#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cay h HIS 0 N 0.00 0.00 0.00 4.41 -0.00 -1.99 -2.12 115.15 115.45 2cay h HIS 0 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 2cay h HIS 0 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.41 2cay h HIS 0 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 177.93 176.60 2cay n MET 1 N -4.13 0.26 0.23 5.12 0.00 -1.26 -1.52 117.12 115.82 2cay n MET 1 Ca -0.02 0.11 0.08 0.00 0.00 0.00 0.00 57.70 57.88 2cay n MET 1 Cb 0.14 -1.50 0.56 0.00 0.00 0.00 0.00 33.22 32.42 2cay n MET 1 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 175.97 177.46 2cay h GLU 2 N 0.00 0.00 0.00 0.03 4.81 -1.86 -3.36 114.58 114.19 2cay h GLU 2 Ca 0.00 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 2cay h GLU 2 Cb 0.17 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 2cay h GLU 2 CO 0.00 0.20 -1.39 0.66 -0.73 0.00 0.00 179.01 177.75 2cay n TYR 3 N -3.91 0.00 -3.84 0.92 4.01 -0.58 -5.00 117.16 108.76 2cay n TYR 3 Ca -0.02 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.39 2cay n TYR 3 Cb 0.29 -0.28 -0.05 0.00 -0.31 0.00 0.00 39.34 38.99 2cay n TYR 3 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 2cay s TRP 4 N -2.14 3.54 0.19 -0.72 0.52 -0.76 -4.61 118.94 114.98 2cay s TRP 4 Ca -0.04 0.42 0.10 0.00 0.02 0.00 0.00 56.10 56.60 2cay s TRP 4 Cb 0.02 -1.88 -0.04 0.00 -1.15 0.00 0.00 33.47 30.42 2cay s TRP 4 CO 0.23 0.61 -0.17 -3.38 0.02 0.00 0.00 176.95 174.25 2cay s HIS 5 N -1.39 2.45 0.31 -1.98 -3.43 0.35 -4.65 115.29 106.96 2cay s HIS 5 Ca 0.30 -0.30 -0.30 0.00 -0.80 0.00 0.00 55.06 53.97 2cay s HIS 5 Cb -0.13 -1.19 -0.12 0.00 -1.43 0.00 0.00 32.58 29.71 2cay s HIS 5 CO 0.20 0.52 1.53 0.98 -2.00 0.00 0.00 174.74 175.98 2cay n TYR 6 N 0.09 2.78 -4.08 0.38 9.36 -1.26 -0.30 117.16 124.12 2cay n TYR 6 Ca -0.11 0.34 -0.34 0.00 3.32 0.00 0.00 57.90 61.11 2cay n TYR 6 Cb 0.56 -2.56 -0.15 0.00 -0.63 0.00 0.00 39.34 36.56 2cay n TYR 6 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 2cay s VAL 7 N -0.36 2.45 0.17 2.97 1.01 -0.85 -4.71 120.40 121.08 2cay s VAL 7 Ca 0.61 -0.81 -0.30 0.00 0.00 0.00 0.00 61.98 61.48 2cay s VAL 7 Cb -0.51 -2.06 -0.08 0.00 0.00 0.00 0.00 36.38 33.73 2cay s VAL 7 CO 0.53 0.51 1.18 -0.70 0.00 0.00 0.00 175.10 176.62 2cay s GLU 8 N 1.32 4.51 0.00 2.72 2.12 -1.26 -4.58 118.70 123.53 2cay s GLU 8 Ca 0.05 1.83 0.00 0.00 0.36 0.00 0.00 54.97 57.20 2cay s GLU 8 Cb -0.13 -3.26 0.00 0.00 0.26 0.00 0.00 34.13 30.99 2cay s GLU 8 CO -0.10 -0.07 0.00 0.25 -0.54 0.00 0.00 175.26 174.80 2cay n THR 9 N 2.64 0.00 -4.48 -1.70 -2.24 -1.26 -0.40 114.28 106.84 2cay n THR 9 Ca 0.04 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.59 2cay n THR 9 Cb 0.45 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.59 2cay n THR 9 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2cay s THR 10 N 3.05 0.75 0.49 4.28 -4.23 -0.29 -4.61 115.64 115.08 2cay s THR 10 Ca 0.00 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.67 2cay s THR 10 Cb 0.00 -2.50 0.23 0.00 1.34 0.00 0.00 72.50 71.58 2cay s THR 10 CO 0.00 0.00 2.08 0.77 -0.54 0.00 0.00 174.62 176.93 2cay h SER 11 N 1.94 0.00 -0.02 3.99 4.64 -1.98 -1.08 113.55 121.04 2cay h SER 11 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 2cay h SER 11 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2cay h SER 11 CO 0.60 0.08 0.00 -1.54 -0.87 0.00 0.00 176.83 175.10 2cay n SER 12 N -4.43 0.62 -0.04 4.97 3.41 -1.26 -4.91 113.62 111.98 2cay n SER 12 Ca -0.03 -1.27 0.00 0.00 -0.26 0.00 0.00 58.87 57.32 2cay n SER 12 Cb 0.16 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 2cay n SER 12 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cay n GLY 13 N 1.04 1.02 3.52 5.00 0.00 -0.41 -5.06 105.19 110.30 2cay n GLY 13 Ca 0.21 -0.51 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 2cay n GLY 13 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2cay s GLN 14 N -2.81 3.51 0.46 1.61 -1.52 -1.26 -4.84 119.66 114.81 2cay s GLN 14 Ca 0.00 -0.63 -0.23 0.00 -1.95 0.00 0.00 55.36 52.55 2cay s GLN 14 Cb 0.00 -3.75 -0.07 0.00 -0.22 0.00 0.00 33.01 28.97 2cay s GLN 14 CO 0.00 -0.41 1.15 -1.25 -0.25 0.00 0.00 175.29 174.52 2cay s PRO 15 N 1.70 3.76 -0.45 2.91 0.04 -1.26 -1.13 135.00 140.57 2cay s PRO 15 Ca 0.06 1.72 -0.27 0.00 0.04 0.00 0.00 61.00 62.55 2cay s PRO 15 Cb -0.17 -2.37 0.03 0.00 0.04 0.00 0.00 34.50 32.02 2cay s PRO 15 CO 0.10 -0.54 1.02 -0.51 0.04 0.00 