#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 -2.78 0.00 6.28 2.13 -1.26 -4.55 120.64 120.46 2feb n GLU 2 Ca 0.00 2.04 0.00 0.00 0.66 0.00 0.00 57.16 59.86 2feb n GLU 2 Cb 0.00 -2.28 0.00 0.00 0.27 0.00 0.00 31.44 29.43 2feb n GLU 2 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2feb n GLY 3 N -0.48 2.27 0.00 8.31 0.00 -1.26 -3.37 105.19 110.66 2feb n GLY 3 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 0.00 -1.27 1.61 0.63 -1.26 -4.90 116.66 111.47 2feb n ARG 4 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2feb n ARG 4 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 2feb n ARG 4 CO 0.00 0.00 0.00 1.58 -2.51 0.00 0.00 177.63 176.70 2feb n HIS 5 N 0.00 -3.48 -1.08 -0.14 -0.00 -1.26 -4.57 115.22 104.69 2feb n HIS 5 Ca 0.00 1.88 -0.18 0.00 0.46 0.00 0.00 57.72 59.88 2feb n HIS 5 Cb 0.00 -3.02 0.14 0.00 -0.12 0.00 0.00 29.99 27.00 2feb n HIS 5 CO 0.00 0.00 0.00 -1.33 0.46 0.00 0.00 176.34 175.47 2feb n MET 6 N -2.24 -1.78 -3.19 1.57 2.81 -1.26 -4.70 117.12 108.32 2feb n MET 6 Ca 0.00 -1.12 -0.31 0.00 -1.81 0.00 0.00 57.70 54.46 2feb n MET 6 Cb 0.35 -0.93 -0.05 0.00 -0.71 0.00 0.00 33.22 31.88 2feb n MET 6 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2feb n ALA 7 N -3.92 4.54 -0.06 3.04 0.00 -1.26 -4.51 120.51 118.34 2feb n ALA 7 Ca -0.13 -4.76 -0.14 0.00 0.00 0.00 0.00 53.44 48.42 2feb n ALA 7 Cb 0.35 -1.18 -0.07 0.00 0.00 0.00 0.00 19.45 18.55 2feb n ALA 7 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2feb h PRO 8 N 4.10 0.45 -4.54 0.00 0.13 -1.76 -3.42 132.00 126.96 2feb h PRO 8 Ca 0.21 -0.26 -0.64 0.00 -0.87 0.00 0.00 66.00 64.44 2feb h PRO 8 Cb 0.59 0.02 -0.39 0.00 0.13 0.00 0.00 31.00 31.36 2feb h PRO 8 CO 0.94 0.84 -0.77 0.95 -0.23 0.00 0.00 178.00 179.73 2feb s THR 9 N -4.20 1.89 0.89 1.56 -4.23 -1.25 -4.99 115.64 105.31 2feb s THR 9 Ca -0.14 -1.71 -0.13 0.00 -1.18 0.00 0.00 61.69 58.53 2feb s THR 9 Cb 0.06 -2.20 0.03 0.00 1.34 0.00 0.00 72.50 71.72 2feb s THR 9 CO 0.78 -0.29 0.51 -1.84 -0.54 0.00 0.00 174.62 173.24 2feb n GLU 10 N 4.49 -0.14 0.00 3.99 0.00 -1.19 -0.91 120.64 126.88 2feb n GLU 10 Ca -0.07 0.01 0.00 0.00 0.00 0.00 0.00 57.16 57.10 2feb n GLU 10 Cb 0.43 -1.91 0.00 0.00 0.00 0.00 0.00 31.44 29.96 2feb n GLU 10 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2feb n ASN 11 N -1.33 0.00 -2.00 -1.84 5.03 -1.26 -4.71 115.26 109.16 2feb n ASN 11 Ca 0.08 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.53 2feb n ASN 11 Cb 0.52 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.28 2feb n ASN 11 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 2feb n SER 12 N 1.80 0.00 -3.43 6.41 2.88 -1.21 -4.61 113.62 115.46 2feb n SER 12 Ca 0.00 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.20 2feb n SER 12 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 2feb n SER 12 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 2feb n THR 13 N 0.00 1.67 -2.54 2.46 5.66 -1.25 -3.48 114.28 116.81 2feb n THR 13 Ca 0.00 -1.26 -0.01 0.00 -3.05 0.00 0.00 64.05 59.73 2feb n THR 