#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2feb n GLU 2 N 0.00 0.00 -3.84 9.51 -0.58 -1.26 -4.70 120.64 119.77 2feb n GLU 2 Ca 0.00 0.00 -0.15 0.00 -0.42 0.00 0.00 57.16 56.59 2feb n GLU 2 Cb 0.00 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 30.83 2feb n GLU 2 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2feb n GLY 3 N 0.00 2.44 2.01 0.62 0.00 -1.26 -4.84 105.19 104.17 2feb n GLY 3 Ca 0.00 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.34 2feb n GLY 3 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2feb n ARG 4 N -0.54 0.00 -0.09 1.61 1.85 -1.26 -4.96 116.66 113.27 2feb n ARG 4 Ca 0.03 0.00 -0.18 0.00 -1.00 0.00 0.00 57.85 56.70 2feb n ARG 4 Cb 0.54 0.00 -0.12 0.00 -1.05 0.00 0.00 32.46 31.83 2feb n ARG 4 CO 0.00 0.00 0.00 1.12 -0.01 0.00 0.00 177.63 178.74 2feb h HIS 5 N 0.00 0.00 -0.17 2.89 2.07 -2.00 -3.47 115.15 114.46 2feb h HIS 5 Ca 0.00 0.00 0.21 0.00 -2.85 0.00 0.00 60.37 57.73 2feb h HIS 5 Cb 0.00 0.00 -0.18 0.00 2.57 0.00 0.00 27.41 29.80 2feb h HIS 5 CO 0.00 1.23 -0.01 -1.64 -3.07 0.00 0.00 177.93 174.44 2feb s MET 6 N -2.29 0.11 -0.65 5.12 -1.94 -1.26 -5.08 119.30 113.31 2feb s MET 6 Ca -0.24 0.06 0.04 0.00 -1.71 0.00 0.00 55.69 53.84 2feb s MET 6 Cb 0.01 0.04 0.32 0.00 2.01 0.00 0.00 34.83 37.21 2feb s MET 6 CO 0.64 -0.19 1.00 0.00 -0.01 0.00 0.00 175.02 176.46 2feb n ALA 7 N 4.68 4.70 -1.72 3.03 0.00 -1.26 -5.00 120.51 124.94 2feb n ALA 7 Ca 0.09 -4.72 -0.33 0.00 0.00 0.00 0.00 53.44 48.47 2feb n ALA 7 Cb 0.60 -0.96 -0.06 0.00 0.00 0.00 0.00 19.45 19.03 2feb n ALA 7 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2feb n PRO 8 N 0.07 1.50 0.00 0.00 -0.04 -1.26 -2.85 135.00 132.41 2feb n PRO 8 Ca 0.32 -2.22 0.00 0.00 -0.04 0.00 0.00 63.50 61.56 2feb n PRO 8 Cb 0.38 -3.44 0.00 0.00 -0.04 0.00 0.00 33.50 30.40 2feb n PRO 8 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2feb n THR 9 N 7.23 0.00 -1.16 0.52 -2.24 -1.26 -5.15 114.28 112.22 2feb n THR 9 Ca 0.46 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.89 2feb n THR 9 Cb 0.44 0.00 0.09 0.00 -2.10 0.00 0.00 70.33 68.76 2feb n THR 9 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2feb n GLU 10 N -0.49 0.20 -2.28 -0.78 -0.00 -1.13 -4.87 120.64 111.28 2feb n GLU 10 Ca 0.00 0.12 -0.43 0.00 -0.00 0.00 0.00 57.16 56.85 2feb n GLU 10 Cb 0.00 -1.97 -0.02 0.00 -0.00 0.00 0.00 31.44 29.45 2feb n GLU 10 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 2feb s ASN 11 N -1.68 6.67 0.01 -1.84 2.47 -1.26 -4.92 114.94 114.39 2feb s ASN 11 Ca 0.66 1.60 -0.25 0.00 0.42 0.00 0.00 52.86 55.28 2feb s ASN 11 Cb -0.31 -2.54 -0.18 0.00 -1.45 0.00 0.00 41.25 36.77 2feb s ASN 11 CO 0.58 -1.02 1.36 -1.28 -3.72 0.00 0.00 177.10 173.02 2feb h SER 12 N 9.40 -0.10 -0.77 -4.21 0.87 -1.99 -3.10 113.55 113.65 2feb h SER 12 Ca -0.30 -0.30 -0.30 0.00 -1.23 0.00 0.00 61.79 59.66 2feb h SER 12 Cb 1.12 0.03 -0.18 0.00 -0.44 0.00 0.00 62.40 62.93 2feb h SER 12 CO 1.00 0.25 0.38 1.07 -0.53 0.00 0.00 176.83 179.00 2feb n THR 13 N -4.98 2.83 -0.01 2.23 5.66 -1.26 -4.14 114.28 114.61 2feb n THR 13 Ca -0.08 -1.57 0.01 0.00 -3.05 0.00 0.00 64.05 59.35 2feb n THR 13 Cb 0.21 -0.44 -0.05 0.00 -1.55 0.00 0.00 