0.00 177.00 177.11 2cay s LEU 16 N -3.07 3.86 0.39 -3.56 1.02 0.46 -4.94 118.68 112.83 2cay s LEU 16 Ca 0.64 0.37 -0.01 0.00 0.02 0.00 0.00 54.13 55.15 2cay s LEU 16 Cb -0.27 -3.36 -0.03 0.00 0.02 0.00 0.00 46.19 42.55 2cay s LEU 16 CO 0.33 -1.09 0.62 -0.76 0.02 0.00 0.00 176.35 175.47 2cay s LEU 17 N 3.98 3.88 0.65 1.79 1.43 -1.26 -4.82 118.68 124.33 2cay s LEU 17 Ca 0.42 0.56 -0.06 0.00 -1.03 0.00 0.00 54.13 54.02 2cay s LEU 17 Cb -0.09 -3.44 0.04 0.00 0.03 0.00 0.00 46.19 42.72 2cay s LEU 17 CO 0.27 -0.40 0.96 -0.13 0.23 0.00 0.00 176.35 177.27 2cay s ARG 18 N -4.45 2.51 -0.44 1.70 0.52 -1.26 -4.95 118.95 112.58 2cay s ARG 18 Ca 0.42 -0.17 -0.41 0.00 -0.52 0.00 0.00 55.73 55.06 2cay s ARG 18 Cb -0.10 -2.22 -0.16 0.00 0.52 0.00 0.00 34.95 32.99 2cay s ARG 18 CO 0.38 -1.00 2.13 0.39 0.02 0.00 0.00 175.30 177.22 2cay n GLU 19 N -2.76 0.44 -1.01 3.54 4.71 -1.26 -1.38 120.64 122.92 2cay n GLU 19 Ca 0.07 0.12 -0.00 0.00 -0.01 0.00 0.00 57.16 57.34 2cay n GLU 19 Cb 0.59 -1.88 -0.00 0.00 -1.01 0.00 0.00 31.44 29.14 2cay n GLU 19 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2cay n GLY 20 N 6.94 0.43 3.66 0.62 0.00 -1.26 -5.00 105.19 110.57 2cay n GLY 20 Ca 0.48 -0.08 -0.40 0.00 0.00 0.00 0.00 46.02 46.02 2cay n GLY 20 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2cay s GLU 21 N -0.59 4.22 -0.07 1.61 2.12 -0.48 -5.00 118.70 120.52 2cay s GLU 21 Ca 0.00 0.64 0.02 0.00 0.36 0.00 0.00 54.97 55.99 2cay s GLU 21 Cb 0.00 -3.58 -0.03 0.00 0.26 0.00 0.00 34.13 30.79 2cay s GLU 21 CO 0.00 -0.24 -0.12 0.15 -0.54 0.00 0.00 175.26 174.51 2cay s LYS 22 N 1.90 2.72 0.05 4.30 1.02 -1.26 -4.72 119.74 123.76 2cay s LYS 22 Ca 0.29 -0.66 -0.30 0.00 0.02 0.00 0.00 55.97 55.33 2cay s LYS 22 Cb -0.16 -2.48 -0.09 0.00 -0.52 0.00 0.00 37.83 34.58 2cay s LYS 22 CO 0.11 0.56 1.90 0.34 -0.92 0.00 0.00 175.35 177.34 2cay s ASP 23 N -0.55 6.47 -0.17 2.83 -1.08 -1.26 -1.32 116.67 121.58 2cay s ASP 23 Ca 0.08 2.65 -0.08 0.00 -0.52 0.00 0.00 52.55 54.68 2cay s ASP 23 Cb -0.12 -2.54 -0.08 0.00 -1.46 0.00 0.00 42.92 38.73 2cay s ASP 23 CO 0.02 -1.03 -0.21 -0.38 0.52 0.00 0.00 175.17 174.08 2cay n ILE 24 N 5.36 0.93 -3.58 4.11 5.41 0.49 -4.94 119.36 127.15 2cay n ILE 24 Ca 0.19 -0.25 -0.16 0.00 1.00 0.00 0.00 62.75 63.54 2cay n ILE 24 Cb 0.41 -1.68 -0.06 0.00 -0.71 0.00 0.00 39.64 37.59 2cay n ILE 24 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 176.55 176.67 2cay s PHE 25 N -2.31 -0.49 0.01 1.39 5.36 -1.07 -5.00 117.98 115.86 2cay s PHE 25 Ca -0.24 0.72 0.02 0.00 -0.96 0.00 0.00 56.93 56.48 2cay s PHE 25 Cb 0.09 0.34 -0.01 0.00 -0.34 0.00 0.00 43.02 43.10 2cay s PHE 25 CO 0.30 -0.59 -0.06 0.42 -1.46 0.00 0.00 175.22 173.83 2cay s ILE 26 N -1.73 0.48 0.16 3.12 1.01 -1.26 -0.47 121.20 122.50 2cay s ILE 26 Ca -0.09 -0.41 0.03 0.00 0.00 0.00 0.00 60.65 60.17 2cay s ILE 26 Cb -0.01 -0.43 -0.05 0.00 0.01 0.00 0.00 42.46 41.98 2cay s ILE 26 CO 0.04 0.03 -0.03 -0.62 0.00 0.00 0.00 174.94 174.36 2cay s ASP 27 N -0.43 1.40 0.24 3.58 -1.08 0.47 -4.98 116.67 115.88 2cay s ASP 27 Ca -0.00 -1.11 0.10 0.00 -0.52 0.00 0.00 52.55 51.02 2cay s ASP 27 Cb -0.04 0.07 -0.04 0.00 -1.46 0.00 0.00 42.92 41.45 2cay s ASP 27 CO -0.00 -0.49 -0.12 -1.10 0.52 0.00 0.00 175.17 173.98 2cay s GLN 28 N -3.86 1.94 -1.21 4.34 1.11 -1.26 -0.14 119.66 120.58 2cay s GLN 28 Ca 0.21 -1.50 -0.09 0.00 0.01 0.00 0.00 55.36 53.99 2cay s GLN 28 Cb 0.05 -2.00 -0.01 0.00 -1.01 0.00 0.00 33.01 30.04 2cay s GLN 28 CO 0.02 0.38 0.74 0.43 0.01 0.00 0.00 175.29 176.87 2cay n SER 29 N -0.40 -3.49 -4.73 5.90 7.64 -0.97 -4.49 113.62 113.09 2cay n SER 29 Ca -0.08 -0.90 -0.34 0.00 1.01 0.00 0.00 58.87 58.56 2cay n SER 29 Cb 0.58 -3.85 -0.08 0.00 -1.01 0.00 0.00 64.21 59.85 2cay n SER 29 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2cay s VAL 30 N -3.58 4.48 0.19 0.44 1.01 0.05 -1.68 120.40 121.31 2cay s VAL 30 Ca 0.25 -0.39 0.08 0.00 0.00 0.00 0.00 61.98 61.93 2cay s VAL 30 Cb -0.08 -2.98 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 2cay s VAL 30 CO 0.83 0.44 -0.05 -0.83 0.00 0.00 0.00 175.10 175.50 2cay s GLY 31 N -1.40 1.72 -0.05 4.51 0.00 -0.03 -1.28 107.32 110.79 2cay s GLY 31 Ca 0.19 -1.45 -0.00 0.00 0.00 0.00 0.00 44.72 43.46 2cay s GLY 31 CO 0.09 -1.47 -0.01 1.08 0.00 0.00 0.00 173.10 172.79 2cay s LEU 32 N -2.97 3.51 0.08 0.66 1.43 -0.38 -0.62 118.68 120.39 2cay s LEU 32 Ca 0.27 0.06 0.09 0.00 -1.03 0.00 0.00 54.13 53.52 2cay s