#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cik h SER 2 N 0.00 0.05 -5.13 1.61 0.87 -1.14 -3.48 113.55 106.33 2cik h SER 2 Ca 0.00 -0.64 -0.12 0.00 -1.23 0.00 0.00 61.79 59.80 2cik h SER 2 Cb 0.00 -0.02 -0.17 0.00 -0.44 0.00 0.00 62.40 61.78 2cik h SER 2 CO 0.00 0.68 -0.54 -1.00 -0.53 0.00 0.00 176.83 175.44 2cik s HIS 3 N -3.67 0.27 0.05 2.24 4.02 -0.94 -4.98 115.29 112.28 2cik s HIS 3 Ca -0.16 -0.65 -0.09 0.00 1.02 0.00 0.00 55.06 55.18 2cik s HIS 3 Cb 0.01 -0.19 -0.00 0.00 -1.02 0.00 0.00 32.58 31.38 2cik s HIS 3 CO 0.69 -0.39 0.18 -1.54 1.02 0.00 0.00 174.74 174.70 2cik s SER 4 N -2.40 0.08 -0.03 1.40 1.04 -1.26 -0.12 113.70 112.40 2cik s SER 4 Ca -0.01 -0.46 0.06 0.00 0.48 0.00 0.00 55.95 56.01 2cik s SER 4 Cb 0.02 0.29 -0.01 0.00 0.10 0.00 0.00 66.02 66.42 2cik s SER 4 CO -0.07 -0.59 -0.21 -0.32 0.98 0.00 0.00 173.24 173.03 2cik s MET 5 N -2.90 1.87 0.00 4.02 0.00 -0.63 -1.12 119.30 120.55 2cik s MET 5 Ca -0.02 -0.74 0.00 0.00 0.00 0.00 0.00 55.69 54.93 2cik s MET 5 Cb 0.00 -1.71 -0.00 0.00 0.00 0.00 0.00 34.83 33.12 2cik s MET 5 CO -0.06 0.38 -0.01 1.03 0.00 0.00 0.00 175.02 176.36 2cik s ARG 6 N -0.29 0.12 -0.01 4.11 1.81 -0.48 -1.95 118.95 122.26 2cik s ARG 6 Ca 0.03 -0.07 0.04 0.00 -1.72 0.00 0.00 55.73 54.00 2cik s ARG 6 Cb -0.10 -0.10 -0.03 0.00 -0.45 0.00 0.00 34.95 34.27 2cik s ARG 6 CO 0.01 0.03 -0.11 0.71 -0.68 0.00 0.00 175.30 175.26 2cik s TYR 7 N -0.09 2.78 -0.18 -0.53 2.02 -0.29 -0.57 117.35 120.49 2cik s TYR 7 Ca -0.00 -0.10 0.00 0.00 -0.37 0.00 0.00 57.07 56.60 2cik s TYR 7 Cb -0.01 -1.60 0.04 0.00 -0.40 0.00 0.00 41.96 39.99 2cik s TYR 7 CO -0.00 0.30 -0.09 -0.06 -1.57 0.00 0.00 175.55 174.13 2cik s PHE 8 N -0.89 2.12 -0.13 2.71 0.40 -0.07 -2.06 117.98 120.05 2cik s PHE 8 Ca 0.15 -1.36 -0.03 0.00 -0.60 0.00 0.00 56.93 55.09 2cik s PHE 8 Cb -0.11 -1.51 -0.03 0.00 0.51 0.00 0.00 43.02 41.88 2cik s PHE 8 CO 0.04 -0.69 -0.03 0.71 0.70 0.00 0.00 175.22 175.96 2cik s TYR 9 N 1.50 3.05 -0.08 0.36 2.02 0.01 -1.59 117.35 122.61 2cik s TYR 9 Ca 0.00 -0.12 0.01 0.00 -0.37 0.00 0.00 57.07 56.60 2cik s TYR 9 Cb -0.15 -1.89 0.02 0.00 -0.40 0.00 0.00 41.96 39.54 2cik s TYR 9 CO -0.08 0.14 -0.10 0.99 -1.57 0.00 0.00 175.55 174.93 2cik s THR 10 N -0.10 1.07 -0.10 -0.71 2.01 -0.22 -0.96 115.64 116.62 2cik s THR 10 Ca 0.03 -0.39 0.04 0.00 0.31 0.00 0.00 61.69 61.68 2cik s THR 10 Cb -0.13 -1.02 0.00 0.00 0.01 0.00 0.00 72.50 71.36 2cik s THR 10 CO 0.02 0.35 -0.23 0.00 -0.69 0.00 0.00 174.62 174.07 2cik s ALA 11 N 1.09 2.15 -0.14 7.40 0.00 -0.17 -0.58 121.76 131.52 2cik s ALA 11 Ca -0.07 -0.97 -0.01 0.00 0.00 0.00 0.00 51.96 50.92 2cik s ALA 11 Cb -0.14 -0.83 0.04 0.00 0.00 0.00 0.00 23.12 22.19 2cik s ALA 11 CO -0.01 0.24 -0.03 -1.64 0.00 0.00 0.00 175.76 174.32 2cik s MET 12 N 0.41 1.14 0.63 0.00 -1.94 0.36 -1.34 119.30 118.56 2cik s MET 12 Ca -0.17 -0.31 -0.13 0.00 -1.71 0.00 0.00 55.69 53.37 2cik s MET 12 Cb -0.18 -1.70 -0.02 0.00 2.01 0.00 0.00 34.83 34.94 2cik s MET 12 CO 0.07 -0.40 1.04 -1.54 -0.01 0.00 0.00 175.02 174.18 2cik s SER 13 N 1.76 5.83 -0.48 3.03 1.04 -0.10 -1.33 113.70 123.46 2cik s SER 13 Ca 0.02 1.61 0.06 0.00 0.48 0.00 0.00 55.95 58.12 2cik s SER 13 Cb -0.14 -2.50 0.26 0.00 0.10 0.00 0.00 66.02 63.74 2cik s SER 13 CO -0.07 -1.14 0.95 -2.11 0.98 0.00 0.00 173.24 171.85 2cik n ARG 14 N -2.58 0.81 -1.63 4.02 1.85 -1.26 -3.94 116.66 113.93 2cik n ARG 14 Ca 0.07 -1.74 -0.50 0.00 -1.00 0.00 0.00 57.85 54.68 2cik n ARG 14 Cb 0.54 -1.34 -0.05 0.00 -1.05 0.00 0.00 32.46 30.55 2cik n ARG 14 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 2cik n PRO 15 N 1.37 1.53 -0.26 2.89 -0.02 -1.26 -0.58 135.00 138.66 2cik n PRO 15 Ca 0.08 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 2cik n PRO 15 Cb 0.65 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 2cik n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2cik n GLY 16 N 2.99 1.09 2.10 -1.23 0.00 -1.26 -4.88 105.19 103.99 2cik n GLY 16 Ca 0.18 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.13 2cik n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cik n ARG 17 N -2.00 2.13 0.00 1.61 1.74 0.25 -5.12 116.66 115.27 2cik n ARG 17 Ca 0.00 -3.51 0.00 0.00 -0.77 0.00 0.00 57.85 53.57 2cik n ARG 17 Cb 0.00 -1.62 0.00 0.00 -1.02 0.00 0.00 32.46 29.82 2cik n ARG 17 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2cik n GLY 18 N -0.55 -3.23 3.83 -0.13 0.00 -1.25 -4.94 105.19 98.91 2cik n GLY 18 Ca 0.21 -1.98 -0.31 0.00 0.00 0.00 0.00 46.02 43.94 2cik n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cik s GLU 19 N -0.66 3.09 0.33 1.61 0.41 -1.26 -4.59 118.70 117.63 2cik s GLU 19 Ca 0.00 0.95 -0.28 0.00 -0.41 0.00 0.00 54.97 55.22 2cik s GLU 19 Cb 0.00 -2.01 -0.13 0.00 -1.78 0.00 0.00 34.13 30.21 2cik s GLU 19 CO 0.00 -0.98 1.25 -2.30 -0.49 0.00 0.00 175.26 172.74 2cik n PRO 20 N -2.95 1.99 -2.99 0.39 -0.02 -1.26 -4.83 135.00 125.33 2cik n PRO 20 Ca 0.07 0.70 -0.39 0.00 -2.02 0.00 0.00 63.50 61.86 2cik n PRO 20 Cb 0.54 -2.25 -0.06 0.00 -0.02 0.00 0.00 33.50 31.71 2cik n PRO 20 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 2cik s ARG 21 N -1.79 4.54 -0.13 -0.52 3.52 -0.44 -4.84 118.95 119.30 2cik s ARG 21 Ca 0.56 1.13 0.03 0.00 -0.13 0.00 0.00 55.73 57.32 2cik s ARG 21 Cb -0.59 -3.23 0.01 0.00 -1.56 0.00 0.00 34.95 29.58 2cik s ARG 21 CO 0.62 0.56 -0.21 0.12 -0.81 0.00 0.00 175.30 175.57 2cik s PHE 22 N -1.18 2.54 -0.02 5.12 5.36 -1.26 -0.49 117.98 128.04 2cik s PHE 22 Ca 0.36 -1.23 0.05 0.00 -0.96 0.00 0.00 56.93 55.16 2cik s PHE 22 Cb -0.22 -1.73 -0.01 0.00 -0.34 0.00 0.00 43.02 40.71 2cik s PHE 22 CO 0.26 -0.56 -0.19 0.42 -1.46 0.00 0.00 175.22 173.70 2cik s ILE 23 N 0.75 1.49 -0.03 3.12 1.01 0.26 -1.24 121.20 126.56 2cik s ILE 23 Ca -0.09 -0.79 0.04 0.00 0.00 0.00 0.00 60.65 59.81 2cik s ILE 23 Cb -0.16 -1.25 -0.00 0.00 0.01 0.00 0.00 42.46 41.06 2cik s ILE 23 CO 0.00 0.42 -0.13 0.00 0.00 0.00 0.00 174.94 175.23 2cik s ALA 24 N -0.29 1.17 0.06 9.38 0.00 -0.56 -1.05 121.76 130.47 2cik s ALA 24 Ca 0.04 -0.53 0.04 0.00 0.00 0.00 0.00 51.96 51.50 2cik s ALA 24 Cb -0.09 -0.37 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 2cik s ALA 24 CO 0.00 0.23 -0.11 0.14 0.00 0.00 0.00 175.76 176.02 2cik s VAL 25 N -0.02 0.84 -0.03 0.00 -7.23 -0.62 -0.80 120.40 112.54 2cik s VAL 25 Ca -0.01 -1.17 0.07 0.00 -1.81 0.00 0.00 61.98 59.06 2cik s VAL 25 Cb -0.09 -0.85 -0.02 0.00 0.56 0.00 0.00 36.38 35.99 2cik s VAL 25 CO 0.01 -0.28 -0.24 -0.83 -0.31 0.00 0.00 175.10 173.45 2cik s GLY 26 N -1.61 1.19 0.03 2.32 0.00 -0.98 -0.90 107.32 107.38 2cik s GLY 26 Ca -0.05 -1.02 0.05 0.00 0.00 0.00 0.00 44.72 43.70 2cik s GLY 26 CO 0.01 -0.78 -0.16 -0.19 0.00 0.00 0.00 173.10 171.99 2cik s TYR 27 N -0.43 1.39 -0.22 1.90 1.51 0.27 -0.55 117.35 121.21 2cik s TYR 27 Ca 0.05 -0.34 -0.04 0.00 -1.01 0.00 0.00 57.07 55.73 2cik s TYR 27 Cb -0.11 -0.84 -0.01 0.00 -0.11 0.00 0.00 41.96 40.90 2cik s TYR 27 CO 0.00 0.04 -0.02 0.08 -1.11 0.00 0.00 175.55 174.54 2cik s VAL 28 N -0.74 3.54 0.00 0.71 1.01 -0.22 -1.38 120.40 123.33 2cik s VAL 28 Ca 0.04 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.58 2cik s VAL 28 Cb -0.08 -2.62 0.00 0.00 0.00 0.00 0.00 36.38 33.69 2cik s VAL 28 CO 0.01 0.41 0.00 0.47 0.00 0.00 0.00 175.10 175.99 2cik n ASP 29 N 4.75 0.00 -1.87 3.32 8.00 -0.27 -1.04 116.55 129.44 2cik n ASP 29 Ca -0.18 0.00 -0.05 0.00 0.71 0.00 0.00 54.79 55.27 2cik n ASP 29 Cb 0.51 0.00 0.27 0.00 -0.02 0.00 0.00 41.12 41.88 2cik n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2cik n ASP 30 N 3.62 4.54 -4.13 -2.24 8.00 -1.26 -4.85 116.55 120.23 2cik n ASP 30 Ca 0.00 -3.06 -0.33 0.00 0.71 0.00 0.00 54.79 52.11 2cik n ASP 30 Cb 0.00 -0.72 -0.15 0.00 -0.02 0.00 0.00 41.12 40.23 2cik n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2cik s THR 31 N -2.68 2.37 0.30 -3.53 2.01 -0.21 -5.01 115.64 108.89 2cik s THR 31 Ca 0.49 -1.15 -0.29 0.00 0.31 0.00 0.00 61.69 61.04 2cik s THR 31 Cb 0.39 -2.18 -0.10 0.00 0.01 0.00 0.00 72.50 70.62 2cik s THR 31 CO 0.12 0.27 1.15 -1.58 -0.69 0.00 0.00 174.62 173.89 2cik s GLN 32 N 1.25 4.52 0.00 4.92 0.74 -1.26 -1.06 119.66 128.77 2cik s GLN 32 Ca -0.00 1.88 0.00 0.00 0.05 0.00 0.00 55.36 57.29 2cik s GLN 32 Cb -0.16 -3.11 0.00 0.00 1.10 0.00 0.00 33.01 30.84 2cik s GLN 32 CO -0.08 0.08 0.00 1.97 -0.55 0.00 0.00 175.29 176.71 2cik n PHE 33 N 0.98 0.00 -3.91 1.67 -1.74 0.29 -3.94 117.46 110.80 2cik n PHE 33 Ca -0.00 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.79 2cik n PHE 33 Cb 0.44 0.00 -0.09 0.00 1.52 0.00 0.00 39.48 41.35 2cik n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 2cik s VAL 34 N -1.21 0.13 0.05 1.97 -7.23 -1.23 -0.71 120.40 112.17 2cik s VAL 34 Ca 0.00 -1.06 -0.01 0.00 -1.81 0.00 0.00 61.98 59.10 2cik s VAL 34 Cb 0.00 -0.90 -0.04 0.00 0.56 0.00 0.00 36.38 36.00 2cik s VAL 34 CO 0.00 -0.59 -0.03 0.00 -0.31 0.00 0.00 175.10 174.17 2cik s ARG 35 N -2.61 0.58 -0.10 4.82 1.70 -0.74 -2.31 118.95 120.28 2cik s ARG 35 Ca -0.05 -1.14 -0.08 0.00 -0.47 0.00 0.00 55.73 53.99 2cik s ARG 35 Cb -0.01 0.18 0.03 0.00 -0.57 0.00 0.00 34.95 34.59 2cik s ARG 35 CO -0.05 -0.10 0.26 0.12 -1.08 0.00 0.00 175.30 174.46 2cik s PHE 36 N -3.59 -0.31 -0.08 5.89 2.19 0.02 -1.04 117.98 121.05 2cik s PHE 36 Ca 0.04 0.75 -0.03 0.00 0.33 0.00 0.00 56.93 58.03 2cik s PHE 36 Cb 0.06 0.09 0.04 