#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oco s HIS 2 N 0.00 3.46 0.00 7.33 4.02 -1.26 -3.71 115.29 125.13 1oco s HIS 2 Ca 0.00 1.38 0.00 0.00 1.02 0.00 0.00 55.06 57.46 1oco s HIS 2 Cb 0.00 -3.07 0.00 0.00 -1.02 0.00 0.00 32.58 28.49 1oco s HIS 2 CO 0.00 -0.22 0.00 0.41 1.02 0.00 0.00 174.74 175.95 1oco n GLY 3 N 3.30 1.71 3.57 -2.22 0.00 -1.26 -4.91 105.19 105.38 1oco n GLY 3 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1oco n GLY 3 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1oco s SER 4 N 0.00 5.79 0.07 1.61 1.04 -1.24 -4.97 113.70 115.99 1oco s SER 4 Ca 0.00 0.48 0.05 0.00 0.48 0.00 0.00 55.95 56.96 1oco s SER 4 Cb 0.00 -2.54 -0.03 0.00 0.10 0.00 0.00 66.02 63.56 1oco s SER 4 CO 0.00 -1.94 -0.15 -1.00 0.98 0.00 0.00 173.24 171.13 1oco s HIS 5 N 7.24 1.28 0.53 5.02 3.76 -1.26 -4.57 115.29 127.29 1oco s HIS 5 Ca 0.62 -0.43 -0.02 0.00 -0.15 0.00 0.00 55.06 55.08 1oco s HIS 5 Cb -0.13 -0.73 0.01 0.00 1.11 0.00 0.00 32.58 32.84 1oco s HIS 5 CO 0.25 0.07 0.78 -1.83 -0.85 0.00 0.00 174.74 173.16 1oco s GLU 6 N -1.60 2.88 0.64 1.40 -1.05 -1.26 -5.11 118.70 114.59 1oco s GLU 6 Ca -0.00 -0.37 -0.07 0.00 -0.15 0.00 0.00 54.97 54.37 1oco s GLU 6 Cb -0.09 -2.43 0.02 0.00 -0.44 0.00 0.00 34.13 31.18 1oco s GLU 6 CO 0.02 -0.54 0.97 0.95 0.95 0.00 0.00 175.26 177.61 1oco s THR 7 N -2.77 3.39 0.16 1.83 -4.23 -1.26 -4.86 115.64 107.90 1oco s THR 7 Ca 0.52 0.07 -0.16 0.00 -1.18 0.00 0.00 61.69 60.94 1oco s THR 7 Cb -0.10 -3.39 0.03 0.00 1.34 0.00 0.00 72.50 70.38 1oco s THR 7 CO 0.41 -0.43 1.73 0.44 -0.54 0.00 0.00 174.62 176.23 1oco h ASP 8 N -0.36 0.04 -0.53 3.99 3.32 -1.99 -0.10 116.42 120.79 1oco h ASP 8 Ca -0.45 0.05 0.08 0.00 0.02 0.00 0.00 57.03 56.73 1oco h ASP 8 Cb 1.27 0.07 -0.06 0.00 0.22 0.00 0.00 39.33 40.82 1oco h ASP 8 CO 0.61 0.06 0.19 -0.33 -1.72 0.00 0.00 179.24 178.05 1oco h GLU 9 N 0.21 0.36 -0.78 3.56 3.07 -1.99 0.06 114.58 119.06 1oco h GLU 9 Ca 0.17 -0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 58.98 1oco h GLU 9 Cb 0.18 -0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 27.98 1oco h GLU 9 CO -0.21 0.24 0.38 0.93 -1.40 0.00 0.00 179.01 178.94 1oco h GLU 10 N 0.37 1.13 -0.23 2.33 5.08 -1.70 -0.70 114.58 120.86 1oco h GLU 10 Ca 0.26 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1oco h GLU 10 Cb 0.29 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1oco h GLU 10 CO -0.27 0.87 0.15 0.35 -1.00 0.00 0.00 179.01 179.11 1oco h PHE 11 N 1.11 0.29 -0.57 4.33 3.57 0.24 0.05 116.94 125.97 1oco h PHE 11 Ca 0.27 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.77 1oco h PHE 11 Cb 0.12 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 1oco h PHE 11 CO 0.01 0.20 0.35 -0.44 -2.23 0.00 0.00 178.31 176.20 1oco h ASP 12 N 0.30 0.68 0.46 0.41 3.32 -0.75 -2.61 116.42 118.23 1oco h ASP 12 Ca 0.08 -0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 1oco h ASP 12 Cb -0.02 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.37 1oco h ASP 12 CO -0.02 0.53 -0.22 0.00 -1.72 0.00 0.00 179.24 177.82 1oco h ALA 13 N 1.17 -0.61 -1.23 3.45 0.00 -0.87 -0.56 119.26 120.61 1oco h ALA 13 Ca 0.20 -0.15 0.37 0.00 0.00 0.00 0.00 54.91 55.34 1oco h ALA 13 Cb -0.02 0.24 -0.11 0.00 0.00 0.00 0.00 17.79 17.90 1oco h ALA 13 CO -0.04 -0.82 0.81 -0.09 0.00 0.00 0.00 179.25 179.11 1oco h ARG 14 N -0.65 0.18 0.19 0.00 2.43 -0.87 0.26 114.38 115.91 1oco h ARG 14 Ca -0.06 -0.01 -0.35 0.00 -0.81 0.00 0.00 59.98 58.75 1oco h ARG 14 Cb 0.49 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 30.01 1oco h ARG 14 CO 0.10 0.12 -1.73 -1.49 -1.51 0.00 0.00 179.97 175.46 1oco h TRP 15 N 0.18 0.74 -0.58 2.20 4.06 -1.06 -1.97 115.95 119.53 1oco h