70.33 68.50 2feb n THR 13 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2feb n GLY 14 N -0.43 -0.28 3.69 1.09 0.00 -1.18 -4.98 105.19 103.10 2feb n GLY 14 Ca 0.44 -0.13 -0.44 0.00 0.00 0.00 0.00 46.02 45.89 2feb n GLY 14 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2feb n VAL 15 N -1.90 0.76 0.00 1.61 3.14 -1.20 -4.37 118.33 116.37 2feb n VAL 15 Ca -0.04 -0.19 0.00 0.00 -2.96 0.00 0.00 64.34 61.15 2feb n VAL 15 Cb 0.35 -1.63 0.00 0.00 -1.06 0.00 0.00 33.84 31.51 2feb n VAL 15 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2feb n GLN 16 N 2.39 0.00 -2.98 1.45 10.64 -1.26 -5.10 117.38 122.52 2feb n GLN 16 Ca 0.12 0.00 -0.40 0.00 -1.83 0.00 0.00 57.00 54.89 2feb n GLN 16 Cb 0.32 0.00 -0.06 0.00 -0.86 0.00 0.00 30.24 29.65 2feb n GLN 16 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 2feb s ASP 17 N -0.86 7.34 -0.05 2.61 2.15 -1.26 -4.96 116.67 121.63 2feb s ASP 17 Ca 0.00 1.59 -0.04 0.00 0.43 0.00 0.00 52.55 54.53 2feb s ASP 17 Cb 0.00 -2.49 -0.04 0.00 -0.30 0.00 0.00 42.92 40.09 2feb s ASP 17 CO 0.00 0.15 0.13 0.00 -0.17 0.00 0.00 175.17 175.27 2feb s TYR 19 N -1.15 3.18 0.07 0.00 -0.85 1.27 -4.25 117.35 115.61 2feb s TYR 19 Ca 0.21 -0.10 0.08 0.00 -0.52 0.00 0.00 57.07 56.74 2feb s TYR 19 Cb -0.12 -1.44 -0.03 0.00 0.38 0.00 0.00 41.96 40.75 2feb s TYR 19 CO 0.11 0.50 -0.22 1.03 -1.52 0.00 0.00 175.55 175.45 2feb s ARG 20 N -3.87 1.35 8.00 -3.49 0.52 -1.26 -3.98 118.95 116.21 2feb s ARG 20 Ca 0.33 -1.06 0.00 0.00 -0.52 0.00 0.00 55.73 54.48 2feb s ARG 20 Cb -0.08 -1.55 0.00 0.00 0.52 0.00 0.00 34.95 33.84 2feb s ARG 20 CO 0.26 0.38 0.00 0.41 0.02 0.00 0.00 175.30 176.37 2feb n GLY 21 N 1.53 4.28 3.10 -3.53 0.00 -1.26 -3.70 105.19 105.61 2feb n GLY 21 Ca -0.18 0.12 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 2feb n GLY 21 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2feb s ASP 22 N -4.00 5.63 0.58 1.61 1.47 -1.26 -4.91 116.67 115.78 2feb s ASP 22 Ca 0.00 -3.31 0.33 0.00 1.18 0.00 0.00 52.55 50.75 2feb s ASP 22 Cb 0.00 -1.88 1.38 0.00 -0.34 0.00 0.00 42.92 42.08 2feb s ASP 22 CO 0.00 -0.27 1.68 1.23 0.68 0.00 0.00 175.17 178.48 2feb h GLY 23 N 6.49 0.00 0.60 2.12 0.00 -1.77 0.23 103.07 110.74 2feb h GLY 23 Ca 0.08 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.39 2feb h GLY 23 CO 0.78 0.00 -0.04 0.06 0.00 0.00 0.00 176.54 177.34 2feb h GLN 24 N 0.00 0.11 -6.40 4.80 3.07 -0.43 -3.40 115.11 112.87 2feb h GLN 24 Ca 0.47 -0.06 -0.56 0.00 0.09 0.00 0.00 58.65 58.59 2feb h GLN 24 Cb 2.24 0.00 0.03 0.00 0.08 0.00 0.00 27.48 29.83 2feb h GLN 24 CO -0.00 0.55 1.09 0.45 0.09 0.00 0.00 178.83 181.00 2feb n SER 25 N -4.77 3.76 -4.55 0.06 2.88 0.80 -4.39 113.62 107.41 2feb n SER 25 Ca -0.08 0.98 -0.17 0.00 -1.33 0.00 0.00 58.87 58.27 2feb n SER 25 Cb 0.27 -1.47 -0.10 0.00 -0.75 0.00 0.00 64.21 62.16 2feb n SER 25 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2feb n TYR 26 N 6.05 0.95 -1.98 0.66 0.18 -1.26 -4.34 117.16 117.42 2feb n TYR 26 Ca 0.20 -0.00 -0.05 0.00 1.88 0.00 0.00 57.90 59.93 2feb n TYR 26 Cb 0.34 -2.22 -0.05 0.00 -0.38 0.00 0.00 39.34 37.04 2feb n TYR 26 CO 0.00 0.00 0.00 2.89 -2.08 0.00 0.00 176.86 177.67 2feb n ARG 27 N 8.19 0.00 -0.13 -3.48 1.85 -1.26 -4.98 116.66 116.86 2feb n ARG 27 Ca 0.51 -0.68 -0.25 0.00 -1.00 0.00 0.00 57.85 56.42 2feb n ARG 27 Cb 0.38 0.35 -0.09 0.00 -1.05 0.00 0.00 32.46 32.04 2feb n ARG 27 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2feb n GLY 28 N 0.00 -0.39 3.79 2.89 0.00 -1.26 -5.01 105.19 105.20 2feb n GLY 28 Ca -0.19 -0.13 -0.27 0.00 0.00 0.00 0.00 46.02 45.43 2feb n GLY 28 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2feb n THR 29 N -3.98 -2.66 -0.01 2.61 -2.24 -1.26 -4.89 114.28 101.84 2feb n THR 29 Ca -0.48 -0.06 -0.15 0.00 -2.27 0.00 0.00 64.05 61.08 2feb n THR 29 Cb 0.87 -3.34 -0.14 0.00 -2.10 0.00 0.00 70.33 65.62 2feb n THR 29 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2feb n LEU 30 N -4.73 1.73 -1.64 3.22 4.77 -1.26 -4.97 117.00 114.12 2feb n LEU 30 Ca -0.01 0.30 -0.17 0.00 -0.03 0.00 0.00 56.01 56.10 2feb n LEU 30 Cb 0.55 -0.46 -0.04 0.00 -2.33 0.00 0.00 43.42 41.14 2feb n LEU 30 CO 0.71 0.62 -0.19 -0.24 -1.33 0.00 0.00 177.39 176.96 2feb n SER 31 N -3.25 -5.07 -4.49 -1.43 2.88 -1.26 -4.86 113.62 96.14 2feb n SER 31 Ca -0.25 0.21 -0.23 0.00 -1.33 0.00 0.00 58.87 57.27 2feb n SER 31 Cb 1.05 -4.13 -0.11 0.00 -0.75 0.00 0.00 64.21 60.28 2feb n SER 31 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2feb s THR 32 N -2.75 1.45 -0.30 2.46 2.01 -1.26 -4.28 115.64 112.97 2feb s THR 32 Ca 0.00 -2.02 -0.01 0.00 0.31 0.00 0.00 61.69 59.97 2feb s THR 32 Cb 0.00 -2.80 0.19 0.00 0.01 0.00 0.00 72.50 69.90 2feb s THR 32 CO 0.00 -0.04 0.63 0.28 -0.69 0.00 0.00 174.62 174.80 2feb s THR 33 N -3.11 -0.95 0.00 -0.82 -1.32 0.35 -4.08 115.64 105.71 2feb s THR 33 Ca 0.35 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.83 2feb s THR 33 Cb 0.08 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.08 2feb s THR 33 CO 0.16 0.00 0.00 -0.38 -2.21 0.00 0.00 174.62 172.19 2feb n ILE 34 N 5.43 0.00 -3.12 5.08 2.08 -0.98 -3.21 119.36 124.64 2feb n ILE 34 Ca -0.01 0.00 -0.17 0.00 0.56 0.00 0.00 62.75 63.13 2feb n ILE 34 Cb 0.51 0.00 -0.01 0.00 -0.75 0.00 0.00 39.64 39.39 2feb n ILE 34 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 176.55 177.52 2feb n THR 35 N 0.00 -0.15 0.00 1.39 -1.04 -1.26 -4.52 114.28 108.69 2feb n THR 35 Ca 0.00 -4.09 0.00 0.00 -2.04 0.00 0.00 64.05 57.92 2feb n THR 35 Cb 0.00 -0.02 0.00 0.00 -1.82 0.00 0.00 70.33 68.49 2feb n THR 35 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2feb n GLY 36 N 0.32 0.56 3.38 3.41 0.00 -1.26 -5.13 105.19 106.47 2feb n GLY 36 Ca 0.22 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.96 2feb n GLY 36 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2feb s ARG 37 N 0.00 1.39 0.00 1.61 0.52 -1.20 -4.95 118.95 116.32 2feb s ARG 37 Ca 0.00 -1.35 0.00 0.00 -0.52 0.00 0.00 55.73 53.86 2feb s ARG 37 Cb 0.00 -1.84 0.00 0.00 0.52 0.00 0.00 34.95 33.63 2feb s ARG 37 CO 0.00 0.43 0.00 0.25 0.02 0.00 0.00 175.30 176.00 2feb n THR 38 N 0.84 0.00 0.14 0.02 -2.24 -1.26 0.13 114.28 111.90 2feb n THR 38 Ca -0.17 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.62 2feb n THR 38 Cb 0.53 -0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 2feb n THR 38 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2feb