0.00 -1.31 0.00 0.00 43.02 41.89 2cik s PHE 36 CO -0.09 -0.18 0.05 0.34 1.83 0.00 0.00 175.22 177.18 2cik s ASP 37 N 0.57 1.54 0.63 6.13 3.68 -1.26 -1.50 116.67 126.47 2cik s ASP 37 Ca -0.04 -0.13 0.41 0.00 2.13 0.00 0.00 52.55 54.93 2cik s ASP 37 Cb -0.05 -0.23 2.12 0.00 -1.45 0.00 0.00 42.92 43.31 2cik s ASP 37 CO -0.03 -0.26 2.26 0.77 0.13 0.00 0.00 175.17 178.04 2cik h SER 38 N 8.41 0.00 0.72 -0.34 4.64 -1.58 -2.16 113.55 123.24 2cik h SER 38 Ca -0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 2cik h SER 38 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2cik h SER 38 CO 0.21 0.00 -0.02 0.47 -0.87 0.00 0.00 176.83 176.61 2cik n ASP 39 N -3.09 0.05 -4.76 4.97 9.92 -1.26 -4.82 116.55 117.56 2cik n ASP 39 Ca -0.02 0.07 -0.34 0.00 -0.53 0.00 0.00 54.79 53.97 2cik n ASP 39 Cb 0.14 -0.34 0.05 0.00 -0.64 0.00 0.00 41.12 40.33 2cik n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2cik s ALA 40 N -2.74 2.43 0.21 2.24 0.00 -0.81 -4.91 121.76 118.17 2cik s ALA 40 Ca 0.22 0.76 -0.11 0.00 0.00 0.00 0.00 51.96 52.84 2cik s ALA 40 Cb 0.20 -3.39 0.28 0.00 0.00 0.00 0.00 23.12 20.21 2cik s ALA 40 CO 0.50 -1.33 1.68 0.00 0.00 0.00 0.00 175.76 176.60 2cik h ALA 41 N 0.28 0.63 -3.24 0.00 0.00 -1.92 -3.27 119.26 111.75 2cik h ALA 41 Ca -0.48 0.16 -0.61 0.00 0.00 0.00 0.00 54.91 53.98 2cik h ALA 41 Cb 1.27 0.26 -0.40 0.00 0.00 0.00 0.00 17.79 18.92 2cik h ALA 41 CO 0.54 -0.36 -0.73 -1.12 0.00 0.00 0.00 179.25 177.57 2cik s SER 42 N -5.26 4.09 0.03 0.00 0.01 -1.26 -5.10 113.70 106.22 2cik s SER 42 Ca -0.13 -2.19 -0.30 0.00 1.31 0.00 0.00 55.95 54.64 2cik s SER 42 Cb 0.18 -1.15 -0.08 0.00 0.21 0.00 0.00 66.02 65.18 2cik s SER 42 CO 0.74 -0.34 1.71 -2.84 0.41 0.00 0.00 173.24 172.91 2cik s PRO 43 N 0.89 4.18 0.06 12.44 0.02 -1.23 -4.95 135.00 146.41 2cik s PRO 43 Ca 0.13 2.34 -0.24 0.00 0.02 0.00 0.00 61.00 63.25 2cik s PRO 43 Cb -0.21 -3.80 0.06 0.00 0.02 0.00 0.00 34.50 30.57 2cik s PRO 43 CO -0.11 -0.81 0.57 -0.98 -0.33 0.00 0.00 177.00 175.34 2cik s ARG 44 N 3.35 1.11 0.09 5.54 1.70 -1.26 -5.04 118.95 124.44 2cik s ARG 44 Ca 0.76 -0.22 -0.31 0.00 -0.47 0.00 0.00 55.73 55.49 2cik s ARG 44 Cb -0.39 0.51 -0.08 0.00 -0.57 0.00 0.00 34.95 34.42 2cik s ARG 44 CO 0.33 -0.42 1.54 0.99 -1.08 0.00 0.00 175.30 176.66 2cik s THR 45 N -2.62 3.07 0.04 4.99 2.01 -1.26 -4.61 115.64 117.26 2cik s THR 45 Ca -0.04 0.65 0.08 0.00 0.31 0.00 0.00 61.69 62.70 2cik s THR 45 Cb -0.01 -3.42 -0.03 0.00 0.01 0.00 0.00 72.50 69.06 2cik s THR 45 CO -0.03 0.02 -0.24 -1.61 -0.69 0.00 0.00 174.62 172.07 2cik s GLU 46 N 1.87 1.68 0.41 4.92 2.02 -0.21 -4.98 118.70 124.42 2cik s GLU 46 Ca 0.69 -1.02 -0.25 0.00 0.02 0.00 0.00 54.97 54.42 2cik s GLU 46 Cb -0.39 -1.81 -0.08 0.00 0.10 0.00 0.00 34.13 31.95 2cik s GLU 46 CO 0.31 0.47 1.14 -1.25 0.02 0.00 0.00 175.26 175.95 2cik s PRO 47 N -1.13 4.05 0.00 0.39 0.04 -1.26 -1.79 135.00 135.30 2cik s PRO 47 Ca 0.10 1.75 0.00 0.00 0.04 0.00 0.00 61.00 62.89 2cik s PRO 47 Cb -0.09 -2.62 0.00 0.00 0.04 0.00 0.00 34.50 31.83 2cik s PRO 47 CO 0.02 -0.30 0.48 0.54 0.04 0.00 0.00 177.00 177.78 2cik n ARG 48 N -0.01 0.47 -4.15 4.56 5.12 0.11 -4.86 116.66 117.90 2cik n ARG 48 Ca 0.05 -0.59 -0.15 0.00 -1.93 0.00 0.00 57.85 55.22 2cik n ARG 48 Cb 0.47 -0.72 -0.13 0.00 -1.16 0.00 0.00 32.46 30.93 2cik n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2cik s ALA 49 N -0.23 0.68 0.32 7.54 0.00 -1.23 -4.64 121.76 124.20 2cik s ALA 49 Ca 0.00 -0.64 0.01 0.00 0.00 0.00 0.00 51.96 51.33 2cik s ALA 49 Cb 0.00 -0.05 0.53 0.00 0.00 0.00 0.00 23.12 23.60 2cik s ALA 49 CO 0.00 0.07 1.92 -1.35 0.00 0.00 0.00 175.76 176.40 2cik h PRO 50 N 4.98 0.81 0.00 0.00 0.11 -1.95 -2.87 132.00 133.09 2cik h PRO 50 Ca -0.34 -0.10 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2cik h PRO 50 Cb 1.19 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2cik h PRO 50 CO 0.44 0.64 0.00 -2.67 -0.21 0.00 0.00 178.00 176.19 2cik n TRP 51 N -4.35 0.65 0.15 0.65 4.27 -1.26 -2.06 117.44 115.48 2cik n TRP 51 Ca 0.05 0.28 0.12 0.00 -3.89 0.00 0.00 57.50 54.05 2cik n TRP 51 Cb 0.14 -0.95 0.05 0.00 -1.36 0.00 0.00 31.31 29.19 2cik n TRP 51 CO 0.00 0.00 0.00 0.97 -2.29 0.00 0.00 177.69 176.37 2cik h ILE 52 N 0.00 0.00 -0.63 -1.67 6.09 -1.85 -3.37 117.51 116.08 2cik h ILE 52 Ca 0.00 -0.98 0.13 0.00 -1.37 0.00 0.00 64.86 62.64 2cik h ILE 52 Cb 0.24 1.62 -0.04 0.00 0.47 0.00 0.00 36.82 39.12 2cik h ILE 52 CO 0.00 0.00 0.43 -0.33 -3.07 0.00 0.00 178.15 175.18 2cik h GLU 53 N 0.00 0.28 0.00 2.19 5.08 -1.54 -1.69 114.58 118.90 2cik h GLU 53 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2cik h GLU 53 Cb 0.99 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.18 2cik h GLU 53 CO 0.00 0.18 0.00 0.00 -1.00 0.00 0.00 179.01 178.19 2cik n GLN 54 N -4.45 0.02 -2.15 2.33 10.64 -1.26 -4.78 117.38 117.73 2cik n GLN 54 Ca 0.11 0.32 -0.38 0.00 -1.83 0.00 0.00 57.00 55.23 2cik n GLN 54 Cb 0.49 -1.55 -0.00 0.00 -0.86 0.00 0.00 30.24 28.32 2cik n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 2cik s GLU 55 N -3.05 3.69 0.80 2.61 0.41 -0.64 -4.99 118.70 117.53 2cik s GLU 55 Ca 0.05 1.90 -0.12 0.00 -0.41 0.00 0.00 54.97 56.39 2cik s GLU 55 Cb 0.08 -2.43 0.07 0.00 -1.78 0.00 0.00 34.13 30.07 2cik s GLU 55 CO 0.23 -0.65 1.15 0.20 -0.49 0.00 0.00 175.26 175.70 2cik s GLY 56 N -1.21 1.60 0.32 -1.39 0.00 -1.26 -4.88 107.32 100.51 2cik s GLY 56 Ca 0.64 -0.52 0.11 0.00 0.00 0.00 0.00 44.72 44.95 2cik s GLY 56 CO 0.39 -0.05 1.69 -2.55 0.00 0.00 0.00 173.10 172.57 2cik h PRO 57 N -1.04 0.40 -0.57 2.90 0.11 -1.97 -1.39 132.00 130.44 2cik h PRO 57 Ca -0.47 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 2cik h PRO 57 Cb 1.31 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 2cik h PRO 57 CO 0.64 0.27 0.08 1.05 -0.21 0.00 0.00 178.00 179.83 2cik h GLU 58 N 0.42 0.93 -0.04 1.05 4.11 -1.98 -0.03 114.58 119.02 2cik h GLU 58 Ca 0.67 -0.23 0.01 0.00 0.07 0.00 0.00 59.36 59.88 2cik h GLU 58 Cb 1.42 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.55 2cik h GLU 58 CO -0.56 0.87 0.01 -0.92 0.07 0.00 0.00 179.01 178.48 2cik h TYR 59 N 0.87 0.01 -0.40 2.06 3.20 -1.61 0.03 116.97 121.13 2cik h TYR 59 Ca 0.18 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.97 2cik h TYR 59 Cb 0.40 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.66 2cik h TYR 59 CO 0.03 0.00 -0.06 -1.49 -1.64 0.00 0.00 178.16 175.00 2cik h TRP 60 N 0.03 0.84 -1.00 -3.82 4.06 -1.38 -0.74 115.95 113.94 2cik h TRP 60 Ca 0.02 -0.17 0.01 0.00 2.06 0.00 0.00 58.89 60.81 2cik h TRP 60 Cb 0.02 -0.21 -0.05 0.00 -1.00 0.00 0.00 29.16 27.92 2cik h TRP 60 CO -0.10 0.86 0.66 -0.44 -3.56 0.00 0.00 178.44 175.86 2cik h ASP 61 N 0.57 1.15 -0.22 -3.49 3.32 -0.91 -0.84 116.42 116.01 2cik h ASP 61 Ca 0.11 -0.03 -0.09 0.00 0.02 0.00 0.00 57.03 57.03 2cik h ASP 61 Cb 0.57 -0.29 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 2cik h ASP 61 CO 0.03 0.84 -0.23 -0.09 -1.72 0.00 0.00 179.24 178.08 2cik h ARG 62 N 1.36 0.53 -0.26 3.56 9.65 -0.72 -0.75 114.38 127.76 2cik h ARG 62 Ca 0.37 -0.29 0.03 0.00 -1.10 0.00 0.00 59.98 58.99 2cik h ARG 62 Cb -0.15 0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 28.41 2cik h ARG 62 CO -0.08 0.87 0.05 -0.91 2.80 0.00 0.00 179.97 182.71 2cik h ASN 63 N 0.22 0.02 -0.66 -3.80 2.35 -0.97 -1.62 115.58 111.13 2cik h ASN 63 Ca 0.03 0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 55.75 2cik h ASN 63 Cb 0.78 0.05 -0.03 0.00 0.05 0.00 0.00 38.32 39.17 2cik h ASN 63 CO 0.06 0.04 0.12 0.74 -1.65 0.00 0.00 177.43 176.74 2cik h THR 64 N 0.15 1.26 -0.30 2.81 2.02 -1.07 -0.32 112.91 117.47 2cik h THR 64 Ca 0.12 -1.02 0.03 0.00 0.77 0.00 0.00 66.41 66.31 2cik h THR 64 Cb 0.12 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 67.11 2cik h THR 64 CO -0.15 0.38 0.13 -0.61 0.37 0.00 0.00 175.52 175.64 2cik h GLN 65 N 1.03 0.27 -0.18 6.66 -0.00 -0.93 0.12 115.11 122.06 2cik h GLN 65 Ca 0.21 -0.02 0.01 0.00 -0.00 0.00 0.00 58.65 58.85 2cik h GLN 65 Cb 0.42 -0.06 -0.01 0.00 0.00 0.00 0.00 27.48 27.83 2cik h GLN 65 CO 0.01 0.18 0.10 0.82 0.00 0.00 0.00 178.83 179.93 2cik h ILE 66 N 0.27 1.01 -0.09 2.39 2.04 -0.72 -0.45 117.51 121.97 2cik h ILE 66 Ca 0.13 -0.07 -0.16 0.00 1.00 0.00 0.00 64.86 65.76 2cik h ILE 66 Cb 0.07 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 2cik h ILE 66 CO -0.11 0.04 -0.62 -0.26 0.00 0.00 0.00 178.15 177.20 2cik h PHE 67 N 0.21 0.42 -0.45 1.37 0.04 -0.91 -0.01 116.94 117.61 2cik h PHE 67 Ca 0.07 -0.17 -0.03 0.00 2.80 0.00 0.00 57.97 60.65 2cik h PHE 67 Cb 0.00 -0.07 -0.02 0.00 2.20 0.00 0.00 35.95 38.06 2cik h PHE 67 CO -0.08 0.86 0.17 0.87 -0.60 0.00 0.00 178.31 179.52 2cik h LYS 68 N 0.24 0.69 -0.51 1.51 1.57 -0.75 -0.76 116.57 118.56 2cik h LYS 68 Ca -0.01 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.59 2cik h LYS 68 Cb 1.14 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.33 2cik h LYS 68 CO 0.10 0.64 0.12 1.15 -0.57 0.00 0.00 179.45 180.89 2cik h THR 69 N 0.59 1.24 -0.94 -0.16 2.02 -0.92 -2.70 112.91 112.04 2cik h THR 69 Ca 0.15 -0.86 0.07 0.00 0.77 0.00 0.00 66.41 66.55 2cik h THR 69 Cb 0.22 0.83 -0.06 0.00 -1.74 0.00 0.00 68.15 67.40 2cik h THR 69 CO -0.01 0.31 0.61 0.78 0.37 0.00 0.00 175.52 177.58 2cik h ASN 70 N 0.70 0.94 -0.63 4.18 -0.26 -0.87 -1.02 115.58 118.61 2cik h ASN 70 Ca 0.16 0.01 0.10 0.00 -0.56 0.00 