#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 -2.11 -4.06 0.38 2.13 -1.26 -4.98 120.64 110.75 2feb n GLU 2 Ca 0.00 0.96 -0.26 0.00 0.66 0.00 0.00 57.16 58.52 2feb n GLU 2 Cb 0.00 -5.82 -0.04 0.00 0.27 0.00 0.00 31.44 25.85 2feb n GLU 2 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2feb s GLY 3 N -3.33 2.43 -0.11 8.31 0.00 -1.26 -5.15 107.32 108.21 2feb s GLY 3 Ca 0.39 -1.47 -0.05 0.00 0.00 0.00 0.00 44.72 43.59 2feb s GLY 3 CO 0.74 -1.95 0.25 1.09 0.00 0.00 0.00 173.10 173.24 2feb s ARG 4 N -4.09 0.19 0.00 2.90 3.03 -1.26 -4.92 118.95 114.81 2feb s ARG 4 Ca 0.34 0.57 0.00 0.00 2.03 0.00 0.00 55.73 58.67 2feb s ARG 4 Cb 0.00 -0.11 0.00 0.00 -1.03 0.00 0.00 34.95 33.81 2feb s ARG 4 CO 0.20 -0.19 0.00 1.58 -1.13 0.00 0.00 175.30 175.76 2feb n HIS 5 N 4.44 -0.10 0.18 5.89 -0.00 -1.26 -5.06 115.22 119.30 2feb n HIS 5 Ca -0.22 0.00 -0.08 0.00 0.46 0.00 0.00 57.72 57.88 2feb n HIS 5 Cb 0.52 0.00 -0.04 0.00 -0.12 0.00 0.00 29.99 30.35 2feb n HIS 5 CO 0.00 0.00 0.00 1.98 0.46 0.00 0.00 176.34 178.78 2feb h MET 6 N 0.00 -0.48 -5.10 1.57 4.05 -1.92 -3.43 114.93 109.62 2feb h MET 6 Ca 0.00 0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.45 2feb h MET 6 Cb 0.00 0.11 0.00 0.00 -0.80 0.00 0.00 31.60 30.91 2feb h MET 6 CO 0.00 -0.32 -0.86 0.00 0.23 0.00 0.00 176.91 175.96 2feb n ALA 7 N -2.38 -3.38 -1.43 0.39 0.00 -1.26 -4.57 120.51 107.89 2feb n ALA 7 Ca -0.06 0.63 -0.30 0.00 0.00 0.00 0.00 53.44 53.71 2feb n ALA 7 Cb 0.21 -1.58 0.10 0.00 0.00 0.00 0.00 19.45 18.18 2feb n ALA 7 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2feb s PRO 8 N -1.80 1.93 0.63 0.00 0.04 -1.26 -4.64 135.00 129.90 2feb s PRO 8 Ca 0.05 0.76 0.00 0.00 0.04 0.00 0.00 61.00 61.86 2feb s PRO 8 Cb -0.02 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2feb s PRO 8 CO 0.76 -1.76 0.00 -2.37 0.04 0.00 0.00 177.00 173.67 2feb n THR 9 N -3.54 0.00 -4.31 1.26 5.66 -1.26 -4.13 114.28 107.96 2feb n THR 9 Ca 0.07 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 60.87 2feb n THR 9 Cb 0.55 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.23 2feb n THR 9 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 2feb s GLU 10 N 0.00 1.21 2.20 1.09 2.12 -1.26 -4.79 118.70 119.27 2feb s GLU 10 Ca 0.00 -1.40 0.00 0.00 0.36 0.00 0.00 54.97 53.93 2feb s GLU 10 Cb 0.00 -1.16 0.00 0.00 0.26 0.00 0.00 34.13 33.23 2feb s GLU 10 CO 0.00 0.22 0.00 -1.71 -0.54 0.00 0.00 175.26 173.23 2feb n ASN 11 N 0.22 -2.10 -4.25 -1.70 2.85 -1.25 -4.71 115.26 104.31 2feb n ASN 11 Ca -0.13 0.00 -0.34 0.00 -0.11 0.00 0.00 54.58 54.00 2feb n ASN 11 Cb 0.58 0.00 0.08 0.00 1.24 0.00 0.00 39.78 41.68 2feb n ASN 11 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 2feb n SER 12 N -1.42 -3.63 -2.42 1.20 2.88 -1.26 -2.30 113.62 106.66 2feb n SER 12 Ca 0.00 0.29 -0.17 0.00 -1.33 0.00 0.00 58.87 57.66 2feb n SER 12 Cb 0.00 -1.02 -0.01 0.00 -0.75 0.00 0.00 64.21 62.43 2feb n SER 12 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2feb n THR 13 N -3.05 -0.84 -2.65 2.46 -2.24 -1.26 -4.84 