n GLN 40 N -0.24 -5.82 -1.64 0.00 -0.06 -1.26 -3.02 117.38 105.34 2feb n GLN 40 Ca 0.01 4.10 -0.46 0.00 -2.00 0.00 0.00 57.00 58.65 2feb n GLN 40 Cb 0.07 -4.43 -0.03 0.00 -4.06 0.00 0.00 30.24 21.79 2feb n GLN 40 CO 0.00 0.00 0.00 -1.13 -0.20 0.00 0.00 177.06 175.73 2feb n SER 41 N 1.99 2.22 -0.66 1.69 3.41 -1.26 -4.73 113.62 116.28 2feb n SER 41 Ca 0.00 1.15 0.00 0.00 -0.26 0.00 0.00 58.87 59.76 2feb n SER 41 Cb 0.00 -1.36 0.00 0.00 -0.26 0.00 0.00 64.21 62.59 2feb n SER 41 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2feb n TRP 42 N 1.57 0.00 -0.17 7.33 7.02 -0.82 -1.60 117.44 130.77 2feb n TRP 42 Ca 0.12 -0.07 0.00 0.00 -1.02 0.00 0.00 57.50 56.53 2feb n TRP 42 Cb 0.30 -0.08 0.00 0.00 -2.42 0.00 0.00 31.31 29.10 2feb n TRP 42 CO 0.00 0.00 0.00 0.43 -2.02 0.00 0.00 177.69 176.10 2feb n SER 43 N 0.44 0.30 -4.40 -0.99 7.64 -1.26 -4.36 113.62 110.98 2feb n SER 43 Ca 0.00 -0.64 -0.45 0.00 1.01 0.00 0.00 58.87 58.79 2feb n SER 43 Cb 0.14 0.33 -0.03 0.00 -1.01 0.00 0.00 64.21 63.65 2feb n SER 43 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2feb s SER 44 N -0.33 6.56 -1.21 6.43 0.15 -0.63 -4.96 113.70 119.71 2feb s SER 44 Ca 0.00 -2.06 -0.14 0.00 0.70 0.00 0.00 55.95 54.46 2feb s SER 44 Cb 0.00 -2.33 0.17 0.00 -1.71 0.00 0.00 66.02 62.15 2feb s SER 44 CO 0.00 -0.96 1.43 -0.04 1.20 0.00 0.00 173.24 174.87 2feb s MET 45 N 2.06 4.10 0.21 5.44 -1.94 -1.26 -4.44 119.30 123.47 2feb s MET 45 Ca 0.24 -2.60 0.00 0.00 -1.71 0.00 0.00 55.69 51.62 2feb s MET 45 Cb -0.10 -5.05 0.00 0.00 2.01 0.00 0.00 34.83 31.68 2feb s MET 45 CO -0.05 -1.76 0.00 -2.37 -0.01 0.00 0.00 175.02 170.83 2feb n THR 46 N 4.57 0.00 -0.19 2.05 5.66 -1.26 -4.96 114.28 120.15 2feb n THR 46 Ca 0.36 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 61.28 2feb n THR 46 Cb 0.43 -0.12 0.05 0.00 -1.55 0.00 0.00 70.33 69.14 2feb n THR 46 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2feb h PRO 47 N 0.00 1.01 -2.00 1.09 0.13 -1.97 -3.45 132.00 126.81 2feb h PRO 47 Ca 0.00 -0.32 -0.04 0.00 -0.87 0.00 0.00 66.00 64.77 2feb h PRO 47 Cb 0.00 -0.09 -0.21 0.00 0.13 0.00 0.00 31.00 30.83 2feb h PRO 47 CO 0.00 1.00 0.14 -3.38 -0.23 0.00 0.00 178.00 175.53 2feb s HIS 48 N -4.98 -0.78 -0.33 1.56 -3.43 -1.26 -4.94 115.29 101.13 2feb s HIS 48 Ca -0.11 1.87 -0.28 0.00 -0.80 0.00 0.00 55.06 55.74 2feb s HIS 48 Cb 0.14 0.28 -0.03 0.00 -1.43 0.00 0.00 32.58 31.54 2feb s HIS 48 CO 0.85 -0.39 1.96 -1.58 -2.00 0.00 0.00 174.74 173.58 2feb s TRP 49 N 0.27 1.57 1.12 0.38 0.52 -1.26 -4.74 118.94 116.79 2feb s TRP 49 Ca -0.01 0.67 -0.19 0.00 0.02 0.00 0.00 56.10 56.60 2feb s TRP 49 Cb -0.05 -4.03 0.29 0.00 -1.15 0.00 0.00 33.47 28.53 2feb s TRP 49 CO 0.02 -3.20 0.74 0.72 0.02 0.00 0.00 176.95 175.25 2feb n HIS 50 N 11.24 -3.52 -3.36 -1.98 8.25 -1.26 -4.96 115.22 119.62 2feb n HIS 50 Ca 0.26 -0.69 -0.43 0.00 -0.26 0.00 0.00 57.72 56.59 2feb n HIS 50 Cb 0.47 -0.97 -0.09 0.00 1.12 0.00 0.00 29.99 30.52 2feb n HIS 50 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 2feb s ARG 51 N -4.75 3.03 -0.47 -0.41 1.04 -1.26 -4.72 118.95 111.41 2feb s ARG 51 Ca 0.54 -1.01 -0.30 0.00 -1.04 0.00 0.00 55.73 53.92 2feb s ARG 51 Cb -0.08 -4.03 