#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 -0.07 9.51 1.02 -1.26 -4.71 120.64 125.13 2feb n GLU 2 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2feb n GLU 2 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2feb n GLU 2 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2feb n GLY 3 N 0.00 2.07 1.54 0.62 0.00 -1.26 -4.66 105.19 103.49 2feb n GLY 3 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2feb n GLY 3 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2feb n ARG 4 N 0.00 0.00 -3.07 1.61 1.74 -1.26 -5.15 116.66 110.53 2feb n ARG 4 Ca 0.00 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.96 2feb n ARG 4 Cb 0.00 -0.09 -0.03 0.00 -1.02 0.00 0.00 32.46 31.32 2feb n ARG 4 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 2feb n HIS 5 N -2.87 0.23 -1.57 -1.55 1.44 -1.26 -5.03 115.22 104.62 2feb n HIS 5 Ca 0.00 -1.09 -0.13 0.00 -2.01 0.00 0.00 57.72 54.48 2feb n HIS 5 Cb 0.00 -0.06 -0.09 0.00 0.12 0.00 0.00 29.99 29.97 2feb n HIS 5 CO 0.00 0.00 0.00 -0.12 -2.81 0.00 0.00 176.34 173.41 2feb n MET 6 N -0.45 0.41 -3.80 -1.40 0.00 -1.26 -4.81 117.12 105.81 2feb n MET 6 Ca -0.05 -1.12 -0.28 0.00 -0.00 0.00 0.00 57.70 56.25 2feb n MET 6 Cb 0.27 -3.78 -0.12 0.00 0.00 0.00 0.00 33.22 29.59 2feb n MET 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2feb s ALA 7 N 15.72 3.34 1.00 -5.12 0.00 -1.26 -5.11 121.76 130.33 2feb s ALA 7 Ca 0.90 -3.56 0.00 0.00 0.00 0.00 0.00 51.96 49.30 2feb s ALA 7 Cb -0.11 -2.06 0.00 0.00 0.00 0.00 0.00 23.12 20.96 2feb s ALA 7 CO 0.12 -2.07 0.00 -0.35 0.00 0.00 0.00 175.76 173.45 2feb n PRO 8 N 2.16 -0.80 0.00 0.00 -0.04 -1.26 -3.53 135.00 131.53 2feb n PRO 8 Ca 0.21 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 2feb n PRO 8 Cb 0.37 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.83 2feb n PRO 8 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2feb n THR 9 N -2.25 0.00 -4.39 0.52 -1.04 -1.26 -4.74 114.28 101.12 2feb n THR 9 Ca 0.00 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.77 2feb n THR 9 Cb 0.00 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 68.42 2feb n THR 9 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2feb s GLU 10 N 0.00 1.98 0.00 -2.82 8.01 -1.26 -4.39 118.70 120.23 2feb s GLU 10 Ca 0.00 -1.68 0.00 0.00 0.01 0.00 0.00 54.97 53.30 2feb s GLU 10 Cb 0.00 -1.92 0.00 0.00 -4.31 0.00 0.00 34.13 27.90 2feb s GLU 10 CO 0.00 0.27 0.00 0.09 0.01 0.00 0.00 175.26 175.63 2feb n ASN 11 N -0.81 0.00 -4.93 -0.19 3.02 -1.26 -4.73 115.26 106.35 2feb n ASN 11 Ca -0.05 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.25 2feb n ASN 11 Cb 0.61 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.80 2feb n ASN 11 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2feb s SER 12 N -2.80 5.75 0.00 6.41 0.01 -1.23 -3.49 113.70 118.35 2feb s SER 12 Ca 0.00 0.52 0.00 0.00 1.31 0.00 0.00 55.95 57.78 2feb s SER 12 Cb 0.00 -1.65 0.00 0.00 0.21 0.00 0.00 66.02 64.58 2feb s SER 12 CO 0.00 -0.86 0.00 0.35 0.41 0.00 0.00 173.24 173.14 2feb n THR 13 N -2.32 0.00 -0.29 1.44 -2.24 -1.26 -4.05 114.28 105.55 2feb n THR 13 Ca 0.03 