114.28 101.85 2feb n THR 13 Ca 0.03 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.78 2feb n THR 13 Cb 0.54 -2.49 0.04 0.00 -2.10 0.00 0.00 70.33 66.32 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 -0.94 -1.94 0.00 3.38 0.00 -0.97 -4.83 105.19 99.89 2feb n GLY 14 Ca -0.21 1.42 0.00 0.00 0.00 0.00 0.00 46.02 47.23 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 2.39 0.00 -3.12 1.61 3.14 -1.26 -3.93 118.33 117.16 2feb n VAL 15 Ca 0.09 0.00 -0.14 0.00 -2.96 0.00 0.00 64.34 61.33 2feb n VAL 15 Cb 0.67 0.00 0.07 0.00 -1.06 0.00 0.00 33.84 33.52 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 -0.47 -4.70 -3.57 1.45 0.00 -1.26 -4.59 117.38 104.24 2feb n GLN 16 Ca 0.00 0.70 -0.01 0.00 -0.00 0.00 0.00 57.00 57.69 2feb n GLN 16 Cb 0.00 -5.22 -0.05 0.00 0.00 0.00 0.00 30.24 24.97 2feb n GLN 16 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2feb s ASP 17 N -3.95 -0.88 0.16 1.69 1.01 -1.26 -4.78 116.67 108.66 2feb s ASP 17 Ca 0.08 1.25 0.04 0.00 0.71 0.00 0.00 52.55 54.62 2feb s ASP 17 Cb -0.01 1.87 -0.04 0.00 1.01 0.00 0.00 42.92 45.75 2feb s ASP 17 CO 0.60 -0.18 0.21 0.00 0.21 0.00 0.00 175.17 176.01 2feb n TYR 19 N -0.48 -1.67 -3.81 0.00 0.18 0.67 0.55 117.16 112.60 2feb n TYR 19 Ca -0.08 -1.50 -0.12 0.00 1.88 0.00 0.00 57.90 58.08 2feb n TYR 19 Cb 0.54 -0.34 -0.12 0.00 -0.38 0.00 0.00 39.34 39.05 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 -3.64 0.28 4.08 -3.48 0.52 -1.26 -4.17 118.95 111.27 2feb s ARG 20 Ca 0.31 0.16 0.00 0.00 -0.52 0.00 0.00 55.73 55.68 2feb s ARG 20 Cb -0.02 0.13 0.00 0.00 0.52 0.00 0.00 34.95 35.57 2feb s ARG 20 CO 0.19 -0.04 0.00 0.41 0.02 0.00 0.00 175.30 175.88 2feb n GLY 21 N 2.71 3.12 3.45 -3.53 0.00 -1.26 -3.42 105.19 106.26 2feb n GLY 21 Ca -0.14 0.27 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 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 6.77 0.44 1.61 1.11 -1.26 -4.87 116.67 116.47 2feb s ASP 22 Ca 0.00 -2.36 0.37 0.00 0.18 0.00 0.00 52.55 50.74 2feb s ASP 22 Cb 0.00 -2.39 1.43 0.00 1.07 0.00 0.00 42.92 43.03 2feb s ASP 22 CO 0.00 -0.95 1.38 0.61 1.18 0.00 0.00 175.17 177.39 2feb n GLY 23 N 5.01 -0.81 0.04 0.21 0.00 -1.22 0.97 105.19 109.40 2feb n GLY 23 Ca 0.27 0.64 -0.12 0.00 0.00 0.00 0.00 46.02 46.82 2feb n GLY 23 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2feb h GLN 24 N 0.00 -0.00 -3.06 1.61 3.07 -1.71 -3.45 115.11 111.57 2feb h GLN 24 Ca 0.81 0.00 -0.19 0.00 0.09 0.00 0.00 58.65 59.35 2feb h GLN 24 Cb 2.93 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 30.46 2feb h GLN 24 CO -0.21 0.01 -0.22 0.45 0.09 0.00 0.00 178.83 178.95 2feb n SER 25 N -5.09 -2.97 0.00 0.06 2.88 0.27 -4.05 113.62 104.72 2feb n SER 25 Ca -0.07 0.25 0.00 0.00 -1.33 0.00 0.00 58.87 57.72 2feb n SER 25 Cb 0.04 -2.69 0.00 0.00 -0.75 0.00 0.00 64.21 60.81 2feb n SER 25 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2feb n TYR 26 N -2.57 0.00 -4.43 0.66 4.01 -1.26 -4.45 117.16 109.12 2feb n TYR 26 Ca -0.11 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.38 2feb