LEU 32 Cb -0.09 -1.90 -0.03 0.00 0.03 0.00 0.00 46.19 44.20 2cay s LEU 32 CO 0.17 0.33 -0.23 -0.31 0.23 0.00 0.00 176.35 176.55 2cay s TYR 33 N -0.97 2.42 -0.24 0.29 1.51 0.03 -0.78 117.35 119.61 2cay s TYR 33 Ca 0.16 -0.33 -0.00 0.00 -1.01 0.00 0.00 57.07 55.88 2cay s TYR 33 Cb -0.11 -1.37 0.03 0.00 -0.11 0.00 0.00 41.96 40.40 2cay s TYR 33 CO 0.06 0.26 -0.09 -1.58 -1.11 0.00 0.00 175.55 173.09 2cay s HIS 34 N -0.97 3.07 0.00 2.71 2.46 -0.00 -2.11 115.29 120.45 2cay s HIS 34 Ca 0.14 -1.74 0.00 0.00 0.47 0.00 0.00 55.06 53.94 2cay s HIS 34 Cb -0.10 -2.01 0.00 0.00 -0.13 0.00 0.00 32.58 30.33 2cay s HIS 34 CO 0.05 -0.78 0.00 0.41 -2.47 0.00 0.00 174.74 171.96 2cay n GLY 35 N 4.61 3.21 0.01 1.59 0.00 0.35 -2.28 105.19 112.68 2cay n GLY 35 Ca -0.17 -0.13 0.14 0.00 0.00 0.00 0.00 46.02 45.86 2cay n GLY 35 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2cay n LYS 36 N 14.00 0.11 -4.07 1.61 5.02 -1.26 -4.65 118.16 128.92 2cay n LYS 36 Ca 0.00 -0.01 -0.33 0.00 -2.02 0.00 0.00 58.31 55.95 2cay n LYS 36 Cb 0.00 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.44 2cay n LYS 36 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2cay s SER 37 N -2.90 5.77 0.36 4.39 0.01 -0.96 -5.08 113.70 115.29 2cay s SER 37 Ca 0.17 0.17 -0.28 0.00 1.31 0.00 0.00 55.95 57.32 2cay s SER 37 Cb 0.19 -1.68 -0.10 0.00 0.21 0.00 0.00 66.02 64.65 2cay s SER 37 CO 0.53 0.27 1.30 -0.54 0.41 0.00 0.00 173.24 175.21 2cay s LYS 38 N -1.79 4.19 -0.36 12.44 1.02 -1.26 -0.82 119.74 133.16 2cay s LYS 38 Ca 0.24 2.18 -0.28 0.00 0.02 0.00 0.00 55.97 58.13 2cay s LYS 38 Cb -0.12 -2.93 0.02 0.00 -0.52 0.00 0.00 37.83 34.27 2cay s LYS 38 CO 0.15 -0.32 1.02 0.42 -0.92 0.00 0.00 175.35 175.71 2cay s ILE 39 N -1.20 4.49 0.13 2.17 1.01 0.04 -4.75 121.20 123.09 2cay s ILE 39 Ca 0.52 1.44 -0.18 0.00 0.00 0.00 0.00 60.65 62.44 2cay s ILE 39 Cb -0.39 -4.41 -0.03 0.00 0.01 0.00 0.00 42.46 37.64 2cay s ILE 39 CO 0.51 -0.58 1.76 -0.07 0.00 0.00 0.00 174.94 176.56 2cay h LEU 40 N 10.25 0.37 -2.15 2.97 3.38 -1.94 -2.34 115.31 125.87 2cay h LEU 40 Ca -0.22 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2cay h LEU 40 Cb 1.07 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.72 2cay h LEU 40 CO 1.03 0.32 0.00 0.00 0.09 0.00 0.00 178.44 179.87 2cay n GLN 41 N -4.84 2.75 -2.75 1.13 3.00 -1.26 -4.33 117.38 111.09 2cay n GLN 41 Ca -0.01 -1.81 -0.20 0.00 -0.01 0.00 0.00 57.00 54.96 2cay n GLN 41 Cb 0.05 -1.67 -0.01 0.00 0.00 0.00 0.00 30.24 28.62 2cay n GLN 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 2cay n ARG 42 N 0.62 2.34 0.00 -1.09 3.00 -0.88 -4.83 116.66 115.82 2cay n ARG 42 Ca 0.16 -4.04 0.07 0.00 -0.01 0.00 0.00 57.85 54.03 2cay n ARG 42 Cb 0.62 -1.88 -0.02 0.00 0.00 0.00 0.00 32.46 31.18 2cay n ARG 42 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 2cay n GLN 43 N -0.19 2.06 -3.38 5.56 1.13 -1.26 -1.24 117.38 120.07 2cay n GLN 43 Ca 0.27 -0.51 -0.14 0.00 -1.94 0.00 0.00 57.00 54.67 2cay n GLN 43 Cb 0.65 -1.18 -0.09 0.00 0.11 0.00 0.00 30.24 29.73 2cay n GLN 43 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 2cay s ARG 44 N -1.88 0.33 0.27 -1.09 3.52 -1.23 -4.02 118.95 114.86 2cay s ARG 44 Ca 0.10 0.08 -0.12 0.00 -0.13 0.00 0.00 55.73 55.65 2cay s ARG 44 Cb 0.11 -0.60 0.00 0.00 -1.56 0.00 0.00 34.95 32.90 2cay s ARG 44 CO 0.41 -0.93 0.52 0.20 -0.81 0.00 0.00 175.30 174.69 2cay s GLY 45 N 2.43 0.59 0.17 8.12 0.00 -0.40 -1.05 107.32 117.18 2cay s GLY 45 Ca 0.10 -0.91 -0.17 0.00 0.00 0.00 0.00 44.72 43.74 2cay s GLY 45 CO -0.27 -0.61 0.63 0.50 0.00 0.00 0.00 173.10 173.35 2cay s ARG 46 N -3.78 4.14 -0.12 2.90 0.52 -0.36 -0.77 118.95 121.48 2cay s ARG 46 Ca 0.22 0.70 -0.00 0.00 -0.52 0.00 0.00 55.73 56.13 2cay s ARG 46 Cb -0.01 -2.96 -0.02 0.00 0.52 0.00 0.00 34.95 32.48 2cay s ARG 46 CO 0.10 0.47 -0.10 -1.50 0.02 0.00 0.00 175.30 174.29 2cay s ILE 47 N -1.43 3.34 -0.14 1.52 1.10 0.80 -0.74 121.20 125.66 2cay s ILE 47 Ca 0.39 -0.57 0.00 0.00 -0.51 0.00 0.00 60.65 59.95 2cay s ILE 47 Cb -0.16 -2.40 0.02 0.00 0.15 0.00 0.00 42.46 40.07 2cay s ILE 47 CO 0.20 0.54 -0.12 0.12 -2.11 0.00 0.00 174.94 173.57 2cay s PHE 48 N 0.03 1.93 -0.23 3.50 5.36 -0.12 -0.40 117.98 128.05 2cay s PHE 48 Ca -0.03 -1.05 -0.13 0.00 -0.96 0.00 0.00 56.93 54.75 2cay s PHE 48 Cb -0.14 -1.47 -0.04 0.00 -0.34 0.00 0.00 43.02 41.03 2cay s PHE 48 CO 0.04 -0.62 0.29 -1.17 -1.46 0.00 0.00 175.22 172.30 2cay s LEU 49 N 1.56 4.11 0.49 