33 38.98 2c80 h ASP 137 CO -0.07 0.75 0.46 0.40 -0.00 0.00 0.00 179.24 180.78 2c80 h ILE 138 N 0.31 0.94 -0.66 2.25 2.04 -1.14 0.31 117.51 121.57 2c80 h ILE 138 Ca 0.08 -0.27 -0.05 0.00 1.00 0.00 0.00 64.86 65.61 2c80 h ILE 138 Cb 0.50 0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 2c80 h ILE 138 CO 0.02 0.15 0.19 0.40 0.00 0.00 0.00 178.15 178.91 2c80 h ILE 139 N 0.80 1.25 -0.54 -0.67 2.04 -0.51 -2.06 117.51 117.82 2c80 h ILE 139 Ca 0.38 -0.87 -0.04 0.00 1.00 0.00 0.00 64.86 65.33 2c80 h ILE 139 Cb 0.30 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 36.89 2c80 h ILE 139 CO -0.22 0.33 0.16 0.00 0.00 0.00 0.00 178.15 178.42 2c80 h GLU 141 N 0.79 0.73 -0.48 0.00 4.39 -0.65 -0.94 114.58 118.41 2c80 h GLU 141 Ca 0.18 -0.27 0.06 0.00 0.34 0.00 0.00 59.36 59.67 2c80 h GLU 141 Cb 0.24 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.79 2c80 h GLU 141 CO -0.01 0.86 0.19 0.77 -1.16 0.00 0.00 179.01 179.66 2c80 h SER 142 N 0.54 0.23 -0.48 1.42 0.02 -1.09 -2.54 113.55 111.64 2c80 h SER 142 Ca 0.10 0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 61.07 2c80 h SER 142 Cb 0.57 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.11 2c80 h SER 142 CO 0.03 0.16 0.18 -0.07 -1.14 0.00 0.00 176.83 176.00 2c80 h LEU 143 N 0.38 0.68 -1.66 5.07 3.38 -1.00 -2.89 115.31 119.28 2c80 h LEU 143 Ca 0.23 -0.18 0.14 0.00 0.09 0.00 0.00 57.88 58.15 2c80 h LEU 143 Cb 0.21 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 2c80 h LEU 143 CO -0.21 0.67 0.46 0.50 0.09 0.00 0.00 178.44 179.95 2c80 h LYS 144 N 0.64 0.34 -0.00 1.13 3.64 -0.96 -2.37 116.57 118.98 2c80 h LYS 144 Ca 0.16 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 2c80 h LYS 144 Cb 0.22 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2c80 h LYS 144 CO -0.01 0.22 -0.14 0.00 -2.27 0.00 0.00 179.45 177.26 2c80 n ALA 145 N -2.54 2.81 -1.77 5.00 0.00 -0.98 -4.88 120.51 118.16 2c80 n ALA 145 Ca 0.12 -0.29 -0.39 0.00 0.00 0.00 0.00 53.44 52.89 2c80 n ALA 145 Cb 0.50 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.65 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 -2.50 6.11 0.20 0.00 0.15 -0.90 -4.92 113.70 111.85 2c80 s SER 146 Ca 0.28 2.64 0.26 0.00 0.70 0.00 0.00 55.95 59.82 2c80 s SER 146 Cb 0.20 -2.63 0.83 0.00 -1.71 0.00 0.00 66.02 62.71 2c80 s SER 146 CO 0.49 -0.99 1.78 0.35 1.20 0.00 0.00 173.24 176.07 2c80 n THR 147 N -0.16 0.58 -3.46 6.45 -2.24 -1.26 -4.92 114.28 109.27 2c80 n THR 147 Ca 0.05 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2c80 