0.00 56.30 56.02 2cik h ASN 70 Cb 0.34 -0.19 -0.08 0.00 -1.06 0.00 0.00 38.32 37.33 2cik h ASN 70 CO 0.00 0.59 0.23 0.74 -1.06 0.00 0.00 177.43 177.93 2cik h THR 71 N 1.06 0.73 -0.11 2.81 2.02 -0.81 0.20 112.91 118.81 2cik h THR 71 Ca 0.41 -0.14 -0.11 0.00 0.77 0.00 0.00 66.41 67.35 2cik h THR 71 Cb 0.24 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 2cik h THR 71 CO -0.17 0.07 -0.37 1.56 0.37 0.00 0.00 175.52 176.99 2cik h GLN 72 N 0.39 0.45 -0.66 6.66 1.08 -1.25 -2.63 115.11 119.15 2cik h GLN 72 Ca 0.33 -0.33 0.04 0.00 -1.45 0.00 0.00 58.65 57.24 2cik h GLN 72 Cb 0.43 0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 27.87 2cik h GLN 72 CO -0.34 0.95 0.39 1.15 -0.95 0.00 0.00 178.83 180.04 2cik h THR 73 N 0.03 1.04 -0.05 -0.54 2.02 -0.86 -2.44 112.91 112.10 2cik h THR 73 Ca -0.01 -0.26 -0.08 0.00 0.77 0.00 0.00 66.41 66.83 2cik h THR 73 Cb 0.99 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 2cik h THR 73 CO 0.08 0.14 -0.35 1.88 0.37 0.00 0.00 175.52 177.63 2cik h TYR 74 N 0.75 0.10 -0.42 3.16 0.05 -0.63 -0.49 116.97 119.49 2cik h TYR 74 Ca 0.28 -0.02 -0.05 0.00 0.05 0.00 0.00 58.73 58.98 2cik h TYR 74 Cb 0.09 -0.03 -0.02 0.00 1.01 0.00 0.00 36.73 37.79 2cik h TYR 74 CO -0.06 0.44 0.07 0.00 -1.05 0.00 0.00 178.16 177.55 2cik h ARG 75 N 0.08 0.70 -0.70 4.88 3.08 -1.06 -0.35 114.38 121.00 2cik h ARG 75 Ca 0.01 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 59.85 2cik h ARG 75 Cb 0.66 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.60 2cik h ARG 75 CO 0.05 0.73 0.35 1.49 -1.07 0.00 0.00 179.97 181.53 2cik h GLU 76 N 0.55 1.00 -0.83 0.04 4.81 -1.17 -2.40 114.58 116.58 2cik h GLU 76 Ca 0.13 -0.14 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 2cik h GLU 76 Cb 0.37 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.53 2cik h GLU 76 CO 0.01 0.78 0.41 0.77 -0.73 0.00 0.00 179.01 180.24 2cik h SER 77 N 0.97 1.08 -0.81 1.04 0.02 -0.84 -0.32 113.55 114.70 2cik h SER 77 Ca 0.24 -0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 2cik h SER 77 Cb 0.09 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.32 2cik h SER 77 CO -0.03 0.91 0.43 -0.07 -1.14 0.00 0.00 176.83 176.92 2cik h LEU 78 N 1.18 1.02 -0.35 5.07 3.38 -0.87 0.40 115.31 125.14 2cik h LEU 78 Ca 0.29 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.15 2cik h LEU 78 Cb 0.11 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2cik h LEU 78 CO -0.04 0.84 0.22 0.03 0.09 0.00 0.00 178.44 179.58 2cik h ARG 79 N 1.13 0.44 -0.09 1.13 3.08 -0.94 -1.80 114.38 117.33 2cik h ARG 79 Ca 0.28 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.31 2cik h ARG 79 Cb 0.06 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 2cik h ARG 79 CO -0.04 0.29 0.05 -0.91 -1.07 0.00 0.00 179.97 178.29 2cik h ASN 80 N 0.45 0.09 -0.85 7.04 -0.26 -0.72 -2.75 115.58 118.58 2cik h ASN 80 Ca 0.13 -0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.87 2cik h ASN 80 Cb -0.03 -0.02 -0.04 0.00 -1.06 0.00 0.00 38.32 37.17 2cik h ASN 80 CO -0.04 0.07 0.52 -0.07 -1.06 0.00 0.00 177.43 176.85 2cik h LEU 81 N 0.11 1.02 -0.57 1.61 -0.00 -0.82 -1.02 115.31 115.64 2cik h LEU 81 Ca 0.03 -0.06 0.11 0.00 -0.00 0.00 0.00 57.88 57.96 2cik h LEU 81 Cb -0.01 -0.26 -0.09 0.00 -0.00 0.00 0.00 40.66 40.31 2cik h LEU 81 CO -0.01 0.78 0.08 -0.09 -0.00 0.00 0.00 178.44 179.20 2cik h ARG 82 N 1.17 0.20 -0.62 1.13 2.43 -1.22 -2.08 114.38 115.39 2cik h ARG 82 Ca 0.31 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.39 2cik h ARG 82 Cb -0.06 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.42 2cik h ARG 82 CO -0.06 0.13 0.11 0.78 -1.51 0.00 0.00 179.97 179.43 2cik h GLY 83 N 0.21 1.09 2.00 2.80 0.00 -1.05 -0.97 103.07 107.14 2cik h GLY 83 Ca 0.30 -0.69 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 2cik h GLY 83 CO -0.41 0.64 -0.03 -0.97 0.00 0.00 0.00 176.54 175.77 2cik h TYR 84 N 0.95 0.00 -0.28 5.60 0.05 -0.52 -2.18 116.97 120.59 2cik h TYR 84 Ca 0.19 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.97 2cik h TYR 84 Cb 0.40 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.14 2cik h TYR 84 CO 0.03 0.03 0.00 0.66 -1.05 0.00 0.00 178.16 177.83 2cik n TYR 85 N -3.63 0.46 -3.46 4.88 4.01 -1.00 -4.76 117.16 113.66 2cik n TYR 85 Ca -0.03 -0.57 -0.25 0.00 -0.16 0.00 0.00 57.90 56.89 2cik n TYR 85 Cb 0.13 -0.08 0.03 0.00 -0.31 0.00 0.00 39.34 39.11 2cik n TYR 85 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2cik n ASN 86 N 0.16 -5.05 -4.85 7.72 3.02 -0.82 -4.95 115.26 110.48 2cik n ASN 86 Ca 0.12 -0.49 -0.33 0.00 -0.03 0.00 0.00 54.58 53.84 2cik n ASN 86 Cb 0.48 -4.08 -0.06 0.00 -0.61 0.00 0.00 39.78 35.52 2cik n ASN 86 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2cik s GLN 87 N -6.14 3.95 0.69 3.52 -0.21 -0.41 -5.03 119.66 116.02 2cik s GLN 87 Ca 0.47 0.52 -0.14 0.00 0.02 0.00 0.00 55.36 56.24 2cik s GLN 87 Cb -0.23 -2.62 0.01 0.00 1.00 0.00 0.00 33.01 31.17 2cik s GLN 87 CO 0.59 0.28 1.10 -1.54 -2.12 0.00 0.00 175.29 173.60 2cik s SER 88 N -2.17 4.95 0.00 5.90 1.04 -1.26 -4.72 113.70 117.44 2cik s SER 88 Ca 0.48 1.95 0.18 0.00 0.48 0.00 0.00 55.95 59.04 2cik s SER 88 Cb -0.12 -2.54 1.03 0.00 0.10 0.00 0.00 66.02 64.49 2cik s SER 88 CO 0.19 -1.74 1.50 -0.62 0.98 0.00 0.00 173.24 173.56 2cik n GLU 89 N -2.72 0.48 0.04 4.02 1.02 -1.26 -3.64 120.64 118.59 2cik n GLU 89 Ca 0.10 0.04 -0.01 0.00 -0.02 0.00 0.00 57.16 57.27 2cik n GLU 89 Cb 0.52 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.37 2cik n GLU 89 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2cik h ALA 90 N 3.05 0.66 -2.29 0.62 0.00 -1.98 -3.44 119.26 115.87 2cik h ALA 90 Ca 0.00 -0.86 -0.49 0.00 0.00 0.00 0.00 54.91 53.56 2cik h ALA 90 Cb 0.05 0.25 0.03 0.00 0.00 0.00 0.00 17.79 18.11 2cik h ALA 90 CO 0.00 0.95 0.06 0.20 0.00 0.00 0.00 179.25 180.46 2cik s GLY 91 N -4.78 1.49 -0.12 0.00 0.00 -1.24 -4.68 107.32 97.99 2cik s GLY 91 Ca -0.02 -0.56 -0.09 0.00 0.00 0.00 0.00 44.72 44.05 2cik s GLY 91 CO 0.81 -0.42 0.18 -0.56 0.00 0.00 0.00 173.10 173.11 2cik s SER 92 N -4.05 6.42 0.07 1.64 0.01 -1.26 -4.60 113.70 111.92 2cik s SER 92 Ca 0.46 0.50 0.01 0.00 1.31 0.00 0.00 55.95 58.22 2cik s SER 92 Cb -0.10 -2.10 -0.04 0.00 0.21 0.00 0.00 66.02 63.99 2cik s SER 92 CO 0.43 0.35 -0.05 -1.00 0.41 0.00 0.00 173.24 173.38 2cik s HIS 93 N -0.77 0.68 -0.05 2.43 3.76 -1.25 -4.96 115.29 115.13 2cik s HIS 93 Ca 0.15 -0.92 0.01 0.00 -0.15 0.00 0.00 55.06 54.15 2cik s HIS 93 Cb -0.12 -0.43 0.02 0.00 1.11 0.00 0.00 32.58 33.15 2cik s HIS 93 CO 0.04 -0.24 -0.07 0.42 -0.85 0.00 0.00 174.74 174.04 2cik s ILE 94 N -3.44 0.76 -0.14 0.60 1.01 -1.26 -0.92 121.20 117.81 2cik s ILE 94 Ca 0.06 -0.25 -0.05 0.00 0.00 0.00 0.00 60.65 60.41 2cik s ILE 94 Cb 0.04 -0.74 -0.04 0.00 0.01 0.00 0.00 42.46 41.74 2cik s ILE 94 CO -0.06 0.27 0.03 -0.63 0.00 0.00 0.00 174.94 174.55 2cik s ILE 95 N 0.83 4.49 0.01 2.92 1.01 -0.45 -0.31 121.20 129.69 2cik s ILE 95 Ca -0.12 -0.16 0.07 0.00 0.00 0.00 0.00 60.65 60.45 2cik s ILE 95 Cb -0.15 -2.96 -0.02 0.00 0.01 0.00 0.00 42.46 39.34 2cik s ILE 95 CO 0.01 0.53 -0.23 -1.10 0.00 0.00 0.00 174.94 174.15 2cik s GLN 96 N -0.13 1.75 -0.02 2.79 -0.21 -0.11 -1.00 119.66 122.73 2cik s GLN 96 Ca 0.05 -0.89 0.02 0.00 0.02 0.00 0.00 55.36 54.56 2cik s GLN 96 Cb -0.12 -1.77 0.01 0.00 1.00 0.00 0.00 33.01 32.13 2cik s GLN 96 CO 0.02 0.47 -0.06 0.50 -2.12 0.00 0.00 175.29 174.10 2cik s ARG 97 N -0.79 0.73 -0.02 2.91 3.52 -0.14 -1.08 118.95 124.09 2cik s ARG 97 Ca 0.09 -0.20 0.05 0.00 -0.13 0.00 0.00 55.73 55.54 2cik s ARG 97 Cb -0.09 -0.71 -0.01 0.00 -1.56 0.00 0.00 34.95 32.57 2cik s ARG 97 CO 0.00 0.06 -0.17 0.00 -0.81 0.00 0.00 175.30 174.38 2cik s MET 98 N 0.31 1.47 0.05 5.12 0.23 -0.10 -0.81 119.30 125.56 2cik s MET 98 Ca -0.04 -0.61 -0.12 0.00 -1.03 0.00 0.00 55.69 53.89 2cik s MET 98 Cb -0.08 -1.39 0.01 0.00 -1.53 0.00 0.00 34.83 31.84 2cik s MET 98 CO 0.00 0.35 0.27 1.52 -2.03 0.00 0.00 175.02 175.12 2cik s TYR 99 N -0.32 -0.04 -4.91 3.16 1.13 -0.88 -0.90 117.35 114.60 2cik s TYR 99 Ca 0.05 -0.15 0.00 0.00 -1.41 0.00 0.00 57.07 55.56 2cik s TYR 99 Cb -0.08 0.05 0.00 0.00 -1.10 0.00 0.00 41.96 40.84 2cik s TYR 99 CO -0.00 -0.49 0.00 0.41 -2.51 0.00 0.00 175.55 172.95 2cik n GLY 100 N 0.52 -1.36 3.24 5.49 0.00 -0.73 -1.14 105.19 111.21 2cik n GLY 100 Ca -0.18 -1.22 -0.23 0.00 0.00 0.00 0.00 46.02 44.39 2cik n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cik s ASP 102 N -1.50 3.87 0.01 0.00 1.01 -0.20 -1.60 116.67 118.25 2cik s ASP 102 Ca 0.05 -0.34 0.03 0.00 0.71 0.00 0.00 52.55 53.00 2cik s ASP 102 Cb -0.09 -1.41 -0.03 0.00 1.01 0.00 0.00 42.92 42.39 2cik s ASP 102 CO 0.03 0.20 -0.04 -0.76 0.21 0.00 0.00 175.17 174.81 2cik s LEU 103 N 0.12 3.32 0.80 1.23 1.43 0.83 0.11 118.68 126.53 2cik s LEU 103 Ca -0.07 -0.09 -0.09 0.00 -1.03 0.00 0.00 54.13 52.84 2cik s LEU 103 Cb -0.15 -1.91 0.11 0.00 0.03 0.00 0.00 46.19 44.28 2cik s LEU 103 CO 0.05 0.28 1.13 -0.83 0.23 0.00 0.00 176.35 177.21 2cik s GLY 104 N -1.52 1.71 0.54 -3.19 0.00 -0.35 -0.71 107.32 103.80 2cik s GLY 104 Ca 0.18 -1.08 0.37 0.00 0.00 0.00 0.00 44.72 44.19 2cik s GLY 104 CO 0.09 -0.53 1.80 -2.55 0.00 0.00 0.00 173.10 171.91 2cik h PRO 105 N -0.98 0.01 0.00 2.90 0.11 -1.92 0.32 132.00 132.44 2cik h PRO 105 Ca -0.43 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2cik h PRO 105 Cb 1.29 