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.79 2feb n THR 13 Cb 0.57 0.00 0.16 0.00 -2.10 0.00 0.00 70.33 68.96 2feb n THR 13 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2feb h GLY 14 N 0.00 1.24 -1.95 3.38 0.00 -1.76 -3.44 103.07 100.54 2feb h GLY 14 Ca 0.00 -0.51 -0.54 0.00 0.00 0.00 0.00 47.33 46.28 2feb h GLY 14 CO 0.00 0.49 0.07 1.55 0.00 0.00 0.00 176.54 178.65 2feb n VAL 15 N -4.37 2.02 -2.00 4.60 3.14 -1.23 -4.46 118.33 116.03 2feb n VAL 15 Ca 0.09 -0.28 -0.06 0.00 -2.96 0.00 0.00 64.34 61.13 2feb n VAL 15 Cb 0.06 -1.05 -0.06 0.00 -1.06 0.00 0.00 33.84 31.73 2feb n VAL 15 CO 0.00 0.00 0.00 1.67 -6.46 0.00 0.00 176.83 172.04 2feb n GLN 16 N -2.35 0.00 -3.61 1.45 0.00 -1.26 -5.04 117.38 106.58 2feb n GLN 16 Ca 0.12 -0.94 -0.16 0.00 -0.00 0.00 0.00 57.00 56.02 2feb n GLN 16 Cb 0.50 0.46 -0.07 0.00 0.00 0.00 0.00 30.24 31.14 2feb n GLN 16 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 2feb s ASP 17 N -0.94 -0.56 0.19 1.69 -1.08 -1.26 -5.05 116.67 109.66 2feb s ASP 17 Ca 0.00 0.73 0.05 0.00 -0.52 0.00 0.00 52.55 52.81 2feb s ASP 17 Cb 0.00 0.69 -0.04 0.00 -1.46 0.00 0.00 42.92 42.11 2feb s ASP 17 CO -0.00 -0.47 0.24 0.00 0.52 0.00 0.00 175.17 175.45 2feb s TYR 19 N -1.87 1.70 -0.02 0.00 -0.85 0.74 -4.27 117.35 112.78 2feb s TYR 19 Ca 0.33 -0.74 0.01 0.00 -0.52 0.00 0.00 57.07 56.15 2feb s TYR 19 Cb -0.10 -2.07 0.02 0.00 0.38 0.00 0.00 41.96 40.18 2feb s TYR 19 CO 0.26 -0.70 -0.02 1.03 -1.52 0.00 0.00 175.55 174.60 2feb s ARG 20 N -4.42 0.36 4.13 -3.49 0.52 -1.26 -3.92 118.95 110.88 2feb s ARG 20 Ca 0.47 -0.01 0.00 0.00 -0.52 0.00 0.00 55.73 55.67 2feb s ARG 20 Cb -0.04 -0.46 0.00 0.00 0.52 0.00 0.00 34.95 34.97 2feb s ARG 20 CO 0.29 -0.06 0.00 0.41 0.02 0.00 0.00 175.30 175.96 2feb n GLY 21 N 3.75 1.29 2.98 -3.53 0.00 -1.26 -3.65 105.19 104.77 2feb n GLY 21 Ca -0.22 0.50 -0.31 0.00 0.00 0.00 0.00 46.02 45.99 2feb n GLY 21 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2feb s ASP 22 N -4.00 4.57 -1.09 1.61 1.01 -1.26 -5.00 116.67 112.51 2feb s ASP 22 Ca 0.00 -2.42 -0.08 0.00 0.71 0.00 0.00 52.55 50.76 2feb s ASP 22 Cb 0.00 -1.59 -0.07 0.00 1.01 0.00 0.00 42.92 42.27 2feb s ASP 22 CO 0.00 -0.33 2.30 0.61 0.21 0.00 0.00 175.17 177.96 2feb n GLY 23 N 3.90 3.39 1.32 0.21 0.00 -1.21 -3.40 105.19 109.40 2feb n GLY 23 Ca 0.04 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 45.00 2feb n GLY 23 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2feb n GLN 24 N 4.35 0.00 -1.56 1.61 3.00 -1.26 -3.64 117.38 119.88 2feb n GLN 24 Ca 0.53 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 57.39 2feb n GLN 24 Cb 0.19 -0.13 -0.11 0.00 0.00 0.00 0.00 30.24 30.18 2feb n GLN 24 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 2feb n SER 25 N -2.16 1.32 -0.19 1.08 3.41 -1.22 -4.75 113.62 111.11 2feb n SER 25 Ca 0.00 -2.29 0.00 0.00 -0.26 0.00 0.00 58.87 56.32 2feb n SER 25 Cb 0.00 -1.70 0.00 0.00 -0.26 0.00 0.00 64.21 62.25 2feb n SER 25 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2feb n TYR 26 N 19.50 -0.88 -2.31 7.33 4.01 -1.26 -4.99 117.16 138.57 2feb n TYR 26 Ca 0.41 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 