n THR 147 Cb 0.44 -0.60 0.00 0.00 -2.10 0.00 0.00 70.33 68.07 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 1.28 5.67 0.20 3.38 0.00 -1.24 -4.91 105.19 109.58 2c80 n GLY 148 Ca 0.06 -1.92 0.13 0.00 0.00 0.00 0.00 46.02 44.29 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 6.56 -1.83 -3.45 116.57 119.46 2c80 h LYS 149 Ca 0.00 0.00 -0.20 0.00 -1.06 0.00 0.00 60.65 59.39 2c80 h LYS 149 Cb 0.00 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.65 2c80 h LYS 149 CO 0.00 0.00 -0.08 1.28 -2.06 0.00 0.00 179.45 178.59 2c80 n LEU 150 N -2.90 0.00 -0.18 2.94 4.77 -0.70 -4.79 117.00 116.14 2c80 n LEU 150 Ca 0.04 -0.99 -0.02 0.00 -0.03 0.00 0.00 56.01 55.01 2c80 n LEU 150 Cb 0.47 -0.05 0.08 0.00 -2.33 0.00 0.00 43.42 41.59 2c80 n LEU 150 CO 0.32 -0.42 0.98 0.00 -1.33 0.00 0.00 177.39 176.94 2c80 h ALA 151 N 0.63 0.70 -3.15 -1.18 0.00 -1.89 -3.38 119.26 110.99 2c80 h ALA 151 Ca -0.12 0.07 -0.50 0.00 0.00 0.00 0.00 54.91 54.36 2c80 h ALA 151 Cb 0.45 0.03 -0.40 0.00 0.00 0.00 0.00 17.79 17.87 2c80 h ALA 151 CO 0.18 -0.18 -0.76 0.08 0.00 0.00 0.00 179.25 178.57 2c80 s VAL 152 N -6.11 0.25 0.00 0.00 1.01 -1.26 -4.49 120.40 109.80 2c80 s VAL 152 Ca -0.13 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.42 2c80 s VAL 152 Cb 0.16 -0.86 0.00 0.00 0.00 0.00 0.00 36.38 35.68 2c80 s VAL 152 CO 0.74 -0.28 0.00 0.61 0.00 0.00 0.00 175.10 176.16 2c80 n GLY 153 N 5.15 1.40 0.01 4.51 0.00 -1.26 -4.38 105.19 110.61 2c80 n GLY 153 Ca -0.08 -0.66 0.04 0.00 0.00 0.00 0.00 46.02 45.32 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 0.53 2.99 -4.93 1.61 9.92 -1.26 -1.72 116.55 123.68 2c80 n ASP 154 Ca 0.00 0.00 -0.26 0.00 -0.53 0.00 0.00 54.79 54.00 2c80 n ASP 154 Cb 0.00 1.38 -0.03 0.00 -0.64 0.00 0.00 41.12 41.83 2c80 n ASP 154 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2c80 s LYS 155 N -2.60 3.38 0.31 -1.24 1.02 -1.26 -4.72 119.74 114.63 2c80 s LYS 155 Ca -0.03 -0.64 -0.29 0.00 0.02 0.00 0.00 55.97 55.02 2c80 s LYS 155 Cb 0.06 -2.92 -0.10 0.00 -0.52 0.00 0.00 37.83 34.34 2c80 s LYS 155 CO 0.36 0.51 1.35 0.08 -0.92 0.00 0.00 175.35 176.73 2c80 s VAL 156 N -1.77 2.68 0.34 3.17 1.01 -1.26 -4.78 120.40 119.78 2c80 s VAL 156 Ca 0.34 0.65 0.03 0.00 0.00 0.00 0.00 61.98 63.00 2c80 s VAL 156 Cb -0.11 -3.41 -0.05 0.00 0.00 0.00 0.00 36.38 32.81 2c80 s VAL 156 CO 0.28 0.14 0.08 0.42 0.00 0.00 0.00 175.10 176.02 2c80 s THR 157 N -0.83 0.94 0.49 3.92 -4.23 -1.26 -4.52 115.64 110.15 2c80 s THR 157 Ca 0.52 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 