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2cik h PRO 105 CO 0.52 0.01 0.00 -0.40 -0.21 0.00 0.00 178.00 177.91 2cik n ASP 106 N -4.18 0.00 0.00 -2.05 5.75 -1.26 -4.92 116.55 109.89 2cik n ASP 106 Ca 0.26 -0.05 0.00 0.00 -0.01 0.00 0.00 54.79 54.99 2cik n ASP 106 Cb 1.26 -0.31 0.00 0.00 -1.03 0.00 0.00 41.12 41.04 2cik n ASP 106 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2cik n GLY 107 N 1.24 0.64 3.87 6.12 0.00 0.11 -5.06 105.19 112.10 2cik n GLY 107 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2cik n GLY 107 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2cik s ARG 108 N -0.25 3.82 -0.11 1.61 1.70 -1.26 -4.79 118.95 119.68 2cik s ARG 108 Ca 0.00 0.30 -0.30 0.00 -0.47 0.00 0.00 55.73 55.27 2cik s ARG 108 Cb 0.00 -2.67 -0.07 0.00 -0.57 0.00 0.00 34.95 31.64 2cik s ARG 108 CO 0.00 0.33 2.10 -0.11 -1.08 0.00 0.00 175.30 176.54 2cik n LEU 109 N -0.05 3.62 -0.07 -1.89 7.94 -1.26 -1.22 117.00 124.07 2cik n LEU 109 Ca -0.00 0.56 -0.13 0.00 -1.11 0.00 0.00 56.01 55.33 2cik n LEU 109 Cb 0.52 -1.52 -0.11 0.00 0.53 0.00 0.00 43.42 42.85 2cik n LEU 109 CO 0.45 -0.27 0.18 -0.07 -1.11 0.00 0.00 177.39 176.57 2cik h LEU 110 N 12.68 0.00 -7.00 -1.96 3.38 -0.65 -3.47 115.31 118.29 2cik h LEU 110 Ca -0.45 -0.76 0.12 0.00 0.09 0.00 0.00 57.88 56.88 2cik h LEU 110 Cb 1.25 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.84 2cik h LEU 110 CO 0.95 1.00 0.53 0.00 0.09 0.00 0.00 178.44 181.02 2cik s ARG 111 N -2.15 0.75 0.25 1.13 1.70 -1.16 -5.02 118.95 114.45 2cik s ARG 111 Ca -0.18 -0.26 0.09 0.00 -0.47 0.00 0.00 55.73 54.92 2cik s ARG 111 Cb -0.01 0.35 -0.04 0.00 -0.57 0.00 0.00 34.95 34.67 2cik s ARG 111 CO 0.57 -0.32 -0.01 0.20 -1.08 0.00 0.00 175.30 174.65 2cik s GLY 112 N -2.37 1.67 0.00 3.88 0.00 -1.26 -1.03 107.32 108.20 2cik s GLY 112 Ca 0.05 -1.61 0.01 0.00 0.00 0.00 0.00 44.72 43.17 2cik s GLY 112 CO -0.08 -1.67 -0.05 0.30 0.00 0.00 0.00 173.10 171.61 2cik s HIS 113 N -2.21 0.41 -0.25 1.90 0.09 0.59 -4.87 115.29 110.95 2cik s HIS 113 Ca 0.30 -0.13 -0.04 0.00 -0.00 0.00 0.00 55.06 55.20 2cik s HIS 113 Cb -0.07 -0.26 0.13 0.00 -0.00 0.00 0.00 32.58 32.38 2cik s HIS 113 CO 0.19 -0.02 0.46 0.34 -0.00 0.00 0.00 174.74 175.71 2cik s ASP 114 N -0.28 -0.33 0.01 1.40 2.15 -1.26 -1.77 116.67 116.58 2cik s ASP 114 Ca 0.00 0.68 0.02 0.00 0.43 0.00 0.00 52.55 53.68 2cik s ASP 114 Cb -0.03 1.49 -0.01 0.00 -0.30 0.00 0.00 42.92 44.07 2cik s ASP 114 CO -0.00 -0.27 -0.06 -1.10 -0.17 0.00 0.00 175.17 173.57 2cik s GLN 115 N 2.66 0.46 0.08 4.34 -0.21 -0.08 -0.50 119.66 126.41 2cik s GLN 115 Ca 0.09 -0.34 0.05 0.00 0.02 0.00 0.00 55.36 55.18 2cik s GLN 115 Cb -0.14 -0.39 -0.03 0.00 1.00 0.00 0.00 33.01 33.45 2cik s GLN 115 CO -0.16 0.10 -0.14 -1.12 -2.12 0.00 0.00 175.29 171.85 2cik s SER 116 N -0.51 1.70 0.03 5.90 0.01 0.31 -0.93 113.70 120.22 2cik s SER 116 Ca -0.01 -0.66 0.02 0.00 1.31 0.00 0.00 55.95 56.62 2cik s SER 116 Cb -0.04 -0.05 -0.02 0.00 0.21 0.00 0.00 66.02 66.12 2cik s SER 116 CO -0.00 -0.10 -0.08 0.00 0.41 0.00 0.00 173.24 173.47 2cik s ALA 117 N -1.48 0.59 -0.14 1.44 0.00 -0.24 -1.19 121.76 120.74 2cik s ALA 117 Ca -0.00 -0.65 0.02 0.00 0.00 0.00 0.00 51.96 51.33 2cik s ALA 117 Cb -0.09 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.04 2cik s ALA 117 CO 0.02 0.03 -0.20 -0.47 0.00 0.00 0.00 175.76 175.14 2cik s TYR 118 N -1.06 2.55 -1.53 0.00 5.04 -0.33 -0.93 117.35 121.10 2cik s TYR 118 Ca -0.06 -1.31 -0.16 0.00 -2.44 0.00 0.00 57.07 53.10 2cik s TYR 118 Cb -0.08 -1.76 0.13 0.00 0.35 0.00 0.00 41.96 40.61 2cik s TYR 118 CO 0.00 -0.62 0.68 -0.25 -1.34 0.00 0.00 175.55 174.02 2cik n ASP 119 N 4.18 -3.34 0.00 4.32 8.00 0.57 -1.68 116.55 128.60 2cik n ASP 119 Ca -0.20 -0.78 0.00 0.00 0.71 0.00 0.00 54.79 54.52 2cik n ASP 119 Cb 0.51 -2.75 0.00 0.00 -0.02 0.00 0.00 41.12 38.86 2cik n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2cik n GLY 120 N -1.28 0.80 3.51 0.44 0.00 -1.26 -5.03 105.19 102.37 2cik n GLY 120 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 2cik n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cik s LYS 121 N -0.30 3.13 0.23 1.61 -0.14 -0.68 -5.05 119.74 118.54 2cik s LYS 121 Ca 0.00 -0.57 -0.32 0.00 -1.36 0.00 0.00 55.97 53.72 2cik s LYS 121 Cb 0.00 -2.68 -0.14 0.00 -1.68 0.00 0.00 37.83 33.33 2cik s LYS 121 CO 0.00 0.45 1.41 -0.25 -0.76 0.00 0.00 175.35 176.21 2cik n ASP 122 N 2.85 2.71 0.04 2.83 8.00 -1.26 -1.19 116.55 130.54 2cik n ASP 122 Ca -0.18 1.14 -0.00 0.00 0.71 0.00 0.00 54.79 56.46 2cik n ASP 122 Cb 0.53 -1.42 -0.00 0.00 -0.02 0.00 0.00 41.12 40.21 2cik n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2cik n TYR 123 N 2.02 0.00 -3.73 1.24 9.36 -0.33 -4.72 117.16 120.99 2cik n TYR 123 Ca 0.12 0.00 -0.13 0.00 3.32 0.00 0.00 57.90 61.21 2cik n TYR 123 Cb 0.31 -0.00 -0.10 0.00 -0.63 0.00 0.00 39.34 38.92 2cik n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 2cik s ILE 124 N -2.00 0.01 -0.00 2.97 2.07 -1.14 -1.09 121.20 122.01 2cik s ILE 124 Ca -0.00 -0.06 0.01 0.00 -1.41 0.00 0.00 60.65 59.18 2cik s ILE 124 Cb 0.00 -0.59 -0.00 0.00 0.13 0.00 0.00 42.46 42.00 2cik s ILE 124 CO 0.00 -0.03 -0.02 0.00 -1.91 0.00 0.00 174.94 172.98 2cik s ALA 125 N -0.02 0.18 0.10 1.50 0.00 -0.64 -0.53 121.76 122.35 2cik s ALA 125 Ca -0.02 -0.10 -0.31 0.00 0.00 0.00 0.00 51.96 51.54 2cik s ALA 125 Cb -0.03 -0.04 -0.07 0.00 0.00 0.00 0.00 23.12 22.98 2cik s ALA 125 CO 0.01 0.04 1.28 -1.17 0.00 0.00 0.00 175.76 175.92 2cik s LEU 126 N -0.06 4.38 0.88 0.00 2.96 0.35 -0.90 118.68 126.28 2cik s LEU 126 Ca 0.01 2.18 -0.12 0.00 -0.22 0.00 0.00 54.13 55.98 2cik s LEU 126 Cb -0.01 -3.59 0.12 0.00 0.50 0.00 0.00 46.19 43.21 2cik s LEU 126 CO -0.00 -0.53 1.11 0.20 -1.32 0.00 0.00 176.35 175.81 2cik s ASN 127 N 0.92 3.76 0.58 3.68 0.01 0.05 -4.58 114.94 119.36 2cik s ASN 127 Ca 0.60 1.20 0.33 0.00 -0.71 0.00 0.00 52.86 54.29 2cik s ASN 127 Cb -0.33 -1.86 1.77 0.00 0.41 0.00 0.00 41.25 41.24 2cik s ASN 127 CO 0.31 -2.42 2.17 -0.08 -1.51 0.00 0.00 177.10 175.57 2cik h GLU 128 N -1.40 0.00 0.00 -0.60 4.81 -1.89 -0.11 114.58 115.39 2cik h GLU 128 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2cik h GLU 128 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 2cik h GLU 128 CO 0.59 0.05 0.00 -0.40 -0.73 0.00 0.00 179.01 178.52 2cik n ASP 129 N -3.45 0.00 -2.30 1.04 5.68 -1.26 -4.80 116.55 111.46 2cik n ASP 129 Ca -0.02 0.34 -0.16 0.00 -0.50 0.00 0.00 54.79 54.45 2cik n ASP 129 Cb 0.17 -0.41 -0.02 0.00 -1.14 0.00 0.00 41.12 39.73 2cik n ASP 129 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2cik n LEU 130 N -1.41 -1.47 0.00 -2.12 4.77 -0.05 -4.75 117.00 111.96 2cik n LEU 130 Ca 0.04 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 2cik n LEU 130 Cb 0.13 -2.49 0.00 0.00 -2.33 0.00 0.00 43.42 38.73 2cik n LEU 130 CO 0.11 -0.25 -0.13 -1.20 -1.33 0.00 0.00 177.39 174.58 2cik n SER 131 N -1.77 1.32 -4.36 -1.43 7.64 -1.26 -4.46 113.62 109.30 2cik n SER 131 Ca -0.19 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.51 2cik n SER 131 Cb 0.63 0.15 -0.10 0.00 -1.01 0.00 0.00 64.21 63.88 2cik n SER 131 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2cik s SER 132 N -1.41 1.97 0.12 6.43 1.04 -1.26 -4.90 113.70 115.70 2cik s SER 132 Ca 0.00 -1.26 0.09 0.00 0.48 0.00 0.00 55.95 55.26 2cik s SER 132 Cb 0.00 -0.01 -0.04 0.00 0.10 0.00 0.00 66.02 66.07 2cik s SER 132 CO 0.00 -0.53 -0.16 0.26 0.98 0.00 0.00 173.24 173.78 2cik s TRP 133 N -3.38 2.57 -0.29 5.02 0.52 -1.26 -0.77 118.94 121.34 2cik s TRP 133 Ca 0.31 -0.25 -0.02 0.00 0.02 0.00 0.00 56.10 56.17 2cik s TRP 133 Cb 0.06 -1.34 0.05 0.00 -1.15 0.00 0.00 33.47 31.09 2cik s TRP 133 CO 0.11 0.41 -0.01 0.99 0.02 0.00 0.00 176.95 178.46 2cik s THR 134 N -1.23 2.94 -0.16 2.01 2.01 -0.08 -4.88 115.64 116.25 2cik s THR 134 Ca 0.19 -1.34 -0.12 0.00 0.31 0.00 0.00 61.69 60.73 2cik s THR 134 Cb -0.10 -2.67 -0.05 0.00 0.01 0.00 0.00 72.50 69.69 2cik s THR 134 CO 0.11 -0.06 0.23 0.00 -0.69 0.00 0.00 174.62 174.21 2cik s ALA 135 N 1.26 3.66 0.28 7.40 0.00 -1.26 -1.62 121.76 131.47 2cik s ALA 135 Ca -0.05 -0.53 0.15 0.00 0.00 0.00 0.00 51.96 51.52 2cik s ALA 135 Cb -0.19 -2.27 0.62 0.00 0.00 0.00 0.00 23.12 21.27 2cik s ALA 135 CO -0.02 0.20 1.73 0.00 0.00 0.00 0.00 175.76 177.68 2cik h ALA 136 N 6.35 1.11 -2.46 0.00 0.00 -1.39 -3.47 119.26 119.39 2cik h ALA 136 Ca -0.43 -0.41 0.02 0.00 0.00 0.00 0.00 54.91 54.09 2cik h ALA 136 Cb 1.17 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 2cik h ALA 136 CO 0.73 0.56 0.23 -0.40 0.00 0.00 0.00 179.25 180.36 2cik n ASP 137 N -3.80 -1.28 0.24 0.00 5.68 -1.26 -5.03 116.55 111.10 2cik n ASP 137 Ca -0.01 -1.83 0.10 0.00 -0.50 0.00 0.00 54.79 52.55 2cik n ASP 137 Cb 0.50 2.12 0.57 0.00 -1.14 0.00 0.00 41.12 43.17 2cik n ASP 137 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 2cik h THR 138 N 1.59 0.63 0.04 2.12 1.35 -1.99 -1.92 112.91 114.73 2cik h THR 138 Ca -0.19 -0.90 -0.00 0.00 -0.55 0.00 0.00 66.41 64.77 2cik h THR 138 Cb 0.74 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 2cik h THR 138 CO 0.24 0.20 -0.02 0.00 -0.25 0.00 0.00 175.52 175.69 2cik h ALA 139 N 1.80 -0.05 -0.09 6.62 0.00 -1.97 -3.10 119.26 122.47 2cik h ALA 139 Ca -0.00 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.69 2cik h ALA 139 Cb 0.57 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2cik