0.05 0.00 -2.04 0.00 0.00 34.95 28.84 2feb s ARG 51 CO 0.44 -0.91 0.60 0.54 -0.04 0.00 0.00 175.30 175.94 2feb n ARG 52 N 5.42 -1.70 -0.77 3.89 1.74 -1.26 -4.85 116.66 119.13 2feb n ARG 52 Ca -0.10 1.19 -0.33 0.00 -0.77 0.00 0.00 57.85 57.84 2feb n ARG 52 Cb 0.46 -1.85 0.13 0.00 -1.02 0.00 0.00 32.46 30.18 2feb n ARG 52 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 2feb n ILE 53 N -0.56 0.00 -0.27 0.55 -5.35 -1.26 -4.57 119.36 107.90 2feb n ILE 53 Ca -0.12 -0.23 -0.17 0.00 -0.27 0.00 0.00 62.75 61.96 2feb n ILE 53 Cb 0.63 -0.60 -0.05 0.00 -1.74 0.00 0.00 39.64 37.89 2feb n ILE 53 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 2feb n PRO 54 N -1.69 0.00 0.00 6.28 -0.04 -1.26 -2.92 135.00 135.37 2feb n PRO 54 Ca 0.05 -0.64 0.00 0.00 -0.04 0.00 0.00 63.50 62.86 2feb n PRO 54 Cb 0.56 -2.09 0.00 0.00 -0.04 0.00 0.00 33.50 31.93 2feb n PRO 54 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2feb n LEU 55 N 6.34 0.00 -0.13 1.53 7.94 -1.26 -4.97 117.00 126.45 2feb n LEU 55 Ca 0.18 0.00 -0.25 0.00 -1.11 0.00 0.00 56.01 54.84 2feb n LEU 55 Cb 0.17 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.02 2feb n LEU 55 CO 0.73 0.00 -1.37 -1.22 -1.11 0.00 0.00 177.39 174.42 2feb n TYR 56 N -1.01 0.00 -2.79 1.96 4.02 -1.15 -4.98 117.16 113.21 2feb n TYR 56 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.54 2feb n TYR 56 Cb 0.00 -0.94 -0.07 0.00 -0.02 0.00 0.00 39.34 38.32 2feb n TYR 56 CO 0.00 0.00 0.00 1.52 -1.01 0.00 0.00 176.86 177.37 2feb s TYR 57 N -2.48 3.50 -0.36 -0.72 1.13 -1.26 -4.94 117.35 112.22 2feb s TYR 57 Ca -0.35 1.70 -0.31 0.00 -1.41 0.00 0.00 57.07 56.70 2feb s TYR 57 Cb 0.12 -2.89 -0.09 0.00 -1.10 0.00 0.00 41.96 38.00 2feb s TYR 57 CO 0.49 0.04 2.27 -0.35 -2.51 0.00 0.00 175.55 175.49 2feb n PRO 58 N -0.03 1.35 -1.43 -3.49 -0.04 -1.26 -4.72 135.00 125.37 2feb n PRO 58 Ca 0.04 0.31 -0.27 0.00 -0.04 0.00 0.00 63.50 63.54 2feb n PRO 58 Cb 0.52 -2.88 -0.19 0.00 -0.04 0.00 0.00 33.50 30.91 2feb n PRO 58 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2feb n ASN 59 N 11.68 -0.83 0.02 3.54 5.03 -1.26 -4.78 115.26 128.66 2feb n ASN 59 Ca 0.38 -0.28 -0.01 0.00 0.87 0.00 0.00 54.58 55.53 2feb n ASN 59 Cb 0.36 -0.64 -0.00 0.00 -1.02 0.00 0.00 39.78 38.48 2feb n ASN 59 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2feb h ALA 60 N 10.85 -0.38 0.00 5.41 0.00 -2.02 -3.48 119.26 129.63 2feb h ALA 60 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2feb h ALA 60 Cb 1.14 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2feb h ALA 60 CO 1.48 -0.38 0.00 0.41 0.00 0.00 0.00 179.25 180.76 2feb n GLY 61 N 0.86 0.00 3.69 0.00 0.00 -1.26 -5.13 105.19 103.35 2feb n GLY 61 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2feb n GLY 61 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2feb s LEU 62 N 0.00 4.39 -1.43 0.99 1.43 -1.26 -4.87 118.68 117.93 2feb s LEU 62 Ca 0.00 2.74 -0.15 0.00 -1.03 0.00 0.00 54.13 55.69 2feb s LEU 62 Cb 0.00 -3.57 0.04 0.00 0.03 0.00 0.00 46.19 42.69 2feb s LEU 62 CO 0.00 -0.98 2.17 0.35 0.23 0.00 0.00 176.35 178.12 2feb n THR 63 N 4.63 3.47 0.00 5.49 -2.24 -1.26 -4.85 114.28 119.53 2feb n THR 63 Ca 0.17 -3.10 0.00 0.00 -2.27 