6.12 2.96 0.38 -0.41 118.68 133.90 2cay s LEU 49 Ca 0.05 0.29 0.05 0.00 -0.22 0.00 0.00 54.13 54.30 2cay s LEU 49 Cb -0.13 -2.32 0.00 0.00 0.50 0.00 0.00 46.19 44.24 2cay s LEU 49 CO -0.10 -0.04 0.27 0.42 -1.32 0.00 0.00 176.35 175.58 2cay s THR 50 N 1.39 1.80 -0.03 3.68 -4.23 0.17 -0.38 115.64 118.05 2cay s THR 50 Ca 0.13 -1.63 0.28 0.00 -1.18 0.00 0.00 61.69 59.29 2cay s THR 50 Cb -0.15 -2.43 0.28 0.00 1.34 0.00 0.00 72.50 71.55 2cay s THR 50 CO 0.07 0.00 1.85 0.77 -0.54 0.00 0.00 174.62 176.77 2cay h SER 51 N 1.06 0.00 0.00 3.99 4.64 -1.56 -3.27 113.55 118.40 2cay h SER 51 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 2cay h SER 51 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 2cay h SER 51 CO 0.64 0.00 -0.94 0.00 -0.87 0.00 0.00 176.83 175.66 2cay n GLN 52 N -2.49 2.96 -3.98 4.77 6.02 -1.26 -4.99 117.38 118.41 2cay n GLN 52 Ca -0.01 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 56.89 2cay n GLN 52 Cb 0.08 -0.97 -0.08 0.00 1.02 0.00 0.00 30.24 30.29 2cay n GLN 52 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2cay s ARG 53 N -1.92 0.86 -0.16 -1.09 0.52 -1.24 -1.13 118.95 114.80 2cay s ARG 53 Ca 0.00 -1.14 -0.06 0.00 -0.52 0.00 0.00 55.73 54.00 2cay s ARG 53 Cb 0.00 0.30 -0.04 0.00 0.52 0.00 0.00 34.95 35.73 2cay s ARG 53 CO 0.00 -0.26 0.06 0.42 0.02 0.00 0.00 175.30 175.54 2cay s ILE 54 N -3.93 4.75 -0.12 1.52 1.01 -0.18 -0.65 121.20 123.60 2cay s ILE 54 Ca 0.11 -0.05 0.02 0.00 0.00 0.00 0.00 60.65 60.72 2cay s ILE 54 Cb 0.06 -3.11 0.01 0.00 0.01 0.00 0.00 42.46 39.43 2cay s ILE 54 CO -0.06 0.50 -0.17 -0.63 0.00 0.00 0.00 174.94 174.58 2cay s ILE 55 N 0.05 1.62 -0.27 2.92 1.01 0.45 -0.76 121.20 126.23 2cay s ILE 55 Ca 0.05 -0.71 -0.14 0.00 0.00 0.00 0.00 60.65 59.85 2cay s ILE 55 Cb -0.12 -1.47 -0.04 0.00 0.01 0.00 0.00 42.46 40.84 2cay s ILE 55 CO 0.01 0.46 0.34 -0.47 0.00 0.00 0.00 174.94 175.28 2cay s TYR 56 N 0.98 3.24 -0.34 3.97 5.04 0.71 -0.95 117.35 130.00 2cay s TYR 56 Ca -0.06 0.36 -0.10 0.00 -2.44 0.00 0.00 57.07 54.83 2cay s TYR 56 Cb -0.15 -2.53 0.02 0.00 0.35 0.00 0.00 41.96 39.64 2cay s TYR 56 CO -0.02 -0.21 0.16 0.42 -1.34 0.00 0.00 175.55 174.56 2cay s ILE 57 N 2.00 4.42 0.28 3.14 -1.09 0.08 -1.35 121.20 128.69 2cay s ILE 57 Ca 0.13 -0.73 -0.29 0.00 -2.23 0.00 0.00 60.65 57.54 2cay s ILE 57 Cb -0.16 -3.38 -0.10 0.00 -1.58 0.00 0.00 42.46 37.25 2cay s ILE 57 CO 0.10 -0.09 1.26 -0.62 -1.23 0.00 0.00 174.94 174.36 2cay s ASP 58 N 1.55 6.91 -0.04 3.58 2.15 -1.26 -1.23 116.67 128.33 2cay s ASP 58 Ca 0.03 2.52 -0.26 0.00 0.43 0.00 0.00 52.55 55.27 2cay s ASP 58 Cb -0.18 -2.63 -0.21 0.00 -0.30 0.00 0.00 42.92 39.59 2cay s ASP 58 CO 0.06 -0.45 1.17 0.44 -0.17 0.00 0.00 175.17 176.22 2cay h ASP 59 N 4.02 0.01 -0.05 -0.34 5.19 -1.44 -3.05 116.42 120.76 2cay h ASP 59 Ca -0.47 -0.59 -0.15 0.00 -0.62 0.00 0.00 57.03 55.20 2cay h ASP 59 Cb 1.22 -0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.74 2cay h ASP 59 CO 0.69 0.60 -0.57 0.00 -3.12 0.00 0.00 179.24 176.84 2cay h ALA 60 N 0.42 0.13 -2.07 3.45 0.00 -1.92 -3.40 119.26 115.87 2cay h ALA 60 Ca 0.00 -0.54 -0.56 0.00 0.00 0.00 0.00 54.91 53.80 2cay h ALA 60 Cb 0.60 0.01 -0.40 0.00 0.00 0.00 0.00 17.79 18.00 2cay h ALA 60 CO 0.00 0.37 -0.95 1.63 0.00 0.00 0.00 179.25 180.31 2cay n LYS 61 N -4.21 1.37 0.04 0.00 5.02 -1.26 -4.98 118.16 114.13 2cay n LYS 61 Ca -0.09 -3.72 0.06 0.00 -2.02 0.00 0.00 58.31 52.53 2cay n LYS 61 Cb 0.64 -1.61 0.48 0.00 -0.02 0.00 0.00 35.03 34.52 2cay n LYS 61 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2cay h PRO 62 N 3.89 0.42 -0.00 1.97 0.13 -1.76 0.07 132.00 136.72 2cay h PRO 62 Ca 0.11 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 2cay h PRO 62 Cb 0.81 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.84 2cay h PRO 62 CO 0.59 0.28 -0.04 0.25 -0.23 0.00 0.00 178.00 178.84 2cay n THR 63 N -4.49 0.00 -0.07 1.56 -2.24 -1.26 -3.86 114.28 103.92 2cay n THR 63 Ca 0.03 -0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.67 2cay n THR 63 Cb 0.11 -0.43 -0.05 0.00 -2.10 0.00 0.00 70.33 67.86 2cay n THR 63 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2cay n GLN 64 N -1.49 0.29 -0.28 -0.78 6.02 -0.79 -4.79 117.38 115.55 2cay n GLN 64 Ca 0.07 0.12 0.09 0.00 -0.01 0.00 0.00 57.00 57.27 2cay n GLN 64 Cb 0.34 -1.01 0.25 0.00 1.02 0.00 0.00 30.24 30.84 2cay n GLN 64 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2cay n ASN 65 N -3.52 