h ALA 139 CO 0.03 -0.28 0.08 0.00 0.00 0.00 0.00 179.25 179.07 2cik h ALA 140 N 0.38 1.79 -0.18 0.00 0.00 -1.78 -1.32 119.26 118.15 2cik h ALA 140 Ca -0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2cik h ALA 140 Cb 0.50 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2cik h ALA 140 CO 0.01 -0.13 0.08 1.96 0.00 0.00 0.00 179.25 181.17 2cik h GLN 141 N 0.00 0.24 -0.04 0.00 4.20 -1.28 0.42 115.11 118.65 2cik h GLN 141 Ca 0.04 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 2cik h GLN 141 Cb 0.20 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.93 2cik h GLN 141 CO -0.00 0.20 -0.01 0.82 -0.67 0.00 0.00 178.83 179.17 2cik h ILE 142 N 0.25 1.28 -0.74 2.54 2.04 -1.26 -1.64 117.51 119.98 2cik h ILE 142 Ca 0.06 -0.86 0.09 0.00 1.00 0.00 0.00 64.86 65.15 2cik h ILE 142 Cb 0.04 1.77 -0.07 0.00 -0.74 0.00 0.00 36.82 37.83 2cik h ILE 142 CO -0.01 0.23 0.39 0.74 0.00 0.00 0.00 178.15 179.51 2cik h THR 143 N -0.25 0.89 -0.30 -0.27 2.02 -1.43 -1.78 112.91 111.79 2cik h THR 143 Ca 0.01 -0.23 0.03 0.00 0.77 0.00 0.00 66.41 66.99 2cik h THR 143 Cb 0.38 0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 66.91 2cik h THR 143 CO 0.00 0.12 0.11 -0.61 0.37 0.00 0.00 175.52 175.52 2cik h GLN 144 N 0.67 0.24 -0.60 6.66 4.15 -0.82 0.09 115.11 125.50 2cik h GLN 144 Ca 0.36 -0.01 0.05 0.00 0.77 0.00 0.00 58.65 59.81 2cik h GLN 144 Cb 0.34 -0.05 -0.05 0.00 0.21 0.00 0.00 27.48 27.92 2cik h GLN 144 CO -0.25 0.16 0.33 0.00 -1.93 0.00 0.00 178.83 177.14 2cik h ARG 145 N 0.25 0.60 -0.48 1.69 3.08 -0.90 0.04 114.38 118.66 2cik h ARG 145 Ca 0.13 -0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.18 2cik h ARG 145 Cb 0.09 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 29.97 2cik h ARG 145 CO -0.13 0.40 0.25 0.87 -1.07 0.00 0.00 179.97 180.29 2cik h LYS 146 N 0.62 0.48 -0.01 0.04 1.57 -0.81 -1.81 116.57 116.65 2cik h LYS 146 Ca 0.26 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.89 2cik h LYS 146 Cb 0.15 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 2cik h LYS 146 CO -0.16 0.32 -0.57 -1.49 -0.57 0.00 0.00 179.45 176.98 2cik h TRP 147 N 0.50 0.04 -0.22 -1.35 4.06 -0.53 -1.22 115.95 117.22 2cik h TRP 147 Ca 0.21 -0.01 -0.06 0.00 2.06 0.00 0.00 58.89 61.08 2cik h TRP 147 Cb 0.10 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 28.25 2cik h TRP 147 CO -0.10 0.59 -0.10 0.93 -3.56 0.00 0.00 178.44 176.20 2cik h GLU 148 N 0.02 0.46 -0.81 0.49 5.08 -0.83 -0.44 114.58 118.56 2cik h GLU 148 Ca -0.00 -0.20 0.03 0.00 -1.00 0.00 0.00 59.36 58.19 2cik h GLU 148 Cb 1.01 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.20 2cik h GLU 148 CO 0.08 0.73 0.53 0.00 -1.00 0.00 0.00 179.01 179.35 2cik h ALA 149 N 0.72 1.51 -0.09 3.43 0.00 -1.07 -2.71 119.26 121.04 2cik h ALA 149 Ca 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2cik h ALA 149 Cb 0.59 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2cik h ALA 149 CO 0.03 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.70 2cik n ALA 150 N -2.42 2.56 -3.89 0.00 0.00 -0.48 -4.93 120.51 111.34 2cik n ALA 150 Ca 0.10 -0.42 -0.28 0.00 0.00 0.00 0.00 53.44 52.84 2cik n ALA 150 Cb 0.11 -1.17 0.02 0.00 0.00 0.00 0.00 19.45 18.41 2cik n ALA 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2cik n ARG 151 N 0.03 -4.91 -0.16 0.00 1.74 -0.89 -4.91 116.66 107.56 2cik n ARG 151 Ca 0.17 0.56 -0.08 0.00 -0.77 0.00 0.00 57.85 57.73 2cik n ARG 151 Cb 0.28 -5.27 0.01 0.00 -1.02 0.00 0.00 32.46 26.46 2cik n ARG 151 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2cik h VAL 152 N -1.95 1.20 -0.89 1.55 2.07 -1.37 -2.25 116.25 114.61 2cik h VAL 152 Ca -0.59 -0.60 -0.02 0.00 0.82 0.00 0.00 66.70 66.31 2cik h VAL 152 Cb 1.37 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 2cik h VAL 152 CO 0.65 0.23 0.49 0.00 0.02 0.00 0.00 177.57 178.96 2cik h ALA 153 N 1.05 1.14 -0.44 1.67 0.00 -1.91 -0.21 119.26 120.56 2cik h ALA 153 Ca 0.16 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2cik h ALA 153 Cb 0.16 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2cik h ALA 153 CO -0.02 0.64 0.16 1.49 0.00 0.00 0.00 179.25 181.52 2cik h GLU 154 N 1.24 0.68 -0.41 0.00 4.81 -1.77 -0.39 114.58 118.74 2cik h GLU 154 Ca 0.31 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 2cik h GLU 154 Cb 0.02 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 2cik h GLU 154 CO -0.05 0.64 0.27 1.96 -0.73 0.00 0.00 179.01 181.11 2cik h GLN 155 N 0.58 0.55 -0.64 1.92 4.20 -0.97 -1.73 115.11 119.01 2cik h GLN 155 Ca 0.15 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.79 2cik h GLN 155 Cb 0.23 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 27.86 2cik h GLN 155 CO -0.01 0.36 0.27 -0.07 -0.67 0.00 0.00 178.83 178.71 2cik h LEU 156 N 0.56 0.87 -0.42 1.46 3.38 -0.87 -1.74 115.31 118.55 2cik h LEU 156 Ca 0.15 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2cik h LEU 156 Cb -0.07 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 2cik h LEU 156 CO -0.03 0.80 0.24 -0.09 0.09 0.00 0.00 178.44 179.44 2cik h ARG 157 N 0.89 0.57 -0.58 1.13 2.43 -0.80 0.28 114.38 118.30 2cik h ARG 157 Ca 0.21 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 2cik h ARG 157 Cb 0.19 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 2cik h ARG 157 CO -0.02 0.44 0.36 0.00 -1.51 0.00 0.00 179.97 179.24 2cik h ALA 158 N 1.10 0.74 0.11 2.80 0.00 -1.20 -0.93 119.26 121.87 2cik h ALA 158 Ca 0.15 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2cik h ALA 158 Cb 0.02 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.58 2cik h ALA 158 CO -0.03 0.21 -0.05 -0.92 0.00 0.00 0.00 179.25 178.46 2cik h TYR 159 N 0.78 -0.13 -0.81 0.00 3.20 -0.79 -1.77 116.97 117.45 2cik h TYR 159 Ca 0.21 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.04 2cik h TYR 159 Cb -0.03 0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.25 2cik h TYR 159 CO -0.02 0.14 0.38 -0.07 -1.64 0.00 0.00 178.16 176.94 2cik h LEU 160 N -0.39 1.06 -0.15 2.82 3.38 -0.32 0.19 115.31 121.90 2cik h LEU 160 Ca -0.01 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 2cik h LEU 160 Cb 0.33 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 2cik h LEU 160 CO 0.02 0.90 -0.16 -0.33 0.09 0.00 0.00 178.44 178.96 2cik h GLU 161 N 1.15 0.00 0.00 1.13 5.08 -1.21 -3.35 114.58 117.38 2cik h GLU 161 Ca 0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 2cik h GLU 161 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2cik h GLU 161 CO -0.03 0.16 0.00 0.41 -1.00 0.00 0.00 179.01 178.55 2cik n GLY 162 N 1.02 0.48 0.37 -3.84 0.00 -0.67 -4.70 105.19 97.86 2cik n GLY 162 Ca 0.03 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.08 2cik n GLY 162 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2cik h LEU 163 N 0.00 1.03 -0.17 0.99 -0.00 -1.56 -1.30 115.31 114.30 2cik h LEU 163 Ca 0.00 0.01 0.04 0.00 -0.00 0.00 0.00 57.88 57.94 2cik h LEU 163 Cb 0.00 -0.21 -0.04 0.00 -0.00 0.00 0.00 40.66 40.41 2cik h LEU 163 CO 0.00 0.65 -0.11 0.00 -0.00 0.00 0.00 178.44 178.98 2cik h VAL 165 N -0.11 1.27 -0.28 0.00 2.07 -1.54 -0.43 116.25 117.23 2cik h VAL 165 Ca 0.10 -1.07 0.02 0.00 0.82 0.00 0.00 66.70 66.56 2cik h VAL 165 Cb 0.26 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 2cik h VAL 165 CO -0.24 0.35 0.15 -0.33 0.02 0.00 0.00 177.57 177.52 2cik h GLU 166 N 0.38 0.30 -0.37 1.57 5.08 -1.04 -0.05 114.58 120.45 2cik h GLU 166 Ca 0.08 -0.02 -0.16 0.00 -1.00 0.00 0.00 59.36 58.27 2cik h GLU 166 Cb 0.53 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2cik h GLU 166 CO 0.03 0.20 -0.39 -1.49 -1.00 0.00 0.00 179.01 176.36 2cik h TRP 167 N 0.31 1.10 -0.36 4.33 4.06 -0.88 -1.80 115.95 122.70 2cik h TRP 167 Ca 0.11 -0.33 0.05 0.00 2.06 0.00 0.00 58.89 60.78 2cik h TRP 167 Cb 0.02 -0.23 -0.04 0.00 -1.00 0.00 0.00 29.16 27.91 2cik h TRP 167 CO -0.09 1.16 0.09 1.25 -3.56 0.00 0.00 178.44 177.29 2cik h LEU 168 N 0.72 0.06 -1.08 -4.49 5.85 -0.83 -0.51 115.31 115.04 2cik h LEU 168 Ca 0.06 0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.76 2cik h LEU 168 Cb 0.98 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.05 2cik h LEU 168 CO 0.09 0.07 -0.07 0.03 -0.34 0.00 0.00 178.44 178.22 2cik h ARG 169 N 0.23 0.57 -0.09 1.25 3.08 -0.89 -0.62 114.38 117.92 2cik h ARG 169 Ca 0.17 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 2cik h ARG 169 Cb 0.18 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 2cik h ARG 169 CO -0.20 0.65 0.04 -0.09 -1.07 0.00 0.00 179.97 179.30 2cik h ARG 170 N 0.53 0.12 -0.71 0.04 2.43 -0.91 -2.19 114.38 113.70 2cik h ARG 170 Ca 0.10 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2cik h ARG 170 Cb 0.45 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.95 2cik h ARG 170 CO 0.02 0.18 0.44 1.88 -1.51 0.00 0.00 179.97 180.99 2cik h TYR 171 N 0.03 0.91 -0.60 2.20 0.05 -0.78 -0.39 116.97 118.39 2cik h TYR 171 Ca 0.03 0.01 -0.00 0.00 0.05 0.00 0.00 58.73 58.81 2cik h TYR 171 Cb 0.10 -0.30 -0.03 0.00 1.01 0.00 0.00 36.73 37.51 2cik h TYR 171 CO -0.04 0.60 0.36 -0.07 -1.05 0.00 0.00 178.16 177.96 2cik h LEU 172 N 0.96 0.71 -0.01 3.88 3.38 -1.01 0.22 115.31 123.45 2cik h LEU 172 Ca 0.26 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 2cik h LEU 172 Cb -0.07 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.51 2cik h LEU 172 CO -0.05 0.55 -0.04 -0.08 