n TYR 26 Cb 0.48 0.00 -0.17 0.00 -0.31 0.00 0.00 39.34 39.34 2feb n TYR 26 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 2feb s ARG 27 N 0.00 1.72 0.18 -0.72 1.04 -1.26 -4.38 118.95 115.54 2feb s ARG 27 Ca 0.00 -0.40 0.05 0.00 -1.04 0.00 0.00 55.73 54.34 2feb s ARG 27 Cb 0.00 -1.49 -0.04 0.00 -2.04 0.00 0.00 34.95 31.38 2feb s ARG 27 CO 0.00 -0.04 0.18 0.20 -0.04 0.00 0.00 175.30 175.60 2feb s GLY 28 N 0.91 1.62 -0.31 3.88 0.00 -1.22 -5.02 107.32 107.17 2feb s GLY 28 Ca -0.10 -1.23 0.09 0.00 0.00 0.00 0.00 44.72 43.48 2feb s GLY 28 CO 0.01 -1.25 1.60 -1.30 0.00 0.00 0.00 173.10 172.16 2feb n THR 29 N -0.60 2.71 -0.06 0.90 -2.24 -1.26 -4.54 114.28 109.19 2feb n THR 29 Ca -0.08 -2.32 -0.22 0.00 -2.27 0.00 0.00 64.05 59.16 2feb n THR 29 Cb 0.55 -0.35 -0.13 0.00 -2.10 0.00 0.00 70.33 68.31 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 -0.94 2.18 -3.66 3.22 4.77 -1.26 -5.00 117.00 116.32 2feb n LEU 30 Ca 0.38 0.33 -0.24 0.00 -0.03 0.00 0.00 56.01 56.46 2feb n LEU 30 Cb 1.20 -1.03 0.06 0.00 -2.33 0.00 0.00 43.42 41.32 2feb n LEU 30 CO 0.31 0.52 0.14 -1.20 -1.33 0.00 0.00 177.39 175.83 2feb n SER 31 N -4.04 -4.37 -0.74 -1.43 7.64 -1.26 -4.94 113.62 104.48 2feb n SER 31 Ca -0.32 -0.66 0.00 0.00 1.01 0.00 0.00 58.87 58.90 2feb n SER 31 Cb 0.84 -4.62 0.00 0.00 -1.01 0.00 0.00 64.21 59.42 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 -4.65 0.00 0.00 0.44 -1.04 -1.26 -4.01 114.28 103.76 2feb n THR 32 Ca -0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.92 2feb n THR 32 Cb 0.59 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.10 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 0.00 12.58 -2.24 -0.85 -3.75 114.28 120.02 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 -0.54 0.00 -1.02 2.28 0.13 -1.20 -0.49 119.36 118.51 2feb n ILE 34 Ca 0.00 0.00 0.09 0.00 -1.10 0.00 0.00 62.75 61.74 2feb n ILE 34 Cb 0.00 -0.07 0.23 0.00 -0.84 0.00 0.00 39.64 38.96 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 -1.65 2.21 0.00 9.51 -1.04 -1.26 -4.60 114.28 117.45 2feb n THR 35 Ca 0.00 -1.98 0.00 0.00 -2.04 0.00 0.00 64.05 60.03 2feb n THR 35 Cb 0.01 -0.26 0.00 0.00 -1.82 0.00 0.00 70.33 68.26 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 -0.72 3.07 3.72 3.41 0.00 -1.26 -4.87 105.19 108.54 2feb n GLY 36 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.45 4.13 1.02 1.61 1.70 -1.26 -4.60 118.95 121.09 2feb s ARG 37 Ca 0.00 2.60 -0.14 0.00 -0.47 0.00 0.00 55.73 57.72 2feb s ARG 37 Cb 0.00 -3.14 0.16 0.00 -0.57 0.00 0.00 34.95 31.40 2feb s ARG 37 CO 0.00 -0.76 0.25 0.25 -1.08 0.00 0.00 175.30 173.96 2feb n THR 38 N 4.08 0.00 0.73 4.99 -2.24 -1.26 -2.01 114.28 118.57 2feb n THR 38 Ca 0.16 -0.06 0.12 0.00 -2.27 0.00 0.00 64.05 62.00 2feb n THR 38 Cb 0.36 -0.49 0.24 0.00 -2.10 0.00 0.00 70.33 68.33 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 1.16 -3.61 -2.77 0.00 1.13 -1.23 -1.16 117.38 110.90 2feb n GLN 40 Ca 0.17 2.71 -0.42 0.00 -1.94 0.00 0.00 57.00 57.52 2feb n GLN 40 Cb 0.54 -3.12 -0.03 0.00 0.11 