0.00 0.00 64.05 58.85 2feb n THR 63 Cb 0.38 -2.58 0.00 0.00 -2.10 0.00 0.00 70.33 66.03 2feb n THR 63 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2feb n ARG 64 N 6.36 0.00 -0.26 -0.78 3.00 -1.26 -0.15 116.66 123.57 2feb n ARG 64 Ca 0.52 0.00 0.02 0.00 -0.01 0.00 0.00 57.85 58.37 2feb n ARG 64 Cb 0.40 0.00 0.03 0.00 0.00 0.00 0.00 32.46 32.88 2feb n ARG 64 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 2feb n ASN 65 N 2.44 0.60 -4.59 0.55 0.23 -1.26 -1.94 115.26 111.28 2feb n ASN 65 Ca 0.00 -1.96 -0.42 0.00 -0.53 0.00 0.00 54.58 51.67 2feb n ASN 65 Cb 0.00 -0.18 -0.03 0.00 -2.08 0.00 0.00 39.78 37.49 2feb n ASN 65 CO 0.00 0.00 0.00 -0.31 -0.93 0.00 0.00 177.26 176.02 2feb s TYR 66 N -0.61 1.22 -0.24 -2.53 1.51 0.78 -4.20 117.35 113.29 2feb s TYR 66 Ca 0.06 0.69 -0.27 0.00 -1.01 0.00 0.00 57.07 56.53 2feb s TYR 66 Cb 0.05 -3.90 -0.12 0.00 -0.11 0.00 0.00 41.96 37.88 2feb s TYR 66 CO 0.01 -3.75 0.89 0.00 -1.11 0.00 0.00 175.55 171.59 2feb n ARG 68 N 2.09 0.57 -3.81 0.00 1.74 -1.26 -4.58 116.66 111.41 2feb n ARG 68 Ca 0.17 -1.19 -0.13 0.00 -0.77 0.00 0.00 57.85 55.94 2feb n ARG 68 Cb -0.02 1.54 -0.13 0.00 -1.02 0.00 0.00 32.46 32.83 2feb n ARG 68 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2feb s ASN 69 N -2.48 -0.11 0.44 0.55 2.20 -1.26 -2.89 114.94 111.39 2feb s ASN 69 Ca 0.13 0.24 0.11 0.00 -0.94 0.00 0.00 52.86 52.40 2feb s ASN 69 Cb -0.02 0.21 0.98 0.00 -2.00 0.00 0.00 41.25 40.41 2feb s ASN 69 CO 0.06 -0.07 2.04 1.55 -2.94 0.00 0.00 177.10 177.73 2feb h PRO 70 N 6.34 0.22 0.00 3.55 0.13 -1.94 -3.43 132.00 136.86 2feb h PRO 70 Ca -0.30 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2feb h PRO 70 Cb 1.18 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2feb h PRO 70 CO 0.44 0.23 0.00 -0.25 -0.23 0.00 0.00 178.00 178.19 2feb n ASP 71 N -4.42 0.00 -3.33 1.44 8.00 -1.26 -5.13 116.55 111.85 2feb n ASP 71 Ca -0.01 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.49 2feb n ASP 71 Cb 0.15 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.21 2feb n ASP 71 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2feb s ALA 72 N -2.71 -1.89 -0.45 2.24 0.00 -1.26 -4.85 121.76 112.84 2feb s ALA 72 Ca 0.00 1.73 0.06 0.00 0.00 0.00 0.00 51.96 53.75 2feb s ALA 72 Cb 0.00 -1.92 0.19 0.00 0.00 0.00 0.00 23.12 21.39 2feb s ALA 72 CO 0.00 -1.19 0.72 -2.00 0.00 0.00 0.00 175.76 173.29 2feb s GLU 73 N 2.78 0.86 0.00 0.00 2.12 -1.26 -5.09 118.70 118.12 2feb s GLU 73 Ca 0.12 -0.58 0.00 0.00 0.36 0.00 0.00 54.97 54.87 2feb s GLU 73 Cb -0.14 0.03 0.00 0.00 0.26 0.00 0.00 34.13 34.28 2feb s GLU 73 CO -0.19 -1.15 0.00 0.44 -0.54 0.00 0.00 175.26 173.82 2feb n ILE 74 N 3.68 0.00 -2.25 -3.70 -5.35 -1.26 -4.21 119.36 106.28 2feb n ILE 74 Ca 0.14 0.00 -0.42 0.00 -0.27 0.00 0.00 62.75 62.19 2feb n ILE 74 Cb 0.57 0.00 -0.03 0.00 -1.74 0.00 0.00 39.64 38.44 2feb n ILE 74 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 2feb s ARG 75 N 0.00 4.32 0.49 6.28 0.52 -1.26 0.34 118.95 129.63 2feb s ARG 75 Ca 0.00 1.95 -0.07 0.00 -0.52 0.00 0.00 55.73 57.09 2feb s ARG 75 Cb 0.00 -3.45 0.11 0.00 0.52 0.00 0.00 34.95 32.14 2feb s ARG 75 CO 0.00 -0.48 0.26 -0.35 0.02 0.00 0.00 175.30 