0.09 0.00 0.00 178.44 178.91 2cik h GLU 173 N 0.82 0.04 -0.48 1.13 4.57 -0.96 -1.71 114.58 118.00 2cik h GLU 173 Ca 0.22 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.33 2cik h GLU 173 Cb -0.03 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.54 2cik h GLU 173 CO -0.04 0.70 0.17 -0.91 -1.18 0.00 0.00 179.01 177.74 2cik h ASN 174 N -0.60 0.63 -0.58 1.04 2.35 -0.85 -2.40 115.58 115.16 2cik h ASN 174 Ca -0.00 -0.08 -0.12 0.00 -0.55 0.00 0.00 56.30 55.54 2cik h ASN 174 Cb 0.70 -0.16 -0.07 0.00 0.05 0.00 0.00 38.32 38.84 2cik h ASN 174 CO 0.01 0.59 0.13 0.61 -1.65 0.00 0.00 177.43 177.12 2cik n GLY 175 N -1.07 3.67 0.34 2.83 0.00 0.76 -4.77 105.19 106.96 2cik n GLY 175 Ca 0.04 -1.01 0.12 0.00 0.00 0.00 0.00 46.02 45.16 2cik n GLY 175 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2cik h LYS 176 N 2.70 0.33 0.00 1.61 2.10 -0.77 0.14 116.57 122.69 2cik h LYS 176 Ca 0.15 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.78 2cik h LYS 176 Cb 2.04 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 33.30 2cik h LYS 176 CO 0.56 0.22 0.00 0.93 -2.00 0.00 0.00 179.45 179.16 2cik h GLU 177 N 0.34 0.00 0.00 0.07 5.08 -1.86 -2.25 114.58 115.97 2cik h GLU 177 Ca 0.23 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.46 2cik h GLU 177 Cb 0.48 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 2cik h GLU 177 CO -0.06 0.00 -1.37 0.25 -1.00 0.00 0.00 179.01 176.83 2cik n THR 178 N -3.02 0.61 0.16 1.13 -2.24 -0.64 -4.43 114.28 105.84 2cik n THR 178 Ca -0.01 -0.07 0.03 0.00 -2.27 0.00 0.00 64.05 61.72 2cik n THR 178 Cb 0.21 -1.65 0.39 0.00 -2.10 0.00 0.00 70.33 67.17 2cik n THR 178 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2cik h LEU 179 N -0.33 0.12 -3.39 3.22 3.38 -0.86 -2.61 115.31 114.84 2cik h LEU 179 Ca -0.21 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.64 2cik h LEU 179 Cb 1.10 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.76 2cik h LEU 179 CO -0.13 0.37 0.04 0.00 0.09 0.00 0.00 178.44 178.81 2cik n GLN 180 N -4.21 2.81 -3.98 1.13 6.02 -0.85 -4.87 117.38 113.43 2cik n GLN 180 Ca -0.01 -2.99 -0.34 0.00 -0.01 0.00 0.00 57.00 53.65 2cik n GLN 180 Cb 0.32 -1.92 -0.14 0.00 1.02 0.00 0.00 30.24 29.52 2cik n GLN 180 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 2cik s ARG 181 N -2.98 2.66 -0.25 -1.09 3.52 -0.98 -4.94 118.95 114.88 2cik s ARG 181 Ca 0.46 -1.09 -0.19 0.00 -0.13 0.00 0.00 55.73 54.77 2cik s ARG 181 Cb 0.38 -2.97 -0.02 0.00 -1.56 0.00 0.00 34.95 30.77 2cik s ARG 181 CO 0.07 -0.46 0.58 0.00 -0.81 0.00 0.00 175.30 174.69 2cik s ALA 182 N 1.27 3.60 -0.24 6.12 0.00 -1.26 -4.76 121.76 126.48 2cik s ALA 182 Ca -0.02 -0.49 -0.18 0.00 0.00 0.00 0.00 51.96 51.27 2cik s ALA 182 Cb -0.18 -2.97 -0.03 0.00 0.00 0.00 0.00 23.12 19.95 2cik s ALA 182 CO -0.05 -0.76 0.50 -0.51 0.00 0.00 0.00 175.76 174.94 2cik s ASP 183 N 1.48 6.46 0.66 0.00 1.01 0.16 -4.44 116.67 122.00 2cik s ASP 183 Ca 0.24 0.55 -0.13 0.00 0.71 0.00 0.00 52.55 53.92 2cik s ASP 183 Cb -0.16 -2.28 -0.00 0.00 1.01 0.00 0.00 42.92 41.49 2cik s ASP 183 CO 0.09 -0.24 1.07 -2.16 0.21 0.00 0.00 175.17 174.14 2cik s PRO 184 N 2.04 2.98 0.32 8.23 0.04 -1.26 -1.58 135.00 145.77 2cik s PRO 184 Ca 0.21 1.12 -0.28 0.00 0.04 0.00 0.00 61.00 62.09 2cik s PRO 184 Cb -0.15 -1.99 -0.10 0.00 0.04 0.00 0.00 34.50 32.30 2cik s PRO 184 CO 0.09 -1.08 1.17 -1.25 0.04 0.00 0.00 177.00 175.97 2cik s PRO 185 N -4.56 4.43 -0.01 0.56 0.04 -1.26 -4.29 135.00 129.90 2cik s PRO 185 Ca 0.61 1.92 -0.26 0.00 0.04 0.00 0.00 61.00 63.31 2cik s PRO 185 Cb -0.16 -3.03 -0.04 0.00 0.04 0.00 0.00 34.50 31.32 2cik s PRO 185 CO 0.47 -0.02 0.83 0.15 0.04 0.00 0.00 177.00 178.47 2cik s LYS 186 N -1.76 4.51 0.14 4.56 1.02 0.56 -4.84 119.74 123.93 2cik s LYS 186 Ca 0.49 1.14 0.08 0.00 0.02 0.00 0.00 55.97 57.69 2cik s LYS 186 Cb -0.33 -3.43 -0.04 0.00 -0.52 0.00 0.00 37.83 33.50 2cik s LYS 186 CO 0.43 0.07 -0.17 0.95 -0.92 0.00 0.00 175.35 175.71 2cik s THR 187 N 0.68 1.64 0.05 2.17 -4.23 -1.26 -0.59 115.64 114.10 2cik s THR 187 Ca 0.43 -1.76 -0.27 0.00 -1.18 0.00 0.00 61.69 58.91 2cik s THR 187 Cb -0.20 -1.67 0.09 0.00 1.34 0.00 0.00 72.50 72.06 2cik s THR 187 CO 0.23 -0.29 0.93 -1.38 -0.54 0.00 0.00 174.62 173.58 2cik s HIS 188 N -1.86 -0.25 -0.10 3.99 -3.43 -1.08 -5.00 115.29 107.56 2cik s HIS 188 Ca 0.11 0.06 0.03 0.00 -0.80 0.00 0.00 55.06 54.46 2cik s HIS 188 Cb -0.07 0.58 -0.01 0.00 -1.43 0.00 0.00 32.58 31.65 2cik s HIS 188 CO 0.05 -0.64 -0.20 0.08 -2.00 0.00 0.00 174.74 172.03 2cik s VAL 189 N -3.15 2.43 0.28 -5.38 1.01 -1.26 -0.99 120.40 113.34 2cik s VAL 189 Ca 0.08 -0.90 0.09 0.00 0.00 0.00 0.00 61.98 61.25 2cik s VAL 189 Cb -0.01 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 2cik s VAL 189 CO -0.05 0.55 0.05 0.42 0.00 0.00 0.00 175.10 176.07 2cik s THR 190 N 0.21 3.41 -0.05 3.92 -4.23 -0.18 -4.73 115.64 113.99 2cik s THR 190 Ca -0.13 -1.82 0.01 0.00 -1.18 0.00 0.00 61.69 58.57 2cik s THR 190 Cb -0.16 -2.92 0.02 0.00 1.34 0.00 0.00 72.50 70.77 2cik s THR 190 CO 0.07 -0.32 -0.05 -2.28 -0.54 0.00 0.00 174.62 171.50 2cik s HIS 191 N -2.34 0.79 -0.27 3.99 2.46 -1.26 -1.43 115.29 117.23 2cik s HIS 191 Ca 0.33 -0.23 -0.03 0.00 0.47 0.00 0.00 55.06 55.60 2cik s HIS 191 Cb -0.05 -0.70 0.09 0.00 -0.13 0.00 0.00 32.58 31.79 2cik s HIS 191 CO 0.21 -0.21 0.11 -1.01 -2.47 0.00 0.00 174.74 171.37 2cik s HIS 192 N 0.97 0.70 0.29 3.88 3.76 -0.25 -4.97 115.29 119.67 2cik s HIS 192 Ca -0.10 -1.01 -0.29 0.00 -0.15 0.00 0.00 55.06 53.50 2cik s HIS 192 Cb -0.14 -1.08 -0.13 0.00 1.11 0.00 0.00 32.58 32.34 2cik s HIS 192 CO -0.00 -0.78 1.28 -2.30 -0.85 0.00 0.00 174.74 172.09 2cik n PRO 193 N 5.14 1.94 -0.03 8.40 -0.02 -1.26 -0.13 135.00 149.04 2cik n PRO 193 Ca -0.05 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 2cik n PRO 193 Cb 0.43 -2.25 -0.09 0.00 -0.02 0.00 0.00 33.50 31.57 2cik n PRO 193 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2cik n VAL 194 N 0.92 0.39 -3.58 -1.45 0.24 -0.20 -4.80 118.33 109.85 2cik n VAL 194 Ca 0.08 -0.38 -0.06 0.00 -2.04 0.00 0.00 64.34 61.94 2cik n VAL 194 Cb 0.33 -0.24 0.01 0.00 -1.47 0.00 0.00 33.84 32.47 2cik n VAL 194 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2cik n SER 195 N -2.17 -1.16 0.29 -1.34 3.41 -0.87 -4.98 113.62 106.81 2cik n SER 195 Ca -0.10 -1.97 0.19 0.00 -0.26 0.00 0.00 58.87 56.72 2cik n SER 195 Cb 0.59 1.98 0.86 0.00 -0.26 0.00 0.00 64.21 67.38 2cik n SER 195 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2cik h ASP 196 N 1.14 0.00 0.00 4.04 3.32 -2.03 -3.28 116.42 119.61 2cik h ASP 196 Ca -0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.87 2cik h ASP 196 Cb 0.70 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.25 2cik h ASP 196 CO 0.23 0.00 0.00 1.57 -1.72 0.00 0.00 179.24 179.32 2cik n HIS 197 N -3.05 0.00 -3.94 4.55 -0.00 -1.26 -4.87 115.22 106.65 2cik n HIS 197 Ca -0.01 0.00 -0.10 0.00 -0.00 0.00 0.00 57.72 57.62 2cik n HIS 197 Cb 0.22 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.11 2cik n HIS 197 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 2cik s GLU 198 N -0.27 0.41 0.02 1.57 2.02 -1.24 -0.76 118.70 120.46 2cik s GLU 198 Ca 0.00 -0.56 -0.03 0.00 0.02 0.00 0.00 54.97 54.40 2cik s GLU 198 Cb 0.00 0.16 -0.02 0.00 0.10 0.00 0.00 34.13 34.37 2cik s GLU 198 CO 0.00 -0.08 0.03 0.00 0.02 0.00 0.00 175.26 175.22 2cik s ALA 199 N -1.59 0.04 -0.16 5.21 0.00 -0.40 -1.03 121.76 123.83 2cik s ALA 199 Ca -0.14 -0.56 -0.20 0.00 0.00 0.00 0.00 51.96 51.06 2cik s ALA 199 Cb -0.08 0.18 -0.03 0.00 0.00 0.00 0.00 23.12 23.18 2cik s ALA 199 CO -0.01 -0.22 0.58 0.99 0.00 0.00 0.00 175.76 177.10 2cik s THR 200 N -1.95 5.09 -0.23 0.00 2.01 0.82 -0.65 115.64 120.73 2cik s THR 200 Ca -0.11 1.11 -0.12 0.00 0.31 0.00 0.00 61.69 62.89 2cik s THR 200 Cb -0.06 -3.90 -0.05 0.00 0.01 0.00 0.00 72.50 68.50 2cik s THR 200 CO -0.02 0.20 0.20 -0.76 -0.69 0.00 0.00 174.62 173.56 2cik s LEU 201 N 1.34 4.12 -0.14 4.42 1.43 0.04 -1.09 118.68 128.81 2cik s LEU 201 Ca 0.28 0.18 0.03 0.00 -1.03 0.00 0.00 54.13 53.59 2cik s LEU 201 Cb -0.16 -2.18 0.01 0.00 0.03 0.00 0.00 46.19 43.89 2cik s LEU 201 CO 0.11 0.04 -0.22 -0.60 0.23 0.00 0.00 176.35 175.91 2cik s ARG 202 N 1.12 2.95 -0.25 1.70 3.52 -0.51 -1.46 118.95 126.02 2cik s ARG 202 Ca 0.10 -0.83 -0.09 0.00 -0.13 0.00 0.00 55.73 54.78 2cik s ARG 202 Cb -0.14 -2.38 -0.04 0.00 -1.56 0.00 0.00 34.95 30.83 2cik s ARG 202 CO 0.05 -0.01 0.11 0.00 -0.81 0.00 0.00 175.30 174.64 2cik s TRP 204 N 1.51 3.18 -0.13 0.00 0.52 -0.16 -1.51 118.94 122.34 2cik s TRP 204 Ca 0.06 0.14 0.00 0.00 0.02 0.00 0.00 56.10 56.33 2cik s TRP 204 Cb -0.15 -1.84 0.02 0.00 -1.15 0.00 0.00 33.47 30.35 2cik s TRP 204 CO 0.06 0.39 -0.12 0.00 0.02 0.00 0.00 176.95 177.30 2cik s ALA 205 N -0.62 1.67 0.06 0.98 0.00 0.25 -2.64 121.76 121.45 2cik s ALA 205 Ca 0.10 -0.77 0.05 0.00 0.00 0.00 0.00 51.96 51.35 2cik s ALA 205 Cb -0.12 -0.98 -0.03 0.00 0.00 0.00 0.00 23.12 22.00 2cik s ALA 205 CO 0.02 -0.35 -0.15 -0.51 0.00 0.00 0.00 175.76 174.77 2cik s LEU 206 N 1.48 2.23 -0.59 0.00 1.43 0.25 -1.20 118.68 122.27 2cik s LEU 206 Ca 0.03 -0.55 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 2cik s LEU 206 Cb -0.13 -0.62 0.00 0.00 0.03 0.00 0.00 46.19 45.47 2cik s LEU 206 CO -0.09 -0.00 0.00 0.61 0.23 0.00 0.00 176.35 177.10 2cik n GLY 207 N 1.56 0.79 3.90 -3.19 0.00 -0.80 -0.32 105.19 107.13 2cik n GLY 207 Ca -0.19 -0.80 -0.29 0.00 0.00 0.00 0.00 46.02 44.73 2cik n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2cik s PHE 208 N -2.21 3.47 -0.17 1.61 -0.71 -1.10 -4.69 117.98 114.18 2cik s PHE 208 Ca 0.00 0.59 -0.13 0.00 -1.04 0.00 0.00 56.93 56.35 2cik s PHE 208 Cb 0.00 -2.05 0.05 0.00 -1.21 0.00 0.00 43.02 39.81 2cik s PHE 208 CO 0.00 0.29 0.44 -0.47 -1.34 0.00 0.00 175.22 174.14 2cik s TYR 209 N -1.91 -0.57 0.79 3.49 6.14 -0.61 -0.53 117.35 124.16 2cik s TYR 209 Ca 0.43 1.29 -0.13 0.00 0.64 0.00 0.00 57.07 59.29 2cik s TYR 209 Cb -0.11 0.23 0.19 0.00 0.42 0.00 0.00 41.96 42.69 2cik s TYR 209 CO 0.27 -0.30 0.92 -0.35 0.64 0.00 0.00 175.55 176.74 2cik n PRO 210 N 3.52 -1.57 0.25 4.97 -0.04 -1.26 -0.67 135.00 140.20 2cik n PRO 210 Ca -0.18 -1.44 0.13 0.00 -0.04 0.00 0.00 63.50 61.97 2cik n PRO 210 Cb 0.56 -1.09 0.60 0.00 -0.04 0.00 0.00 33.50 33.53 2cik n PRO 210 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2cik h ALA 211 N -2.11 1.06 -2.49 0.55 0.00 -1.94 -3.44 119.26 110.88 2cik h ALA 211 Ca -0.31 -0.12 -0.53 0.00 0.00 0.00 0.00 54.91 53.95 2cik h ALA 211 Cb 0.90 -0.02 0.04 0.00 0.00 0.00 0.00 17.79 18.70 2cik h ALA 211 CO 0.22 0.16 1.13 -2.00 0.00 0.00 0.00 179.25 178.76 2cik s GLU 212 N -3.76 4.14 -0.02 0.00 2.56 -1.26 -4.96 118.70 115.39 2cik s GLU 212 Ca -0.00 2.60 -0.29 0.00 0.00 0.00 0.00 54.97 57.28 2cik s GLU 212 Cb 0.10 -3.66 0.07 0.00 2.00 0.00 0.00 34.13 32.64 2cik s GLU 212 CO 0.59 -0.86 0.65 -1.50 -0.56 0.00 0.00 175.26 173.58 2cik s ILE 213 N 2.94 0.00 -0.17 -3.70 2.07 -1.26 -4.68 121.20 116.40 2cik s ILE 213 Ca 0.82 -0.03 0.01 0.00 -1.41 0.00 0.00 60.65 60.04 2cik s ILE 213 Cb -0.46 -0.98 0.01 0.00 0.13 0.00 0.00 42.46 41.17 2cik s ILE 213 CO 0.37 -0.02 -0.20 -0.89 -1.91 0.00 0.00 174.94 172.30 2cik s THR 214 N -1.48 2.15 -0.17 4.00 2.01 -0.60 -5.01 115.64 116.53 2cik s THR 214 Ca -0.10 -0.92 0.01 0.00 0.31 0.00 0.00 61.69 60.99 2cik s THR 214 Cb -0.00 -1.89 0.02 0.00 0.01 0.00 0.00 72.50 70.64 2cik s THR 214 CO 0.07 0.54 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.60 2cik s LEU 215 N 1.14 2.05 0.04 4.42 1.43 -1.26 -1.46 118.68 125.05 2cik s LEU 215 Ca 0.01 -0.64 0.04 0.00 -1.03 0.00 0.00 54.13 52.51 2cik s LEU 215 Cb -0.14 -1.38 -0.02 0.00 0.03 0.00 0.00 46.19 44.68 2cik s LEU 215 CO -0.09 -0.03 -0.11 0.42 0.23 0.00 0.00 176.35 176.77 2cik s THR 216 N 1.35 0.85 -0.14 5.49 -4.23 -0.73 -4.93 115.64 113.30 2cik s THR 216 Ca 0.04 -1.04 -0.06 0.00 -1.18 0.00 0.00 61.69 59.45 2cik s THR 216 Cb -0.13 -0.83 -0.04 0.00 1.34 0.00 0.00 72.50 72.84 2cik s THR 216 CO -0.12 -0.18 0.08 0.26 -0.54 0.00 0.00 174.62 174.13 2cik s TRP 217 N -1.07 3.36 0.07 3.99 0.52 -1.26 -0.59 118.94 123.96 2cik s TRP 217 Ca -0.03 0.28 0.08 0.00 0.02 0.00 0.00 56.10 56.44 2cik s TRP 217 Cb -0.09 -1.97 -0.04 0.00 -1.15 0.00 0.00 33.47 30.23 2cik s TRP 217 CO 0.01 0.43 -0.17 -0.65 0.02 0.00 0.00 176.95 176.59 2cik s GLN 218 N -0.38 1.99 -0.17 4.98 -0.21 0.41 -0.56 119.66 125.73 2cik s GLN 218 Ca 0.10 -1.04 0.00 0.00 0.02 0.00 0.00 55.36 54.44 2cik s GLN 218 Cb -0.12 -2.18 0.01 0.00 1.00 0.00 0.00 33.01 31.72 2cik s GLN 218 CO 0.02 0.52 -0.17 0.50 -2.12 0.00 0.00 175.29 174.04 2cik s ARG 219 N -1.71 3.13 -1.47 2.91 3.52 -0.33 -1.23 118.95 123.78 2cik s ARG 219 Ca 0.16 -0.78 -0.08 0.00 -0.13 0.00 0.00 55.73 54.91 2cik s ARG 219 Cb -0.11 -2.62 0.03 0.00 -1.56 0.00 0.00 34.95 30.69 2cik s ARG 219 CO 0.07 -0.09 0.81 -0.25 -0.81 0.00 0.00 175.30 175.04 2cik n ASP 220 N 4.33 -5.72 -0.05 -2.12 8.00 0.22 -1.72 116.55 119.49 2cik n ASP 220 Ca -0.20 -0.44 -0.01 0.00 0.71 0.00 0.00 54.79 54.86 2cik n ASP 220 Cb 0.51 -4.58 -0.00 0.00 -0.02 0.00 0.00 41.12 37.02 2cik n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2cik n GLY 221 N -1.64 0.43 3.24 0.44 0.00 -1.26 -5.03 105.19 101.36 2cik n GLY 221 Ca -0.04 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 2cik n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cik s GLU 222 N -0.72 3.17 0.19 1.61 2.02 -0.70 -5.02 118.70 119.24 2cik s GLU 222 Ca 0.00 -0.77 -0.33 0.00 0.02 0.00 0.00 54.97 53.89 2cik s GLU 222 Cb 0.00 -2.60 -0.14 0.00 0.10 0.00 0.00 34.13 31.49 2cik s GLU 222 CO 0.00 -0.02 1.40 -0.25 0.02 0.00 0.00 175.26 176.42 2cik n ASP 223 N 4.13 2.46 -2.92 -0.19 10.43 -1.26 -1.18 116.55 128.03 2cik n ASP 223 Ca -0.19 1.12 -0.36 0.00 2.57 0.00 0.00 54.79 57.93 2cik n ASP 223 Cb 0.52 -1.36 0.02 0.00 1.84 0.00 0.00 41.12 42.13 2cik n ASP 223 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2cik n GLN 224 N 2.43 3.37 -0.28 -1.24 1.13 0.28 -4.86 117.38 118.21 2cik n GLN 224 Ca 0.15 -4.06 -0.05 0.00 -1.94 0.00 0.00 57.00 51.10 2cik n GLN 224 Cb 0.28 -2.29 0.07 0.00 0.11 0.00 0.00 30.24 28.40 2cik n GLN 224 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 2cik h THR 225 N 2.26 1.21 -0.09 5.09 1.35 -1.91 -2.20 112.91 118.63 2cik h THR 225 Ca 0.46 -0.45 -0.09 0.00 -0.55 0.00 0.00 66.41 65.78 2cik h THR 225 Cb 0.34 0.12 -0.01 0.00 -1.73 0.00 0.00 68.15 66.87 2cik h THR 225 CO 1.20 0.22 -0.38 1.56 -0.25 0.00 0.00 175.52 177.87 2cik h GLN 226 N 1.05 0.18 -0.02 4.72 1.08 -1.99 -3.13 115.11 117.00 2cik h GLN 226 Ca 0.28 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.40 2cik h GLN 226 Cb -0.06 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.36 2cik h GLN 226 CO -0.05 0.53 -0.05 -0.25 -0.95 0.00 0.00 178.83 178.06 2cik n ASP 227 N -4.06 1.65 -4.71 1.46 10.43 -0.88 -4.89 116.55 115.55 2cik n ASP 227 Ca -0.01 -1.48 -0.37 0.00 2.57 0.00 0.00 54.79 55.50 2cik n ASP 227 Cb 0.44 0.03 -0.07 0.00 1.84 0.00 0.00 41.12 43.36 2cik n ASP 227 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 2cik s THR 228 N -2.09 5.28 -0.28 -3.53 2.01 -0.88 -4.52 115.64 111.64 2cik s THR 228 Ca 0.34 0.56 -0.17 0.00 0.31 0.00 0.00 61.69 62.73 2cik s THR 228 Cb 0.21 -3.65 -0.03 0.00 0.01 0.00 0.00 72.50 69.04 2cik s THR 228 CO 0.36 0.35 0.46 -0.70 -0.69 0.00 0.00 174.62 174.40 2cik s GLU 229 N 0.76 3.99 -0.25 4.92 2.12 0.24 -4.91 118.70 125.56 2cik s GLU 229 Ca 0.16 0.15 0.02 0.00 0.36 0.00 0.00 54.97 55.67 2cik s GLU 229 Cb -0.13 -3.67 0.05 0.00 0.26 0.00 0.00 34.13 30.63 2cik s GLU 229 CO 0.05 -0.36 -0.11 -0.51 -0.54 0.00 0.00 175.26 173.79 2cik s LEU 230 N 2.23 3.33 0.60 2.70 1.43 -1.26 -0.45 118.68 127.26 2cik s LEU 230 Ca 0.19 -1.29 -0.16 0.00 -1.03 0.00 0.00 54.13 51.83 2cik s LEU 230 Cb -0.16 -1.56 -0.03 0.00 0.03 0.00 0.00 46.19 44.47 2cik s LEU 230 CO 0.10 -0.17 1.07 0.68 0.23 0.00 0.00 176.35 178.26 2cik s VAL 231 N 1.14 3.67 0.33 -1.59 -7.23 -1.01 -4.99 120.40 110.72 2cik s VAL 231 Ca -0.07 0.82 -0.29 0.00 -1.81 0.00 0.00 61.98 60.63 2cik s VAL 231 Cb -0.19 -3.33 -0.12 0.00 0.56 0.00 0.00 36.38 33.30 2cik s VAL 231 CO -0.06 -0.44 1.50 1.21 -0.31 0.00 0.00 175.10 177.00 2cik n GLU 232 N -2.00 2.58 -1.74 4.82 2.13 -1.26 -4.65 120.64 120.52 2cik n GLU 232 Ca 0.09 0.91 -0.42 0.00 0.66 0.00 0.00 57.16 58.41 2cik n GLU 232 Cb 0.53 -2.64 -0.02 0.00 0.27 0.00 0.00 31.44 29.58 2cik n GLU 232 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 2cik s THR 233 N -0.59 2.01 0.03 6.31 2.01 -1.26 -4.86 115.64 119.28 2cik s THR 233 Ca 0.59 0.00 0.05 0.00 0.31 0.00 0.00 61.69 62.64 2cik s THR 233 Cb -0.51 -3.00 -0.02 0.00 0.01 0.00 0.00 72.50 68.98 2cik s THR 233 CO 0.56 0.00 -0.14 0.00 -0.69 0.00 0.00 174.62 174.36 2cik s ARG 234 N 0.05 0.95 0.16 4.92 1.70 -0.56 -4.95 118.95 121.22 2cik s ARG 234 Ca 0.67 -0.68 -0.30 0.00 -0.47 0.00 0.00 55.73 54.95 2cik s ARG 234 Cb -0.49 -0.95 -0.07 0.00 -0.57 0.00 0.00 34.95 32.87 2cik s ARG 234 CO 0.43 0.24 1.06 -1.25 -1.08 0.00 0.00 175.30 174.70 2cik s PRO 235 N -0.94 4.63 0.43 3.89 0.04 -1.26 -0.85 135.00 140.93 2cik s PRO 235 Ca 0.02 1.65 0.23 0.00 0.04 0.00 0.00 61.00 62.93 2cik s PRO 235 Cb -0.07 -3.30 0.32 0.00 0.04 0.00 0.00 34.50 31.49 2cik s PRO 235 CO 0.01 0.12 1.60 0.00 0.04 0.00 0.00 177.00 178.77 2cik h ALA 236 N 5.18 0.98 0.00 8.56 0.00 -1.20 -3.47 119.26 129.31 2cik h ALA 236 Ca -0.44 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2cik h ALA 236 Cb 1.