TRP 15 Ca 0.72 -0.54 -0.00 0.00 2.06 0.00 0.00 58.89 61.12 1oco h TRP 15 Cb 2.21 -0.03 -0.03 0.00 -1.00 0.00 0.00 29.16 30.32 1oco h TRP 15 CO -0.00 1.67 0.35 0.28 -3.56 0.00 0.00 178.44 177.17 1oco h VAL 16 N 0.11 1.17 -0.70 1.49 2.07 0.65 -0.03 116.25 121.01 1oco h VAL 16 Ca -0.34 -0.39 -0.07 0.00 0.82 0.00 0.00 66.70 66.73 1oco h VAL 16 Cb 2.11 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 32.24 1oco h VAL 16 CO 0.19 0.18 0.16 0.74 0.02 0.00 0.00 177.57 178.86 1oco h THR 17 N 0.78 1.26 0.15 2.57 2.02 -0.70 -2.05 112.91 116.95 1oco h THR 17 Ca 0.21 -0.98 -0.01 0.00 0.77 0.00 0.00 66.41 66.40 1oco h THR 17 Cb -0.02 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 1oco h THR 17 CO -0.04 0.38 -0.08 0.22 0.37 0.00 0.00 175.52 176.37 1oco h TYR 18 N 1.07 -0.20 0.00 3.16 3.20 -0.52 -2.75 116.97 120.93 1oco h TYR 18 Ca 0.22 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.09 1oco h TYR 18 Cb 0.38 0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.71 1oco h TYR 18 CO 0.03 -0.12 0.00 0.74 -1.64 0.00 0.00 178.16 177.17 1oco h PHE 19 N -0.21 0.00 -0.00 -3.82 0.04 -0.88 -2.97 116.94 109.10 1oco h PHE 19 Ca -0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.75 1oco h PHE 19 Cb 0.16 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.31 1oco h PHE 19 CO -0.07 0.00 -0.38 0.09 -0.60 0.00 0.00 178.31 177.35 1oco n ASN 20 N -2.35 0.71 -4.56 2.17 3.02 -0.78 -4.56 115.26 108.91 1oco n ASN 20 Ca 0.02 -0.52 -0.53 0.00 -0.03 0.00 0.00 54.58 53.52 1oco n ASN 20 Cb 0.23 0.19 -0.07 0.00 -0.61 0.00 0.00 39.78 39.52 1oco n ASN 20 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1oco n LYS 21 N -1.13 1.24 -0.33 3.52 4.81 -1.12 -4.76 118.16 120.38 1oco n LYS 21 Ca 0.09 0.40 0.04 0.00 -0.87 0.00 0.00 58.31 57.97 1oco n LYS 21 Cb 0.34 -2.35 0.20 0.00 0.02 0.00 0.00 35.03 33.24 1oco n LYS 21 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 1oco h PRO 22 N 10.17 0.89 -0.94 1.64 0.13 -1.92 -2.15 132.00 139.82 1oco h PRO 22 Ca -0.36 -0.05 -0.23 0.00 -0.87 0.00 0.00 66.00 64.48 1oco h PRO 22 Cb 1.32 -0.20 -0.14 0.00 0.13 0.00 0.00 31.00 32.11 1oco h PRO 22 CO 0.99 0.59 0.29 -0.40 -0.23 0.00 0.00 178.00 179.25 1oco n ASP 23 N -4.67 3.53 -4.76 1.44 5.75 -1.26 -4.94 116.55 111.65 1oco n ASP 23 Ca 0.16 -2.85 -0.41 0.00 -0.01 0.00 0.00 54.79 51.68 1oco n ASP 23 Cb 0.30 -0.68 -0.03 0.00 -1.03 0.00 0.00 41.12 39.68 1oco n ASP 23 CO 0.00 0.00 0.00 -0.51 -0.11 0.00 0.00 177.20 176.58 1oco s ILE 24 N -1.97 3.12 0.51 2.12 2.07 -0.81 -5.04 121.20 121.21 1oco s ILE 24 Ca 0.33 1.12 0.07 0.00 -1.41 0.00 0.00 60.65 60.76 1oco s ILE 24 Cb 0.27 -3.71 0.03 0.00 0.13 0.00 0.00 42.46 39.18 1oco s ILE 24 CO 0.07 0.26 0.46 1.51 -1.91 0.00 0.00 174.94 175.34 1oco s ASP 25 N -0.63 4.82 0.37 4.50 -4.77 -1.26 -4.94 116.67 114.76 1oco s ASP 25 Ca 0.47 -1.04 0.04 0.00 -3.30 0.00 0.00 52.55 48.72 1oco s ASP 25 Cb -0.36 0.12 0.73 0.00 -1.09 0.00 0.00 42.92 42.32 1oco s ASP 25 CO 0.46 -1.02 2.03 0.00 0.70 0.00 0.00 175.17 177.34 1oco h ALA 26 N 0.73 1.62 0.29 2.11 0.00 -1.98 -1.56 119.26 120.47 1oco h ALA 26 Ca -0.37 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 1oco h ALA 26 Cb 1.29 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1oco h ALA 26 CO 0.54 0.36 -0.24 2.35 0.00 0.00 0.00 179.25 182.26 1oco h TRP 27 N 0.74 -0.64 0.00 0.00 7.01 -1.99 -0.09 115.95 120.97 1oco h TRP 27 Ca 0.20 0.00 -0.03 0.00 2.11 0.00 0.00 58.89 61.18 1oco h TRP 27 Cb -0.08 0.24 -0.00 0.00 -2.10 0.00 0.00 29.16 27.22 1oco h TRP 27 CO -0.00 -0.36 -0.12 0.93 -2.79 0.00 0.00 178.44 176.10 1oco h GLU 28 N -0.55 0.00 0.20 2.65 5.08 -1.82 0.70 114.58 120.84 1oco h GLU 28 Ca -0.02 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1oco