59.24 2c80 s THR 157 Cb -0.41 -2.66 0.27 0.00 1.34 0.00 0.00 72.50 71.05 2c80 s THR 157 CO 0.51 0.00 2.11 0.25 -0.54 0.00 0.00 174.62 176.95 2c80 h LEU 158 N 2.08 0.00 -0.86 4.79 5.85 -1.25 -2.72 115.31 123.20 2c80 h LEU 158 Ca -0.39 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.32 2c80 h LEU 158 Cb 1.25 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.24 2c80 h LEU 158 CO 0.65 0.08 0.50 0.00 -0.34 0.00 0.00 178.44 179.33 2c80 h ALA 159 N 1.92 1.09 -0.76 1.25 0.00 -1.83 -0.78 119.26 120.14 2c80 h ALA 159 Ca -0.00 -0.11 0.11 0.00 0.00 0.00 0.00 54.91 54.91 2c80 h ALA 159 Cb 0.17 -0.34 -0.08 0.00 0.00 0.00 0.00 17.79 17.54 2c80 h ALA 159 CO 0.01 0.57 0.39 -0.44 0.00 0.00 0.00 179.25 179.78 2c80 h ASP 160 N 1.18 0.50 0.18 0.00 3.32 -1.87 -1.51 116.42 118.22 2c80 h ASP 160 Ca 0.30 0.07 -0.25 0.00 0.02 0.00 0.00 57.03 57.17 2c80 h ASP 160 Cb -0.02 -0.02 0.03 0.00 0.22 0.00 0.00 39.33 39.54 2c80 h ASP 160 CO -0.05 0.27 -1.11 -0.07 -1.72 0.00 0.00 179.24 176.56 2c80 h LEU 161 N 0.63 0.61 -0.99 1.55 3.38 -1.53 -2.91 115.31 116.07 2c80 h LEU 161 Ca 0.38 -0.94 0.03 0.00 0.09 0.00 0.00 57.88 57.44 2c80 h LEU 161 Cb 0.43 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 2c80 h LEU 161 CO -0.29 1.53 0.65 0.58 0.09 0.00 0.00 178.44 181.00 2c80 h VAL 162 N -0.17 1.20 -0.12 1.22 2.07 -1.17 -2.85 116.25 116.43 2c80 h VAL 162 Ca -0.20 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 2c80 h VAL 162 Cb 1.86 -0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 2c80 h VAL 162 CO 0.20 0.23 0.03 0.25 0.02 0.00 0.00 177.57 178.30 2c80 h LEU 163 N 1.27 0.18 -1.05 2.57 5.85 -1.24 -2.69 115.31 120.21 2c80 h LEU 163 Ca 0.38 -0.23 -0.10 0.00 0.84 0.00 0.00 57.88 58.77 2c80 h LEU 163 Cb -0.05 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 2c80 h LEU 163 CO -0.11 0.37 -0.42 0.16 -0.34 0.00 0.00 178.44 178.09 2c80 h ILE 164 N -0.01 1.31 -0.33 4.05 3.07 -1.49 -1.69 117.51 122.43 2c80 h ILE 164 Ca 0.04 -1.50 -0.05 0.00 1.55 0.00 0.00 64.86 64.90 2c80 h ILE 164 Cb 0.25 1.74 -0.01 0.00 -0.27 0.00 0.00 36.82 38.54 2c80 h ILE 164 CO 0.00 0.44 0.01 0.00 -1.05 0.00 0.00 178.15 177.55 2c80 h ALA 165 N 1.48 0.44 -0.46 0.16 0.00 -1.47 -2.44 119.26 116.97 2c80 h ALA 165 Ca 0.01 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.56 2c80 h ALA 165 Cb 0.79 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2c80 h ALA 165 CO 0.06 0.19 -0.21 -0.24 0.00 0.00 0.00 179.25 179.04 2c80 h VAL 166 N 0.38 1.27 -1.00 0.00 3.04 -1.26 -2.74 116.25 115.94 2c80 h VAL 166 Ca 0.09 -1.37 0.07 0.00 -1.01 0.00 0.00 66.70 64.48 2c80 h VAL 166 Cb 0.42 1.14 -0.07 0.00 -2.01 0.00 0.00 31.29 30.78 2c80 h VAL 166 CO 0.01 0.47 0.64 0.40 -1.01 0.00 0.00 177.57 178.09 2c80 h ILE 167 N 0.81 1.08 -0.55 3.17 1.08 -1.30 -1.36 117.51 120.43 2c80 h ILE 167 Ca 0.11 -0.40 0.03 0.00 -0.39 0.00 0.00 64.86 64.21 2c80 h ILE 167 Cb 0.78 -0.19 -0.03 0.00 -3.07 0.00 0.00 36.82 34.31 2c80 h ILE 167 CO 0.06 0.21 0.37 0.44 -0.69 0.00 0.00 178.15 178.54 2c80 h ASP 168 N 1.16 0.55 0.03 1.72 3.45 -1.15 -0.48 116.42 121.70 2c80 h ASP 168 Ca 0.43 -0.01 -0.14 0.00 0.43 0.00 0.00 57.03 57.74 2c80 h ASP 168 Cb 0.18 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 38.82 2c80 h ASP 168 CO -0.18 0.38 -0.48 0.45 -1.57 0.00 0.00 179.24 177.84 2c80 h HIS 169 N 0.64 0.63 -0.41 4.55 3.86 -1.03 -1.81 115.15 121.59 2c80 h HIS 169 Ca 0.22 -0.20 -0.04 0.00 -1.16 0.00 0.00 60.37 59.18 2c80 h HIS 169 Cb 0.09 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 2c80 h HIS 169 CO -0.00 0.90 0.09 0.28 0.86 0.00 0.00 177.93 180.06 2c80 h VAL 170 N 0.41 1.23 0.00 2.45 2.07 -0.47 -2.77 116.25 119.18 2c80 h VAL 170 Ca 0.02 -0.82 -0.04 0.00 0.82 0.00 0.00 66.70 66.68 2c80 h VAL 170 Cb 0.99 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 2c80 h VAL 170 CO 0.09 0.28 -0.21 0.71 0.02 0.00 0.00 177.57 178.47 2c80 h THR 171 N 0.52 0.55 -0.55 2.57 1.35 -1.11 -1.71 112.91 114.54 2c80 h THR 171 Ca 0.13 -1.00 -0.01 0.00 -0.55 0.00 0.00 66.41 64.97 2c80 h THR 171 Cb 0.33 1.68 -0.03 0.00 -1.73 0.00 0.00 68.15 68.41 2c80 h THR 171 CO 0.00 0.20 0.29 0.44 -0.25 0.00 0.00 175.52 176.20 2c80 h ASP 172 N 0.00 0.68 0.16 5.36 3.45 -1.05 -2.15 116.42 122.87 2c80 h ASP 172 Ca -0.00 -0.05 -0.24 0.00 0.43 0.00 0.00 57.03 57.16 2c80 h ASP 172 Cb 0.66 -0.17 0.01 0.00 -0.56 0.00 0.00 39.33 39.27 2c80 h ASP 172 CO 0.03 0.56 -0.96 -0.07 -1.57 0.00 0.00 179.24 177.23 2c80 h LEU 173 N 0.77 0.71 -6.04 1.55 3.38 -1.10 -3.44 115.31 111.14 2c80 h LEU 173 Ca 0.19 -0.56 0.06 0.00 0.09 0.00 0.00 57.88 57.66 2c80 h LEU 173 Cb 0.05 -0.22 -0.22 0.00 0.09 0.00 0.00 40.66 40.36 2c80 h LEU 173 CO -0.03 1.36 -0.31 -0.62 0.09 0.00 0.00 178.44 178.93 2c80 s ASP 174 N -7.16 -1.30 0.48 -0.43 2.15 -0.84 -5.06 116.67 104.51 2c80 s ASP 174 Ca -0.08 0.69 0.15 0.00 0.43 0.00 0.00 52.55 53.75 2c80 s ASP 174 Cb 0.08 2.06 1.16 0.00 -0.30 0.00 0.00 42.92 45.92 2c80 s ASP 174 CO 0.89 -0.27 2.07 0.07 -0.17 0.00 0.00 175.17 177.76 2c80 h LYS 175 N 8.01 0.18 -0.65 4.34 2.10 -1.66 -2.79 116.57 126.11 2c80 h LYS 175 Ca -0.19 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.45 2c80 h LYS 175 Cb 1.16 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.45 2c80 h LYS 175 CO 0.24 0.12 0.00 0.39 -2.00 0.00 0.00 179.45 178.20 2c80 n GLU 176 N -4.49 3.40 0.09 0.07 -0.58 -1.26 -4.62 120.64 113.25 2c80 n GLU 176 Ca 0.03 -2.79 0.03 0.00 -0.42 0.00 0.00 57.16 54.01 2c80 n GLU 176 Cb 0.22 -1.77 0.42 0.00 -0.57 0.00 0.00 31.44 29.74 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 4.01 0.33 -0.03 -0.32 3.57 -1.85 -2.05 116.94 120.61 2c80 h PHE 177 Ca 0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2c80 h PHE 177 Cb 1.29 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.93 2c80 h PHE 177 CO 0.66 0.33 -0.04 1.28 -2.23 0.00 0.00 178.31 178.31 2c80 n LEU 178 N -4.37 2.64 -4.68 0.59 4.32 -1.26 -4.84 117.00 109.40 2c80 n LEU 178 Ca 0.00 -0.89 -0.42 0.00 -0.02 0.00 0.00 56.01 54.69 2c80 n LEU 178 Cb 0.18 -0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 41.95 2c80 n LEU 178 CO 0.37 0.44 1.43 -0.89 -1.22 0.00 0.00 177.39 177.52 2c80 s THR 179 N -2.04 3.06 0.00 -5.08 2.01 -0.77 -1.44 115.64 111.36 2c80 s THR 179 Ca 0.29 0.34 0.00 0.00 0.31 0.00 0.00 61.69 62.62 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 0.33 -0.01 0.00 0.61 -0.69 0.00 0.00 174.62 174.86 2c80 n GLY 180 N 4.21 0.67 3.45 4.40 0.00 -1.26 -4.99 105.19 111.66 2c80 n GLY 180 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.22 1.77 -1.13 1.61 1.02 -0.52 -4.94 119.74 117.32 2c80 s LYS 181 Ca 0.00 -2.05 -0.27 0.00 0.02 0.00 0.00 55.97 53.68 2c80 s LYS 181 Cb 0.00 -0.49 0.03 0.00 -0.52 0.00 0.00 37.83 36.85 2c80 s LYS 181 CO 0.00 -0.42 0.69 0.66 -0.92 0.00 0.00 175.35 175.36 2c80 n TYR 182 N -0.77 -1.59 -0.15 3.18 4.02 -1.26 -4.84 117.16 115.75 2c80 n TYR 182 Ca -0.03 0.26 0.15 0.00 -0.01 0.00 0.00 57.90 58.27 2c80 n TYR 182 Cb 0.65 -2.89 0.51 0.00 -0.02 0.00 0.00 39.34 37.59 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 -2.11 0.39 -0.35 -0.72 0.13 -1.92 -1.90 132.00 125.53 2c80 h PRO 183 Ca -0.69 -0.02 -0.06 0.00 -0.87 0.00 0.00 66.00 64.36 2c80 h PRO 183 Cb 1.39 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 32.42 2c80 h PRO 183 CO 0.48 0.26 -0.03 0.93 -0.23 0.00 0.00 178.00 179.41 2c80 h GLU 184 N 0.40 0.56 -0.13 0.86 3.07 -1.91 -1.64 114.58 115.79 2c80 h GLU 184 Ca 0.36 -0.14 -0.08 0.00 -0.50 0.00 0.00 59.36 59.00 2c80 h GLU 184 Cb 0.82 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.66 2c80 h GLU 184 CO -0.11 0.61 -0.25 0.82 -1.40 0.00 0.00 179.01 178.68 2c80 h ILE 185 N 0.53 1.38 -0.12 3.13 2.04 -1.70 -0.85 117.51 121.92 2c80 h ILE 185 Ca 0.11 -1.52 0.00 0.00 1.00 0.00 0.00 64.86 64.45 2c80 h ILE 185 Cb 0.39 2.05 -0.01 0.00 -0.74 0.00 0.00 36.82 38.52 2c80 h ILE 185 CO 0.02 0.45 0.07 0.45 0.00 0.00 0.00 178.15 179.14 2c80 h HIS 186 N -0.02 0.14 -0.67 1.37 3.86 -1.52 -2.22 115.15 116.09 2c80 h HIS 186 Ca 0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.21 2c80 h HIS 186 Cb 0.84 -0.05 -0.03 0.00 1.06 0.00 0.00 27.41 29.23 2c80 h HIS 186 CO 0.10 0.09 0.37 -0.22 0.86 0.00 0.00 177.93 179.13 2c80 h LYS 187 N 0.15 0.92 0.15 2.45 1.63 -1.30 -2.04 116.57 118.53 2c80 h LYS 187 Ca 0.04 -0.10 -0.01 0.00 -0.85 0.00 0.00 60.65 59.74 2c80 h LYS 187 Cb -0.01 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 31.43 2c80 h LYS 187 CO -0.02 0.68 -0.07 1.25 -3.45 0.00 0.00 179.45 177.84 2c80 h HIS 188 N 0.93 -0.19 -0.88 1.91 2.76 -0.89 -0.40 115.15 118.39 2c80 h HIS 188 Ca 0.24 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.43 2c80 h HIS 188 Cb 0.02 0.06 -0.05 0.00 1.55 0.00 0.00 27.41 28.99 2c80 h HIS 188 CO 0.01 -0.12 0.57 -0.09 -1.30 0.00 0.00 177.93 176.99 2c80 h ARG 189 N -0.21 1.07 -0.10 5.26 2.43 -1.11 0.66 114.38 122.38 2c80 h ARG 189 Ca -0.02 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.08 2c80 h ARG 189 Cb 0.16 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 29.46 2c80 h ARG 189 CO 0.03 0.71 0.06 1.49 -1.51 0.00 0.00 179.97 180.75 2c80 h GLU 190 N 1.11 0.14 -0.12 0.20 4.81 -1.15 -1.85 114.58 117.72 2c80 h GLU 190 Ca 0.35 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.50 2c80 h GLU 190 Cb -0.01 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 2c80 h GLU 190 CO -0.11 0.18 -0.19 -0.91 -0.73 0.00 0.00 179.01 177.24 2c80 h ASN 191 N 0.07 0.18 -0.12 1.04 2.35 -0.78 -2.60 115.58 115.73 2c80 h ASN 191 Ca 0.04 -0.04 -0.04 0.00 -0.55 0.00 0.00 56.30 55.70 2c80 h ASN 191 Cb 0.07 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.39 2c80 h ASN 191 CO -0.01 0.39 -0.10 0.25 -1.65 0.00 0.00 177.43 176.32 2c80 h LEU 192 N 0.18 0.29 -0.94 1.61 5.85 -0.63 -2.03 115.31 119.64 2c80 h LEU 192 Ca 0.03 -0.46 -0.11 0.00 0.84 0.00 0.00 57.88 58.18 2c80 h LEU 192 Cb 0.44 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 2c80 h LEU 192 CO 0.03 0.69 -0.46 -0.07 -0.34 0.00 0.00 178.44 178.30 2c80 h LEU 193 N -0.10 0.17 -0.40 2.25 3.38 -1.33 -1.13 115.31 118.15 2c80 h LEU 193 Ca 0.02 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 