0.00 0.00 30.24 27.74 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 -3.55 6.98 0.65 1.08 0.15 -1.26 -4.41 113.70 113.34 2feb s SER 41 Ca 0.00 1.22 0.22 0.00 0.70 0.00 0.00 55.95 58.09 2feb s SER 41 Cb 0.00 -2.49 1.17 0.00 -1.71 0.00 0.00 66.02 62.99 2feb s SER 41 CO 0.00 -0.59 1.65 -0.50 1.20 0.00 0.00 173.24 175.01 2feb h TRP 42 N 7.54 0.00 0.00 3.44 4.06 -1.84 0.74 115.95 129.89 2feb h TRP 42 Ca -0.21 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.74 2feb h TRP 42 Cb 1.08 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.24 2feb h TRP 42 CO 0.75 0.00 -1.61 0.43 -3.56 0.00 0.00 178.44 174.45 2feb n SER 43 N -2.92 0.85 -3.64 -3.49 7.64 -1.26 -4.48 113.62 106.33 2feb n SER 43 Ca 0.01 -0.20 -0.41 0.00 1.01 0.00 0.00 58.87 59.28 2feb n SER 43 Cb 0.63 1.64 -0.01 0.00 -1.01 0.00 0.00 64.21 65.47 2feb n SER 43 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2feb n SER 44 N -1.97 5.29 -2.69 6.43 7.64 0.26 -4.77 113.62 123.81 2feb n SER 44 Ca -0.02 -2.82 -0.29 0.00 1.01 0.00 0.00 58.87 56.76 2feb n SER 44 Cb 0.43 -1.61 -0.06 0.00 -1.01 0.00 0.00 64.21 61.96 2feb n SER 44 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 2feb n MET 45 N 5.13 2.91 -0.07 1.43 0.00 -1.26 -4.50 117.12 120.76 2feb n MET 45 Ca 0.57 -2.46 -0.06 0.00 0.00 0.00 0.00 57.70 55.76 2feb n MET 45 Cb 0.34 -2.26 -0.02 0.00 0.00 0.00 0.00 33.22 31.28 2feb n MET 45 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 175.97 177.76 2feb h THR 46 N 2.17 0.06 0.10 3.17 1.35 -1.95 -3.42 112.91 114.39 2feb h THR 46 Ca 0.46 -1.08 -0.28 0.00 -0.55 0.00 0.00 66.41 64.96 2feb h THR 46 Cb 0.69 0.15 -0.01 0.00 -1.73 0.00 0.00 68.15 67.25 2feb h THR 46 CO 0.97 0.02 -1.38 1.55 -0.25 0.00 0.00 175.52 176.44 2feb h PRO 47 N -1.00 0.22 -2.18 4.72 0.13 -1.98 -3.47 132.00 128.43 2feb h PRO 47 Ca -0.02 -0.37 -0.05 0.00 -0.87 0.00 0.00 66.00 64.69 2feb h PRO 47 Cb 0.54 0.14 -0.22 0.00 0.13 0.00 0.00 31.00 31.59 2feb h PRO 47 CO -0.01 1.11 0.01 -3.38 -0.23 0.00 0.00 178.00 175.49 2feb s HIS 48 N -2.64 -0.78 1.35 1.56 -3.43 -1.26 -5.01 115.29 105.08 2feb s HIS 48 Ca -0.06 1.78 -0.21 0.00 -0.80 0.00 0.00 55.06 55.77 2feb s HIS 48 Cb 0.07 0.33 0.33 0.00 -1.43 0.00 0.00 32.58 31.88 2feb s HIS 48 CO 0.86 -0.38 0.78 0.91 -2.00 0.00 0.00 174.74 174.91 2feb n TRP 49 N 3.21 -3.08 0.00 0.38 7.02 -1.26 -4.46 117.44 119.24 2feb n TRP 49 Ca -0.16 -0.55 0.00 0.00 -1.02 0.00 0.00 57.50 55.77 2feb n TRP 49 Cb 0.56 -1.42 0.00 0.00 -2.42 0.00 0.00 31.31 28.04 2feb n TRP 49 CO 0.00 0.00 0.00 0.72 -2.02 0.00 0.00 177.69 176.39 2feb n HIS 50 N -5.45 0.00 -3.78 -5.99 8.25 -1.26 -4.97 115.22 102.01 2feb n HIS 50 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 2feb n HIS 50 Cb 0.55 0.46 0.00 0.00 1.12 0.00 0.00 29.99 32.12 2feb n HIS 50 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 2feb n ARG 51 N -2.43 0.00 -1.53 -0.41 1.85 -1.26 -5.07 116.66 107.81 2feb n ARG 51 Ca 0.00 0.00 -0.23 0.00 -1.00 0.00 0.00 57.85 56.62 2feb n ARG 51 Cb 0.00 0.00 -0.12 0.00 -1.05 0.00 0.00 32.46 31.29 2feb