h GLU 28 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1oco h GLU 28 CO -0.02 0.12 -0.10 1.25 -1.00 0.00 0.00 179.01 179.26 1oco h LEU 29 N 0.00 -0.23 -0.61 1.33 6.46 -0.57 -1.27 115.31 120.42 1oco h LEU 29 Ca -0.00 -0.20 -0.02 0.00 -0.12 0.00 0.00 57.88 57.54 1oco h LEU 29 Cb 0.24 0.06 -0.03 0.00 -0.73 0.00 0.00 40.66 40.20 1oco h LEU 29 CO 0.02 0.09 0.31 0.03 -0.62 0.00 0.00 178.44 178.26 1oco h ARG 30 N -0.56 0.88 0.77 1.25 3.08 -0.56 -2.50 114.38 116.73 1oco h ARG 30 Ca -0.03 -0.12 -0.03 0.00 0.07 0.00 0.00 59.98 59.87 1oco h ARG 30 Cb 0.42 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 1oco h ARG 30 CO 0.04 0.69 -0.47 -0.22 -1.07 0.00 0.00 179.97 178.94 1oco h LYS 31 N 0.84 -1.12 -0.51 0.04 1.63 -0.85 0.17 116.57 116.77 1oco h LYS 31 Ca 0.21 0.08 0.08 0.00 -0.85 0.00 0.00 60.65 60.17 1oco h LYS 31 Cb 0.09 0.25 -0.10 0.00 -0.60 0.00 0.00 32.23 31.88 1oco h LYS 31 CO -0.03 -0.75 -0.44 0.78 -3.45 0.00 0.00 179.45 175.57 1oco h GLY 32 N -1.16 -0.52 0.86 5.01 0.00 -1.20 0.19 103.07 106.25 1oco h GLY 32 Ca -0.10 0.57 -0.01 0.00 0.00 0.00 0.00 47.33 47.79 1oco h GLY 32 CO 0.10 -0.16 -0.05 -0.33 0.00 0.00 0.00 176.54 176.10 1oco h MET 33 N -0.27 -0.13 -0.29 4.80 2.86 -1.36 0.73 114.93 121.27 1oco h MET 33 Ca 0.16 0.01 0.08 0.00 -2.06 0.00 0.00 59.70 57.89 1oco h MET 33 Cb 0.57 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.25 1oco h MET 33 CO -0.64 0.04 0.30 -0.91 1.06 0.00 0.00 176.91 176.75 1oco h ASN 34 N -0.28 0.00 0.05 1.22 2.35 -0.08 -1.00 115.58 117.85 1oco h ASN 34 Ca -0.01 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.58 1oco h ASN 34 Cb 0.23 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.59 1oco h ASN 34 CO 0.02 0.00 -0.77 0.74 -1.65 0.00 0.00 177.43 175.78 1oco h THR 35 N 0.00 1.37 -0.26 2.81 2.02 -0.14 -3.34 112.91 115.36 1oco h THR 35 Ca 0.14 -2.36 0.08 0.00 0.77 0.00 0.00 66.41 65.03 1oco h THR 35 Cb 0.74 2.94 -0.01 0.00 -1.74 0.00 0.00 68.15 70.08 1oco h THR 35 CO -0.00 0.59 0.22 0.25 0.37 0.00 0.00 175.52 176.95 1oco h LEU 36 N -0.72 0.00 -0.48 2.58 5.85 0.41 -1.75 115.31 121.20 1oco h LEU 36 Ca -0.18 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.54 1oco h LEU 36 Cb 1.37 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.40 1oco h LEU 36 CO -0.00 0.00 0.00 0.58 -0.34 0.00 0.00 178.44 178.68 1oco h VAL 37 N 0.00 0.00 -0.01 1.05 2.07 -1.45 -3.07 116.25 114.84 1oco h VAL 37 Ca 0.13 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.25 1oco h VAL 37 Cb 0.56 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1oco h VAL 37 CO -0.00 0.00 -0.13 0.61 0.02 0.00 0.00 177.57 178.07 1oco n GLY 38 N 0.55 -0.33 3.92 2.17 0.00 -0.66 -4.88 105.19 105.96 1oco n GLY 38 Ca 0.03 -0.42 -0.26 0.00 0.00 0.00 0.00 46.02 45.37 1oco n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oco s TYR 39 N -2.27 3.23 -1.25 1.61 2.02 -1.16 -5.00 117.35 114.52 1oco s TYR 39 Ca 0.31 0.57 -0.12 0.00 -0.37 0.00 0.00 57.07 57.46 1oco s TYR 39 Cb 0.20 -2.70 0.16 0.00 -0.40 0.00 0.00 41.96 39.22 1oco s TYR 39 CO 0.43 -0.79 1.69 -3.47 -1.57 0.00 0.00 175.55 171.84 1oco n ASP 40 N -2.53 5.12 0.00 2.29 2.03 -1.26 -4.88 116.55 117.32 1oco n ASP 40 Ca 0.04 -3.04 0.00 0.00 0.52 0.00 0.00 54.79 52.31 1oco n ASP 40 Cb 0.58 -1.53 0.00 0.00 -0.72 0.00 0.00 41.12 39.45 1oco n ASP 40 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1oco n LEU 41 N 4.81 0.00 -4.69 -2.67 -0.00 -1.26 -5.10 117.00 108.09 1oco n LEU 41 Ca 0.39 0.00 -0.39 0.00 -0.00 0.00 0.00 56.01 56.01 1oco n LEU 41 Cb 0.39 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.76 1oco n LEU 41 CO 0.73 0.00 0.32 -0.69 -0.00 0.00 0.00 177.39 177.76 1oco s VAL 42 N -2.00 5.08 0.51 1.47 1.01 -1.26 -4.97 120.40 120.24 1oco s VAL 42 Ca 0.00 1.20 -0.22 0.00 0.00 0.00 0.00 61.98 62.95 1oco s VAL 42 Cb 0.00 -3.94 -0.07 0.00 0.00 0.00 0.00 36.38 32.38 1oco s VAL 42 CO 0.00 0.21 1.21 -2.65 0.00 0.00 0.00 175.10 173.87 1oco n PRO 43 N 4.29 1.54 -1.73 2.72 -0.02 -1.26 -4.95 135.00 135.58 1oco n PRO 43 Ca -0.03 0.56 -0.38 0.00 -2.02 0.00 0.00 63.50 61.63 1oco n PRO 43 Cb 0.51 -2.37 0.04 0.00 -0.02 0.00 0.00 33.50 31.66 1oco n PRO 43 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1oco n GLU 44 N -0.61 1.61 -0.19 -0.52 -0.58 -1.26 -4.78 120.64 114.30 1oco n GLU 44 Ca 0.10 0.59 0.04 0.00 -0.42 0.00 0.00 57.16 57.47 1oco n GLU 44 Cb 0.43 -2.54 0.31 0.00 -0.57 0.00 0.00 31.44 29.07 1oco n GLU 44 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 1oco h PRO 45 N 1.32 0.84 0.00 3.49 0.11 -1.93 0.18 132.00 136.01 1oco h PRO 45 Ca -0.51 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.54 1oco h PRO 45 Cb 1.31 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 1oco h PRO 45 CO 0.56 0.55 -0.06 1.57 -0.21 0.00 0.00 178.00 180.42 1oco h LYS 46 N 0.86 0.00 0.18 1.05 2.10 -1.95 0.41 116.57 119.23 1oco h LYS 46 Ca 0.29 0.00 -0.29 0.00 -2.00 0.00 0.00 60.65 58.65 1oco h LYS 46 Cb 0.09 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.44 1oco h LYS 46 CO -0.09 0.06 -1.38 0.82 -2.00 0.00 0.00 179.45 176.86 1oco h ILE 47 N 0.00 1.19 0.00 0.07 2.04 -1.05 -3.10 117.51 116.65 1oco h ILE 47 Ca -0.00 -2.54 -0.04 0.00 1.00 0.00 0.00 64.86 63.27 1oco h ILE 47 Cb 0.16 2.93 -0.01 0.00 -0.74 0.00 0.00 36.82 39.17 1oco h ILE 47 CO 0.01 0.78 -0.21 0.40 0.00 0.00 0.00 178.15 179.13 1oco h ILE 48 N -0.09 0.98 0.64 -0.67 1.08 0.10 -2.66 117.51 116.90 1oco h ILE 48 Ca -0.27 -0.75 -0.03 0.00 -0.39 0.00 0.00 64.86 63.42 1oco h ILE 48 Cb 1.94 1.42 0.01 0.00 -3.07 0.00 0.00 36.82 37.11 1oco h ILE 48 CO 0.17 0.20 -0.31 -0.78 -0.69 0.00 0.00 178.15 176.75 1oco h ASP 49 N 0.00 -0.73 -0.88 1.72 1.82 -0.29 -1.41 116.42 116.65 1oco h ASP 49 Ca -0.00 0.02 0.23 0.00 -0.39 0.00 0.00 57.03 56.89 1oco h ASP 49 Cb 0.41 0.19 -0.13 0.00 0.68 0.00 0.00 39.33 40.47 1oco h ASP 49 CO 0.03 -0.34 0.32 0.00 -1.61 0.00 0.00 179.24 177.64 1oco h ALA 50 N -1.22 1.37 -0.12 -0.78 0.00 -1.44 0.13 119.26 117.21 1oco h ALA 50 Ca -0.09 0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.85 1oco h ALA 50 Cb 0.66 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1oco h ALA 50 CO 0.14 -0.41 -0.62 0.00 0.00 0.00 0.00 179.25 178.37 1oco h ALA 51 N 1.74 0.72 -0.48 0.00 0.00 -1.48 -0.68 119.26 119.07 1oco h ALA 51 Ca 0.56 -0.55 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1oco h ALA 51 Cb 1.10 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1oco h ALA 51 CO -0.59 0.72 0.03 -0.07 0.00 0.00 0.00 179.25 179.34 1oco h LEU 52 N 0.31 0.74 0.21 0.00 3.38 0.35 -2.36 115.31 117.93 1oco h LEU 52 Ca -0.01 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 1oco h LEU 52 Cb 1.16 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1oco h LEU 52 CO 0.11 0.79 -0.10 0.03 0.09 0.00 0.00 178.44 179.35 1oco h ARG 53 N 0.73 -0.28 -1.28 1.13 3.08 -0.94 -2.96 114.38 113.86 1oco h ARG 53 Ca 0.15 0.02 0.41 0.00 0.07 0.00 0.00 59.98 60.62 1oco h ARG 53 Cb 0.41 0.06 -0.12 0.00 0.08 0.00 0.00 29.97 30.40 1oco h ARG 53 CO 0.01 0.11 0.83 0.00 -1.07 0.00 0.00 179.97 179.86 1oco h ALA 54 N -0.34 2.69 -0.27 0.04 0.00 -1.03 1.27 119.26 121.61 1oco h ALA 54 Ca -0.03 0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1oco h ALA 54 Cb 0.51 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1oco h ALA 54 CO 0.05 -1.27 0.14 0.00 0.00 0.00 0.00 179.25 178.17 1oco h ARG 56 N 0.29 -0.13 -0.83 0.00 9.65 0.17 