2c80 h LEU 193 Cb 0.60 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 2c80 h LEU 193 CO 0.03 0.61 0.06 0.00 0.09 0.00 0.00 178.44 179.22 2c80 h ALA 194 N 1.40 0.53 0.00 1.53 0.00 -1.49 -3.08 119.26 118.15 2c80 h ALA 194 Ca 0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 2c80 h ALA 194 Cb 0.86 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 2c80 h ALA 194 CO 0.07 0.24 -0.08 0.77 0.00 0.00 0.00 179.25 180.25 2c80 h SER 195 N 0.51 0.00 -2.69 0.00 0.02 -1.12 -3.39 113.55 106.87 2c80 h SER 195 Ca 0.12 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.47 2c80 h SER 195 Cb 0.37 0.00 -0.39 0.00 0.14 0.00 0.00 62.40 62.52 2c80 h SER 195 CO 0.01 0.08 -0.84 -0.55 -1.14 0.00 0.00 176.83 174.38 2c80 s SER 196 N -5.94 2.62 0.37 3.07 0.15 -0.45 -4.96 113.70 108.55 2c80 s SER 196 Ca 0.02 -3.13 0.12 0.00 0.70 0.00 0.00 55.95 53.66 2c80 s SER 196 Cb 0.08 -0.79 0.91 0.00 -1.71 0.00 0.00 66.02 64.52 2c80 s SER 196 CO 0.60 -0.17 1.83 -0.65 1.20 0.00 0.00 173.24 176.04 2c80 h PRO 197 N 5.82 0.57 -0.26 5.44 0.11 -1.78 -0.56 132.00 141.36 2c80 h PRO 197 Ca 0.19 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 66.30 2c80 h PRO 197 Cb 0.88 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.83 2c80 h PRO 197 CO 0.46 0.38 0.06 0.00 -0.21 0.00 0.00 178.00 178.68 2c80 h ARG 198 N 0.59 0.15 -0.26 1.05 3.08 -1.90 0.20 114.38 117.29 2c80 h ARG 198 Ca 0.51 -0.01 -0.07 0.00 0.07 0.00 0.00 59.98 60.48 2c80 h ARG 198 Cb 1.00 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.01 2c80 h ARG 198 CO -0.25 0.10 -0.10 1.25 -1.07 0.00 0.00 179.97 179.90 2c80 h LEU 199 N 0.16 0.53 -0.69 3.04 5.85 -1.61 -0.95 115.31 121.64 2c80 h LEU 199 Ca 0.12 -0.39 0.10 0.00 0.84 0.00 0.00 57.88 58.54 2c80 h LEU 199 Cb 0.11 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 40.93 2c80 h LEU 199 CO -0.15 0.80 0.32 0.00 -0.34 0.00 0.00 178.44 179.07 2c80 h ALA 200 N 0.75 0.94 -0.20 1.25 0.00 -1.04 0.27 119.26 121.24 2c80 h ALA 200 Ca 0.06 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2c80 h ALA 200 Cb 0.59 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2c80 h ALA 200 CO 0.03 -0.09 0.12 -0.22 0.00 0.00 0.00 179.25 179.09 2c80 h LYS 201 N 0.55 0.27 -0.74 0.00 1.63 -0.49 -2.41 116.57 115.38 2c80 h LYS 201 Ca 0.34 -0.03 0.02 0.00 -0.85 0.00 0.00 60.65 60.14 2c80 h LYS 201 Cb 0.39 -0.06 -0.04 0.00 -0.60 0.00 0.00 32.23 31.92 2c80 h LYS 201 CO -0.29 0.23 0.48 -0.92 -3.45 0.00 0.00 179.45 175.50 2c80 h TYR 202 N 0.24 0.90 0.00 1.91 