3.50 -4.78 1.08 5.03 -0.05 -4.97 115.26 111.55 2cay n ASN 65 Ca -0.26 -1.99 -0.37 0.00 0.87 0.00 0.00 54.58 52.83 2cay n ASN 65 Cb 0.69 -0.37 -0.06 0.00 -1.02 0.00 0.00 39.78 39.02 2cay n ASN 65 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 2cay s SER 66 N -1.04 7.32 0.04 6.41 0.01 -1.25 -4.62 113.70 120.57 2cay s SER 66 Ca 0.38 1.78 -0.00 0.00 1.31 0.00 0.00 55.95 59.42 2cay s SER 66 Cb 0.20 -2.56 -0.03 0.00 0.21 0.00 0.00 66.02 63.84 2cay s SER 66 CO 0.27 -0.03 -0.04 -0.76 0.41 0.00 0.00 173.24 173.09 2cay s LEU 67 N -1.96 2.36 0.09 2.44 1.43 -0.45 -2.02 118.68 120.56 2cay s LEU 67 Ca 0.48 -0.73 0.06 0.00 -1.03 0.00 0.00 54.13 52.91 2cay s LEU 67 Cb -0.19 0.10 -0.03 0.00 0.03 0.00 0.00 46.19 46.10 2cay s LEU 67 CO 0.24 -0.42 -0.16 -0.83 0.23 0.00 0.00 176.35 175.41 2cay s GLY 68 N -2.14 1.01 -0.06 -3.19 0.00 0.59 -0.21 107.32 103.32 2cay s GLY 68 Ca -0.05 -1.11 0.02 0.00 0.00 0.00 0.00 44.72 43.58 2cay s GLY 68 CO -0.05 -1.13 -0.10 -2.27 0.00 0.00 0.00 173.10 169.56 2cay s LEU 69 N -1.85 1.52 -0.00 0.66 2.96 0.06 -0.50 118.68 121.53 2cay s LEU 69 Ca 0.02 -0.25 -0.30 0.00 -0.22 0.00 0.00 54.13 53.38 2cay s LEU 69 Cb -0.10 -0.72 -0.05 0.00 0.50 0.00 0.00 46.19 45.83 2cay s LEU 69 CO 0.03 -0.00 1.29 -1.61 -1.32 0.00 0.00 176.35 174.74 2cay s GLU 70 N 0.81 4.34 0.52 1.98 0.41 -1.26 -1.01 118.70 124.48 2cay s GLU 70 Ca -0.12 1.83 0.16 0.00 -0.41 0.00 0.00 54.97 56.43 2cay s GLU 70 Cb -0.15 -3.50 1.26 0.00 -1.78 0.00 0.00 34.13 29.95 2cay s GLU 70 CO 0.02 -0.46 2.14 -0.07 -0.49 0.00 0.00 175.26 176.40 2cay h LEU 71 N 7.91 0.00 -0.50 1.80 3.38 -1.46 -0.94 115.31 125.50 2cay h LEU 71 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2cay h LEU 71 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2cay h LEU 71 CO 0.88 0.01 0.00 -0.67 0.09 0.00 0.00 178.44 178.75 2cay n ASP 72 N -4.52 0.27 -0.81 -0.43 2.03 -1.26 -1.93 116.55 109.90 2cay n ASP 72 Ca -0.03 0.60 0.12 0.00 0.52 0.00 0.00 54.79 56.00 2cay n ASP 72 Cb 0.10 -0.65 0.26 0.00 -0.72 0.00 0.00 41.12 40.12 2cay n ASP 72 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2cay n ASP 73 N -1.84 2.51 -4.80 1.67 8.00 -0.36 -4.96 116.55 116.78 2cay n ASP 73 Ca 0.01 -1.83 -0.26 0.00 0.71 0.00 0.00 54.79 53.42 2cay n ASP 73 Cb 0.09 -0.04 -0.05 0.00 -0.02 0.00 0.00 41.12 41.10 2cay n ASP 73 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2cay s LEU 74 N -1.89 3.79 0.00 0.64 1.43 -0.82 -1.15 118.68 120.68 2cay s LEU 74 Ca 0.33 -0.14 0.00 0.00 -1.03 0.00 0.00 54.13 53.28 2cay s LEU 74 Cb 0.20 -2.40 0.00 0.00 0.03 0.00 0.00 46.19 44.03 2cay s LEU 74 CO 0.31 0.06 0.00 0.00 0.23 0.00 0.00 176.35 176.95 2cay n ALA 75 N -0.39 2.05 -2.52 4.21 0.00 0.20 -4.59 120.51 119.47 2cay n ALA 75 Ca -0.08 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.27 2cay n ALA 75 Cb 0.55 0.44 -0.08 0.00 0.00 0.00 0.00 19.45 20.36 2cay n ALA 75 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2cay s TYR 76 N -1.89 0.27 0.01 0.00 2.02 -1.20 -5.02 117.35 111.54 2cay s TYR 76 Ca 0.00 -0.70 0.01 0.00 -0.37 0.00 0.00 57.07 56.01 2cay s TYR 76 Cb 0.00 -0.11 -0.01 0.00 -0.40 0.00 0.00 41.96 41.44 2cay s TYR 76 CO 0.00 -0.56 -0.03 0.08 -1.57 0.00 0.00 175.55 173.46 2cay s VAL 77 N -3.90 0.23 -0.06 0.71 1.01 -1.26 -1.16 120.40 115.97 2cay s VAL 77 Ca 0.09 -0.42 -0.02 0.00 0.00 0.00 0.00 61.98 61.62 2cay s VAL 77 Cb 0.05 -0.26 0.04 0.00 0.00 0.00 0.00 36.38 36.21 2cay s VAL 77 CO -0.08 -0.12 0.13 0.21 0.00 0.00 0.00 175.10 175.24 2cay s ASN 78 N -0.58 0.05 -0.06 3.32 2.47 -0.22 -4.98 114.94 114.94 2cay s ASN 78 Ca -0.04 0.26 -0.21 0.00 0.42 0.00 0.00 52.86 53.29 2cay s ASN 78 Cb -0.04 0.16 -0.04 0.00 -1.45 0.00 0.00 41.25 39.87 2cay s ASN 78 CO -0.00 -0.16 0.62 -0.47 -3.72 0.00 0.00 177.10 173.36 2cay s TYR 79 N 1.32 3.59 -0.13 0.43 5.04 -1.26 -0.28 117.35 126.07 2cay s TYR 79 Ca -0.07 1.15 0.02 0.00 -2.44 0.00 0.00 57.07 55.73 2cay s TYR 79 Cb -0.12 -2.69 0.00 0.00 0.35 0.00 0.00 41.96 39.51 2cay s TYR 79 CO -0.05 0.18 -0.21 0.45 -1.34 0.00 0.00 175.55 174.58 2cay s SER 80 N 0.49 3.27 0.00 4.32 0.15 0.30 -5.01 113.70 117.22 2cay s SER 80 Ca 0.33 -0.55 0.31 0.00 0.70 0.00 0.00 55.95 56.74 2cay s SER 80 Cb -0.17 -1.47 1.66 0.00 -1.71 0.00 0.00 66.02 64.33 2cay s SER 80 CO 0.16 0.11 2.11 -1.54 1.20 0.00 0.00 173.24 175.28 2cay n SER 81 N 3.84 0.08 -0.04 5.45 3.41 -1.26 -1.18 113.62 123.91 2cay n SER 81 Ca -0.19 -0.59 0.00 0.00 -0.26 0.00 0.00 58.87 