n ARG 51 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2feb n ARG 52 N 0.00 0.43 -0.67 2.89 3.00 -1.26 -4.88 116.66 116.17 2feb n ARG 52 Ca 0.00 -0.36 -0.31 0.00 -0.01 0.00 0.00 57.85 57.16 2feb n ARG 52 Cb 0.00 -2.65 0.17 0.00 0.00 0.00 0.00 32.46 29.99 2feb n ARG 52 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.63 178.07 2feb n ILE 53 N 7.59 0.00 -0.16 0.55 -5.35 -1.26 -4.68 119.36 116.05 2feb n ILE 53 Ca 0.53 -0.19 -0.06 0.00 -0.27 0.00 0.00 62.75 62.76 2feb n ILE 53 Cb 0.32 -0.84 -0.02 0.00 -1.74 0.00 0.00 39.64 37.37 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 -3.37 0.00 0.00 6.28 -0.04 -1.26 -2.83 135.00 133.78 2feb n PRO 54 Ca 0.07 -0.50 0.00 0.00 -0.04 0.00 0.00 63.50 63.04 2feb n PRO 54 Cb 0.54 -1.92 0.00 0.00 -0.04 0.00 0.00 33.50 32.08 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 5.21 0.00 -0.02 1.53 4.77 -1.26 -4.93 117.00 122.30 2feb n LEU 55 Ca 0.07 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.85 2feb n LEU 55 Cb 0.07 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.02 2feb n LEU 55 CO 0.53 0.00 -0.88 -1.22 -1.33 0.00 0.00 177.39 174.49 2feb n TYR 56 N -1.21 0.99 -3.19 -1.77 4.02 -1.13 -4.93 117.16 109.94 2feb n TYR 56 Ca 0.00 0.22 -0.29 0.00 -0.01 0.00 0.00 57.90 57.82 2feb n TYR 56 Cb 0.00 -1.13 -0.03 0.00 -0.02 0.00 0.00 39.34 38.15 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 -2.55 3.47 -0.23 -0.72 -0.85 -1.26 -4.99 117.35 110.21 2feb s TYR 57 Ca -0.22 0.79 -0.35 0.00 -0.52 0.00 0.00 57.07 56.77 2feb s TYR 57 Cb 0.07 -2.22 -0.11 0.00 0.38 0.00 0.00 41.96 40.07 2feb s TYR 57 CO 0.75 0.09 2.02 -0.35 -1.52 0.00 0.00 175.55 176.54 2feb n PRO 58 N -0.99 1.57 -1.52 -3.49 -0.04 -1.26 -4.73 135.00 124.54 2feb n PRO 58 Ca -0.00 0.51 -0.28 0.00 -0.04 0.00 0.00 63.50 63.69 2feb n PRO 58 Cb 0.54 -2.55 -0.15 0.00 -0.04 0.00 0.00 33.50 31.29 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 8.27 0.08 0.00 3.54 5.03 -1.26 -4.77 115.26 126.15 2feb n ASN 59 Ca 0.31 -0.46 0.00 0.00 0.87 0.00 0.00 54.58 55.30 2feb n ASN 59 Cb 0.26 -0.97 0.00 0.00 -1.02 0.00 0.00 39.78 38.05 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 10.50 0.00 0.00 5.41 0.00 -1.26 -5.04 120.51 130.12 2feb n ALA 60 Ca 0.60 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 54.02 2feb n ALA 60 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.65 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 1.97 0.00 3.69 0.00 0.00 -1.26 -5.12 105.19 104.47 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 4.40 -1.43 0.99 1.43 -1.26 -4.87 118.68 117.94 2feb s LEU 62 Ca 0.00 2.76 -0.14 0.00 -1.03 0.00 0.00 54.13 55.71 2feb s LEU 62 Cb 0.00 -3.56 0.04 0.00 0.03 0.00 0.00 46.19 42.70 2feb s LEU 62 CO 0.00 -1.01 2.18 0.35 0.23 0.00 0.00 176.35 178.10 2feb n THR 63 N 4.81 3.47 0.00 5.49 -2.24 -1.26 -4.90 114.28 119.65 2feb n THR 63 Ca 0.18 -3.08 0.00 0.00 -2.27 0.00 0.00 64.05 58.88 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 6.32 0.00 -1.86 -0.78 3.00 -1.26 -0.47 116.66 121.60 2feb n ARG 64 Ca 