0.29 114.38 123.82 1oco h ARG 56 Ca 0.11 0.01 0.13 0.00 -1.10 0.00 0.00 59.98 59.13 1oco h ARG 56 Cb 0.03 0.03 -0.06 0.00 -1.39 0.00 0.00 29.97 28.57 1oco h ARG 56 CO -0.07 -0.08 0.54 0.00 2.80 0.00 0.00 179.97 183.16 1oco h ARG 57 N -0.13 0.63 -0.55 0.20 3.08 -0.74 0.72 114.38 117.58 1oco h ARG 57 Ca 0.14 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1oco h ARG 57 Cb 0.34 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.25 1oco h ARG 57 CO -0.33 0.41 0.00 1.28 -1.07 0.00 0.00 179.97 180.26 1oco n LEU 58 N -4.53 3.02 -4.08 3.04 4.77 -0.14 -4.93 117.00 114.16 1oco n LEU 58 Ca 0.16 -1.52 -0.41 0.00 -0.03 0.00 0.00 56.01 54.21 1oco n LEU 58 Cb 0.44 -0.41 -0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1oco n LEU 58 CO 0.31 0.61 -0.23 0.59 -1.33 0.00 0.00 177.39 177.34 1oco n ASN 59 N 0.78 -2.96 -3.82 -1.43 3.02 0.25 -4.92 115.26 106.19 1oco n ASN 59 Ca 0.17 -1.25 -0.30 0.00 -0.03 0.00 0.00 54.58 53.17 1oco n ASN 59 Cb 0.54 -1.93 -0.14 0.00 -0.61 0.00 0.00 39.78 37.64 1oco n ASN 59 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1oco s ASP 60 N -3.76 4.11 -0.02 6.41 -1.08 0.16 -4.98 116.67 117.51 1oco s ASP 60 Ca 0.36 -2.30 -0.23 0.00 -0.52 0.00 0.00 52.55 49.85 1oco s ASP 60 Cb -0.19 -1.21 -0.20 0.00 -1.46 0.00 0.00 42.92 39.86 1oco s ASP 60 CO 0.96 -0.33 1.16 0.15 0.52 0.00 0.00 175.17 177.63 1oco h PHE 61 N 7.27 0.29 -0.62 -5.34 3.57 -1.91 -3.17 116.94 117.03 1oco h PHE 61 Ca -0.06 -0.12 0.12 0.00 3.53 0.00 0.00 57.97 61.43 1oco h PHE 61 Cb 0.97 -0.05 -0.09 0.00 2.79 0.00 0.00 35.95 39.57 1oco h PHE 61 CO 0.45 0.83 0.15 0.00 -2.23 0.00 0.00 178.31 177.51 1oco h ALA 62 N 0.40 0.76 -0.43 2.41 0.00 -1.99 0.57 119.26 120.98 1oco h ALA 62 Ca -0.01 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1oco h ALA 62 Cb 0.85 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1oco h ALA 62 CO 0.04 -0.29 0.10 0.77 0.00 0.00 0.00 179.25 179.87 1oco h SER 63 N 0.28 0.59 -0.62 0.00 0.02 -1.99 -0.07 113.55 111.76 1oco h SER 63 Ca 0.33 -0.09 0.01 0.00 -0.84 0.00 0.00 61.79 61.20 1oco h SER 63 Cb 0.49 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.84 1oco h SER 63 CO -0.40 0.60 0.41 0.00 -1.14 0.00 0.00 176.83 176.29 1oco h ALA 64 N 1.49 0.79 -0.07 3.77 0.00 -0.88 0.31 119.26 124.66 1oco h ALA 64 Ca 0.14 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1oco h ALA 64 Cb 0.25 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1oco h ALA 64 CO -0.00 0.20 -0.04 0.28 0.00 0.00 0.00 179.25 179.69 1oco h VAL 65 N 0.82 1.33 -0.53 0.00 2.07 -0.75 -3.10 116.25 116.09 1oco h VAL 65 Ca 0.23 -1.07 0.00 0.00 0.82 0.00 0.00 66.70 66.68 1oco h VAL 65 Cb -0.08 1.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 1oco h VAL 65 CO -0.06 0.30 0.34 -0.09 0.02 0.00 0.00 177.57 178.08 1oco h ARG 66 N -0.24 0.70 -0.83 1.57 2.43 -0.81 -1.02 114.38 116.18 1oco h ARG 66 Ca 0.01 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1oco h ARG 66 Cb 0.49 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.85 1oco h ARG 66 CO 0.01 0.47 0.47 0.82 -1.51 0.00 0.00 179.97 180.24 1oco h ILE 67 N 0.72 1.23 0.00 1.20 2.04 -0.92 -1.09 117.51 120.70 1oco h ILE 67 Ca 0.19 -0.55 -0.07 0.00 1.00 0.00 0.00 64.86 65.43 1oco h ILE 67 Cb -0.06 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.10 1oco h ILE 67 CO -0.04 0.26 -0.36 -0.07 0.00 0.00 0.00 178.15 177.94 1oco h LEU 68 N 1.14 0.00 -0.30 1.44 3.38 -1.14 -2.44 115.31 117.39 1oco h LEU 68 Ca 0.29 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.22 1oco h LEU 68 Cb -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1oco h LEU 68 CO -0.05 0.36 0.03 -0.33 0.09 0.00 0.00 178.44 178.53 1oco h GLU 69 N 0.00 0.51 -0.67 1.13 