13 Cb 0.00 -2.17 0.01 0.00 -1.55 0.00 0.00 70.33 66.62 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 4.31 -0.76 0.00 1.09 0.00 -0.09 -3.93 105.19 105.82 2feb n GLY 14 Ca 0.44 -0.01 0.03 0.00 0.00 0.00 0.00 46.02 46.47 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 -0.19 0.00 -0.59 1.61 3.14 -1.23 -3.17 118.33 117.90 2feb n VAL 15 Ca -0.06 -0.24 0.07 0.00 -2.96 0.00 0.00 64.34 61.16 2feb n VAL 15 Cb 0.55 0.64 -0.03 0.00 -1.06 0.00 0.00 33.84 33.94 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 -1.45 -1.33 -1.48 1.45 7.27 -1.26 -4.04 117.38 116.53 2feb n GLN 16 Ca -0.00 1.05 0.18 0.00 0.07 0.00 0.00 57.00 58.30 2feb n GLN 16 Cb 0.12 -1.57 -0.09 0.00 2.41 0.00 0.00 30.24 31.11 2feb n GLN 16 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 2feb n ASP 17 N -3.11 -8.28 -4.98 1.69 9.92 -1.26 -0.48 116.55 110.06 2feb n ASP 17 Ca -0.03 1.39 -0.21 0.00 -0.53 0.00 0.00 54.79 55.40 2feb n ASP 17 Cb 0.28 -5.03 0.03 0.00 -0.64 0.00 0.00 41.12 35.76 2feb n ASP 17 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2feb s TYR 19 N -2.64 2.91 -0.30 0.00 2.02 2.14 -2.94 117.35 118.54 2feb s TYR 19 Ca 0.52 -0.10 -0.10 0.00 -0.37 0.00 0.00 57.07 57.02 2feb s TYR 19 Cb -0.05 -1.43 0.13 0.00 -0.40 0.00 0.00 41.96 40.21 2feb s TYR 19 CO 0.32 0.51 0.66 1.03 -1.57 0.00 0.00 175.55 176.49 2feb s ARG 20 N -2.80 0.58 1.29 -0.62 0.52 -1.26 -4.15 118.95 112.51 2feb s ARG 20 Ca 0.27 1.44 0.00 0.00 -0.52 0.00 0.00 55.73 56.93 2feb s ARG 20 Cb -0.10 0.85 0.00 0.00 0.52 0.00 0.00 34.95 36.22 2feb s ARG 20 CO 0.19 -0.20 0.00 0.41 0.02 0.00 0.00 175.30 175.72 2feb n GLY 21 N 5.41 0.22 2.84 -3.53 0.00 -1.26 -3.74 105.19 105.13 2feb n GLY 21 Ca -0.12 0.71 -0.13 0.00 0.00 0.00 0.00 46.02 46.48 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 0.85 0.51 1.61 1.11 -1.26 -5.01 116.67 110.48 2feb s ASP 22 Ca 0.00 -0.90 0.43 0.00 0.18 0.00 0.00 52.55 52.26 2feb s ASP 22 Cb 0.00 0.83 1.64 0.00 1.07 0.00 0.00 42.92 46.46 2feb s ASP 22 CO 0.00 -0.32 1.56 0.61 1.18 0.00 0.00 175.17 178.20 2feb n GLY 23 N 4.92 -0.93 0.10 0.21 0.00 -1.19 -1.27 105.19 107.03 2feb n GLY 23 Ca 0.04 0.72 -0.04 0.00 0.00 0.00 0.00 46.02 46.75 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 -0.22 -2.05 1.61 -0.00 -1.80 -3.43 115.11 109.22 2feb h GLN 24 Ca 0.92 0.02 -0.28 0.00 -0.00 0.00 0.00 58.65 59.31 2feb h GLN 24 Cb 3.40 0.05 -0.08 0.00 -0.00 0.00 0.00 27.48 30.85 2feb h GLN 24 CO -0.20 -0.15 -0.28 0.45 -0.00 0.00 0.00 178.83 178.65 2feb n SER 25 N -2.77 -3.75 -1.86 0.06 2.88 -0.39 -1.21 113.62 106.57 2feb n SER 25 Ca -0.03 0.28 -0.12 0.00 -1.33 0.00 0.00 58.87 57.67 2feb n SER 25 Cb 0.10 -3.39 -0.03 0.00 -0.75 0.00 0.00 64.21 60.13 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 -2.36 -0.88 -0.78 0.66 9.36 -1.26 -4.79 117.16 117.11 2feb n TYR 26 Ca -0.14 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.08 2feb n TYR 26 Cb 0.50 -2.59 0.00 0.00 -0.63 0.00 0.00 39.34 36.62 2feb n TYR 26 CO 0.00 0.00 0.00 2.89 0.22 0.00 0.00 176.86 179.97 2feb n ARG 27 N -2.27 -2.60 0.00 2.98 1.85 -0.35 -5.02 116.66 111.25 2feb n ARG 27 Ca -0.13 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.72 2feb n ARG 27 Cb 0.50 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.91 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 -0.08 0.59 0.26 2.89 0.00 -1.26 -4.74 105.19 102.85 2feb n GLY 28 Ca 0.00 0.63 -0.00 0.00 0.00 0.00 0.00 46.02 46.65 2feb n GLY 28 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2feb h THR 29 N 0.00 1.20 -2.41 2.61 1.35 -1.91 -3.38 112.91 110.38 2feb h THR 29 Ca 0.00 -0.87 -0.57 0.00 -0.55 0.00 0.00 66.41 64.42 2feb h THR 29 Cb 0.00 1.09 -0.01 0.00 -1.73 0.00 0.00 68.15 67.50 2feb h THR 29 CO 0.00 0.29 1.31 -1.48 -0.25 0.00 0.00 175.52 175.39 2feb s LEU 30 N -8.91 3.70 0.00 3.87 0.05 -1.26 -4.84 118.68 111.30 2feb s LEU 30 Ca -0.07 1.77 0.29 0.00 0.05 0.00 0.00 54.13 56.18 2feb s LEU 30 Cb 0.15 -3.52 1.35 0.00 -2.05 0.00 0.00 46.19 42.12 2feb s LEU 30 CO 0.76 -1.61 1.93 -1.54 -0.55 0.00 0.00 176.35 175.35 2feb n SER 31 N 9.99 0.39 -2.22 1.48 3.41 -1.26 -2.03 113.62 123.38 2feb n SER 31 Ca 0.24 -0.61 -0.03 0.00 -0.26 0.00 0.00 58.87 58.22 2feb n SER 31 Cb 0.45 -0.09 0.02 0.00 -0.26 0.00 0.00 64.21 64.33 2feb n SER 31 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2feb n THR 32 N -0.95 0.00 0.00 6.66 -2.24 -1.26 -1.36 114.28 115.12 2feb n THR 32 Ca 0.16 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 2feb n THR 32 Cb 0.25 -1.88 0.00 0.00 -2.10 0.00 0.00 70.33 66.61 2feb n THR 32 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2feb n THR 33 N -2.22 0.00 0.00 4.28 5.66 -1.06 -4.29 114.28 116.64 2feb n THR 33 Ca 0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.02 2feb n THR 33 Cb 0.06 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.84 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 -1.26 0.00 0.00 1.09 2.08 -1.26 0.16 119.36 120.16 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 0.00 -0.13 0.00 0.00 -0.75 0.00 0.00 39.64 38.76 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 -2.07 0.00 0.00 1.39 -1.04 -1.26 -4.17 114.28 107.12 2feb n THR 35 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2feb n THR 35 Cb 0.00 -0.77 0.00 0.00 -1.82 0.00 0.00 70.33 67.74 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 2.42 0.00 3.41 3.41 0.00 -1.26 -5.10 105.19 108.07 2feb n GLY 36 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.87 -1.68 0.00 1.61 3.00 -1.26 -4.88 118.95 114.87 2feb s ARG 37 Ca 0.00 0.69 0.00 0.00 0.00 0.00 0.00 55.73 56.42 2feb s ARG 37 Cb 0.00 -1.48 0.00 0.00 0.00 0.00 0.00 34.95 33.47 2feb s ARG 37 CO 0.00 -4.19 0.00 0.25 0.00 0.00 0.00 175.30 171.36 2feb n THR 38 N -5.23 0.00 1.07 0.02 -2.24 -1.26 -2.57 114.28 104.07 2feb n THR 38 Ca 0.04 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.94 2feb n THR 38 Cb 0.55 0.00 0.10 0.00 -2.10 0.00 0.00 70.33 68.89 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 -0.16 -5.12 -1.54 0.00 1.13 -0.95 -3.44 117.38 107.30 2feb n GLN 40 Ca 0.10 3.73 -0.42 0.00 -1.94 0.00 0.00 57.00 