#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2feb s GLU 2 N 0.00 2.44 0.00 6.28 2.56 -1.26 -4.54 118.70 124.17 2feb s GLU 2 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 54.97 55.08 2feb s GLU 2 Cb 0.00 -4.84 0.00 0.00 2.00 0.00 0.00 34.13 31.29 2feb s GLU 2 CO 0.00 -3.34 0.00 0.41 -0.56 0.00 0.00 175.26 171.77 2feb n GLY 3 N 6.52 5.57 1.48 -1.50 0.00 -1.26 -4.83 105.19 111.17 2feb n GLY 3 Ca 0.36 -1.04 -0.11 0.00 0.00 0.00 0.00 46.02 45.23 2feb n GLY 3 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2feb n ARG 4 N 0.00 2.05 -2.07 1.61 0.00 -1.26 -5.03 116.66 111.95 2feb n ARG 4 Ca 0.00 -3.23 0.00 0.00 -0.00 0.00 0.00 57.85 54.62 2feb n ARG 4 Cb 0.00 -1.94 0.00 0.00 0.00 0.00 0.00 32.46 30.52 2feb n ARG 4 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 2feb n HIS 5 N -1.10 -4.62 -2.11 -0.14 -0.00 -1.26 -4.93 115.22 101.07 2feb n HIS 5 Ca 0.41 2.77 0.00 0.00 -0.00 0.00 0.00 57.72 60.90 2feb n HIS 5 Cb 1.14 -3.64 0.00 0.00 -0.00 0.00 0.00 29.99 27.48 2feb n HIS 5 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.34 175.01 2feb n MET 6 N 1.76 -5.10 -3.83 1.57 2.81 -1.26 -5.08 117.12 107.98 2feb n MET 6 Ca 0.00 3.68 -0.11 0.00 -1.81 0.00 0.00 57.70 59.46 2feb n MET 6 Cb 0.00 -4.23 -0.09 0.00 -0.71 0.00 0.00 33.22 28.19 2feb n MET 6 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2feb s ALA 7 N -0.52 -0.46 0.04 3.04 0.00 -1.26 -5.03 121.76 117.56 2feb s ALA 7 Ca 0.00 -0.08 -0.20 0.00 0.00 0.00 0.00 51.96 51.68 2feb s ALA 7 Cb 0.00 0.18 -0.14 0.00 0.00 0.00 0.00 23.12 23.16 2feb s ALA 7 CO 0.00 -0.29 1.34 -1.00 0.00 0.00 0.00 175.76 175.81 2feb h PRO 8 N 3.79 0.37 -0.15 0.00 0.13 -1.92 -3.42 132.00 130.79 2feb h PRO 8 Ca -0.31 -0.19 -0.25 0.00 -0.87 0.00 0.00 66.00 64.37 2feb h PRO 8 Cb 1.19 0.01 -0.16 0.00 0.13 0.00 0.00 31.00 32.16 2feb h PRO 8 CO 0.44 0.75 -0.52 2.41 -0.23 0.00 0.00 178.00 180.85 2feb n THR 9 N -4.54 -0.04 -3.65 1.56 -1.04 -1.26 -4.84 114.28 100.47 2feb n THR 9 Ca -0.06 -1.71 -0.03 0.00 -2.04 0.00 0.00 64.05 60.21 2feb n THR 9 Cb 0.37 1.29 -0.07 0.00 -1.82 0.00 0.00 70.33 70.10 2feb n THR 9 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2feb s GLU 10 N 0.34 0.12 0.00 -2.82 2.12 -1.26 -4.97 118.70 112.23 2feb s GLU 10 Ca 0.28 0.16 0.00 0.00 0.36 0.00 0.00 54.97 55.77 2feb s GLU 10 Cb 0.26 0.05 0.00 0.00 0.26 0.00 0.00 34.13 34.70 2feb s GLU 10 CO -0.16 -0.02 0.00 0.09 -0.54 0.00 0.00 175.26 174.64 2feb n ASN 11 N 2.04 0.00 -4.46 -1.70 3.02 -1.26 -4.57 115.26 108.32 2feb n ASN 11 Ca -0.12 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.17 2feb n ASN 11 Cb 0.57 0.00 -0.11 0.00 -0.61 0.00 0.00 39.78 39.63 2feb n ASN 11 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2feb s SER 12 N 0.00 3.62 -1.45 6.41 1.04 -1.26 -4.16 113.70 117.90 2feb s SER 12 Ca 0.00 -0.88 -0.07 0.00 0.48 0.00 0.00 55.95 55.48 2feb s SER 12 Cb 0.00 -0.34 0.03 0.00 0.10 0.00 0.00 66.02 65.81 2feb s SER 12 CO 0.00 0.09 0.60 0.35 0.98 0.00 0.00 173.24 175.26 2feb n THR 13 N -0.10 -1.69 0.14 2.02 -2.24 -1.26 -4.47 114.28 106.67 2feb n THR 13 Ca -0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 2feb n THR 13 Cb 0.57 -2.90 0.00 0.00 -2.10 0.00 0.00 70.33 65.91 2feb n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2feb n GLY 14 N -1.42 -1.29 3.76 3.38 0.00 -1.26 -4.62 105.19 103.74 2feb n GLY 14 Ca -0.07 0.23 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 2feb n GLY 14 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2feb s VAL 15 N -2.00 4.60 -0.09 1.61 -7.23 -1.26 -4.90 120.40 111.14 2feb s VAL 15 Ca 0.00 1.59 0.08 0.00 -1.81 0.00 0.00 61.98 61.84 2feb s VAL 15 Cb 0.00 -4.09 -0.11 0.00 0.56 0.00 0.00 36.38 32.74 2feb s VAL 15 CO 0.00 0.45 0.03 0.00 -0.31 0.00 0.00 175.10 175.26 2feb n GLN 16 N 2.22 2.49 -1.77 4.82 10.64 -1.26 -4.92 117.38 129.61 2feb n GLN 16 Ca -0.05 -0.00 -0.41 0.00 -1.83 0.00 0.00 57.00 54.71 2feb n GLN 16 Cb 0.50 -1.22 -0.00 0.00 -0.86 0.00 0.00 30.24 28.65 2feb n GLN 16 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 2feb n ASP 17 N -2.34 3.69 -4.84 2.61 9.92 -1.26 -4.81 116.55 119.51 2feb n ASP 17 Ca -0.14 1.22 -0.34 0.00 -0.53 0.00 0.00 54.79 55.00 2feb n ASP 17 Cb 0.78 -1.60 -0.06 0.00 -0.64 0.00 0.00 41.12 39.60 2feb n ASP 17 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2feb n TYR 19 N 1.35 -1.47 -3.81 0.00 0.18 0.83 -4.23 117.16 110.01 2feb n TYR 19 Ca -0.14 -2.26 -0.13 0.00 1.88 0.00 0.00 57.90 57.25 2feb n TYR 19 Cb 0.53 -0.51 -0.15 0.00 -0.38 0.00 0.00 39.34 38.83 2feb n TYR 19 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 2feb s ARG 20 N -4.50 0.02 1.82 -3.48 0.52 -1.26 -4.02 118.95 108.06 2feb s ARG 20 Ca 0.48 0.16 0.00 0.00 -0.52 0.00 0.00 55.73 55.85 2feb s ARG 20 Cb -0.04 -0.11 0.00 0.00 0.52 0.00 0.00 34.95 35.32 2feb s ARG 20 CO 0.30 -0.09 0.00 0.41 0.02 0.00 0.00 175.30 175.94 2feb n GLY 21 N 3.68 0.28 2.71 -3.53 0.00 -1.26 -3.71 105.19 103.36 2feb n GLY 21 Ca -0.21 0.57 -0.29 0.00 0.00 0.00 0.00 46.02 46.10 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 3.69 0.61 1.61 1.47 -1.26 -4.99 116.67 113.80 2feb s ASP 22 Ca 0.00 -1.38 0.27 0.00 1.18 0.00 0.00 52.55 52.62 2feb s ASP 22 Cb 0.00 -0.73 1.14 0.00 -0.34 0.00 0.00 42.92 42.99 2feb s ASP 22 CO 0.00 -0.39 1.55 1.23 0.68 0.00 0.00 175.17 178.24 2feb h GLY 23 N 8.17 0.00 -2.89 2.12 0.00 -0.97 -1.28 103.07 108.22 2feb h GLY 23 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.18 2feb h GLY 23 CO 0.43 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.58 2feb n GLN 24 N -3.37 0.95 -1.04 4.80 -0.00 -0.40 -4.17 117.38 114.15 2feb n GLN 24 Ca 0.16 0.00 -0.06 0.00 -0.00 0.00 0.00 57.00 57.09 2feb n GLN 24 Cb 1.13 -1.03 0.31 0.00 -0.00 0.00 0.00 30.24 30.65 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 1.37 4.88 -2.32 2.61 3.41 -0.48 -4.80 113.62 118.29 2feb n SER 25 Ca 0.00 -3.22 -0.09 0.00 -0.26 0.00 0.00 58.87 55.30 2feb n SER 25 Cb 0.47 -0.75 -0.01 0.00 -0.26 0.00 0.00 64.21 63.66 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 -0.14 -1.47 -4.54 7.33 4.01 -1.26 -4.91 117.16 116.17 2feb n TYR 26 Ca 0.42 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.88 2feb n TYR 26 Cb 1.41 -2.22 -0.10 0.00 -0.31 0.00 0.00 