58.11 2feb n TYR 26 Cb 0.46 0.10 -0.03 0.00 -0.31 0.00 0.00 39.34 39.56 2feb n TYR 26 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2feb n ARG 27 N -0.38 -3.61 -2.69 -0.72 5.12 -1.26 -5.02 116.66 108.10 2feb n ARG 27 Ca 0.00 2.82 -0.04 0.00 -1.93 0.00 0.00 57.85 58.70 2feb n ARG 27 Cb 0.00 -4.10 0.03 0.00 -1.16 0.00 0.00 32.46 27.23 2feb n ARG 27 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2feb n GLY 28 N 1.32 -1.41 2.16 -0.13 0.00 -1.26 -4.89 105.19 100.98 2feb n GLY 28 Ca -0.30 1.06 -0.24 0.00 0.00 0.00 0.00 46.02 46.54 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 2.57 3.12 -0.10 2.61 -2.24 -1.26 -4.40 114.28 114.59 2feb n THR 29 Ca 0.12 -1.94 -0.21 0.00 -2.27 0.00 0.00 64.05 59.75 2feb n THR 29 Cb 0.63 -0.63 -0.11 0.00 -2.10 0.00 0.00 70.33 68.13 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 -0.98 1.86 -3.53 3.22 4.77 -1.26 -5.00 117.00 116.08 2feb n LEU 30 Ca 0.56 0.43 -0.20 0.00 -0.03 0.00 0.00 56.01 56.77 2feb n LEU 30 Cb 1.43 -0.96 0.08 0.00 -2.33 0.00 0.00 43.42 41.64 2feb n LEU 30 CO 0.59 0.23 0.15 -1.20 -1.33 0.00 0.00 177.39 175.84 2feb n SER 31 N -4.44 -3.78 0.00 -1.43 7.64 -1.26 -4.97 113.62 105.39 2feb n SER 31 Ca -0.31 -0.61 0.00 0.00 1.01 0.00 0.00 58.87 58.96 2feb n SER 31 Cb 0.66 -4.99 0.00 0.00 -1.01 0.00 0.00 64.21 58.87 2feb n SER 31 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2feb n THR 32 N -4.50 0.00 0.00 0.44 -1.04 -1.26 -4.57 114.28 103.34 2feb n THR 32 Ca -0.16 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 2feb n THR 32 Cb 0.62 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.13 2feb n THR 32 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2feb n THR 33 N 0.00 0.00 -1.19 12.58 -2.24 -1.02 -4.13 114.28 118.28 2feb n THR 33 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2feb n THR 33 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2feb n THR 33 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2feb n ILE 34 N 0.00 0.00 -2.01 2.28 0.13 -1.18 -1.25 119.36 117.33 2feb n ILE 34 Ca 0.00 0.00 -0.04 0.00 -1.10 0.00 0.00 62.75 61.61 2feb n ILE 34 Cb 0.00 1.46 -0.04 0.00 -0.84 0.00 0.00 39.64 40.22 2feb n ILE 34 CO 0.00 0.00 0.00 0.41 2.80 0.00 0.00 176.55 179.76 2feb n THR 35 N 0.00 0.00 0.00 9.51 -1.04 -1.26 -3.51 114.28 117.98 2feb n THR 35 Ca 0.00 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 2feb n THR 35 Cb 0.30 0.33 0.00 0.00 -1.82 0.00 0.00 70.33 69.14 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 0.01 2.26 3.70 3.41 0.00 -1.26 -5.05 105.19 108.25 2feb n GLY 36 Ca -0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.76 1.35 0.03 1.61 3.00 -1.26 -4.78 118.95 118.14 2feb s ARG 37 Ca 0.00 1.47 0.03 0.00 0.00 0.00 0.00 55.73 57.23 2feb s ARG 37 Cb 0.00 -1.77 -0.04 0.00 0.00 0.00 0.00 34.95 33.14 2feb s ARG 37 CO 0.00 -2.37 -0.03 0.95 0.00 0.00 0.00 175.30 173.85 2feb s THR 38 N -2.69 3.88 0.63 0.02 -4.23 -1.26 -2.44 115.64 109.55 2feb s THR 38 Ca 0.66 -0.81 0.27 0.00 -1.18 0.00 0.00 61.69 60.63 2feb s THR 38 Cb -0.22 -2.75 0.27 0.00 1.34 0.00 0.00 72.50 71.14 2feb s THR 38 CO 0.57 0.30 1.82 0.00 -0.54 0.00 0.00 174.62 