57.83 2cay n SER 81 Cb 0.52 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 2cay n SER 81 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cay n GLY 82 N 1.16 1.19 0.18 5.00 0.00 -1.26 -4.40 105.19 107.06 2cay n GLY 82 Ca 0.19 -0.40 -0.12 0.00 0.00 0.00 0.00 46.02 45.69 2cay n GLY 82 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2cay h PHE 83 N 0.00 0.63 0.00 1.61 3.57 -1.91 -3.33 116.94 117.50 2cay h PHE 83 Ca 0.00 -0.15 0.00 0.00 3.53 0.00 0.00 57.97 61.35 2cay h PHE 83 Cb 0.47 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.06 2cay h PHE 83 CO 0.00 0.78 -1.15 1.28 -2.23 0.00 0.00 178.31 177.00 2cay n LEU 84 N -4.47 0.54 -4.87 0.59 4.77 -1.26 -4.97 117.00 107.33 2cay n LEU 84 Ca -0.04 -0.33 -0.30 0.00 -0.03 0.00 0.00 56.01 55.31 2cay n LEU 84 Cb 0.34 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.38 2cay n LEU 84 CO 0.41 0.14 -0.19 0.42 -1.33 0.00 0.00 177.39 176.83 2cay s THR 85 N -2.83 5.06 0.32 -5.08 -4.23 -1.25 -4.99 115.64 102.63 2cay s THR 85 Ca 0.02 -0.56 0.03 0.00 -1.18 0.00 0.00 61.69 60.00 2cay s THR 85 Cb 0.12 -3.47 0.29 0.00 1.34 0.00 0.00 72.50 70.79 2cay s THR 85 CO 0.72 0.12 1.91 0.03 -0.54 0.00 0.00 174.62 176.86 2cay h ARG 86 N 3.10 0.91 -5.90 3.99 3.08 -1.93 -3.43 114.38 114.18 2cay h ARG 86 Ca -0.46 -0.05 -0.51 0.00 0.07 0.00 0.00 59.98 59.02 2cay h ARG 86 Cb 1.16 -0.20 -0.19 0.00 0.08 0.00 0.00 29.97 30.82 2cay h ARG 86 CO 0.72 0.60 -0.79 -1.12 -1.07 0.00 0.00 179.97 178.31 2cay s SER 87 N -6.01 2.53 0.72 7.04 0.01 -1.26 -5.03 113.70 111.69 2cay s SER 87 Ca -0.11 -0.81 -0.15 0.00 1.31 0.00 0.00 55.95 56.19 2cay s SER 87 Cb 0.20 -0.14 0.03 0.00 0.21 0.00 0.00 66.02 66.32 2cay s SER 87 CO 0.79 -0.03 1.22 -2.84 0.41 0.00 0.00 173.24 172.79 2cay s PRO 88 N -2.53 2.21 -0.01 12.44 0.02 -1.26 -4.48 135.00 141.39 2cay s PRO 88 Ca 0.12 1.80 0.04 0.00 0.02 0.00 0.00 61.00 62.98 2cay s PRO 88 Cb -0.07 -1.84 -0.01 0.00 0.02 0.00 0.00 34.50 32.60 2cay s PRO 88 CO 0.05 -1.79 -0.13 1.03 -0.33 0.00 0.00 177.00 175.83 2cay s ARG 89 N -3.83 1.08 -0.26 5.54 1.81 -0.33 -1.75 118.95 121.21 2cay s ARG 89 Ca 0.75 -0.49 -0.08 0.00 -1.72 0.00 0.00 55.73 54.20 2cay s ARG 89 Cb -0.30 -1.04 -0.03 0.00 -0.45 0.00 0.00 34.95 33.12 2cay s ARG 89 CO 0.44 0.29 0.09 -1.17 -0.68 0.00 0.00 175.30 174.27 2cay s LEU 90 N -0.34 3.57 -0.20 2.53 2.96 0.12 -0.54 118.68 126.78 2cay s LEU 90 Ca 0.05 -0.19 -0.10 0.00 -0.22 0.00 0.00 54.13 53.67 2cay s LEU 90 Cb -0.05 -1.96 -0.05 0.00 0.50 0.00 0.00 46.19 44.63 2cay s LEU 90 CO -0.00 -0.05 0.14 -0.63 -1.32 0.00 0.00 176.35 174.49 2cay s ILE 91 N 1.64 5.40 -0.11 6.68 -1.09 0.62 -1.00 121.20 133.34 2cay s ILE 91 Ca 0.06 0.21 0.02 0.00 -2.23 0.00 0.00 60.65 58.72 2cay s ILE 91 Cb -0.15 -3.48 -0.01 0.00 -1.58 0.00 0.00 42.46 37.24 2cay s ILE 91 CO 0.05 0.44 -0.19 -0.76 -1.23 0.00 0.00 174.94 173.25 2cay s LEU 92 N 0.37 2.38 -0.19 2.97 1.43 0.06 -1.06 118.68 124.65 2cay s LEU 92 Ca 0.08 -0.45 -0.06 0.00 -1.03 0.00 0.00 54.13 52.67 2cay s LEU 92 Cb -0.11 -1.50 -0.03 0.00 0.03 0.00 0.00 46.19 44.57 2cay s LEU 92 CO -0.02 0.16 0.04 -0.36 0.23 0.00 0.00 176.35 176.40 2cay s PHE 93 N 0.33 3.15 0.53 0.29 0.08 -0.31 -1.12 117.98 120.94 2cay s PHE 93 Ca -0.15 -0.13 -0.18 0.00 0.12 0.00 0.00 56.93 56.59 2cay s PHE 93 Cb -0.17 -2.08 -0.07 0.00 -0.57 0.00 0.00 43.02 40.14 2cay s PHE 93 CO 0.07 -0.00 1.03 -0.06 -0.10 0.00 0.00 175.22 176.16 2cay s PHE 94 N 0.62 3.09 0.26 0.36 0.08 -1.26 -0.63 117.98 120.50 2cay s PHE 94 Ca 0.02 1.54 -0.03 0.00 0.12 0.00 0.00 56.93 58.57 2cay s PHE 94 Cb -0.13 -2.98 0.32 0.00 -0.57 0.00 0.00 43.02 39.65 2cay s PHE 94 CO 0.02 -0.81 1.80 0.87 -0.10 0.00 0.00 175.22 177.00 2cay h LYS 95 N 1.05 0.94 -2.06 0.44 1.57 -1.39 -3.40 116.57 113.73 2cay h LYS 95 Ca -0.48 -0.19 -0.55 0.00 -1.87 0.00 0.00 60.65 57.55 2cay h LYS 95 Cb 1.21 -0.14 -0.40 0.00 0.08 0.00 0.00 32.23 32.98 2cay h LYS 95 CO 0.59 0.82 -1.00 -3.47 -0.57 0.00 0.00 179.45 175.82 2cay n ASP 96 N -4.27 1.27 -4.76 0.86 2.03 -1.26 -5.04 116.55 105.38 2cay n ASP 96 Ca 0.05 -2.96 -0.39 0.00 0.52 0.00 0.00 54.79 52.00 2cay n ASP 96 Cb 0.22 -0.64 -0.05 0.00 -0.72 0.00 0.00 41.12 39.94 2cay n ASP 96 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2cay s PRO 97 N -1.83 4.59 0.37 -0.67 0.04 -1.26 -4.93 135.00 131.31 2cay s PRO 97 Ca 0.38 1.66 0.18 0.00 0.04 0.00 0.00 61.00 63.25 2cay s PRO 97 Cb 0.21 -3.06 0.65 0.00 0.04 0.00 0.00 34.50 32.34 2cay s PRO 97 