#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o6b s ARG 6 N 0.00 3.43 1.00 0.54 3.52 -1.26 -5.09 118.95 121.09 2o6b s ARG 6 Ca 0.00 -0.64 -0.17 0.00 -0.13 0.00 0.00 55.73 54.79 2o6b s ARG 6 Cb 0.00 -3.45 -0.03 0.00 -1.56 0.00 0.00 34.95 29.91 2o6b s ARG 6 CO 0.00 -0.33 -0.24 -2.30 -0.81 0.00 0.00 175.30 171.61 2o6b n PRO 7 N 4.94 -0.44 -4.10 5.12 -0.02 -1.26 -4.64 135.00 134.61 2o6b n PRO 7 Ca -0.15 -0.11 -0.14 0.00 -2.02 0.00 0.00 63.50 61.08 2o6b n PRO 7 Cb 0.50 -1.49 -0.12 0.00 -0.02 0.00 0.00 33.50 32.37 2o6b n PRO 7 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2o6b s LEU 8 N 2.44 2.20 0.20 2.45 1.43 -1.26 -1.74 118.68 124.40 2o6b s LEU 8 Ca 0.50 -0.44 -0.11 0.00 -1.03 0.00 0.00 54.13 53.04 2o6b s LEU 8 Cb -0.14 -0.21 0.26 0.00 0.03 0.00 0.00 46.19 46.13 2o6b s LEU 8 CO 0.71 -0.13 1.68 -0.09 0.23 0.00 0.00 176.35 178.75 2o6b h ARG 9 N 4.86 0.15 0.00 1.70 2.43 -1.82 -0.15 114.38 121.55 2o6b h ARG 9 Ca -0.34 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.82 2o6b h ARG 9 Cb 1.20 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 2o6b h ARG 9 CO 0.43 0.10 0.00 -0.85 -1.51 0.00 0.00 179.97 178.14 2o6b n GLU 10 N -5.23 0.34 -0.01 0.20 0.00 -1.26 -2.13 120.64 112.55 2o6b n GLU 10 Ca 0.08 0.07 0.14 0.00 0.00 0.00 0.00 57.16 57.44 2o6b n GLU 10 Cb 0.32 -1.50 0.60 0.00 0.00 0.00 0.00 31.44 30.86 2o6b n GLU 10 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 2o6b n GLN 11 N -1.12 1.47 -4.80 3.44 6.02 -0.07 -4.88 117.38 117.44 2o6b n GLN 11 Ca 0.09 -0.69 -0.26 0.00 -0.01 0.00 0.00 57.00 56.13 2o6b n GLN 11 Cb 0.08 -1.46 -0.15 0.00 1.02 0.00 0.00 30.24 29.73 2o6b n GLN 11 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 2o6b s TYR 12 N -1.97 1.80 -0.05 1.08 1.51 -0.91 -4.94 117.35 113.88 2o6b s TYR 12 Ca 0.39 -0.36 0.01 0.00 -1.01 0.00 0.00 57.07 56.10 2o6b s TYR 12 Cb 0.20 -1.11 -0.25 0.00 -0.11 0.00 0.00 41.96 40.68 2o6b s TYR 12 CO 0.32 0.03 0.65 -0.07 -1.11 0.00 0.00 175.55 175.37 2o6b h LEU 13 N 5.24 0.25 -8.77 -1.29 4.07 -1.72 -3.46 115.31 109.63 2o6b h LEU 13 Ca -0.41 -0.47 -0.61 0.00 0.08 0.00 0.00 57.88 56.47 2o6b h LEU 13 Cb 1.15 -0.08 -0.22 0.00 1.08 0.00 0.00 40.66 42.59 2o6b h LEU 13 CO 0.46 1.41 -0.84 -2.28 -1.08 0.00 0.00 