39.34 38.11 2feb n TYR 26 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 2feb s ARG 27 N -4.75 1.98 0.00 -0.72 3.52 -1.26 -4.91 118.95 112.81 2feb s ARG 27 Ca 0.00 -2.05 0.00 0.00 -0.13 0.00 0.00 55.73 53.55 2feb s ARG 27 Cb 0.00 -1.70 0.00 0.00 -1.56 0.00 0.00 34.95 31.69 2feb s ARG 27 CO 0.00 -0.04 0.00 0.41 -0.81 0.00 0.00 175.30 174.86 2feb n GLY 28 N -0.99 3.32 2.23 8.12 0.00 -1.26 -4.85 105.19 111.76 2feb n GLY 28 Ca -0.04 -0.59 -0.11 0.00 0.00 0.00 0.00 46.02 45.28 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 0.00 -0.33 -0.02 2.61 -2.24 -1.26 -4.79 114.28 108.25 2feb n THR 29 Ca 0.00 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.69 2feb n THR 29 Cb 0.00 -1.38 -0.14 0.00 -2.10 0.00 0.00 70.33 66.71 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 -2.39 0.87 -1.40 3.22 4.77 -1.26 -4.97 117.00 115.84 2feb n LEU 30 Ca -0.12 0.41 -0.15 0.00 -0.03 0.00 0.00 56.01 56.11 2feb n LEU 30 Cb 0.51 0.17 -0.04 0.00 -2.33 0.00 0.00 43.42 41.73 2feb n LEU 30 CO 0.16 0.39 -0.17 -0.24 -1.33 0.00 0.00 177.39 176.20 2feb n SER 31 N -3.04 -4.74 -4.60 -1.43 2.88 -1.26 -4.90 113.62 96.53 2feb n SER 31 Ca -0.17 0.22 -0.27 0.00 -1.33 0.00 0.00 58.87 57.31 2feb n SER 31 Cb 1.05 -3.71 -0.11 0.00 -0.75 0.00 0.00 64.21 60.70 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 -2.65 2.02 0.00 2.46 2.01 -1.26 -4.14 115.64 114.09 2feb s THR 32 Ca 0.00 -2.04 0.00 0.00 0.31 0.00 0.00 61.69 59.96 2feb s THR 32 Cb 0.00 -2.93 0.00 0.00 0.01 0.00 0.00 72.50 69.58 2feb s THR 32 CO 0.00 -0.04 0.00 1.07 -0.69 0.00 0.00 174.62 174.96 2feb n THR 33 N -0.93 0.00 0.00 -0.82 5.66 0.91 -4.21 114.28 114.89 2feb n THR 33 Ca -0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.95 2feb n THR 33 Cb 0.66 -0.80 0.00 0.00 -1.55 0.00 0.00 70.33 68.64 2feb n THR 33 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 175.07 171.64 2feb n ILE 34 N -1.86 0.00 0.04 1.09 2.08 -1.23 0.67 119.36 120.16 2feb n ILE 34 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 2feb n ILE 34 Cb 0.43 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.32 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 -1.43 0.00 -1.68 1.39 -1.04 -1.26 -4.44 114.28 105.82 2feb n THR 35 Ca 0.00 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.07 2feb n THR 35 Cb 0.00 -0.46 0.16 0.00 -1.82 0.00 0.00 70.33 68.21 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 1.24 4.21 2.97 3.41 0.00 -1.26 -5.04 105.19 110.72 2feb n GLY 36 Ca 0.00 -1.15 -0.09 0.00 0.00 0.00 0.00 46.02 44.78 2feb n GLY 36 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2feb s ARG 37 N -2.49 0.28 0.03 1.61 1.70 -1.26 -4.89 118.95 113.93 2feb s ARG 37 Ca 0.35 -0.53 0.00 0.00 -0.47 0.00 0.00 55.73 55.08 2feb s ARG 37 Cb 0.34 0.10 0.01 0.00 -0.57 0.00 0.00 34.95 34.83 2feb s ARG 37 CO -0.07 -0.05 0.04 0.25 -1.08 0.00 0.00 175.30 174.40 2feb n THR 38 N 1.76 0.00 -0.20 4.99 -2.24 -1.26 -0.06 114.28 117.27 2feb n THR 38 Ca -0.23 -0.07 0.10 0.00 -2.27 0.00 0.00 64.05 61.59 2feb n THR 38 Cb 0.56 -1.31 0.26 0.00 -2.10 0.00 0.00 70.33 67.73 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 