0.52 0.00 -0.27 0.00 -0.01 0.00 0.00 57.85 58.09 2feb n ARG 64 Cb 0.40 0.00 0.03 0.00 0.00 0.00 0.00 32.46 32.89 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 7.71 5.57 -4.43 0.55 6.94 -1.26 -2.86 115.26 127.48 2feb n ASN 65 Ca 0.00 -3.76 -0.44 0.00 -0.02 0.00 0.00 54.58 50.36 2feb n ASN 65 Cb 0.00 -0.49 -0.03 0.00 -2.36 0.00 0.00 39.78 36.90 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 -3.65 2.98 0.00 -2.53 1.51 0.38 -4.04 117.35 111.99 2feb s TYR 66 Ca 0.54 -1.07 0.00 0.00 -1.01 0.00 0.00 57.07 55.53 2feb s TYR 66 Cb 0.43 -4.23 0.00 0.00 -0.11 0.00 0.00 41.96 38.06 2feb s TYR 66 CO 0.03 -1.49 0.00 0.00 -1.11 0.00 0.00 175.55 172.97 2feb s ARG 68 N 0.00 0.14 -0.01 0.00 1.70 -1.26 -3.45 118.95 116.08 2feb s ARG 68 Ca 0.00 -0.09 0.03 0.00 -0.47 0.00 0.00 55.73 55.20 2feb s ARG 68 Cb 0.00 0.04 -0.01 0.00 -0.57 0.00 0.00 34.95 34.41 2feb s ARG 68 CO 0.00 -0.07 -0.10 0.54 -1.08 0.00 0.00 175.30 174.59 2feb s ASN 69 N -3.79 1.22 0.17 -2.89 4.22 -1.26 -3.67 114.94 108.94 2feb s ASN 69 Ca 0.29 -0.20 -0.11 0.00 -2.14 0.00 0.00 52.86 50.70 2feb s ASN 69 Cb 0.01 -0.13 0.05 0.00 1.28 0.00 0.00 41.25 42.45 2feb s ASN 69 CO -0.03 0.12 1.63 1.55 -2.04 0.00 0.00 177.10 178.33 2feb h PRO 70 N 5.83 0.97 0.00 3.55 0.13 -1.94 -3.44 132.00 137.11 2feb h PRO 70 Ca -0.32 -0.30 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 2feb h PRO 70 Cb 1.18 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2feb h PRO 70 CO 0.49 0.97 0.00 -0.25 -0.23 0.00 0.00 178.00 178.98 2feb n ASP 71 N -4.27 0.00 -3.52 1.44 9.92 -1.26 -5.15 116.55 113.72 2feb n ASP 71 Ca 0.02 0.00 -0.17 0.00 -0.53 0.00 0.00 54.79 54.11 2feb n ASP 71 Cb 0.32 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.74 2feb n ASP 71 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2feb s ALA 72 N -3.58 -1.77 0.00 2.24 0.00 -1.26 -5.03 121.76 112.36 2feb s ALA 72 Ca 0.00 1.29 0.00 0.00 0.00 0.00 0.00 51.96 53.25 2feb s ALA 72 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.13 2feb s ALA 72 CO 0.00 -0.39 0.00 -1.91 0.00 0.00 0.00 175.76 173.46 2feb n GLU 73 N 0.82 0.00 -0.27 0.00 2.13 -1.26 -5.02 120.64 117.04 2feb n GLU 73 Ca -0.18 0.00 0.04 0.00 0.66 0.00 0.00 57.16 57.68 2feb n GLU 73 Cb 0.58 0.00 0.17 0.00 0.27 0.00 0.00 31.44 32.46 2feb n GLU 73 CO 0.00 0.00 0.00 -0.84 -0.41 0.00 0.00 177.13 175.88 2feb h ILE 74 N 0.09 0.78 -3.45 6.31 3.07 -1.99 -3.33 117.51 118.98 2feb h ILE 74 Ca 0.00 -0.20 -0.42 0.00 1.55 0.00 0.00 64.86 65.78 2feb h ILE 74 Cb 0.00 0.14 -0.34 0.00 -0.27 0.00 0.00 36.82 36.35 2feb h ILE 74 CO 0.00 0.11 -0.78 -0.60 -1.05 0.00 0.00 178.15 175.83 2feb s ARG 75 N -6.02 0.94 1.01 0.16 3.52 -1.26 -4.03 118.95 113.26 2feb s ARG 75 Ca -0.12 -0.14 -0.13 0.00 -0.13 0.00 0.00 55.73 55.20 2feb s ARG 75 Cb 0.20 -0.91 0.21 0.00 -1.56 0.00 0.00 34.95 32.88 2feb s ARG 75 CO 0.77 -0.07 0.47 -0.35 -0.81 0.00 0.00 175.30 175.31 2feb n PRO 76 N 4.03 -1.86 -3.28 5.12 -0.04 -1.26 -4.95 135.00 132.76 2feb n PRO 76 Ca -0.24 -0.79 -0.06 0.00 -0.04 0.00 0.00 63.50 62.36 2feb n