174.74 2feb n PRO 76 N 4.74 -1.86 -3.42 3.54 -0.04 -1.26 -4.87 135.00 131.84 2feb n PRO 76 Ca 0.12 -0.43 -0.16 0.00 -0.04 0.00 0.00 63.50 62.99 2feb n PRO 76 Cb 0.44 -0.66 -0.10 0.00 -0.04 0.00 0.00 33.50 33.14 2feb n PRO 76 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 2feb s TRP 77 N -1.27 -0.49 0.34 0.54 1.48 -1.14 -4.27 118.94 114.13 2feb s TRP 77 Ca 0.20 0.17 0.07 0.00 -1.06 0.00 0.00 56.10 55.48 2feb s TRP 77 Cb -0.03 -0.32 -0.02 0.00 -1.16 0.00 0.00 33.47 31.93 2feb s TRP 77 CO 0.17 -0.78 0.32 0.00 -4.06 0.00 0.00 176.95 172.59 2feb n TYR 79 N -0.64 0.00 -3.99 0.00 4.01 -1.17 0.88 117.16 116.25 2feb n TYR 79 Ca 0.07 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.68 2feb n TYR 79 Cb 0.62 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.63 2feb n TYR 79 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2feb s THR 80 N 2.30 0.00 -0.16 -0.72 -4.23 -1.23 -3.52 115.64 108.08 2feb s THR 80 Ca 0.00 -1.38 0.16 0.00 -1.18 0.00 0.00 61.69 59.30 2feb s THR 80 Cb 0.00 -2.74 -0.00 0.00 1.34 0.00 0.00 72.50 71.09 2feb s THR 80 CO 0.00 0.00 1.19 -0.03 -0.54 0.00 0.00 174.62 175.24 2feb h MET 81 N 2.06 0.00 -6.04 3.99 4.05 -1.91 -3.38 114.93 113.69 2feb h MET 81 Ca -0.30 0.00 -0.58 0.00 -0.28 0.00 0.00 59.70 58.54 2feb h MET 81 Cb 1.24 0.00 -0.07 0.00 -0.80 0.00 0.00 31.60 31.97 2feb h MET 81 CO 0.39 0.37 0.70 -0.51 0.23 0.00 0.00 176.91 178.09 2feb s ASP 82 N -6.12 6.95 -0.49 1.39 1.01 -1.26 -4.93 116.67 113.22 2feb s ASP 82 Ca 0.01 1.15 -0.04 0.00 0.71 0.00 0.00 52.55 54.38 2feb s ASP 82 Cb 0.08 -2.51 -0.07 0.00 1.01 0.00 0.00 42.92 41.43 2feb s ASP 82 CO 0.77 -0.69 1.95 -0.81 0.21 0.00 0.00 175.17 176.60 2feb n PRO 83 N 6.38 1.46 -0.96 8.23 -0.04 -1.26 -3.18 135.00 145.63 2feb n PRO 83 Ca 0.10 -1.00 -0.06 0.00 -0.04 0.00 0.00 63.50 62.49 2feb n PRO 83 Cb 0.47 -2.15 -0.06 0.00 -0.04 0.00 0.00 33.50 31.72 2feb n PRO 83 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2feb n SER 84 N 3.77 -0.91 0.04 3.54 2.88 -1.26 -5.01 113.62 116.67 2feb n SER 84 Ca 0.31 -1.88 0.00 0.00 -1.33 0.00 0.00 58.87 55.97 2feb n SER 84 Cb 0.23 0.27 0.00 0.00 -0.75 0.00 0.00 64.21 63.96 2feb n SER 84 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2feb n VAL 85 N 0.00 0.29 0.00 2.46 0.31 -1.19 -5.02 118.33 115.18 2feb n VAL 85 Ca -0.26 0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 2feb n VAL 85 Cb 0.67 -0.78 0.00 0.00 -0.91 0.00 0.00 33.84 32.83 2feb n VAL 85 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2feb n ARG 86 N -2.93 0.00 -3.63 5.55 0.00 -1.26 -4.90 116.66 109.49 2feb n ARG 86 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.85 57.74 2feb n ARG 86 Cb 0.00 -0.47 -0.07 0.00 0.00 0.00 0.00 32.46 31.92 2feb n ARG 86 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.63 177.17 2feb s TRP 87 N -1.02 -0.62 0.06 -0.14 -0.11 -1.26 -4.45 118.94 111.40 2feb s TRP 87 Ca 0.00 1.52 -0.26 0.00 1.22 0.00 0.00 56.10 58.58 2feb s TRP 87 Cb 0.00 0.32 0.08 0.00 -1.50 0.00 0.00 33.47 32.37 2feb s TRP 87 CO 0.00 -0.30 0.69 -2.00 -4.62 0.00 0.00 176.95 170.72 2feb s GLU 88 N 0.31 1.11 0.36 5.86 2.56 0.25 -4.90 118.70 124.25 2feb s GLU 88 Ca 0.02 -0.23 -0.05 0.00 0.00 0.00 0.00 