1.35 -4.98 -2.04 0.00 1.13 -1.23 -2.71 117.38 108.89 2feb n GLN 40 Ca 0.20 3.58 -0.40 0.00 -1.94 0.00 0.00 57.00 58.45 2feb n GLN 40 Cb 0.57 -3.83 -0.03 0.00 0.11 0.00 0.00 30.24 27.06 2feb n GLN 40 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2feb s SER 41 N -0.81 5.44 -0.86 1.08 0.15 -1.26 -4.14 113.70 113.29 2feb s SER 41 Ca 0.00 0.55 -0.12 0.00 0.70 0.00 0.00 55.95 57.08 2feb s SER 41 Cb 0.00 -2.53 -0.26 0.00 -1.71 0.00 0.00 66.02 61.52 2feb s SER 41 CO 0.00 -2.21 2.10 0.79 1.20 0.00 0.00 173.24 175.12 2feb n TRP 42 N 12.11 0.29 0.00 3.44 7.02 -1.24 0.33 117.44 139.39 2feb n TRP 42 Ca 0.21 -0.01 0.00 0.00 -1.02 0.00 0.00 57.50 56.68 2feb n TRP 42 Cb 0.51 -1.04 0.00 0.00 -2.42 0.00 0.00 31.31 28.36 2feb n TRP 42 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2feb n SER 43 N 8.81 0.00 -4.67 -0.99 2.88 -1.26 -4.72 113.62 113.67 2feb n SER 43 Ca 0.56 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.67 2feb n SER 43 Cb 0.25 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.69 2feb n SER 43 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2feb s SER 44 N 0.00 7.11 -0.35 -3.46 1.04 0.15 -5.00 113.70 113.19 2feb s SER 44 Ca 0.00 1.44 0.02 0.00 0.48 0.00 0.00 55.95 57.88 2feb s SER 44 Cb 0.00 -2.54 0.11 0.00 0.10 0.00 0.00 66.02 63.68 2feb s SER 44 CO 0.00 -0.64 0.11 -0.04 0.98 0.00 0.00 173.24 173.65 2feb s MET 45 N 3.00 1.16 0.18 4.02 -1.94 -1.26 -4.45 119.30 120.01 2feb s MET 45 Ca 0.46 -1.61 0.00 0.00 -1.71 0.00 0.00 55.69 52.83 2feb s MET 45 Cb -0.16 -2.57 0.00 0.00 2.01 0.00 0.00 34.83 34.10 2feb s MET 45 CO 0.09 -1.00 0.00 0.25 -0.01 0.00 0.00 175.02 174.35 2feb n THR 46 N 4.33 0.00 0.09 2.05 -2.24 -1.26 -4.95 114.28 112.29 2feb n THR 46 Ca 0.02 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.72 2feb n THR 46 Cb 0.40 -0.11 -0.02 0.00 -2.10 0.00 0.00 70.33 68.51 2feb n THR 46 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2feb h PRO 47 N 0.00 0.13 -2.00 -0.78 0.13 -1.96 -3.46 132.00 124.06 2feb h PRO 47 Ca 0.00 -0.15 -0.04 0.00 -0.87 0.00 0.00 66.00 64.94 2feb h PRO 47 Cb 0.00 0.05 -0.21 0.00 0.13 0.00 0.00 31.00 30.97 2feb h PRO 47 CO 0.00 0.93 0.14 -3.38 -0.23 0.00 0.00 178.00 175.46 2feb s HIS 48 N -3.11 -0.78 0.73 1.56 -3.43 -1.26 -5.02 115.29 103.98 2feb s HIS 48 Ca -0.02 1.89 -0.16 0.00 -0.80 0.00 0.00 55.06 55.97 2feb s HIS 48 Cb 0.10 0.28 -0.03 0.00 -1.43 0.00 0.00 32.58 31.50 2feb s HIS 48 CO 0.82 -0.39 0.62 0.91 -2.00 0.00 0.00 174.74 174.70 2feb n TRP 49 N 2.60 -0.51 -3.30 0.38 7.02 -1.26 -4.68 117.44 117.69 2feb n TRP 49 Ca -0.14 0.36 0.00 0.00 -1.02 0.00 0.00 57.50 56.69 2feb n TRP 49 Cb 0.55 -1.95 0.00 0.00 -2.42 0.00 0.00 31.31 27.50 2feb n TRP 49 CO 0.00 0.00 0.00 1.58 -2.02 0.00 0.00 177.69 177.25 2feb n HIS 50 N -2.46 -1.56 -1.68 -5.99 -0.00 -1.26 -5.04 115.22 97.23 2feb n HIS 50 Ca 0.11 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.29 2feb n HIS 50 Cb 0.50 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.37 2feb n HIS 50 CO 0.00 0.00 0.00 2.89 0.46 0.00 0.00 176.34 179.69 2feb n ARG 51 N -0.52 1.17 -1.61 1.57 1.85 -1.26 -4.89 116.66 112.96 2feb n ARG 51 Ca 0.00 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.70 2feb n ARG 51 Cb 0.00 0.00 -0.10 0.00 -1.05 0.00 0.00 32.46 31.31 2feb n ARG 51 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 2feb s ARG 52 N -0.80 1.35 1.02 2.89 0.52 -1.26 -4.90 118.95 117.76 2feb s ARG 52 Ca 0.00 -0.16 -0.16 0.00 -0.52 0.00 0.00 55.73 54.88 2feb s ARG 52 Cb 0.00 -4.93 0.01 0.00 0.52 0.00 0.00 34.95 30.56 2feb s ARG 52 CO 0.00 -5.13 -0.05 0.44 0.02 0.00 0.00 175.30 170.58 2feb n ILE 53 N 8.93 0.00 -0.14 1.52 -5.35 -1.26 -4.56 119.36 118.49 2feb n ILE 53 Ca 0.43 -0.25 -0.10 0.00 -0.27 0.00 0.00 62.75 62.56 2feb n ILE 53 Cb 0.46 -0.48 -0.03 0.00 -1.74 0.00 0.00 39.64 37.85 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 -0.89 0.00 0.00 6.28 -0.04 -1.26 -2.96 135.00 136.13 2feb n PRO 54 Ca 0.03 -0.58 0.00 0.00 -0.04 0.00 0.00 63.50 62.91 2feb n PRO 54 Cb 0.58 -2.05 0.00 0.00 -0.04 0.00 0.00 33.50 31.99 2feb n PRO 54 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2feb n LEU 55 N 5.74 0.00 -0.07 1.53 4.77 -1.26 -4.90 117.00 122.80 2feb n LEU 55 Ca 0.10 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.89 2feb n LEU 55 Cb 0.09 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.06 2feb n LEU 55 CO 0.63 0.00 -1.12 -1.22 -1.33 0.00 0.00 177.39 174.35 2feb n TYR 56 N -1.25 0.52 -3.49 -1.77 4.02 -1.15 -4.95 117.16 109.08 2feb n TYR 56 Ca 0.00 0.11 -0.31 0.00 -0.01 0.00 0.00 57.90 57.69 2feb n TYR 56 Cb 0.00 -1.07 -0.05 0.00 -0.02 0.00 0.00 39.34 38.20 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 -2.54 3.45 -0.38 -0.72 1.13 -1.26 -4.99 117.35 112.05 2feb s TYR 57 Ca -0.29 0.71 -0.30 0.00 -1.41 0.00 0.00 57.07 55.78 2feb s TYR 57 Cb 0.08 -2.13 -0.09 0.00 -1.10 0.00 0.00 41.96 38.71 2feb s TYR 57 CO 0.68 0.31 2.29 -0.35 -2.51 0.00 0.00 175.55 175.96 2feb n PRO 58 N -0.24 1.29 -1.42 -3.49 -0.04 -1.26 -4.72 135.00 125.12 2feb n PRO 58 Ca -0.01 0.28 -0.27 0.00 -0.04 0.00 0.00 63.50 63.46 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 11.94 -0.80 0.09 3.54 5.03 -1.26 -4.71 115.26 129.08 2feb n ASN 59 Ca 0.38 -0.27 -0.13 0.00 0.87 0.00 0.00 54.58 55.43 2feb n ASN 59 Cb 0.36 -0.64 -0.13 0.00 -1.02 0.00 0.00 39.78 38.35 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 10.79 0.20 0.00 5.41 0.00 -2.00 -3.48 119.26 130.18 2feb h ALA 60 Ca 0.01 -0.92 0.00 0.00 0.00 0.00 0.00 54.91 54.00 2feb h ALA 60 Cb 1.13 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2feb h ALA 60 CO 1.47 1.08 0.00 0.41 0.00 0.00 0.00 179.25 182.21 2feb n GLY 61 N 1.48 0.68 3.68 0.00 0.00 -1.26 -5.05 105.19 104.72 2feb n GLY 61 Ca -0.06 -0.07 -0.44 0.00 0.00 0.00 0.00 46.02 45.45 2feb n GLY 61 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2feb n LEU 62 N 0.00 3.93 -3.31 0.99 4.77 -1.26 -4.85 117.00 117.27 2feb n LEU 62 Ca 0.00 0.95 -0.39 0.00 -0.03 0.00 0.00 56.01 56.54 2feb n LEU 62 Cb 0.00 -1.50 -0.03 0.00 -2.33 0.00 0.00 43.42 39.56 2feb n LEU 62 CO 0.00 0.12 3.41 0.35 -1.33 0.00 0.00 177.39 179.94 2feb n THR 63 N 5.07 4.32 -1.78 -5.08 -2.24 -1.26 -4.94 114.28 108.38 