176.77 2feb n GLN 40 N -2.81 -2.69 -1.69 0.00 1.13 -1.26 -3.27 117.38 106.80 2feb n GLN 40 Ca -0.02 1.99 -0.45 0.00 -1.94 0.00 0.00 57.00 56.58 2feb n GLN 40 Cb 0.42 -2.12 -0.04 0.00 0.11 0.00 0.00 30.24 28.61 2feb n GLN 40 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 2feb n SER 41 N 0.22 3.60 0.23 1.08 7.64 -1.25 -4.71 113.62 120.41 2feb n SER 41 Ca 0.00 1.03 0.12 0.00 1.01 0.00 0.00 58.87 61.03 2feb n SER 41 Cb 0.00 -1.48 0.64 0.00 -1.01 0.00 0.00 64.21 62.36 2feb n SER 41 CO 0.00 0.00 0.00 -0.50 -3.01 0.00 0.00 175.04 171.53 2feb h TRP 42 N 7.37 0.00 0.00 1.43 4.06 -1.85 0.34 115.95 127.30 2feb h TRP 42 Ca -0.46 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.48 2feb h TRP 42 Cb 1.24 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.39 2feb h TRP 42 CO 0.72 0.00 -1.88 0.45 -3.56 0.00 0.00 178.44 174.17 2feb n SER 43 N -2.44 0.13 -4.12 -3.49 2.88 -1.26 -4.61 113.62 100.71 2feb n SER 43 Ca -0.02 0.05 -0.42 0.00 -1.33 0.00 0.00 58.87 57.15 2feb n SER 43 Cb 0.23 1.72 -0.00 0.00 -0.75 0.00 0.00 64.21 65.41 2feb n SER 43 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2feb n SER 44 N -2.35 4.28 -4.49 -3.46 7.64 0.12 -4.92 113.62 110.44 2feb n SER 44 Ca -0.05 -2.87 -0.43 0.00 1.01 0.00 0.00 58.87 56.53 2feb n SER 44 Cb 0.60 -1.68 -0.05 0.00 -1.01 0.00 0.00 64.21 62.06 2feb n SER 44 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2feb s MET 45 N 3.78 3.25 0.11 1.43 1.00 -1.26 -4.68 119.30 122.93 2feb s MET 45 Ca 0.51 -0.51 0.00 0.00 0.00 0.00 0.00 55.69 55.69 2feb s MET 45 Cb 0.09 -4.08 0.00 0.00 0.00 0.00 0.00 34.83 30.84 2feb s MET 45 CO -0.00 -1.44 0.00 2.41 0.00 0.00 0.00 175.02 175.99 2feb n THR 46 N 5.99 0.00 0.10 2.05 -1.04 -1.26 -4.94 114.28 115.18 2feb n THR 46 Ca -0.01 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 61.96 2feb n THR 46 Cb 0.47 -0.07 0.15 0.00 -1.82 0.00 0.00 70.33 69.06 2feb n THR 46 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 2feb h PRO 47 N 0.00 0.17 -1.99 -2.82 0.13 -2.00 -3.44 132.00 122.05 2feb h PRO 47 Ca 0.00 -0.11 0.04 0.00 -0.87 0.00 0.00 66.00 65.06 2feb h PRO 47 Cb 0.00 0.01 -0.21 0.00 0.13 0.00 0.00 31.00 30.94 2feb h PRO 47 CO 0.00 0.70 -0.02 -3.38 -0.23 0.00 0.00 178.00 175.07 2feb s HIS 48 N -3.77 -1.15 0.39 1.56 -3.43 -1.26 -4.92 115.29 102.71 2feb s HIS 48 Ca -0.03 2.18 -0.26 0.00 -0.80 0.00 0.00 55.06 56.15 2feb s HIS 48 Cb 0.12 0.69 -0.11 0.00 -1.43 0.00 0.00 32.58 31.85 2feb s HIS 48 CO 0.78 -0.57 1.12 0.91 -2.00 0.00 0.00 174.74 174.99 2feb n TRP 49 N 4.67 1.61 -3.98 0.38 7.02 -1.26 -4.76 117.44 121.11 2feb n TRP 49 Ca -0.17 0.56 -0.21 0.00 -1.02 0.00 0.00 57.50 56.65 2feb n TRP 49 Cb 0.56 -2.30 -0.03 0.00 -2.42 0.00 0.00 31.31 27.11 2feb n TRP 49 CO 0.00 0.00 0.00 -1.01 -2.02 0.00 0.00 177.69 174.66 2feb s HIS 50 N -1.20 3.12 0.00 -5.99 3.76 -1.26 -5.06 115.29 108.66 2feb s HIS 50 Ca 0.61 -0.15 0.00 0.00 -0.15 0.00 0.00 55.06 55.37 2feb s HIS 50 Cb -0.57 -1.56 0.00 0.00 1.11 0.00 0.00 32.58 31.57 2feb s HIS 50 CO 0.58 0.39 0.00 2.89 -0.85 0.00 0.00 174.74 177.76 2feb n ARG 51 N -1.29 1.73 -0.81 1.40 1.85 -1.26 -4.91 116.66 113.36 2feb n ARG 51 