54.97 54.71 2feb s GLU 88 Cb -0.05 0.52 -0.05 0.00 2.00 0.00 0.00 34.13 36.55 2feb s GLU 88 CO -0.03 -0.45 0.63 0.71 -0.56 0.00 0.00 175.26 175.56 2feb s TYR 89 N -2.89 3.50 0.14 5.30 1.51 -1.26 -2.60 117.35 121.06 2feb s TYR 89 Ca -0.01 0.67 -0.27 0.00 -1.01 0.00 0.00 57.07 56.45 2feb s TYR 89 Cb -0.01 -2.15 -0.07 0.00 -0.11 0.00 0.00 41.96 39.62 2feb s TYR 89 CO -0.06 0.03 0.83 0.00 -1.11 0.00 0.00 175.55 175.24 2feb n ASN 91 N 2.05 1.61 -3.49 0.00 6.94 -1.26 -4.54 115.26 116.58 2feb n ASN 91 Ca -0.03 -1.51 -0.04 0.00 -0.02 0.00 0.00 54.58 52.98 2feb n ASN 91 Cb 0.49 -1.61 -0.06 0.00 -2.36 0.00 0.00 39.78 36.24 2feb n ASN 91 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2feb s LEU 92 N 14.27 -0.95 0.10 -4.53 1.02 -1.22 -4.65 118.68 122.72 2feb s LEU 92 Ca 0.94 0.99 0.02 0.00 0.02 0.00 0.00 54.13 56.10 2feb s LEU 92 Cb -0.16 1.76 -0.04 0.00 0.02 0.00 0.00 46.19 47.77 2feb s LEU 92 CO 0.11 -0.25 -0.07 0.42 0.02 0.00 0.00 176.35 176.58 2feb s THR 93 N 2.74 0.72 -0.17 5.49 -4.23 0.35 -4.56 115.64 115.99 2feb s THR 93 Ca 0.05 -1.89 -0.29 0.00 -1.18 0.00 0.00 61.69 58.38 2feb s THR 93 Cb -0.13 -1.63 -0.05 0.00 1.34 0.00 0.00 72.50 72.03 2feb s THR 93 CO -0.17 -0.83 2.04 -0.13 -0.54 0.00 0.00 174.62 174.99 2feb s ARG 94 N -3.67 3.46 0.45 3.99 0.52 -1.26 0.39 118.95 122.83 2feb s ARG 94 Ca 0.11 2.05 -0.25 0.00 -0.52 0.00 0.00 55.73 57.12 2feb s ARG 94 Cb 0.04 -4.26 -0.08 0.00 0.52 0.00 0.00 34.95 31.17 2feb s ARG 94 CO -0.04 -1.72 1.31 0.00 0.02 0.00 0.00 175.30 174.87 2feb n PRO 96 N -0.26 2.98 -3.47 0.00 -0.04 -1.26 -4.80 135.00 128.16 2feb n PRO 96 Ca 0.06 -1.79 -0.11 0.00 -0.04 0.00 0.00 63.50 61.62 2feb n PRO 96 Cb 0.44 -2.56 -0.03 0.00 -0.04 0.00 0.00 33.50 31.31 2feb n PRO 96 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2feb s VAL 97 N 2.29 0.00 -0.30 0.52 0.11 -1.26 -5.16 120.40 116.60 2feb s VAL 97 Ca 0.61 0.00 -0.18 0.00 -2.93 0.00 0.00 61.98 59.48 2feb s VAL 97 Cb 0.18 -1.00 0.19 0.00 -1.53 0.00 0.00 36.38 34.22 2feb s VAL 97 CO -0.04 0.00 1.21 0.28 -3.33 0.00 0.00 175.10 173.22 2feb s THR 98 N -3.09 -0.16 0.00 5.04 -1.32 -1.26 -5.11 115.64 109.73 2feb s THR 98 Ca 0.01 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.49 2feb s THR 98 Cb -0.01 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.98 2feb s THR 98 CO -0.08 0.00 0.00 -0.62 -2.21 0.00 0.00 174.62 171.71 2feb n GLU 99 N 4.76 0.00 -2.77 7.08 -0.58 -1.26 -5.17 120.64 122.70 2feb n GLU 99 Ca -0.07 0.00 -0.00 0.00 -0.42 0.00 0.00 57.16 56.67 2feb n GLU 99 Cb 0.55 0.00 0.01 0.00 -0.57 0.00 0.00 31.44 31.43 2feb n GLU 99 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2feb n SER 100 N -1.70 -0.72 -1.46 1.62 3.41 -1.26 -5.17 113.62 108.35 2feb n SER 100 Ca 0.00 -1.28 0.19 0.00 -0.26 0.00 0.00 58.87 57.52 2feb n SER 100 Cb 0.00 1.15 -0.06 0.00 -0.26 0.00 0.00 64.21 65.04 2feb n SER 100 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2feb n SER 101 N -0.77 -8.72 0.00 4.04 7.64 -1.26 -5.25 113.62 109.30 2feb n SER 101 Ca 0.01 0.75 0.00 0.00 1.01 0.00 0.00 58.87 60.64 2feb n SER 101 Cb 0.29 -4.53 0.00 0.00 -1.01 0.00 0.00 64.21 58.95 2feb n SER 101 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55