5.08 -0.49 -3.14 114.58 117.00 1oco h GLU 69 Ca -0.00 -0.15 -0.06 0.00 -1.00 0.00 0.00 59.36 58.15 1oco h GLU 69 Cb 0.70 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.87 1oco h GLU 69 CO 0.05 0.63 0.20 -0.24 -1.00 0.00 0.00 179.01 178.65 1oco h VAL 70 N 0.32 1.25 -0.32 3.13 3.04 -0.97 -1.46 116.25 121.24 1oco h VAL 70 Ca 0.09 -0.87 0.01 0.00 -1.01 0.00 0.00 66.70 64.92 1oco h VAL 70 Cb 0.39 0.52 -0.02 0.00 -2.01 0.00 0.00 31.29 30.17 1oco h VAL 70 CO 0.01 0.34 0.18 0.58 -1.01 0.00 0.00 177.57 177.67 1oco h VAL 71 N 0.99 1.03 -0.13 1.51 2.07 -1.47 0.14 116.25 120.39 1oco h VAL 71 Ca 0.22 -0.13 0.02 0.00 0.82 0.00 0.00 66.70 67.62 1oco h VAL 71 Cb 0.30 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 1oco h VAL 71 CO -0.01 0.07 0.02 0.50 0.02 0.00 0.00 177.57 178.18 1oco h LYS 72 N 0.38 0.08 -0.49 1.57 3.64 -1.44 -2.34 116.57 117.96 1oco h LYS 72 Ca 0.13 -0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.56 1oco h LYS 72 Cb 0.00 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.75 1oco h LYS 72 CO -0.06 0.05 0.19 0.22 -2.27 0.00 0.00 179.45 177.59 1oco h ASP 73 N 0.08 0.22 -0.53 4.20 3.58 -0.85 -1.38 116.42 121.74 1oco h ASP 73 Ca 0.06 0.05 0.12 0.00 0.42 0.00 0.00 57.03 57.68 1oco h ASP 73 Cb 0.05 0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.09 1oco h ASP 73 CO -0.08 0.16 0.37 0.11 -2.88 0.00 0.00 179.24 176.92 1oco h LYS 74 N 0.38 0.20 0.00 0.28 1.79 -0.22 0.14 116.57 119.14 1oco h LYS 74 Ca 0.23 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.69 1oco h LYS 74 Cb 0.22 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 1oco h LYS 74 CO -0.22 0.13 0.00 0.00 -1.08 0.00 0.00 179.45 178.29 1oco h ALA 75 N 1.74 1.00 -0.68 3.86 0.00 -0.84 -3.45 119.26 120.88 1oco h ALA 75 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1oco h ALA 75 Cb 0.71 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1oco h ALA 75 CO -0.04 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.62 1oco n GLY 76 N -0.20 3.47 0.08 0.00 0.00 0.03 -1.20 105.19 107.37 1oco n GLY 76 Ca 0.01 0.07 0.11 0.00 0.00 0.00 0.00 46.02 46.20 1oco n GLY 76 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1oco n PRO 77 N 14.00 0.13 -2.71 1.61 -0.04 -1.26 -4.60 135.00 142.13 1oco n PRO 77 Ca 0.00 0.33 -0.43 0.00 -0.04 0.00 0.00 63.50 63.35 1oco n PRO 77 Cb 0.00 -1.73 0.00 0.00 -0.04 0.00 0.00 33.50 31.73 1oco n PRO 77 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1oco n HIS 78 N -1.97 4.75 0.05 0.54 8.25 -0.34 -4.86 115.22 121.65 1oco n HIS 78 Ca 0.03 -3.05 0.03 0.00 -0.26 0.00 0.00 57.72 54.47 1oco n HIS 78 Cb 0.23 -2.45 0.13 0.00 1.12 0.00 0.00 29.99 29.02 1oco n HIS 78 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 1oco n LYS 79 N 7.22 0.03 0.04 -0.41 -0.00 -1.26 -2.17 118.16 121.61 1oco n LYS 79 Ca 0.44 0.43 -0.12 0.00 -0.00 0.00 0.00 58.31 59.06 1oco n LYS 79 Cb 0.44 -1.77 -0.14 0.00 -0.00 0.00 0.00 35.03 33.57 1oco n LYS 79 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1oco h GLU 80 N 0.00 0.12 0.21 -1.58 3.07 -1.97 -3.40 114.58 111.03 1oco h GLU 80 Ca 0.00 -0.20 0.01 0.00 -0.50 0.00 0.00 59.36 58.67 1oco h GLU 80 Cb 0.32 0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.28 1oco h GLU 80 CO 0.00 0.91 -0.28 0.82 -1.40 0.00 0.00 179.01 179.07 1oco h ILE 81 N 0.03 0.40 0.02 3.13 2.04 -1.84 -3.11 117.51 118.19 1oco h ILE 81 Ca -0.20 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.68 1oco h ILE 81 Cb 1.96 0.40 -0.05 0.00 -0.74 0.00 0.00 36.82 38.38 1oco h ILE 81 CO 0.13 0.00 -0.53 0.22 0.00 0.00 0.00 178.15 177.97 1oco h TYR 82 N -0.55 -1.56 -0.98 1.37 3.20 -1.78 -0.67 116.97 116.01 1oco h TYR 82 Ca 0.01 0.05 0.17 0.00 3.14 0.00 0.00 