58.47 2feb n GLN 40 Cb 0.44 -4.78 0.00 0.00 0.11 0.00 0.00 30.24 26.01 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 1.81 0.44 0.00 1.08 7.64 -1.26 -4.60 113.62 118.73 2feb n SER 41 Ca -0.07 1.02 0.02 0.00 1.01 0.00 0.00 58.87 60.86 2feb n SER 41 Cb 0.10 -1.24 0.10 0.00 -1.01 0.00 0.00 64.21 62.16 2feb n SER 41 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 2feb n TRP 42 N -0.47 0.00 -0.17 1.43 7.02 -0.89 -2.83 117.44 121.54 2feb n TRP 42 Ca 0.11 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.59 2feb n TRP 42 Cb 0.37 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.26 2feb n TRP 42 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 2feb n SER 43 N -0.56 0.32 -4.31 -0.99 3.41 -1.26 -4.52 113.62 105.71 2feb n SER 43 Ca 0.03 -0.65 -0.46 0.00 -0.26 0.00 0.00 58.87 57.53 2feb n SER 43 Cb 0.01 0.34 -0.03 0.00 -0.26 0.00 0.00 64.21 64.27 2feb n SER 43 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2feb s SER 44 N -0.34 6.54 -0.62 4.04 1.04 -1.13 -4.90 113.70 118.33 2feb s SER 44 Ca 0.00 -2.56 0.01 0.00 0.48 0.00 0.00 55.95 53.88 2feb s SER 44 Cb 0.00 -2.18 0.41 0.00 0.10 0.00 0.00 66.02 64.35 2feb s SER 44 CO 0.00 -0.60 1.68 1.15 0.98 0.00 0.00 173.24 176.45 2feb n MET 45 N 4.14 3.03 -0.04 4.02 0.00 -1.26 -4.71 117.12 122.30 2feb n MET 45 Ca 0.09 -3.80 -0.02 0.00 0.00 0.00 0.00 57.70 53.96 2feb n MET 45 Cb 0.45 -2.27 -0.01 0.00 0.00 0.00 0.00 33.22 31.39 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 1.93 0.00 -0.22 3.17 1.35 -1.98 -3.43 112.91 113.74 2feb h THR 46 Ca 0.48 -0.57 -0.12 0.00 -0.55 0.00 0.00 66.41 65.65 2feb h THR 46 Cb 0.65 0.00 -0.00 0.00 -1.73 0.00 0.00 68.15 67.07 2feb h THR 46 CO 1.23 0.00 -0.32 1.55 -0.25 0.00 0.00 175.52 177.73 2feb h PRO 47 N -0.57 0.60 -1.99 4.72 0.13 -1.98 -3.46 132.00 129.45 2feb h PRO 47 Ca 0.00 -0.36 -0.01 0.00 -0.87 0.00 0.00 66.00 64.76 2feb h PRO 47 Cb 0.28 0.03 -0.21 0.00 0.13 0.00 0.00 31.00 31.23 2feb h PRO 47 CO 0.00 0.97 0.08 -3.38 -0.23 0.00 0.00 178.00 175.44 2feb s HIS 48 N -4.17 -0.92 0.85 1.56 -3.43 -1.26 -5.00 115.29 102.92 2feb s HIS 48 Ca -0.13 2.01 -0.14 0.00 -0.80 0.00 0.00 55.06 56.01 2feb s HIS 48 Cb 0.07 0.44 0.04 0.00 -1.43 0.00 0.00 32.58 31.71 2feb s HIS 48 CO 0.82 -0.45 0.76 0.91 -2.00 0.00 0.00 174.74 174.78 2feb n TRP 49 N 3.46 -0.21 0.00 0.38 7.02 -1.26 -4.62 117.44 122.21 2feb n TRP 49 Ca -0.17 0.33 0.00 0.00 -1.02 0.00 0.00 57.50 56.64 2feb n TRP 49 Cb 0.57 -1.94 0.00 0.00 -2.42 0.00 0.00 31.31 27.52 2feb n TRP 49 CO 0.00 0.00 0.00 -2.39 -2.02 0.00 0.00 177.69 173.28 2feb n HIS 50 N -3.26 0.00 -3.32 -5.99 1.44 -1.26 -5.03 115.22 97.80 2feb n HIS 50 Ca 0.10 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 55.79 2feb n HIS 50 Cb 0.51 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.63 2feb n HIS 50 CO 0.00 0.00 0.00 2.89 -2.81 0.00 0.00 176.34 176.42 2feb n ARG 51 N -1.27 0.33 -1.54 -1.40 -4.01 -1.26 -5.00 116.66 102.51 2feb n ARG 51 Ca 0.00 -0.66 -0.17 0.00 -1.04 0.00 0.00 57.85 55.98 2feb n ARG 51 Cb 0.00 0.83 -0.11 0.00 -3.04 0.00 0.00 32.46 30.14 2feb n ARG 51 CO 0.00 0.00 0.00 0.54 -3.04 0.00 0.00 177.63 175.13 2feb n ARG 52 N -0.18 0.42 -0.79 2.89 3.00 -1.26 -4.88 116.66 115.86 2feb n ARG 52 Ca -0.02 -0.59 -0.33 0.00 -0.01 0.00 0.00 57.85 56.89 2feb n ARG 52 Cb 0.19 -2.96 0.12 0.00 0.00 0.00 0.00 32.46 29.81 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 7.90 0.00 -0.25 0.55 -5.35 -1.26 -4.57 119.36 116.37 2feb n ILE 53 Ca 0.52 -0.24 -0.18 0.00 -0.27 0.00 0.00 62.75 62.58 2feb n ILE 53 Cb 0.35 -0.54 -0.05 0.00 -1.74 0.00 0.00 39.64 37.66 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 -1.26 0.00 0.00 6.28 -0.04 -1.26 -2.89 135.00 135.83 2feb n PRO 54 Ca 0.04 -0.67 0.00 0.00 -0.04 0.00 0.00 63.50 62.84 2feb n PRO 54 Cb 0.56 -2.13 0.00 0.00 -0.04 0.00 0.00 33.50 31.89 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 6.48 0.00 -0.13 1.53 7.94 -1.26 -4.96 117.00 126.60 2feb n LEU 55 Ca 0.19 0.00 -0.25 0.00 -1.11 0.00 0.00 56.01 54.84 2feb n LEU 55 Cb 0.18 0.00 -0.11 0.00 0.53 0.00 0.00 43.42 44.02 2feb n LEU 55 CO 0.76 0.00 -1.36 -1.22 -1.11 0.00 0.00 177.39 174.46 2feb n TYR 56 N -1.07 0.08 -2.86 1.96 4.02 -1.14 -4.98 117.16 113.18 2feb n TYR 56 Ca 0.00 0.03 -0.32 0.00 -0.01 0.00 0.00 57.90 57.60 2feb n TYR 56 Cb 0.00 -1.01 -0.05 0.00 -0.02 0.00 0.00 39.34 38.26 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 -2.51 3.40 -0.18 -0.72 1.13 -1.26 -4.97 117.35 112.24 2feb s TYR 57 Ca -0.37 1.29 -0.31 0.00 -1.41 0.00 0.00 57.07 56.27 2feb s TYR 57 Cb 0.12 -2.62 -0.08 0.00 -1.10 0.00 0.00 41.96 38.28 2feb s TYR 57 CO 0.54 -0.09 2.11 -0.35 -2.51 0.00 0.00 175.55 175.25 2feb n PRO 58 N -0.91 1.94 -1.51 -3.49 -0.04 -1.26 -4.75 135.00 124.98 2feb n PRO 58 Ca 0.04 0.61 -0.28 0.00 -0.04 0.00 0.00 63.50 63.83 2feb n PRO 58 Cb 0.54 -2.92 -0.17 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 9.67 -0.32 0.06 3.54 5.03 -1.26 -4.71 115.26 127.27 2feb n ASN 59 Ca 0.29 -0.40 -0.06 0.00 0.87 0.00 0.00 54.58 55.28 2feb n ASN 59 Cb 0.36 -0.84 -0.10 0.00 -1.02 0.00 0.00 39.78 38.18 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 12.07 0.45 -0.01 5.41 0.00 -2.01 -3.49 119.26 131.68 2feb h ALA 60 Ca -0.01 -0.91 0.00 0.00 0.00 0.00 0.00 54.91 53.99 2feb h ALA 60 Cb 1.19 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2feb h ALA 60 CO 1.46 1.19 0.00 0.41 0.00 0.00 0.00 179.25 182.31 2feb n GLY 61 N 1.36 0.83 3.74 0.00 0.00 -1.26 -5.08 105.19 104.77 2feb n GLY 61 Ca -0.02 -0.75 -0.40 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.01 4.45 -1.48 0.99 1.43 -1.26 -4.96 118.68 117.84 2feb s LEU 62 Ca 0.00 1.49 -0.14 0.00 -1.03 0.00 0.00 54.13 54.45 2feb s LEU 62 Cb 0.00 -3.28 0.03 0.00 0.03 0.00 0.00 46.19 42.97 2feb s LEU 62 CO 0.00 -0.01 2.31 0.35 0.23 0.00 0.00 176.35 179.22 2feb n THR 63 N 2.89 3.54 0.00 5.49 -2.24 -1.26 -4.90 114.28 117.79 2feb n THR 63 Ca -0.01 -2.96 0.00 0.00 -2.27 0.00 0.00 64.05 58.80 2feb n THR 63 Cb 0.50 -2.61 0.00 0.00 -2.10 0.00 0.00 70.33 66.12 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 5.84 0.00 -2.07 -0.78 3.00 -1.26 -0.28 116.66 121.12 2feb n ARG 64 Ca 0.55 0.00 -0.28 0.00 -0.01 0.00 0.00 57.85 58.11 2feb n ARG 64 Cb 0.37 0.00 0.02 0.00 0.00 0.00 0.00 32.46 32.86 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 6.41 5.42 -4.43 0.55 0.23 -1.26 -2.10 115.26 120.07 2feb n ASN 65 Ca 0.00 -3.75 -0.44 0.00 -0.53 0.00 0.00 54.58 49.86 2feb n ASN 65 Cb 0.00 -0.51 -0.03 0.00 -2.08 0.00 0.00 39.78 37.15 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 -3.65 2.93 0.00 -2.53 1.51 0.62 -3.57 117.35 112.66 2feb s TYR 66 Ca 0.52 -0.98 0.00 0.00 -1.01 0.00 0.00 57.07 55.59 2feb s TYR 66 Cb 0.42 -4.22 0.00 0.00 -0.11 0.00 0.00 41.96 38.05 2feb s TYR 66 CO -0.07 -1.50 0.00 0.00 -1.11 0.00 0.00 175.55 172.86 2feb s ARG 68 N 0.00 1.85 -0.10 0.00 0.52 -1.26 -4.12 118.95 115.84 2feb s ARG 68 Ca 0.00 -1.76 -0.07 0.00 -0.52 0.00 0.00 55.73 53.38 2feb s ARG 68 Cb 0.00 0.43 0.03 0.00 0.52 0.00 0.00 34.95 35.93 2feb s ARG 68 CO 0.00 -0.76 0.25 0.54 0.02 0.00 0.00 175.30 175.36 2feb s ASN 69 N -3.24 -0.27 -0.01 0.23 2.20 -1.26 -2.61 114.94 109.99 2feb s ASN 69 Ca 0.31 0.52 -0.24 0.00 -0.94 0.00 0.00 52.86 52.51 2feb s ASN 69 Cb 0.00 0.47 -0.16 0.00 -2.00 0.00 0.00 41.25 39.56 2feb s ASN 69 CO 0.20 -0.12 1.14 1.55 -2.94 0.00 0.00 177.10 176.93 2feb h PRO 70 N 6.44 -0.36 0.00 3.55 0.13 -2.00 -3.42 132.00 136.35 2feb h PRO 70 Ca -0.33 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2feb h PRO 70 Cb 1.18 0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2feb h PRO 70 CO 0.36 -0.01 0.00 -0.25 -0.23 0.00 0.00 178.00 177.87 2feb n ASP 71 N -5.08 0.00 0.00 1.44 8.00 -1.26 -5.09 116.55 114.56 2feb n ASP 71 Ca -0.09 0.02 0.00 0.00 0.71 0.00 0.00 54.79 55.43 2feb n ASP 71 Cb 0.26 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.36 2feb n ASP 71 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2feb n ALA 72 N -2.59 0.00 -1.48 2.24 0.00 -1.26 -5.06 120.51 112.35 2feb n ALA 72 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.51 2feb n ALA 72 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 2feb n ALA 72 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2feb n GLU 73 N 0.00 -3.69 -0.28 0.00 2.13 -1.26 -4.44 120.64 113.10 2feb n GLU 73 Ca 0.00 2.93 0.01 0.00 0.66 0.00 0.00 57.16 60.76 2feb n GLU 73 Cb 0.00 -3.87 0.08 0.00 0.27 0.00 0.00 31.44 27.92 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 -0.52 0.17 -4.00 6.31 3.07 -2.01 -3.42 117.51 117.11 2feb h ILE 74 Ca -0.09 0.00 -0.11 0.00 1.55 0.00 0.00 64.86 66.21 2feb h ILE 74 Cb 1.12 0.17 -0.14 0.00 -0.27 0.00 0.00 36.82 37.71 2feb h ILE 74 CO 0.03 0.00 -0.46 0.00 -1.05 0.00 0.00 178.15 176.68 2feb s ARG 75 N -6.18 0.89 0.41 0.16 3.03 -1.26 -3.20 118.95 112.80 2feb s ARG 75 Ca -0.15 -1.14 -0.21 0.00 2.03 0.00 0.00 55.73 56.26 2feb s ARG 75 Cb 0.21 0.31 -0.15 0.00 -1.03 0.00 0.00 34.95 34.30 2feb s ARG 75 CO 0.74 -0.28 0.16 -2.30 -1.13 0.00 0.00 175.30 172.50 2feb n PRO 76 N -0.07 0.09 -3.48 3.89 -0.02 -1.26 -4.68 135.00 129.47 2feb n PRO 76 Ca -0.11 0.03 -0.26 0.00 -2.02 0.00 0.00 