CO -0.09 0.21 1.72 0.77 0.04 0.00 0.00 177.00 179.66 2cay h SER 98 N 3.60 0.00 -5.10 6.66 0.02 -1.99 -3.45 113.55 113.29 2cay h SER 98 Ca -0.47 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.36 2cay h SER 98 Cb 1.21 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.57 2cay h SER 98 CO 0.66 0.40 -0.55 -0.55 -1.14 0.00 0.00 176.83 175.64 2cay s SER 99 N -6.49 0.22 0.00 3.07 0.15 -1.26 -5.04 113.70 104.35 2cay s SER 99 Ca -0.00 -0.59 0.29 0.00 0.70 0.00 0.00 55.95 56.34 2cay s SER 99 Cb 0.11 0.22 1.48 0.00 -1.71 0.00 0.00 66.02 66.12 2cay s SER 99 CO 0.69 -0.51 1.98 -1.54 1.20 0.00 0.00 173.24 175.07 2cay n SER 252 N 0.73 0.62 0.00 5.45 3.41 -1.26 -1.08 113.62 121.49 2cay n SER 252 Ca -0.19 -1.25 0.13 0.00 -0.26 0.00 0.00 58.87 57.31 2cay n SER 252 Cb 0.59 -0.01 0.71 0.00 -0.26 0.00 0.00 64.21 65.24 2cay n SER 252 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2cay n THR 253 N -0.50 0.11 -3.79 6.66 -2.24 -1.26 -4.76 114.28 108.50 2cay n THR 253 Ca 0.21 0.03 -0.36 0.00 -2.27 0.00 0.00 64.05 61.66 2cay n THR 253 Cb 0.21 -0.60 -0.13 0.00 -2.10 0.00 0.00 70.33 67.71 2cay n THR 253 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2cay s GLU 254 N -2.38 3.60 0.30 -0.78 2.02 -0.24 -4.12 118.70 117.10 2cay s GLU 254 Ca 0.30 -0.51 -0.19 0.00 0.02 0.00 0.00 54.97 54.59 2cay s GLU 254 Cb 0.18 -3.26 0.04 0.00 0.10 0.00 0.00 34.13 31.19 2cay s GLU 254 CO 0.37 -0.18 0.78 -0.59 0.02 0.00 0.00 175.26 175.66 2cay s PHE 255 N 1.56 -0.06 0.01 1.61 -0.12 -1.26 -4.69 117.98 115.03 2cay s PHE 255 Ca 0.06 -0.47 0.02 0.00 -0.05 0.00 0.00 56.93 56.49 2cay s PHE 255 Cb -0.15 0.75 -0.04 0.00 -0.63 0.00 0.00 43.02 42.96 2cay s PHE 255 CO 0.02 -1.31 0.00 0.08 -0.05 0.00 0.00 175.22 173.96 2cay s VAL 256 N -3.18 4.13 0.01 -2.49 1.01 -0.27 -0.50 120.40 119.12 2cay s VAL 256 Ca 0.13 -0.66 0.06 0.00 0.00 0.00 0.00 61.98 61.51 2cay s VAL 256 Cb -0.05 -2.86 -0.02 0.00 0.00 0.00 0.00 36.38 33.45 2cay s VAL 256 CO 0.08 0.34 -0.18 -1.10 0.00 0.00 0.00 175.10 174.24 2cay s GLN 257 N -1.68 1.31 -0.18 2.72 -0.21 -0.90 -0.76 119.66 119.96 2cay s GLN 257 Ca 0.21 -0.74 -0.07 0.00 0.02 0.00 0.00 55.36 54.78 2cay s GLN 257 Cb -0.12 -1.32 -0.04 0.00 1.00 0.00 0.00 33.01 32.54 2cay s GLN 257 CO 0.12 0.35 0.04 -0.51 -2.12 0.00 0.00 175.29 173.17 2cay s LEU 258 N -0.77 3.67 -0.20 2.90 1.43 -0.17 -0.79 118.68 124.75 2cay s LEU 258 Ca 0.06 0.01 -0.03 0.00 -1.03 0.00 0.00 54.13 53.14 2cay s LEU 258 Cb -0.07 -1.92 -0.01 0.00 0.03 0.00 0.00 46.19 44.21 2cay s LEU 258 CO 0.00 0.15 -0.06 -0.55 0.23 0.00 0.00 176.35 176.13 2cay s SER 259 N 0.48 4.25 -0.53 2.29 0.15 0.20 -0.71 113.70 119.84 2cay s SER 259 Ca 0.02 -0.36 -0.16 0.00 0.70 0.00 0.00 55.95 56.14 2cay s SER 259 Cb -0.13 -1.71 0.11 0.00 -1.71 0.00 0.00 66.02 62.58 2cay s SER 259 CO 0.01 0.03 0.50 -0.36 1.20 0.00 0.00 173.24 174.62 2cay s PHE 260 N 1.17 3.22 -0.37 3.44 0.08 -0.72 -0.85 117.98 123.94 2cay s PHE 260 Ca 0.02 -1.17 0.23 0.00 0.12 0.00 0.00 56.93 56.13 2cay s PHE 260 Cb -0.14 -3.69 0.13 0.00 -0.57 0.00 0.00 43.02 38.75 2cay s PHE 260 CO -0.01 -1.00 1.18 0.00 -0.10 0.00 0.00 175.22 175.28 2cay h ARG 261 N 8.89 0.00 0.00 0.44 -0.00 -1.59 -3.37 114.38 118.75 2cay h ARG 261 Ca -0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.18 2cay h ARG 261 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.07 2cay h ARG 261 CO 1.01 0.00 0.00 1.63 0.00 0.00 0.00 179.97 182.61 2cay n LYS 262 N -2.56 0.07 -4.32 0.04 4.76 -1.26 -5.07 118.16 109.84 2cay n LYS 262 Ca 0.01 -0.45 -0.19 0.00 -2.87 0.00 0.00 58.31 54.82 2cay n LYS 262 Cb 0.52 -0.73 -0.09 0.00 -1.84 0.00 0.00 35.03 32.89 2cay n LYS 262 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2cay s SER 263 N -0.14 1.60 0.00 4.39 1.04 -1.26 -5.04 113.70 114.29 2cay s SER 263 Ca 0.00 -1.66 0.27 0.00 0.48 0.00 0.00 55.95 55.05 2cay s SER 263 Cb 0.00 0.49 0.97 0.00 0.10 0.00 0.00 66.02 67.59 2cay s SER 263 CO 0.00 -0.98 1.71 -0.90 0.98 0.00 0.00 173.24 174.05 2cay n ASP 264 N -1.21 0.58 -0.01 7.02 5.68 -1.26 -4.76 116.55 122.59 2cay n ASP 264 Ca 0.03 -0.50 -0.00 0.00 -0.50 0.00 0.00 54.79 53.82 2cay n ASP 264 Cb 0.64 -0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.62 2cay n ASP 264 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2cay n GLY 265 N 1.35 0.19 0.08 6.12 0.00 -1.26 -4.80 105.19 106.87 2cay n GLY 265 Ca 0.12 -0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.01 2cay n GLY 265 