58.73 62.10 1oco h TYR 82 Cb 0.53 0.68 -0.10 0.00 1.54 0.00 0.00 36.73 39.38 1oco h TYR 82 CO -0.21 -0.58 0.59 -1.35 -1.64 0.00 0.00 178.16 174.97 1oco h PRO 83 N -0.69 0.76 -0.33 1.82 0.11 -1.80 0.51 132.00 132.38 1oco h PRO 83 Ca 0.01 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.06 1oco h PRO 83 Cb 0.73 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 1oco h PRO 83 CO -0.34 0.50 0.14 -0.92 -0.21 0.00 0.00 178.00 177.17 1oco h TYR 84 N 0.78 0.49 -0.07 0.65 3.20 -1.38 0.83 116.97 121.46 1oco h TYR 84 Ca 0.55 -0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.40 1oco h TYR 84 Cb 0.80 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.91 1oco h TYR 84 CO -0.02 0.45 -0.01 0.28 -1.64 0.00 0.00 178.16 177.22 1oco h VAL 85 N 0.39 0.95 -0.18 1.81 2.07 0.13 -1.10 116.25 120.32 1oco h VAL 85 Ca 0.11 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.62 1oco h VAL 85 Cb 0.15 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1oco h VAL 85 CO -0.01 0.00 0.10 0.40 0.02 0.00 0.00 177.57 178.08 1oco h ILE 86 N 0.02 1.05 0.32 4.57 1.08 -0.06 -1.80 117.51 122.69 1oco h ILE 86 Ca 0.03 -0.13 -0.02 0.00 -0.39 0.00 0.00 64.86 64.36 1oco h ILE 86 Cb 0.04 0.81 0.00 0.00 -3.07 0.00 0.00 36.82 34.60 1oco h ILE 86 CO -0.06 0.06 -0.15 -0.61 -0.69 0.00 0.00 178.15 176.69 1oco h GLN 87 N 0.24 -0.42 0.00 2.37 4.15 0.27 -1.58 115.11 120.15 1oco h GLN 87 Ca 0.06 0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.51 1oco h GLN 87 Cb -0.00 0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.78 1oco h GLN 87 CO -0.01 -0.13 0.00 0.39 -1.93 0.00 0.00 178.83 177.15 1oco n GLU 88 N -5.17 0.10 0.00 1.69 -0.58 -0.52 -1.34 120.64 114.81 1oco n GLU 88 Ca -0.10 0.45 0.11 0.00 -0.42 0.00 0.00 57.16 57.21 1oco n GLU 88 Cb 0.25 -1.74 0.02 0.00 -0.57 0.00 0.00 31.44 29.41 1oco n GLU 88 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1oco n LEU 89 N -1.93 2.14 -0.22 -4.62 4.77 -0.71 -4.64 117.00 111.79 1oco n LEU 89 Ca 0.01 -0.78 0.02 0.00 -0.03 0.00 0.00 56.01 55.23 1oco n LEU 89 Cb 0.12 -0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.31 1oco n LEU 89 CO 0.12 0.39 0.79 0.03 -1.33 0.00 0.00 177.39 177.39 1oco h ARG 90 N 2.72 0.06 -0.13 3.23 2.47 -0.23 -0.13 114.38 122.36 1oco h ARG 90 Ca 0.00 -0.00 0.03 0.00 -1.26 0.00 0.00 59.98 58.75 1oco h ARG 90 Cb 0.79 -0.01 -0.07 0.00 -1.65 0.00 0.00 29.97 29.03 1oco h ARG 90 CO 0.00 0.04 -0.50 -1.35 0.56 0.00 0.00 179.97 178.71 1oco h PRO 91 N 0.06 -0.54 -0.41 0.04 0.11 -1.82 -0.45 132.00 128.99 1oco h PRO 91 Ca 0.34 0.04 -0.06 0.00 0.11 0.00 0.00 66.00 66.43 1oco h PRO 91 Cb 0.56 0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.77 1oco h PRO 91 CO -0.63 -0.36 0.00 1.15 -0.21 0.00 0.00 178.00 177.96 1oco h THR 92 N -0.56 1.22 -0.40 -1.15 2.02 -1.76 0.22 112.91 112.51 1oco h THR 92 Ca 0.05 -0.91 -0.01 0.00 0.77 0.00 0.00 66.41 66.32 1oco h THR 92 Cb 0.67 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 67.97 1oco h THR 92 CO -0.43 0.32 0.23 -0.07 0.37 0.00 0.00 175.52 175.94 1oco h LEU 93 N 0.63 0.49 0.40 2.58 3.38 -0.55 -0.87 115.31 121.37 1oco h LEU 93 Ca 0.13 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1oco h LEU 93 Cb 0.39 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1oco h LEU 93 CO 0.01 0.43 -0.19 0.78 0.09 0.00 0.00 178.44 179.56 1oco h ASN 94 N 0.51 -0.46 -0.09 -0.43 2.35 -0.66 0.15 115.58 116.97 1oco h ASN 94 Ca 0.14 -0.04 0.04 0.00 -0.55 0.00 0.00 56.30 55.89 1oco h ASN 94 Cb 0.04 0.12 -0.06 0.00 0.05 0.00 0.00 38.32 38.47 1oco h ASN 94 CO -0.02 -0.25 -0.33 -0.08 -1.65 0.00 0.00 177.43 175.10 1oco h GLU 95 N -0.64 -0.41 -0.00 0.81 4.81 -0.89 -1.88 114.58 116.38 1oco h GLU 95 Ca -0.06 