Ca -0.06 0.00 -0.35 0.00 -1.00 0.00 0.00 57.85 56.44 2feb n ARG 51 Cb 0.58 0.00 0.11 0.00 -1.05 0.00 0.00 32.46 32.10 2feb n ARG 51 CO 0.00 0.00 0.00 -2.13 -0.01 0.00 0.00 177.63 175.49 2feb n ARG 52 N 0.00 -0.88 -3.70 2.89 3.00 -1.26 -5.00 116.66 111.71 2feb n ARG 52 Ca 0.00 -0.25 -0.10 0.00 -0.00 0.00 0.00 57.85 57.50 2feb n ARG 52 Cb 0.00 -1.43 -0.04 0.00 0.00 0.00 0.00 32.46 30.99 2feb n ARG 52 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.63 178.59 2feb s ILE 53 N -2.15 0.04 0.00 5.15 -4.36 -1.26 -4.88 121.20 113.74 2feb s ILE 53 Ca 0.48 -0.71 -0.09 0.00 -0.26 0.00 0.00 60.65 60.08 2feb s ILE 53 Cb -0.05 -1.43 -0.11 0.00 1.25 0.00 0.00 42.46 42.12 2feb s ILE 53 CO 0.67 -0.18 1.06 -0.81 0.24 0.00 0.00 174.94 175.92 2feb n PRO 54 N -0.30 0.00 0.00 0.37 -0.04 -1.26 -2.78 135.00 130.99 2feb n PRO 54 Ca -0.12 -0.58 0.00 0.00 -0.04 0.00 0.00 63.50 62.76 2feb n PRO 54 Cb 0.63 -2.02 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 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 5.88 0.00 -0.02 1.53 0.00 -1.26 -4.90 117.00 118.23 2feb n LEU 55 Ca 0.14 0.00 -0.17 0.00 0.00 0.00 0.00 56.01 55.98 2feb n LEU 55 Cb 0.13 0.20 -0.14 0.00 0.00 0.00 0.00 43.42 43.62 2feb n LEU 55 CO 0.65 -0.30 0.17 1.88 0.00 0.00 0.00 177.39 179.79 2feb h TYR 56 N 0.00 0.22 -3.69 1.96 0.05 -1.96 -3.47 116.97 110.09 2feb h TYR 56 Ca 0.00 -0.16 -0.49 0.00 0.05 0.00 0.00 58.73 58.12 2feb h TYR 56 Cb 0.00 -0.01 0.03 0.00 1.01 0.00 0.00 36.73 37.76 2feb h TYR 56 CO 0.00 1.17 0.15 1.52 -1.05 0.00 0.00 178.16 179.95 2feb s TYR 57 N -2.32 3.56 -0.32 4.88 -0.85 -1.26 -4.93 117.35 116.11 2feb s TYR 57 Ca -0.18 0.91 -0.03 0.00 -0.52 0.00 0.00 57.07 57.25 2feb s TYR 57 Cb -0.01 -2.38 -0.09 0.00 0.38 0.00 0.00 41.96 39.87 2feb s TYR 57 CO 0.74 -0.31 1.90 -0.35 -1.52 0.00 0.00 175.55 176.02 2feb n PRO 58 N -2.18 1.24 -3.18 -3.49 -0.04 -1.26 -4.68 135.00 121.41 2feb n PRO 58 Ca 0.02 -0.81 -0.21 0.00 -0.04 0.00 0.00 63.50 62.46 2feb n PRO 58 Cb 0.55 -2.00 0.02 0.00 -0.04 0.00 0.00 33.50 32.02 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 3.47 -5.51 0.00 3.54 5.03 -1.26 -4.91 115.26 115.61 2feb n ASN 59 Ca 0.27 0.08 0.00 0.00 0.87 0.00 0.00 54.58 55.79 2feb n ASN 59 Cb 0.28 -1.46 0.00 0.00 -1.02 0.00 0.00 39.78 37.57 2feb n ASN 59 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2feb n ALA 60 N 0.46 -0.36 0.00 5.41 0.00 -1.26 -4.92 120.51 119.84 2feb n ALA 60 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2feb n ALA 60 Cb 0.56 0.03 0.00 0.00 0.00 0.00 0.00 19.45 20.04 2feb n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2feb n GLY 61 N -0.89 0.00 3.68 0.00 0.00 -1.26 -5.13 105.19 101.59 2feb n GLY 61 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 4.37 -1.60 0.99 2.01 -1.26 -4.87 118.68 118.31 2feb s LEU 62 Ca 0.00 2.49 -0.10 0.00 0.01 0.00 0.00 54.13 56.53 2feb s LEU 62 Cb 0.00 -3.55 -0.08 0.00 0.01 0.00 0.00 46.19 42.57 2feb s LEU 62 CO 0.00 -0.93 2.90 0.35 1.01 0.00 0.00 176.35 179.68 2feb n THR 63 N 5.01 4.23 0.00 5.49 -2.24 -1.26 -4.84 114.28 120.66 2feb n THR 63 Ca 0.17 -2.58 0.00 0.00 -2.27 0.00 0.00 64.05 59.37 2feb n THR 