2feb n THR 63 Ca 0.20 -2.58 0.00 0.00 -2.27 0.00 0.00 64.05 59.40 2feb n THR 63 Cb 0.37 -2.62 0.00 0.00 -2.10 0.00 0.00 70.33 65.98 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 3.59 0.00 -1.63 -0.78 1.74 -1.26 -2.26 116.66 116.07 2feb n ARG 64 Ca 0.79 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 57.54 2feb n ARG 64 Cb 0.23 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.67 2feb n ARG 64 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2feb n ASN 65 N 2.30 7.04 -4.07 0.55 6.94 -1.26 -3.65 115.26 123.12 2feb n ASN 65 Ca 0.00 -3.52 -0.43 0.00 -0.02 0.00 0.00 54.58 50.61 2feb n ASN 65 Cb 0.00 -1.13 0.00 0.00 -2.36 0.00 0.00 39.78 36.29 2feb n ASN 65 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 2feb n TYR 66 N 0.08 3.57 0.00 -2.53 4.01 -0.96 -4.10 117.16 117.22 2feb n TYR 66 Ca 0.51 -2.98 0.00 0.00 -0.16 0.00 0.00 57.90 55.28 2feb n TYR 66 Cb 0.42 -1.97 0.00 0.00 -0.31 0.00 0.00 39.34 37.48 2feb n TYR 66 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2feb n ARG 68 N 0.85 0.00 -3.74 0.00 1.85 -1.26 -4.64 116.66 109.72 2feb n ARG 68 Ca 0.00 0.00 -0.13 0.00 -1.00 0.00 0.00 57.85 56.72 2feb n ARG 68 Cb 0.00 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.33 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 -0.42 -0.21 0.23 2.89 2.20 -1.26 -3.09 114.94 115.27 2feb s ASN 69 Ca 0.00 0.09 0.09 0.00 -0.94 0.00 0.00 52.86 52.10 2feb s ASN 69 Cb 0.00 0.33 0.21 0.00 -2.00 0.00 0.00 41.25 39.79 2feb s ASN 69 CO 0.00 -0.48 1.53 1.55 -2.94 0.00 0.00 177.10 176.75 2feb h PRO 70 N 3.71 0.01 0.00 3.55 0.13 -2.02 -3.46 132.00 133.92 2feb h PRO 70 Ca -0.30 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2feb h PRO 70 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2feb h PRO 70 CO 0.41 0.72 0.00 -3.47 -0.23 0.00 0.00 178.00 175.43 2feb n ASP 71 N -3.69 0.33 -3.76 1.44 2.03 -1.26 -5.14 116.55 106.49 2feb n ASP 71 Ca -0.01 0.00 -0.19 0.00 0.52 0.00 0.00 54.79 55.11 2feb n ASP 71 Cb 0.70 0.00 -0.17 0.00 -0.72 0.00 0.00 41.12 40.93 2feb n ASP 71 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2feb s ALA 72 N -2.35 0.33 -0.30 -1.67 0.00 -1.26 -5.01 121.76 111.50 2feb s ALA 72 Ca 0.00 0.14 -0.17 0.00 0.00 0.00 0.00 51.96 51.93 2feb s ALA 72 Cb 0.00 -0.47 0.18 0.00 0.00 0.00 0.00 23.12 22.83 2feb s ALA 72 CO 0.00 -0.26 1.13 -1.83 0.00 0.00 0.00 175.76 174.80 2feb s GLU 73 N 1.51 0.17 0.00 0.00 -1.05 -1.26 -5.09 118.70 112.98 2feb s GLU 73 Ca -0.03 0.42 0.00 0.00 -0.15 0.00 0.00 54.97 55.21 2feb s GLU 73 Cb -0.13 0.23 0.00 0.00 -0.44 0.00 0.00 34.13 33.79 2feb s GLU 73 CO -0.03 -0.06 0.00 0.44 0.95 0.00 0.00 175.26 176.57 2feb n ILE 74 N 4.59 0.00 -5.21 1.83 -5.35 -1.26 -4.13 119.36 109.83 2feb n ILE 74 Ca -0.09 0.00 -0.31 0.00 -0.27 0.00 0.00 62.75 62.07 2feb n ILE 74 Cb 0.54 0.00 -0.15 0.00 -1.74 0.00 0.00 39.64 38.29 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 0.00 2.21 0.77 6.28 3.52 -1.26 -0.67 118.95 129.80 2feb s ARG 75 Ca 0.00 -0.87 -0.20 0.00 -0.13 0.00 0.00 55.73 54.53 2feb s ARG 75 Cb 0.00 -2.12 -0.14 0.00 -1.56 0.00 0.00 34.95 31.13 2feb s ARG 75 