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2cik h ALA 236 CO 0.72 0.04 0.00 0.41 0.00 0.00 0.00 179.25 180.42 2cik n GLY 237 N 1.11 0.27 0.53 0.00 0.00 -1.26 -4.94 105.19 100.91 2cik n GLY 237 Ca 0.04 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.12 2cik n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2cik n ASP 238 N 0.00 2.40 0.00 1.61 5.68 -1.26 -4.94 116.55 120.04 2cik n ASP 238 Ca 0.00 -3.44 0.00 0.00 -0.50 0.00 0.00 54.79 50.85 2cik n ASP 238 Cb 0.00 -0.51 0.00 0.00 -1.14 0.00 0.00 41.12 39.47 2cik n ASP 238 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 2cik n ARG 239 N -1.15 0.00 -2.44 0.11 1.85 -1.26 -5.05 116.66 108.72 2cik n ARG 239 Ca 0.21 0.00 -0.24 0.00 -1.00 0.00 0.00 57.85 56.82 2cik n ARG 239 Cb 0.76 -0.37 0.06 0.00 -1.05 0.00 0.00 32.46 31.86 2cik n ARG 239 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 2cik s THR 240 N -1.85 2.41 0.25 8.89 -4.23 -1.26 -4.86 115.64 115.00 2cik s THR 240 Ca 0.00 -0.48 0.07 0.00 -1.18 0.00 0.00 61.69 60.10 2cik s THR 240 Cb 0.00 -2.93 -0.05 0.00 1.34 0.00 0.00 72.50 70.85 2cik s THR 240 CO 0.00 0.00 -0.08 -0.36 -0.54 0.00 0.00 174.62 173.64 2cik s PHE 241 N -3.04 1.84 0.04 3.99 0.40 0.31 -0.64 117.98 120.88 2cik s PHE 241 Ca 0.60 -0.69 0.03 0.00 -0.60 0.00 0.00 56.93 56.27 2cik s PHE 241 Cb -0.10 -1.00 -0.02 0.00 0.51 0.00 0.00 43.02 42.41 2cik s PHE 241 CO 0.42 0.27 -0.09 -0.65 0.70 0.00 0.00 175.22 175.87 2cik s GLN 242 N -3.72 0.60 0.01 0.44 -0.21 -0.03 -1.91 119.66 114.84 2cik s GLN 242 Ca 0.27 -0.72 -0.25 0.00 0.02 0.00 0.00 55.36 54.68 2cik s GLN 242 Cb 0.03 -0.46 0.06 0.00 1.00 0.00 0.00 33.01 33.63 2cik s GLN 242 CO 0.10 0.10 0.57 0.21 -2.12 0.00 0.00 175.29 174.15 2cik s LYS 243 N -1.39 1.03 0.05 2.91 2.20 -0.34 -1.50 119.74 122.69 2cik s LYS 243 Ca -0.06 -0.06 -0.01 0.00 -0.36 0.00 0.00 55.97 55.49 2cik s LYS 243 Cb -0.09 0.47 -0.04 0.00 -1.51 0.00 0.00 37.83 36.67 2cik s LYS 243 CO 0.01 -0.35 -0.03 1.67 -0.36 0.00 0.00 175.35 176.28 2cik s TRP 244 N -1.95 0.50 -0.02 4.03 1.48 -1.26 -0.59 118.94 121.14 2cik s TRP 244 Ca -0.08 -0.97 0.03 0.00 -1.06 0.00 0.00 56.10 54.03 2cik s TRP 244 Cb -0.01 -0.36 -0.00 0.00 -1.16 0.00 0.00 33.47 31.93 2cik s TRP 244 CO 0.03 -0.33 -0.11 0.00 -4.06 0.00 0.00 176.95 172.48 2cik s ALA 245 N -3.47 0.95 0.03 2.67 0.00 -0.57 -2.41 121.76 118.96 2cik s ALA 245 Ca 0.03 -0.43 0.04 0.00 0.00 0.00 0.00 51.96 51.61 2cik s ALA 245 Cb 0.05 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.84 2cik s ALA 245 CO -0.08 0.19 -0.13 0.00 0.00 0.00 0.00 175.76 175.74 2cik s ALA 246 N 0.00 1.04 0.01 0.00 0.00 0.40 -0.33 121.76 122.88 2cik s ALA 246 Ca -0.00 -0.75 0.03 0.00 0.00 0.00 0.00 51.96 51.23 2cik s ALA 246 Cb -0.07 -0.16 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 2cik s ALA 246 CO 0.00 0.19 -0.08 0.14 0.00 0.00 0.00 175.76 176.01 2cik s VAL 247 N -0.80 0.63 -0.21 0.00 -7.23 -0.54 -0.59 120.40 111.66 2cik s VAL 247 Ca 0.01 -0.51 -0.16 0.00 -1.81 0.00 0.00 61.98 59.50 2cik s VAL 247 Cb -0.07 -0.56 -0.04 0.00 0.56 0.00 0.00 36.38 36.27 2cik s VAL 247 CO 0.01 0.05 0.41 -0.69 -0.31 0.00 0.00 175.10 174.58 2cik s VAL 248 N -0.44 5.18 0.14 1.32 1.01 -1.26 -0.78 120.40 125.57 2cik s VAL 248 Ca 0.01 0.73 0.10 0.00 0.00 0.00 0.00 61.98 62.81 2cik s VAL 248 Cb -0.05 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 2cik s VAL 248 CO 0.00 0.23 -0.23 0.68 0.00 0.00 0.00 175.10 175.78 2cik s VAL 249 N 1.45 2.03 0.18 2.92 -7.23 0.18 -4.95 120.40 114.99 2cik s VAL 249 Ca 0.19 -1.78 -0.31 0.00 -1.81 0.00 0.00 61.98 58.27 2cik s VAL 249 Cb -0.15 -1.86 -0.09 0.00 0.56 0.00 0.00 36.38 34.84 2cik s VAL 249 CO 0.08 -0.08 1.43 -2.84 -0.31 0.00 0.00 175.10 173.39 2cik s PRO 250 N -2.28 4.29 0.25 4.82 0.02 -1.26 -1.28 135.00 139.56 2cik s PRO 250 Ca 0.13 2.21 -0.31 0.00 0.02 0.00 0.00 61.00 63.05 2cik s PRO 250 Cb -0.09 -3.17 -0.11 0.00 0.02 0.00 0.00 34.50 31.15 2cik s PRO 250 CO 0.06 -0.43 1.63 -1.12 -0.33 0.00 0.00 177.00 176.81 2cik s SER 251 N 0.73 6.40 0.00 2.53 0.01 0.06 -0.77 113.70 122.66 2cik s SER 251 Ca 0.63 2.88 0.00 0.00 1.31 0.00 0.00 55.95 60.77 2cik s SER 251 Cb -0.40 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.21 2cik s SER 251 CO 0.36 -0.92 0.00 0.61 0.41 0.00 0.00 173.24 173.70 2cik n GLY 252 N 2.92 2.72 1.46 3.44 0.00 -1.26 -4.91 105.19 109.57 2cik n GLY 252 Ca 0.11 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.24 2cik n GLY 252 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2cik n GLU 253 N -2.00 3.10 -0.06 1.61 1.02 0.05 -4.66 120.64 119.70 2cik n GLU 253 Ca 0.00 -2.76 0.12 0.00 -0.02 0.00 0.00 57.16 54.50 2cik n GLU 253 Cb 0.00 -1.70 0.51 0.00 -0.02 0.00 0.00 31.44 30.23 2cik n GLU 253 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2cik h GLU 254 N 4.28 0.37 0.00 3.49 3.07 -1.91 -1.38 114.58 122.50 2cik h GLU 254 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 2cik h GLU 254 Cb 1.17 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.99 2cik h GLU 254 CO 0.09 0.24 0.00 1.04 -1.40 0.00 0.00 179.01 178.98 2cik n GLN 255 N -4.47 0.40 0.00 2.33 1.13 -1.26 -1.96 117.38 113.55 2cik n GLN 255 Ca 0.09 0.02 0.15 0.00 -1.94 0.00 0.00 57.00 55.32 2cik n GLN 255 Cb 0.35 -1.50 0.72 0.00 0.11 0.00 0.00 30.24 29.92 2cik n GLN 255 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2cik n ARG 256 N -1.29 0.30 -4.45 -1.09 1.74 -0.52 -4.84 116.66 106.51 2cik n ARG 256 Ca 0.13 -0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.87 2cik n ARG 256 Cb 0.22 -1.50 -0.11 0.00 -1.02 0.00 0.00 32.46 30.05 2cik n ARG 256 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2cik s TYR 257 N -2.70 3.03 -0.03 -1.55 1.51 -0.83 -0.61 117.35 116.17 2cik s TYR 257 Ca 0.24 -0.11 0.03 0.00 -1.01 0.00 0.00 57.07 56.21 2cik s TYR 257 Cb 0.20 -1.86 0.00 0.00 -0.11 0.00 0.00 41.96 40.19 2cik s TYR 257 CO 0.48 0.16 -0.10 0.95 -1.11 0.00 0.00 175.55 175.93 2cik s THR 258 N -0.18 0.87 -0.11 -0.71 -4.23 -0.36 -4.68 115.64 106.24 2cik s THR 258 Ca 0.04 -0.40 -0.16 0.00 -1.18 0.00 0.00 61.69 59.99 2cik s THR 258 Cb -0.13 -0.78 -0.05 0.00 1.34 0.00 0.00 72.50 72.89 2cik s THR 258 CO 0.02 0.27 0.40 0.00 -0.54 0.00 0.00 174.62 174.78 2cik s HIS 260 N 0.23 2.68 -0.10 0.00 3.76 0.24 -0.22 115.29 121.88 2cik s HIS 260 Ca 0.22 -0.86 0.03 0.00 -0.15 0.00 0.00 55.06 54.30 2cik s HIS 260 Cb -0.15 -1.77 0.01 0.00 1.11 0.00 0.00 32.58 31.78 2cik s HIS 260 CO 0.09 -0.32 -0.18 0.08 -0.85 0.00 0.00 174.74 173.55 2cik s VAL 261 N 0.34 1.69 -0.07 -0.90 1.01 -0.59 -1.78 120.40 120.11 2cik s VAL 261 Ca -0.15 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.07 2cik s VAL 261 Cb -0.17 -1.50 0.01 0.00 0.00 0.00 0.00 36.38 34.72 2cik s VAL 261 CO 0.07 0.48 -0.14 -1.10 0.00 0.00 0.00 175.10 174.41 2cik s GLN 262 N 0.69 1.95 -0.07 2.72 -0.21 -0.54 -1.70 119.66 122.50 2cik s GLN 262 Ca -0.12 -0.50 -0.25 0.00 0.02 0.00 0.00 55.36 54.51 2cik s GLN 262 Cb -0.16 -1.57 0.06 0.00 1.00 0.00 0.00 33.01 32.33 2cik s GLN 262 CO 0.03 0.05 0.57 -1.58 -2.12 0.00 0.00 175.29 172.24 2cik s HIS 263 N 0.62 -0.54 0.52 0.91 2.46 -1.26 -1.56 115.29 116.44 2cik s HIS 263 Ca -0.15 0.99 0.17 0.00 0.47 0.00 0.00 55.06 56.54 2cik s HIS 263 Cb -0.16 0.30 1.31 0.00 -0.13 0.00 0.00 32.58 33.89 2cik s HIS 263 CO 0.05 -0.51 2.15 1.49 -2.47 0.00 0.00 174.74 175.45 2cik h GLU 264 N 3.58 0.00 -0.00 2.88 4.81 -1.93 -2.67 114.58 121.24 2cik h GLU 264 Ca -0.28 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 2cik h GLU 264 Cb 1.15 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.53 2cik h GLU 264 CO 0.35 0.00 -0.08 0.41 -0.73 0.00 0.00 179.01 178.96 2cik n GLY 265 N -1.53 -1.17 3.76 1.92 0.00 -1.26 -4.84 105.19 102.06 2cik n GLY 265 Ca -0.02 -0.20 -0.39 0.00 0.00 0.00 0.00 46.02 45.40 2cik n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cik s LEU 266 N -2.62 4.46 0.20 0.99 1.43 -1.01 -4.19 118.68 117.93 2cik s LEU 266 Ca 0.25 1.34 -0.14 0.00 -1.03 0.00 0.00 54.13 54.56 2cik s LEU 266 Cb 0.20 -3.08 0.22 0.00 0.03 0.00 0.00 46.19 43.55 2cik s LEU 266 CO 0.49 0.10 1.65 -0.65 0.23 0.00 0.00 176.35 178.17 2cik h PRO 267 N 5.38 0.03 -3.65 1.29 0.11 -1.89 -3.44 132.00 129.84 2cik h PRO 267 Ca -0.45 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.55 2cik h PRO 267 Cb 1.20 -0.01 -0.17 0.00 0.11 0.00 0.00 31.00 32.14 2cik h PRO 267 CO 0.69 0.02 -0.41 -1.59 -0.21 0.00 0.00 178.00 176.51 2cik s LYS 268 N -6.20 0.71 0.53 1.05 0.00 -1.26 -5.15 119.74 109.42 2cik s LYS 268 Ca -0.14 -0.72 -0.21 0.00 0.00 0.00 0.00 55.97 54.90 2cik s LYS 268 Cb 0.18 0.29 -0.07 0.00 0.00 0.00 0.00 37.83 38.23 2cik s LYS 268 CO 0.73 -0.21 1.05 -2.30 0.00 0.00 0.00 175.35 174.62 2cik n PRO 269 N 0.54 1.22 -3.84 1.78 -0.02 -1.26 -4.99 135.00 128.43 2cik n PRO 269 Ca -0.18 0.45 -0.33 0.00 -2.02 0.00 0.00 63.50 61.42 2cik n PRO 269 Cb 0.60 -2.19 -0.05 0.00 -0.02 0.00 0.00 33.50 31.83 2cik n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2cik s LEU 270 N -1.67 4.35 -0.16 2.45 1.43 -0.69 -4.95 118.68 119.44 2cik s LEU 270 Ca 0.70 0.42 0.01 0.00 -1.03 0.00 0.00 54.13 54.23 2cik s LEU 270 Cb -0.46 -2.81 0.02 0.00 0.03 0.00 0.00 46.19 42.97 2cik s LEU 270 CO 0.51 0.21 -0.18 -0.89 0.23 0.00 0.00 176.35 176.23 2cik s THR 271 N -1.41 1.87 0.11 5.49 2.01 -1.26 -1.54 115.64 120.92 2cik s THR 271 Ca 0.31 -0.83 0.10 0.00 0.31 0.00 0.00 61.69 61.59 2cik s THR 271 Cb -0.13 -1.70 -0.04 0.00 0.01 0.00 0.00 72.50 70.64 2cik s THR 271 CO 0.21 0.51 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.63 2cik s LEU 272 N 1.30 2.29 0.20 4.42 1.43 0.69 -4.96 118.68 124.06 2cik s LEU 272 Ca 0.03 -0.71 0.05 0.00 -1.03 0.00 0.00 54.13 52.48 2cik s LEU 272 Cb -0.13 -1.15 -0.05 0.00 0.03 0.00 0.00 46.19 44.89 2cik s LEU 272 CO -0.11 0.16 -0.07 -0.13 0.23 0.00 0.00 176.35 176.43 2cik s ARG 273 N -1.90 1.26 0.16 1.70 0.52 -1.26 -0.30 118.95 119.13 2cik s ARG 273 Ca 0.12 -1.59 -0.31 0.00 -0.52 0.00 0.00 55.73 53.43 2cik s ARG 273 Cb -0.10 -0.79 -0.09 0.00 0.52 0.00 0.00 34.95 34.49 2cik s ARG 273 CO 0.05 0.04 1.45 -0.46 0.02 0.00 0.00 175.30 176.40 2cik s TRP 274 N -3.25 3.15 -0.40 -0.53 -0.00 -1.26 -4.72 118.94 111.93 2cik s TRP 274 Ca 0.23 0.89 0.01 0.00 -0.00 0.00 0.00 56.10 57.23 2cik s TRP 274 Cb 0.03 -3.78 0.11 0.00 -0.00 0.00 0.00 33.47 29.83 2cik s TRP 274 CO 0.06 -2.71 0.16 -1.21 -0.00 0.00 0.00 176.95 173.24 2cik s GLU 275 N 0.74 1.80 0.00 5.86 2.02 -1.26 -4.99 118.70 122.87 2cik s GLU 275 Ca 0.65 -1.98 0.06 0.00 0.02 0.00 0.00 54.97 53.71 2cik s GLU 275 Cb -0.40 -3.39 0.35 0.00 0.10 0.00 0.00 34.13 30.79 2cik s GLU 275 CO 0.34 -1.02 0.82 -2.30 0.02 0.00 0.00 175.26 173.11