63 Cb 0.41 -2.61 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 3.75 0.00 -2.73 -0.78 3.00 -1.26 -1.86 116.66 116.78 2feb n ARG 64 Ca 0.77 0.00 -0.05 0.00 -0.01 0.00 0.00 57.85 58.55 2feb n ARG 64 Cb 0.24 0.00 0.04 0.00 0.00 0.00 0.00 32.46 32.74 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 1.95 1.28 -4.49 0.55 6.94 -1.26 -3.00 115.26 117.22 2feb n ASN 65 Ca 0.00 -2.42 -0.43 0.00 -0.02 0.00 0.00 54.58 51.71 2feb n ASN 65 Cb 0.00 -0.42 -0.05 0.00 -2.36 0.00 0.00 39.78 36.95 2feb n ASN 65 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 2feb s TYR 66 N -3.17 2.95 -0.17 -2.53 1.51 -0.77 -4.18 117.35 110.99 2feb s TYR 66 Ca 0.26 -0.20 -0.42 0.00 -1.01 0.00 0.00 57.07 55.70 2feb s TYR 66 Cb 0.40 -3.72 -0.19 0.00 -0.11 0.00 0.00 41.96 38.34 2feb s TYR 66 CO -0.00 -1.12 1.34 0.00 -1.11 0.00 0.00 175.55 174.65 2feb n ARG 68 N 2.78 -2.93 -4.97 0.00 1.85 -1.26 -4.58 116.66 107.56 2feb n ARG 68 Ca 0.24 0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.79 2feb n ARG 68 Cb 0.06 0.00 -0.17 0.00 -1.05 0.00 0.00 32.46 31.30 2feb n ARG 68 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2feb s ASN 69 N 0.00 2.68 0.18 2.89 4.22 -1.26 -4.12 114.94 119.52 2feb s ASN 69 Ca 0.00 -0.48 -0.14 0.00 -2.14 0.00 0.00 52.86 50.10 2feb s ASN 69 Cb 0.00 -1.23 0.11 0.00 1.28 0.00 0.00 41.25 41.41 2feb s ASN 69 CO 0.00 0.11 1.80 1.55 -2.04 0.00 0.00 177.10 178.52 2feb h PRO 70 N 6.86 0.53 0.00 3.55 0.13 -1.95 -3.43 132.00 137.69 2feb h PRO 70 Ca -0.24 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2feb h PRO 70 Cb 1.22 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2feb h PRO 70 CO 0.48 0.35 0.00 -0.40 -0.23 0.00 0.00 178.00 178.20 2feb n ASP 71 N -4.84 0.00 -3.60 1.44 5.75 -1.26 -5.01 116.55 109.03 2feb n ASP 71 Ca 0.04 0.00 -0.07 0.00 -0.01 0.00 0.00 54.79 54.75 2feb n ASP 71 Cb 0.10 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.18 2feb n ASP 71 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2feb s ALA 72 N -3.88 -1.12 0.00 2.12 0.00 -1.26 -4.75 121.76 112.86 2feb s ALA 72 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.56 2feb s ALA 72 Cb 0.00 0.79 0.00 0.00 0.00 0.00 0.00 23.12 23.91 2feb s ALA 72 CO 0.00 -1.03 0.00 -1.91 0.00 0.00 0.00 175.76 172.82 2feb n GLU 73 N -0.48 0.00 0.05 0.00 2.13 -1.26 -5.05 120.64 116.03 2feb n GLU 73 Ca -0.05 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.77 2feb n GLU 73 Cb 0.59 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.30 2feb n GLU 73 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 2feb n ILE 74 N 0.00 0.00 -4.35 6.31 -5.35 -1.26 -5.07 119.36 109.65 2feb n ILE 74 Ca 0.00 0.00 -0.19 0.00 -0.27 0.00 0.00 62.75 62.29 2feb n ILE 74 Cb 0.00 0.00 -0.15 0.00 -1.74 0.00 0.00 39.64 37.75 2feb n ILE 74 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 2feb s ARG 75 N -2.00 0.81 0.45 6.28 3.52 -1.26 -3.28 118.95 123.47 2feb s ARG 75 Ca 0.00 -0.29 -0.20 0.00 -0.13 0.00 0.00 55.73 55.11 2feb s ARG 75 Cb 0.00 -0.77 -0.14 0.00 -1.56 0.00 0.00 34.95 32.47 2feb s ARG 75 CO 0.00 0.13 0.14 -0.35 -0.81 0.00 0.00 175.30 174.41 2feb n PRO 76 N 3.14 0.13 -3.57 