PRO 76 Cb 0.51 -1.45 -0.05 0.00 -0.04 0.00 0.00 33.50 32.47 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 -1.98 -1.15 0.40 0.54 1.48 -1.24 -4.46 118.94 112.53 2feb s TRP 77 Ca 0.36 0.54 0.04 0.00 -1.06 0.00 0.00 56.10 55.99 2feb s TRP 77 Cb -0.06 -0.04 -0.02 0.00 -1.16 0.00 0.00 33.47 32.18 2feb s TRP 77 CO 0.31 -0.97 0.15 0.00 -4.06 0.00 0.00 176.95 172.37 2feb n TYR 79 N -0.88 -0.56 -3.78 0.00 4.02 -0.31 -0.17 117.16 115.48 2feb n TYR 79 Ca -0.04 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.72 2feb n TYR 79 Cb 0.65 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.86 2feb n TYR 79 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 2feb s THR 80 N 0.84 0.02 0.58 -0.72 -4.23 -1.25 -3.55 115.64 107.34 2feb s THR 80 Ca 0.00 -0.20 0.31 0.00 -1.18 0.00 0.00 61.69 60.62 2feb s THR 80 Cb 0.00 -0.46 0.44 0.00 1.34 0.00 0.00 72.50 73.82 2feb s THR 80 CO 0.00 -0.11 1.75 -0.03 -0.54 0.00 0.00 174.62 175.69 2feb h MET 81 N 5.08 0.00 -6.18 3.99 4.05 -1.86 -3.38 114.93 116.64 2feb h MET 81 Ca -0.27 0.00 -0.57 0.00 -0.28 0.00 0.00 59.70 58.57 2feb h MET 81 Cb 1.19 0.00 -0.05 0.00 -0.80 0.00 0.00 31.60 31.93 2feb h MET 81 CO 0.35 0.00 0.86 -0.51 0.23 0.00 0.00 176.91 177.84 2feb s ASP 82 N -4.85 6.97 0.00 1.39 1.11 -1.26 -4.90 116.67 115.13 2feb s ASP 82 Ca -0.04 1.39 0.10 0.00 0.18 0.00 0.00 52.55 54.18 2feb s ASP 82 Cb 0.18 -2.54 0.49 0.00 1.07 0.00 0.00 42.92 42.12 2feb s ASP 82 CO 0.62 -0.79 1.20 -0.81 1.18 0.00 0.00 175.17 176.58 2feb n PRO 83 N 6.63 0.14 -1.10 8.23 -0.04 -1.26 -3.00 135.00 144.59 2feb n PRO 83 Ca 0.13 0.20 -0.25 0.00 -0.04 0.00 0.00 63.50 63.53 2feb n PRO 83 Cb 0.46 -1.50 0.08 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 -1.29 6.33 0.04 3.54 7.64 -1.26 -4.48 113.62 124.14 2feb n SER 84 Ca 0.05 -3.43 0.00 0.00 1.01 0.00 0.00 58.87 56.50 2feb n SER 84 Cb 0.08 -0.95 0.00 0.00 -1.01 0.00 0.00 64.21 62.33 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 -0.48 0.00 0.00 0.44 0.31 -1.16 -5.03 118.33 112.40 2feb n VAL 85 Ca 0.49 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.82 2feb n VAL 85 Cb 0.82 -0.12 0.00 0.00 -0.91 0.00 0.00 33.84 33.63 2feb n VAL 85 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2feb n ARG 86 N -2.77 0.00 -3.60 5.55 1.74 -1.26 -4.91 116.66 111.41 2feb n ARG 86 Ca 0.00 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.95 2feb n ARG 86 Cb 0.00 -0.37 -0.06 0.00 -1.02 0.00 0.00 32.46 31.01 2feb n ARG 86 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 2feb s TRP 87 N -1.16 -0.57 0.15 -1.55 -0.11 -1.26 -4.53 118.94 109.92 2feb s TRP 87 Ca 0.00 1.22 -0.24 0.00 1.22 0.00 0.00 56.10 58.30 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 -0.37 0.71 -2.00 -4.62 0.00 0.00 176.95 170.67 2feb s GLU 88 N -0.34 1.28 0.71 5.86 2.56 0.77 -4.89 118.70 124.65 2feb s GLU 88 Ca -0.02 -0.55 -0.02 0.00 0.00 0.00 0.00 54.97 54.38 2feb s GLU 88 Cb -0.03 0.54 0.12 0.00 2.00 0.00 0.00 34.13 36.76 2feb s GLU 88 CO 0.01 -0.57 0.99 0.71 -0.56 0.00 0.00 175.26 175.84 2feb s TYR 89 N -3.62 1.80 0.30 5.30 1.51 -1.26 -2.69 117.35 118.69 2feb s TYR 89 Ca 0.05 -0.18 0.09 0.00 -1.01 0.00 0.00 57.07 56.01 2feb s TYR 89 Cb -0.02 -3.04 -0.04 0.00 -0.11 0.00 0.00 41.96 38.75 2feb s TYR 89 CO -0.07 -1.65 0.10 0.00 -1.11 0.00 0.00 175.55 172.81 2feb s ASN 91 N -3.78 4.08 -0.30 0.00 2.20 0.36 -4.75 114.94 112.75 2feb s ASN 91 Ca 0.35 -0.79 -0.05 0.00 -0.94 0.00 0.00 52.86 51.42 2feb s ASN 91 Cb -0.05 -2.58 0.16 0.00 -2.00 0.00 0.00 41.25 36.79 2feb s ASN 91 CO 0.22 -3.95 0.63 -0.76 -2.94 0.00 0.00 177.10 170.30 2feb s LEU 92 N 14.38 -1.27 0.05 3.54 1.02 -1.21 -4.13 118.68 131.07 2feb s LEU 92 Ca 0.80 1.21 -0.02 0.00 0.02 0.00 0.00 54.13 56.14 2feb s LEU 92 Cb -0.07 2.23 -0.04 0.00 0.02 0.00 0.00 46.19 48.34 2feb s LEU 92 CO 0.12 -0.24 -0.01 0.42 0.02 0.00 0.00 176.35 176.66 2feb s THR 93 N 2.88 0.21 -0.18 5.49 -4.23 -0.17 -4.65 115.64 114.98 2feb s THR 93 Ca 0.08 -1.73 -0.29 0.00 -1.18 0.00 0.00 61.69 58.58 2feb s THR 93 Cb -0.14 -1.47 -0.05 0.00 1.34 0.00 0.00 72.50 72.19 2feb s THR 93 CO -0.20 -0.95 2.04 -0.13 -0.54 0.00 0.00 174.62 174.83 2feb s ARG 94 N -3.85 3.44 -0.08 3.99 0.52 -1.26 0.24 118.95 121.96 2feb s ARG 94 Ca 0.06 2.02 -0.03 0.00 -0.52 0.00 0.00 55.73 57.26 2feb s ARG 94 Cb 0.07 -4.26 -0.01 0.00 0.52 0.00 0.00 34.95 31.27 2feb s ARG 94 CO -0.10 -1.74 -0.05 0.00 0.02 0.00 0.00 175.30 173.43 2feb n PRO 96 N -3.87 1.79 0.00 0.00 -0.04 -1.26 -4.76 135.00 126.85 2feb n PRO 96 Ca -0.02 0.63 0.00 0.00 -0.04 0.00 0.00 63.50 64.07 2feb n PRO 96 Cb 0.07 -2.54 0.00 0.00 -0.04 0.00 0.00 33.50 31.00 2feb n PRO 96 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2feb n VAL 97 N 5.51 0.00 0.00 0.52 0.31 -1.26 -5.04 118.33 118.36 2feb n VAL 97 Ca 0.27 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.60 2feb n VAL 97 Cb 0.26 -0.01 0.00 0.00 -0.91 0.00 0.00 33.84 33.18 2feb n VAL 97 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2feb n THR 98 N -2.19 0.00 -2.68 2.52 -1.04 -1.26 -3.59 114.28 106.05 2feb n THR 98 Ca 0.00 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.99 2feb n THR 98 Cb 0.00 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 68.54 2feb n THR 98 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2feb s GLU 99 N 0.00 0.10 0.32 -2.82 2.12 -1.26 -5.15 118.70 112.01 2feb s GLU 99 Ca 0.00 -0.09 -0.29 0.00 0.36 0.00 0.00 54.97 54.95 2feb s GLU 99 Cb 0.00 -0.00 -0.12 0.00 0.26 0.00 0.00 34.13 34.27 2feb s GLU 99 CO 0.00 -0.13 1.52 0.45 -0.54 0.00 0.00 175.26 176.55 2feb n SER 100 N 2.87 3.62 -1.47 -1.70 2.88 -1.24 -4.68 113.62 113.91 2feb n SER 100 Ca 0.09 1.18 0.09 0.00 -1.33 0.00 0.00 58.87 58.90 2feb n SER 100 Cb 0.65 -1.57 -0.05 0.00 -0.75 0.00 0.00 64.21 62.49 2feb n SER 100 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2feb n SER 101 N 1.54 -7.94 -0.85 -3.46 7.64 -1.26 -5.25 113.62 104.04 2feb n SER 101 Ca 0.06 1.62 0.11 0.00 1.01 0.00 0.00 58.87 61.67 2feb n SER 101 Cb 0.37 -4.90 0.09 0.00 -1.01 0.00 0.00 64.21 58.75 2feb n SER 101 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55