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2cay h VAL 266 N 0.00 1.33 -0.67 1.61 2.07 -1.99 -1.09 116.25 117.51 2cay h VAL 266 Ca -0.00 -1.02 -0.06 0.00 0.82 0.00 0.00 66.70 66.44 2cay h VAL 266 Cb 0.63 1.90 -0.03 0.00 -1.52 0.00 0.00 31.29 32.28 2cay h VAL 266 CO 0.00 0.28 0.19 -0.07 0.02 0.00 0.00 177.57 177.99 2cay h LEU 267 N -0.28 0.99 -0.47 2.57 3.38 -1.99 0.76 115.31 120.26 2cay h LEU 267 Ca 0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 2cay h LEU 267 Cb 0.46 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2cay h LEU 267 CO 0.01 0.95 0.20 0.15 0.09 0.00 0.00 178.44 179.83 2cay h PHE 268 N 0.98 0.71 -0.37 1.13 3.57 -1.93 -1.57 116.94 119.45 2cay h PHE 268 Ca 0.21 -0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 2cay h PHE 268 Cb 0.33 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 2cay h PHE 268 CO 0.02 0.59 0.16 0.77 -2.23 0.00 0.00 178.31 177.63 2cay h SER 269 N 0.62 0.51 -0.71 0.41 0.02 -0.74 -1.06 113.55 112.60 2cay h SER 269 Ca 0.16 -0.15 0.01 0.00 -0.84 0.00 0.00 61.79 60.97 2cay h SER 269 Cb 0.18 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 62.55 2cay h SER 269 CO -0.01 0.52 0.47 1.56 -1.14 0.00 0.00 176.83 178.22 2cay h GLN 270 N 0.46 0.92 -0.64 3.45 4.20 -0.77 -0.48 115.11 122.25 2cay h GLN 270 Ca 0.13 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.75 2cay h GLN 270 Cb 0.16 -0.21 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 2cay h GLN 270 CO -0.01 0.61 0.27 0.00 -0.67 0.00 0.00 178.83 179.02 2cay h ALA 271 N 1.27 0.83 -0.43 3.87 0.00 -1.00 -2.52 119.26 121.27 2cay h ALA 271 Ca 0.26 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2cay h ALA 271 Cb -0.09 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 2cay h ALA 271 CO -0.07 0.43 0.14 1.15 0.00 0.00 0.00 179.25 180.91 2cay h THR 272 N 0.89 1.21 -0.49 0.00 2.02 -0.89 -0.19 112.91 115.47 2cay h THR 272 Ca 0.21 -0.69 0.10 0.00 0.77 0.00 0.00 66.41 66.80 2cay h THR 272 Cb 0.19 0.87 -0.09 0.00 -1.74 0.00 0.00 68.15 67.37 2cay h THR 272 CO -0.02 0.25 -0.12 -0.33 0.37 0.00 0.00 175.52 175.67 2cay h GLU 273 N 0.55 -0.00 -0.31 6.66 5.08 -0.95 0.92 114.58 126.53 2cay h GLU 273 Ca 0.14 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.46 2cay h GLU 273 Cb 0.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 2cay h GLU 273 CO -0.01 -0.00 0.04 -0.09 -1.00 0.00 0.00 179.01 177.95 2cay h ARG 274 N -0.00 0.52 -0.65 2.33 2.43 -1.16 -0.70 114.38 117.15 2cay h ARG 274 Ca 0.23 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2cay h ARG 274 Cb 0.36 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.82 2cay h ARG 274 CO -0.50 0.62 0.41 0.00 -1.51 0.00 0.00 179.97 178.99 2cay h ALA 275 N 0.87 0.82 -0.01 2.80 0.00 -0.62 -1.34 119.26 121.79 2cay h ALA 275 Ca 0.09 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2cay h ALA 275 Cb 0.36 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2cay h ALA 275 CO 0.01 0.28 0.00 1.25 0.00 0.00 0.00 179.25 180.78 2cay h LEU 276 N 0.88 0.02 -1.47 0.00 5.85 -0.76 -2.77 115.31 117.06 2cay h LEU 276 Ca 0.23 -0.29 0.14 0.00 0.84 0.00 0.00 57.88 58.81 2cay h LEU 276 Cb -0.07 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 40.90 2cay h LEU 276 CO -0.05 0.30 0.52 -0.08 -0.34 0.00 0.00 178.44 178.80 2cay h GLU 277 N -0.26 0.51 -0.58 1.25 4.57 -0.93 -0.69 114.58 118.44 2cay h GLU 277 Ca 0.00 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 58.10 2cay h GLU 277 Cb 0.29 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.74 2cay h GLU 277 CO 0.00 0.34 0.17 -0.91 -1.18 0.00 0.00 179.01 177.43 2cay h ASN 278 N 0.53 0.82 -0.07 1.04 2.35 -0.99 -2.09 115.58 117.17 2cay h ASN 278 Ca 0.39 -0.14 -0.05 0.00 -0.55 0.00 0.00 56.30 55.95 2cay h ASN 278 Cb 0.76 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.92 2cay h ASN 278 CO -0.14 0.79 -0.13 0.40 -1.65 0.00 0.00 177.43 176.69 2cay h ILE 279 N 0.86 1.40 -0.85 2.81 2.04 -0.92 -3.29 117.51 119.56 2cay h ILE 279 Ca 0.19 -1.41 0.02 0.00 1.00 0.00 0.00 64.86 64.66 2cay h ILE 279 Cb 0.27 2.16 -0.04 0.00 -0.74 0.00 0.00 36.82 38.46 2cay h ILE 279 CO -0.01 0.39 0.56 -0.07 0.00 0.00 0.00 178.15 179.03 2cay h LEU 280 N -0.25 0.95 -1.10 1.44 3.38 -1.07 -3.52 115.31 115.14 2cay h LEU 280 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2cay h LEU 280 Cb 0.70 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2cay h LEU 280 CO 0.03 0.68 0.00 0.35 0.09 0.00 0.00 178.44 179.59