CO 0.00 0.57 -1.11 -2.30 -0.81 0.00 0.00 175.30 171.65 2feb n PRO 76 N 2.42 0.00 -3.37 5.12 -0.01 -1.26 -4.83 135.00 133.07 2feb n PRO 76 Ca -0.16 0.00 0.02 0.00 -0.01 0.00 0.00 63.50 63.35 2feb n PRO 76 Cb 0.51 -0.83 -0.02 0.00 -0.01 0.00 0.00 33.50 33.15 2feb n PRO 76 CO 0.00 0.00 0.00 1.67 -0.01 0.00 0.00 175.50 177.16 2feb s TRP 77 N -1.65 -1.48 0.27 6.00 1.48 -1.18 -3.80 118.94 118.57 2feb s TRP 77 Ca 0.26 1.98 -0.00 0.00 -1.06 0.00 0.00 56.10 57.27 2feb s TRP 77 Cb 0.08 0.67 0.00 0.00 -1.16 0.00 0.00 33.47 33.06 2feb s TRP 77 CO 0.47 -0.78 0.35 0.00 -4.06 0.00 0.00 176.95 172.93 2feb n TYR 79 N -0.45 -0.59 -3.93 0.00 4.01 -1.10 -0.16 117.16 114.94 2feb n TYR 79 Ca 0.01 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.66 2feb n TYR 79 Cb 0.45 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.39 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 0.84 0.11 0.42 -0.72 -4.23 -1.23 -3.30 115.64 107.53 2feb s THR 80 Ca 0.00 -0.94 0.33 0.00 -1.18 0.00 0.00 61.69 59.90 2feb s THR 80 Cb 0.00 -0.61 0.35 0.00 1.34 0.00 0.00 72.50 73.58 2feb s THR 80 CO 0.00 -0.52 2.14 0.24 -0.54 0.00 0.00 174.62 175.94 2feb h MET 81 N 4.09 0.00 -6.99 3.99 2.86 -1.91 -3.43 114.93 113.54 2feb h MET 81 Ca -0.32 0.00 -0.50 0.00 -2.06 0.00 0.00 59.70 56.82 2feb h MET 81 Cb 1.19 0.00 0.06 0.00 0.06 0.00 0.00 31.60 32.91 2feb h MET 81 CO 0.45 0.06 0.48 -0.51 1.06 0.00 0.00 176.91 178.45 2feb s ASP 82 N -5.84 6.29 -0.41 1.22 1.01 -1.26 -4.94 116.67 112.75 2feb s ASP 82 Ca -0.03 2.28 -0.02 0.00 0.71 0.00 0.00 52.55 55.49 2feb s ASP 82 Cb 0.12 -2.60 0.23 0.00 1.01 0.00 0.00 42.92 41.68 2feb s ASP 82 CO 0.53 -0.83 2.15 -0.81 0.21 0.00 0.00 175.17 176.42 2feb n PRO 83 N -0.36 2.06 -2.68 8.23 -0.04 -1.26 -4.12 135.00 136.82 2feb n PRO 83 Ca 0.07 -2.01 -0.04 0.00 -0.04 0.00 0.00 63.50 61.48 2feb n PRO 83 Cb 0.48 -1.82 0.13 0.00 -0.04 0.00 0.00 33.50 32.24 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 0.22 -1.65 0.00 3.54 2.88 -1.26 -5.02 113.62 112.33 2feb n SER 84 Ca 0.39 -2.32 0.00 0.00 -1.33 0.00 0.00 58.87 55.61 2feb n SER 84 Cb 0.58 0.82 0.00 0.00 -0.75 0.00 0.00 64.21 64.86 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 -1.17 0.00 0.00 2.46 0.31 -1.26 -5.03 118.33 113.65 2feb n VAL 85 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 2feb n VAL 85 Cb 0.87 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.80 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 -2.19 0.00 -3.59 5.55 0.63 -1.26 -4.92 116.66 110.88 2feb n ARG 86 Ca 0.00 0.00 -0.13 0.00 -0.92 0.00 0.00 57.85 56.80 2feb n ARG 86 Cb 0.00 -0.82 -0.06 0.00 0.45 0.00 0.00 32.46 32.03 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 -1.29 -0.58 0.13 -0.14 -0.11 -1.26 -4.11 118.94 111.58 2feb s TRP 87 Ca 0.00 1.21 -0.24 0.00 1.22 0.00 0.00 56.10 58.29 2feb s TRP 87 Cb 0.00 0.37 0.07 0.00 -1.50 0.00 0.00 33.47 32.41 2feb s TRP 87 CO 0.00 -0.40 0.60 -1.21 -4.62 0.00 0.00 176.95 171.33 2feb s GLU 88 N -0.44 1.24 -0.51 5.86 0.41 0.77 -4.87 118.70 121.16 2feb s GLU 88 Ca -0.03 -0.39 -0.21 0.00 -0.41 0.00 0.00 54.97 53.94 2feb s GLU 88 Cb -0.03 0.57 0.05 0.00 -1.78 0.00 0.00 34.13 32.95 2feb s GLU 88 CO 0.02 -0.53 0.72 0.71 -0.49 0.00 0.00 175.26 175.69 2feb s TYR 89 N -3.43 2.98 0.09 1.61 1.51 -1.26 -3.01 117.35 115.84 2feb s TYR 89 Ca -0.00 -0.30 -0.12 0.00 -1.01 0.00 0.00 57.07 55.63 2feb s TYR 89 Cb -0.01 -3.67 -0.08 0.00 -0.11 0.00 0.00 41.96 38.10 2feb s TYR 89 CO -0.10 -1.10 0.23 0.00 -1.11 0.00 0.00 175.55 173.47 2feb n ASN 91 N 0.89 0.93 -3.69 0.00 0.23 0.21 -4.75 115.26 109.09 2feb n ASN 91 Ca 0.08 -2.29 -0.11 0.00 -0.53 0.00 0.00 54.58 51.73 2feb n ASN 91 Cb 0.11 -1.59 -0.11 0.00 -2.08 0.00 0.00 39.78 36.11 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 15.22 -0.16 0.10 -4.53 1.02 -1.22 -4.49 118.68 124.61 2feb s LEU 92 Ca 0.73 0.83 0.02 0.00 0.02 0.00 0.00 54.13 55.73 2feb s LEU 92 Cb -0.05 1.19 -0.04 0.00 0.02 0.00 0.00 46.19 47.30 2feb s LEU 92 CO 0.16 -0.20 -0.07 0.42 0.02 0.00 0.00 176.35 176.69 2feb s THR 93 N 1.75 0.69 -0.16 5.49 -4.23 0.45 -4.39 115.64 115.25 2feb s THR 93 Ca -0.07 -1.90 -0.29 0.00 -1.18 0.00 0.00 61.69 58.25 2feb s THR 93 Cb -0.10 -1.64 -0.05 0.00 1.34 0.00 0.00 72.50 72.04 2feb s THR 93 CO -0.12 -0.86 2.03 -0.13 -0.54 0.00 0.00 174.62 175.00 2feb s ARG 94 N -3.75 3.53 0.34 3.99 0.52 -1.26 0.29 118.95 122.60 2feb s ARG 94 Ca 0.11 2.09 -0.23 0.00 -0.52 0.00 0.00 55.73 57.18 2feb s ARG 94 Cb 0.05 -4.25 -0.10 0.00 0.52 0.00 0.00 34.95 31.17 2feb s ARG 94 CO -0.05 -1.65 0.91 0.00 0.02 0.00 0.00 175.30 174.54 2feb s PRO 96 N -2.45 3.37 0.83 0.00 0.04 -1.26 -4.99 135.00 130.55 2feb s PRO 96 Ca 0.53 1.35 -0.11 0.00 0.04 0.00 0.00 61.00 62.81 2feb s PRO 96 Cb -0.15 -4.17 0.09 0.00 0.04 0.00 0.00 34.50 30.31 2feb s PRO 96 CO 0.20 -1.81 1.09 0.14 0.04 0.00 0.00 177.00 176.66 2feb s VAL 97 N 6.66 2.98 -0.10 -0.36 -7.23 -1.26 -5.00 120.40 116.09 2feb s VAL 97 Ca 0.77 0.32 0.09 0.00 -1.81 0.00 0.00 61.98 61.34 2feb s VAL 97 Cb -0.21 -2.78 -0.12 0.00 0.56 0.00 0.00 36.38 33.82 2feb s VAL 97 CO 0.33 -0.42 0.02 0.41 -0.31 0.00 0.00 175.10 175.14 2feb n THR 98 N -3.72 0.71 -3.46 5.32 -1.04 -1.26 -5.02 114.28 105.80 2feb n THR 98 Ca 0.08 -0.42 -0.21 0.00 -2.04 0.00 0.00 64.05 61.45 2feb n THR 98 Cb 0.54 -0.74 0.07 0.00 -1.82 0.00 0.00 70.33 68.38 2feb n THR 98 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 2feb n GLU 99 N -2.41 -7.07 -2.26 -2.82 4.07 -1.26 -4.91 120.64 103.97 2feb n GLU 99 Ca -0.17 0.74 -0.01 0.00 -0.06 0.00 0.00 57.16 57.66 2feb n GLU 99 Cb 0.83 -5.53 0.05 0.00 -0.06 0.00 0.00 31.44 26.72 2feb n GLU 99 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 2feb n SER 100 N -2.53 1.78 -4.31 4.31 3.41 -1.26 -5.03 113.62 110.00 2feb n SER 100 Ca 0.01 -2.30 -0.45 0.00 -0.26 0.00 0.00 58.87 55.87 2feb n SER 100 Cb 0.56 -0.42 -0.06 0.00 -0.26 0.00 0.00 64.21 64.03 2feb n SER 100 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2feb s SER 101 N -3.26 6.10 0.00 4.04 1.04 -1.26 -5.33 113.70 115.03 2feb s SER 101 Ca 0.32 -1.72 0.00 0.00 0.48 0.00 0.00 55.95 55.03 2feb s SER 101 Cb 0.35 -2.17 0.00 0.00 0.10 0.00 0.00 66.02 64.30 2feb s SER 101 CO -0.07 -0.79 0.00 0.52 0.98 0.00 0.00 173.24 173.88