63.50 61.14 2feb n PRO 76 Cb 0.62 -1.08 -0.13 0.00 -0.02 0.00 0.00 33.50 32.89 2feb n PRO 76 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 2feb s TRP 77 N -1.65 0.27 0.25 6.00 1.48 -1.07 -2.04 118.94 122.18 2feb s TRP 77 Ca 0.60 -1.00 0.05 0.00 -1.06 0.00 0.00 56.10 54.69 2feb s TRP 77 Cb -0.63 -0.79 -0.02 0.00 -1.16 0.00 0.00 33.47 30.87 2feb s TRP 77 CO 0.62 -0.86 0.19 0.00 -4.06 0.00 0.00 176.95 172.85 2feb s TYR 79 N -2.95 2.10 0.37 0.00 2.02 -1.22 -1.64 117.35 116.03 2feb s TYR 79 Ca 0.27 0.30 0.08 0.00 -0.37 0.00 0.00 57.07 57.35 2feb s TYR 79 Cb 0.01 -3.61 -0.07 0.00 -0.40 0.00 0.00 41.96 37.89 2feb s TYR 79 CO 0.19 -2.06 -0.04 0.95 -1.57 0.00 0.00 175.55 173.02 2feb s THR 80 N -3.56 2.05 -0.45 -0.71 -4.23 -1.23 -2.23 115.64 105.29 2feb s THR 80 Ca 0.68 -2.09 0.23 0.00 -1.18 0.00 0.00 61.69 59.32 2feb s THR 80 Cb -0.07 -2.82 0.24 0.00 1.34 0.00 0.00 72.50 71.20 2feb s THR 80 CO 0.49 -0.10 1.70 0.80 -0.54 0.00 0.00 174.62 176.97 2feb n MET 81 N -0.87 0.19 -3.23 3.99 1.56 -1.26 -4.57 117.12 112.93 2feb n MET 81 Ca -0.05 0.45 -0.40 0.00 -0.27 0.00 0.00 57.70 57.43 2feb n MET 81 Cb 0.65 -1.88 -0.07 0.00 2.15 0.00 0.00 33.22 34.07 2feb n MET 81 CO 0.00 0.00 0.00 -0.51 -0.73 0.00 0.00 175.97 174.73 2feb s ASP 82 N -4.22 6.46 0.05 6.12 1.01 -1.26 -4.94 116.67 119.89 2feb s ASP 82 Ca 0.03 0.55 0.10 0.00 0.71 0.00 0.00 52.55 53.94 2feb s ASP 82 Cb 0.09 -2.29 0.43 0.00 1.01 0.00 0.00 42.92 42.16 2feb s ASP 82 CO 0.37 -0.28 1.30 -0.81 0.21 0.00 0.00 175.17 175.95 2feb n PRO 83 N 5.48 0.03 0.06 8.23 -0.04 -1.26 -1.95 135.00 145.56 2feb n PRO 83 Ca -0.04 0.41 -0.07 0.00 -0.04 0.00 0.00 63.50 63.76 2feb n PRO 83 Cb 0.50 -1.57 -0.12 0.00 -0.04 0.00 0.00 33.50 32.27 2feb n PRO 83 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2feb h SER 84 N 0.00 0.00 0.00 3.54 4.64 -1.94 -3.40 113.55 116.39 2feb h SER 84 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2feb h SER 84 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 2feb h SER 84 CO 0.00 1.00 0.00 0.52 -0.87 0.00 0.00 176.83 177.48 2feb n VAL 85 N -3.35 0.00 0.00 0.95 0.31 -0.82 -4.96 118.33 110.46 2feb n VAL 85 Ca -0.00 0.46 0.00 0.00 -0.01 0.00 0.00 64.34 64.79 2feb n VAL 85 Cb 0.94 -1.42 0.00 0.00 -0.91 0.00 0.00 33.84 32.45 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 -2.15 0.00 -3.63 5.55 1.74 -1.11 -4.92 116.66 112.15 2feb n ARG 86 Ca 0.00 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.97 2feb n ARG 86 Cb 0.00 -1.35 -0.07 0.00 -1.02 0.00 0.00 32.46 30.03 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 -2.21 -0.57 0.11 -1.55 -0.11 -1.26 -3.69 118.94 109.66 2feb s TRP 87 Ca 0.00 1.36 -0.25 0.00 1.22 0.00 0.00 56.10 58.43 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 -0.29 0.67 -1.21 -4.62 0.00 0.00 176.95 171.50 2feb s GLU 88 N 0.16 1.16 -0.20 5.86 0.41 -0.65 -4.86 118.70 120.58 2feb s GLU 88 Ca 0.02 -0.36 -0.18 0.00 -0.41 0.00 0.00 54.97 54.04 2feb s GLU 88 Cb -0.05 0.54 -0.03 0.00 -1.78 0.00 0.00 34.13 32.81 2feb s GLU 88 CO -0.03 -0.50 0.49 