5.12 -0.04 -1.24 -4.91 135.00 133.63 2feb n PRO 76 Ca -0.16 0.05 -0.29 0.00 -0.04 0.00 0.00 63.50 63.05 2feb n PRO 76 Cb 0.55 -1.14 -0.13 0.00 -0.04 0.00 0.00 33.50 32.74 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 -1.74 1.03 0.37 0.54 1.48 -1.26 -3.73 118.94 115.63 2feb s TRP 77 Ca 0.60 -1.64 0.01 0.00 -1.06 0.00 0.00 56.10 54.01 2feb s TRP 77 Cb -0.57 -1.22 -0.01 0.00 -1.16 0.00 0.00 33.47 30.51 2feb s TRP 77 CO 0.62 -0.83 0.05 0.00 -4.06 0.00 0.00 176.95 172.73 2feb n TYR 79 N -0.89 0.00 -3.81 0.00 4.01 -1.20 0.17 117.16 115.44 2feb n TYR 79 Ca -0.12 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.55 2feb n TYR 79 Cb 0.50 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.51 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 2.37 0.00 -0.28 -0.72 -4.23 -0.95 -4.12 115.64 107.72 2feb s THR 80 Ca 0.00 -0.89 0.02 0.00 -1.18 0.00 0.00 61.69 59.64 2feb s THR 80 Cb 0.00 -1.91 0.37 0.00 1.34 0.00 0.00 72.50 72.29 2feb s THR 80 CO 0.00 0.00 1.62 0.80 -0.54 0.00 0.00 174.62 176.50 2feb n MET 81 N -0.45 1.77 -4.41 3.99 1.56 -0.80 -4.58 117.12 114.19 2feb n MET 81 Ca -0.05 -1.78 -0.19 0.00 -0.27 0.00 0.00 57.70 55.41 2feb n MET 81 Cb 0.60 -1.70 -0.15 0.00 2.15 0.00 0.00 33.22 34.12 2feb n MET 81 CO 0.00 0.00 0.00 0.34 -0.73 0.00 0.00 175.97 175.58 2feb s ASP 82 N -0.31 1.18 -0.08 6.12 -1.08 -1.26 -4.92 116.67 116.32 2feb s ASP 82 Ca 0.34 -0.20 -0.03 0.00 -0.52 0.00 0.00 52.55 52.14 2feb s ASP 82 Cb 0.28 -0.13 -0.10 0.00 -1.46 0.00 0.00 42.92 41.52 2feb s ASP 82 CO 0.05 0.11 2.83 -0.81 0.52 0.00 0.00 175.17 177.87 2feb n PRO 83 N 2.77 1.68 -2.70 4.34 -0.04 -1.26 -3.93 135.00 135.87 2feb n PRO 83 Ca -0.14 -0.86 -0.07 0.00 -0.04 0.00 0.00 63.50 62.40 2feb n PRO 83 Cb 0.56 -1.64 0.12 0.00 -0.04 0.00 0.00 33.50 32.50 2feb n PRO 83 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2feb n SER 84 N 1.78 -1.86 0.00 3.54 7.64 -1.26 -5.02 113.62 118.44 2feb n SER 84 Ca 0.28 -2.42 0.00 0.00 1.01 0.00 0.00 58.87 57.74 2feb n SER 84 Cb 0.70 1.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.91 2feb n SER 84 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2feb n VAL 85 N -0.64 0.00 0.00 0.44 0.31 -1.25 -5.02 118.33 112.17 2feb n VAL 85 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 2feb n VAL 85 Cb 0.84 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.77 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 -2.40 0.00 -3.61 5.55 0.63 -1.26 -4.90 116.66 110.67 2feb n ARG 86 Ca 0.00 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 56.81 2feb n ARG 86 Cb 0.00 -0.59 -0.07 0.00 0.45 0.00 0.00 32.46 32.25 2feb n ARG 86 CO 0.00 0.00 0.00 -0.46 -2.51 0.00 0.00 177.63 174.66 2feb s TRP 87 N -0.99 -0.61 0.13 -0.14 -0.11 -1.26 -4.58 118.94 111.38 2feb s TRP 87 Ca 0.00 1.41 -0.24 0.00 1.22 0.00 0.00 56.10 58.49 2feb s TRP 87 Cb 0.00 0.34 0.08 0.00 -1.50 0.00 0.00 33.47 32.39 2feb s TRP 87 CO 0.00 -0.35 0.67 -2.00 -4.62 0.00 0.00 176.95 170.65 2feb s GLU 88 N -0.03 1.20 0.76 5.86 2.56 0.46 -4.89 118.70 124.61 2feb s GLU 88 Ca -0.00 -0.45 -0.02 0.00 0.00 0.00 0.00 54.97 54.49 2feb s GLU 88 Cb -0.04 0.54 0.14 0.00 2.00 