5.03 -0.57 -1.88 116.97 122.60 2c80 h TYR 202 Ca 0.07 0.02 -0.09 0.00 2.58 0.00 0.00 58.73 61.32 2c80 h TYR 202 Cb 0.03 -0.30 -0.01 0.00 1.55 0.00 0.00 36.73 38.00 2c80 h TYR 202 CO -0.05 0.54 -0.42 -0.07 -1.32 0.00 0.00 178.16 176.85 2c80 h LEU 203 N 0.96 0.00 -0.37 2.82 3.38 -0.91 -2.47 115.31 118.72 2c80 h LEU 203 Ca 0.28 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.08 2c80 h LEU 203 Cb -0.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 2c80 h LEU 203 CO -0.08 0.42 -0.50 0.28 0.09 0.00 0.00 178.44 178.64 2c80 h SER 204 N 0.00 0.92 -0.16 -0.43 0.02 -0.95 -3.28 113.55 109.66 2c80 h SER 204 Ca -0.00 -0.47 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2c80 h SER 204 Cb 0.92 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.19 2c80 h SER 204 CO 0.05 1.26 0.00 0.47 -1.14 0.00 0.00 176.83 177.47 2c80 n ASP 205 N -4.01 1.86 -4.66 3.07 8.00 -0.75 -4.88 116.55 115.18 2c80 n ASP 205 Ca -0.04 -1.72 -0.42 0.00 0.71 0.00 0.00 54.79 53.33 2c80 n ASP 205 Cb 0.60 -0.10 -0.03 0.00 -0.02 0.00 0.00 41.12 41.57 2c80 n ASP 205 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2c80 s ARG 206 N -1.80 4.25 0.46 -1.24 3.52 -0.95 -5.02 118.95 118.18 2c80 s ARG 206 Ca 0.34 1.13 -0.24 0.00 -0.13 0.00 0.00 55.73 56.83 2c80 s ARG 206 Cb 0.18 -3.62 -0.07 0.00 -1.56 0.00 0.00 34.95 29.88 2c80 s ARG 206 CO 0.28 -0.50 1.28 0.00 -0.81 0.00 0.00 175.30 175.55 2c80 s ALA 207 N 2.75 3.05 0.29 6.12 0.00 -1.26 -4.95 121.76 127.76 2c80 s ALA 207 Ca 0.40 1.18 -0.30 0.00 0.00 0.00 0.00 51.96 53.24 2c80 s ALA 207 Cb -0.16 -3.48 -0.11 0.00 0.00 0.00 0.00 23.12 19.37 2c80 s ALA 207 CO 0.09 -0.95 1.60 0.00 0.00 0.00 0.00 175.76 176.50 2c80 s ALA 208 N -1.36 3.75 -0.00 0.00 0.00 -1.26 -5.02 121.76 117.87 2c80 s ALA 208 Ca 0.63 1.57 0.02 0.00 0.00 0.00 0.00 51.96 54.18 2c80 s ALA 208 Cb -0.36 -3.65 -0.00 0.00 0.00 0.00 0.00 23.12 19.11 2c80 s ALA 208 CO 0.45 -0.98 -0.06 0.95 0.00 0.00 0.00 175.76 176.12 2c80 s THR 209 N 0.02 0.46 -0.49 0.00 -4.23 -1.26 -5.06 115.64 105.08 2c80 s THR 209 Ca 0.63 -0.25 0.24 0.00 -1.18 0.00 0.00 61.69 61.14 2c80 s THR 209 Cb -0.48 -0.39 0.26 0.00 1.34 0.00 0.00 72.50 73.23 2c80 s THR 209 CO 0.48 0.13 1.73 -0.81 -0.54 0.00 0.00 174.62 175.60 2c80 n PRO 210 N 2.94 0.21 0.00 3.99 -0.04 -1.26 -4.93 135.00 135.90 2c80 n PRO 210 Ca -0.13 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.74 2c80 n PRO 210 Cb 0.58 -1.88 0.00 0.00 -0.04 0.00 0.00 33.50 32.16 2c80 n PRO 210 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43