0.71 -0.49 0.00 0.00 175.26 175.44 2feb s TYR 89 N -3.36 3.37 0.14 1.61 1.51 -1.26 -3.61 117.35 115.75 2feb s TYR 89 Ca 0.01 0.73 -0.32 0.00 -1.01 0.00 0.00 57.07 56.48 2feb s TYR 89 Cb -0.01 -2.64 -0.18 0.00 -0.11 0.00 0.00 41.96 39.03 2feb s TYR 89 CO -0.10 -0.09 0.73 0.00 -1.11 0.00 0.00 175.55 174.98 2feb s ASN 91 N -0.64 4.94 -0.30 0.00 6.03 0.42 -4.86 114.94 120.52 2feb s ASN 91 Ca 0.72 1.24 -0.08 0.00 -1.03 0.00 0.00 52.86 53.71 2feb s ASN 91 Cb -1.02 -2.51 0.15 0.00 -3.03 0.00 0.00 41.25 34.84 2feb s ASN 91 CO 0.56 -2.47 0.67 -0.76 -2.03 0.00 0.00 177.10 173.07 2feb s LEU 92 N 10.31 -1.15 -0.07 3.54 1.02 0.37 -4.50 118.68 128.21 2feb s LEU 92 Ca 0.93 1.36 0.02 0.00 0.02 0.00 0.00 54.13 56.46 2feb s LEU 92 Cb -0.21 2.22 -0.03 0.00 0.02 0.00 0.00 46.19 48.19 2feb s LEU 92 CO 0.29 -0.22 -0.09 0.42 0.02 0.00 0.00 176.35 176.76 2feb s THR 93 N 2.86 3.48 -0.16 5.49 -4.23 0.78 -4.58 115.64 119.28 2feb s THR 93 Ca 0.00 -0.56 -0.29 0.00 -1.18 0.00 0.00 61.69 59.66 2feb s THR 93 Cb -0.12 -2.41 -0.06 0.00 1.34 0.00 0.00 72.50 71.25 2feb s THR 93 CO -0.19 0.59 2.06 -0.13 -0.54 0.00 0.00 174.62 176.41 2feb s ARG 94 N -0.73 3.47 0.69 3.99 0.52 -1.26 0.54 118.95 126.18 2feb s ARG 94 Ca 0.11 2.10 -0.10 0.00 -0.52 0.00 0.00 55.73 57.32 2feb s ARG 94 Cb -0.11 -4.27 0.03 0.00 0.52 0.00 0.00 34.95 31.12 2feb s ARG 94 CO 0.01 -1.71 1.05 0.00 0.02 0.00 0.00 175.30 174.67 2feb s PRO 96 N -5.29 4.24 0.89 0.00 0.04 -1.26 -4.99 135.00 128.63 2feb s PRO 96 Ca 0.58 2.00 -0.11 0.00 0.04 0.00 0.00 61.00 63.51 2feb s PRO 96 Cb -0.11 -3.70 0.12 0.00 0.04 0.00 0.00 34.50 30.85 2feb s PRO 96 CO 0.49 -0.67 1.10 0.28 0.04 0.00 0.00 177.00 178.24 2feb n VAL 97 N 4.97 0.52 -2.47 -0.36 0.31 -1.26 -4.57 118.33 115.47 2feb n VAL 97 Ca 0.14 -0.07 -0.02 0.00 -0.01 0.00 0.00 64.34 64.38 2feb n VAL 97 Cb 0.43 -1.02 -0.02 0.00 -0.91 0.00 0.00 33.84 32.33 2feb n VAL 97 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2feb n THR 98 N -3.96-11.71 0.01 2.52 -2.24 -1.26 -5.01 114.28 92.63 2feb n THR 98 Ca 0.12 2.66 0.00 0.00 -2.27 0.00 0.00 64.05 64.56 2feb n THR 98 Cb 0.52 -5.77 0.00 0.00 -2.10 0.00 0.00 70.33 62.97 2feb n THR 98 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2feb n GLU 99 N 1.86 0.00 -2.67 -0.78 0.28 -1.26 -5.08 120.64 112.99 2feb n GLU 99 Ca -0.17 0.00 -0.03 0.00 -0.16 0.00 0.00 57.16 56.81 2feb n GLU 99 Cb 0.26 0.00 0.03 0.00 1.43 0.00 0.00 31.44 33.16 2feb n GLU 99 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2feb s SER 100 N -2.00 -0.25 0.07 -1.84 0.15 -1.26 -5.11 113.70 103.47 2feb s SER 100 Ca 0.00 -0.29 0.00 0.00 0.70 0.00 0.00 55.95 56.36 2feb s SER 100 Cb 0.00 0.32 0.00 0.00 -1.71 0.00 0.00 66.02 64.63 2feb s SER 100 CO 0.00 -0.01 0.00 -1.20 1.20 0.00 0.00 173.24 173.23 2feb n SER 101 N 2.62 -9.12 0.00 5.45 7.64 -1.26 -5.26 113.62 113.69 2feb n SER 101 Ca 0.11 1.66 0.03 0.00 1.01 0.00 0.00 58.87 61.67 2feb n SER 101 Cb 0.65 -5.01 0.16 0.00 -1.01 0.00 0.00 64.21 59.01 2feb n SER 101 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55