0.00 0.00 34.13 36.78 2feb s GLU 88 CO -0.00 -0.53 1.04 0.71 -0.56 0.00 0.00 175.26 175.92 2feb s TYR 89 N -3.62 1.46 0.25 5.30 1.51 -1.26 -1.66 117.35 119.34 2feb s TYR 89 Ca 0.02 -0.25 0.11 0.00 -1.01 0.00 0.00 57.07 55.95 2feb s TYR 89 Cb -0.01 -3.12 -0.05 0.00 -0.11 0.00 0.00 41.96 38.67 2feb s TYR 89 CO -0.11 -1.87 -0.19 0.00 -1.11 0.00 0.00 175.55 172.27 2feb n ASN 91 N -0.38 1.35 -3.57 0.00 0.23 -0.38 -4.76 115.26 107.75 2feb n ASN 91 Ca -0.07 -1.29 -0.00 0.00 -0.53 0.00 0.00 54.58 52.68 2feb n ASN 91 Cb 0.59 -1.49 -0.04 0.00 -2.08 0.00 0.00 39.78 36.76 2feb n ASN 91 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 2feb s LEU 92 N 12.55 -1.06 0.08 -4.53 1.02 -1.15 -4.68 118.68 120.90 2feb s LEU 92 Ca 0.99 1.39 -0.04 0.00 0.02 0.00 0.00 54.13 56.49 2feb s LEU 92 Cb -0.25 2.18 -0.02 0.00 0.02 0.00 0.00 46.19 48.12 2feb s LEU 92 CO 0.17 -0.20 0.08 0.42 0.02 0.00 0.00 176.35 176.83 2feb s THR 93 N 2.82 0.17 -0.18 5.49 -4.23 -0.61 -4.65 115.64 114.46 2feb s THR 93 Ca -0.04 -1.56 -0.29 0.00 -1.18 0.00 0.00 61.69 58.63 2feb s THR 93 Cb -0.11 -1.52 -0.05 0.00 1.34 0.00 0.00 72.50 72.16 2feb s THR 93 CO -0.19 -0.78 2.08 -0.13 -0.54 0.00 0.00 174.62 175.06 2feb s ARG 94 N -3.91 3.41 0.06 3.99 1.81 -1.26 0.26 118.95 123.31 2feb s ARG 94 Ca 0.08 2.07 -0.18 0.00 -1.72 0.00 0.00 55.73 55.98 2feb s ARG 94 Cb 0.06 -4.29 -0.06 0.00 -0.45 0.00 0.00 34.95 30.21 2feb s ARG 94 CO -0.09 -1.78 0.53 0.00 -0.68 0.00 0.00 175.30 173.27 2feb s PRO 96 N -1.18 2.98 0.01 0.00 0.04 -1.26 -4.62 135.00 130.96 2feb s PRO 96 Ca 0.28 0.46 0.00 0.00 0.04 0.00 0.00 61.00 61.78 2feb s PRO 96 Cb -0.18 -4.26 0.00 0.00 0.04 0.00 0.00 34.50 30.10 2feb s PRO 96 CO 0.18 -2.33 0.00 1.33 0.04 0.00 0.00 177.00 176.21 2feb n VAL 97 N 6.96 0.00 -1.61 -0.36 0.24 -1.26 -5.06 118.33 117.24 2feb n VAL 97 Ca 0.15 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 62.02 2feb n VAL 97 Cb 0.50 -0.01 -0.03 0.00 -1.47 0.00 0.00 33.84 32.83 2feb n VAL 97 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2feb n THR 98 N -2.53 0.43 -3.63 3.34 -1.04 -1.26 -4.91 114.28 104.67 2feb n THR 98 Ca 0.00 -0.40 -0.08 0.00 -2.04 0.00 0.00 64.05 61.52 2feb n THR 98 Cb 0.00 -2.52 -0.07 0.00 -1.82 0.00 0.00 70.33 65.92 2feb n THR 98 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2feb s GLU 99 N 6.01 0.45 0.09 -2.82 2.02 -1.26 -5.11 118.70 118.08 2feb s GLU 99 Ca 0.99 0.47 0.00 0.00 0.02 0.00 0.00 54.97 56.45 2feb s GLU 99 Cb -0.35 0.22 0.00 0.00 0.10 0.00 0.00 34.13 34.10 2feb s GLU 99 CO 0.37 -0.07 0.00 0.45 0.02 0.00 0.00 175.26 176.03 2feb n SER 100 N 1.94 -8.98 -2.14 -0.19 2.88 -1.26 -4.99 113.62 100.87 2feb n SER 100 Ca -0.12 1.58 0.01 0.00 -1.33 0.00 0.00 58.87 59.01 2feb n SER 100 Cb 0.56 -4.96 0.04 0.00 -0.75 0.00 0.00 64.21 59.11 2feb n SER 100 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2feb n SER 101 N 1.77 1.54 0.00 -3.46 3.41 -1.26 -5.26 113.62 110.37 2feb n SER 101 Ca 0.00 -2.20 0.00 0.00 -0.26 0.00 0.00 58.87 56.41 2feb n SER 101 Cb 0.00 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.55 2feb n SER 101 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43