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1oco h GLU 95 Cb 0.47 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.95 1oco h GLU 95 CO 0.09 -0.27 -0.06 1.28 -0.73 0.00 0.00 179.01 179.32 1oco n LEU 96 N -5.41 0.07 -1.56 1.64 4.77 -0.34 -4.91 117.00 111.26 1oco n LEU 96 Ca -0.04 0.40 -0.10 0.00 -0.03 0.00 0.00 56.01 56.24 1oco n LEU 96 Cb 0.33 -0.44 0.02 0.00 -2.33 0.00 0.00 43.42 41.00 1oco n LEU 96 CO 0.16 0.02 0.01 0.61 -1.33 0.00 0.00 177.39 176.86 1oco n GLY 97 N 1.47 0.14 3.66 -0.72 0.00 0.36 -5.00 105.19 105.10 1oco n GLY 97 Ca 0.08 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 1oco n GLY 97 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oco s ILE 98 N -2.86 4.93 0.14 -0.61 1.01 -0.16 -5.03 121.20 118.63 1oco s ILE 98 Ca 0.15 1.47 -0.19 0.00 0.00 0.00 0.00 60.65 62.08 1oco s ILE 98 Cb -0.07 -4.07 -0.07 0.00 0.01 0.00 0.00 42.46 38.26 1oco s ILE 98 CO 0.19 0.05 0.63 -0.44 0.00 0.00 0.00 174.94 175.37 1oco s SER 99 N 1.19 7.04 0.64 3.58 0.01 -1.26 -4.70 113.70 120.19 1oco s SER 99 Ca 0.35 1.30 -0.13 0.00 1.31 0.00 0.00 55.95 58.78 1oco s SER 99 Cb -0.16 -2.37 -0.02 0.00 0.21 0.00 0.00 66.02 63.67 1oco s SER 99 CO 0.11 0.16 1.05 0.42 0.41 0.00 0.00 173.24 175.38 1oco s THR 100 N -1.32 4.11 0.45 1.44 -4.23 -1.26 -4.78 115.64 110.05 1oco s THR 100 Ca 0.36 0.81 0.15 0.00 -1.18 0.00 0.00 61.69 61.83 1oco s THR 100 Cb -0.18 -3.49 0.33 0.00 1.34 0.00 0.00 72.50 70.50 1oco s THR 100 CO 0.20 -0.78 2.01 -0.65 -0.54 0.00 0.00 174.62 174.86 1oco h PRO 101 N -0.15 0.31 -0.26 3.99 0.11 -1.94 -0.99 132.00 133.06 1oco h PRO 101 Ca -0.45 -0.02 -0.16 0.00 0.11 0.00 0.00 66.00 65.48 1oco h PRO 101 Cb 1.21 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1oco h PRO 101 CO 0.58 0.21 -0.46 0.93 -0.21 0.00 0.00 178.00 179.05 1oco h GLU 102 N 0.32 0.77 -0.60 1.05 3.07 -1.93 0.28 114.58 117.55 1oco h GLU 102 Ca 0.24 -0.48 -0.00 0.00 -0.50 0.00 0.00 59.36 58.61 1oco h GLU 102 Cb 0.51 0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 28.44 1oco h GLU 102 CO -0.05 1.11 0.37 0.93 -1.40 0.00 0.00 179.01 179.97 1oco h GLU 103 N 0.52 0.81 0.00 2.33 5.08 -1.58 -0.53 114.58 121.22 1oco h GLU 103 Ca 0.02 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1oco h GLU 103 Cb 1.07 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1oco h GLU 103 CO 0.10 0.57 0.00 1.28 -1.00 0.00 0.00 179.01 179.96 1oco n LEU 104 N -4.63 0.00 -0.11 1.33 4.77 -0.67 -4.88 117.00 112.81 1oco n LEU 104 Ca 0.04 0.40 -0.01 0.00 -0.03 0.00 0.00 56.01 56.40 1oco n LEU 104 Cb 0.04 -0.40 -0.01 0.00 -2.33 0.00 0.00 43.42 40.73 1oco n LEU 104 CO 0.36 -0.10 -0.01 0.61 -1.33 0.00 0.00 177.39 176.92 1oco n GLY 105 N 0.70 0.52 0.00 -0.72 0.00 -0.21 -4.91 105.19 100.58 1oco n GLY 105 Ca 0.08 -0.57 0.14 0.00 0.00 0.00 0.00 46.02 45.67 1oco n GLY 105 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1oco n LEU 106 N -0.16 0.00 -0.51 0.99 4.77 0.93 -3.29 117.00 119.72 1oco n LEU 106 Ca -0.01 0.11 0.07 0.00 -0.03 0.00 0.00 56.01 56.14 1oco n LEU 106 Cb 0.07 -0.11 0.22 0.00 -2.33 0.00 0.00 43.42 41.27 1oco n LEU 106 CO 0.02 -0.01 0.67 -0.90 -1.33 0.00 0.00 177.39 175.84 1oco n ASP 107 N -1.11 1.49 -4.11 -1.43 5.75 -1.19 -4.85 116.55 111.10 1oco n ASP 107 Ca 0.18 -1.89 -0.27 0.00 -0.01 0.00 0.00 54.79 52.80 1oco n ASP 107 Cb 0.14 -0.16 -0.17 0.00 -1.03 0.00 0.00 41.12 39.91 1oco n ASP 107 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1oco s LYS 108 N -1.68 2.15 0.00 0.11 -2.85 -1.21 -5.08 119.74 111.18 1oco s LYS 108 Ca 0.23 -0.61 0.32 0.00 -1.00 0.00 0.00 55.97 54.91 1oco s LYS 108 Cb 0.12 -1.73 1.89 0.00 -2.06 0.00 0.00 37.83 36.05 1oco s LYS 108 CO 0.17 0.12 2.21 1.33 0.10 0.00 0.00 175.35 179.29