178.44 176.11 2o6b s HIS 14 N -2.59 2.00 -0.22 1.13 2.46 0.08 -4.96 115.29 113.18 2o6b s HIS 14 Ca -0.11 -0.40 -0.02 0.00 0.47 0.00 0.00 55.06 54.99 2o6b s HIS 14 Cb 0.07 -1.09 0.07 0.00 -0.13 0.00 0.00 32.58 31.50 2o6b s HIS 14 CO 0.82 0.26 0.04 -0.06 -2.47 0.00 0.00 174.74 173.33 2o6b s PHE 15 N -1.14 1.27 -0.12 3.88 0.40 -1.26 -1.31 117.98 119.69 2o6b s PHE 15 Ca 0.10 -1.12 -0.19 0.00 -0.60 0.00 0.00 56.93 55.12 2o6b s PHE 15 Cb -0.10 -1.21 -0.04 0.00 0.51 0.00 0.00 43.02 42.18 2o6b s PHE 15 CO 0.05 -0.69 0.51 -0.65 0.70 0.00 0.00 175.22 175.14 2o6b s GLN 16 N 1.78 4.33 0.04 0.44 -1.52 -0.72 -4.88 119.66 119.12 2o6b s GLN 16 Ca 0.01 0.49 -0.17 0.00 -1.95 0.00 0.00 55.36 53.74 2o6b s GLN 16 Cb -0.17 -3.45 -0.06 0.00 -0.22 0.00 0.00 33.01 29.10 2o6b s GLN 16 CO -0.12 0.11 0.50 -1.25 -0.25 0.00 0.00 175.29 174.28 2o6b s PRO 17 N 0.75 4.09 -0.04 2.91 0.04 -1.26 0.18 135.00 141.67 2o6b s PRO 17 Ca 0.27 0.60 0.01 0.00 0.04 0.00 0.00 61.00 61.92 2o6b s PRO 17 Cb -0.15 -3.24 0.02 0.00 0.04 0.00 0.00 34.50 31.17 2o6b s PRO 17 CO 0.11 0.65 -0.06 0.42 0.04 0.00 0.00 177.00 178.16 2o6b s ILE 18 N -1.05 0.62 0.15 0.56 1.01 -1.20 -4.95 121.20 116.35 2o6b s ILE 18 Ca 0.27 -0.19 -0.30 0.00 0.00 0.00 0.00 60.65 60.43 2o6b s ILE 18 Cb -0.18 -0.62 -0.07 0.00 0.01 0.00 0.00 42.46 41.60 2o6b s ILE 18 CO 0.16 0.24 1.11 -0.94 0.00 0.00 0.00 174.94 175.52 2o6b s SER 19 N 0.77 7.23 0.80 3.58 1.04 -1.26 -4.20 113.70 121.65 2o6b s SER 19 Ca -0.11 2.07 -0.12 0.00 0.48 0.00 0.00 55.95 58.27 2o6b s SER 19 Cb -0.14 -2.60 0.07 0.00 0.10 0.00 0.00 66.02 63.46 2o6b s SER 19 CO 0.01 -0.27 1.12 0.42 0.98 0.00 0.00 173.24 175.50 2o6b s THR 20 N 0.02 2.70 0.07 2.02 -4.23 -1.26 -5.05 115.64 109.91 2o6b s THR 20 Ca 0.51 0.23 0.03 0.00 -1.18 0.00 0.00 61.69 61.28 2o6b s THR 20 Cb -0.29 -3.09 -0.03 0.00 1.34 0.00 0.00 72.50 70.42 2o6b s THR 20 CO 0.34 -0.30 -0.10 -0.13 -0.54 0.00 0.00 174.62 173.89 2o6b s ARG 21 N -5.33 0.72 0.12 3.99 0.52 -1.26 -5.03 118.95 112.68 2o6b s ARG 21 Ca 0.61 -0.97 -0.22 0.00 -0.52 0.00 0.00 55.73 54.63 2o6b s ARG 21 Cb -0.13 -0.48 -0.06 0.00 0.52 0.00 0.00 34.95 34.80 2o6b s ARG 21 CO 0.52 0.08 1.70 2.35 0.02 0.00 0.00 175.30 179.98 2o6b h TRP 22 N 4.03 -0.18 -0.24 -0.53 2.91 -1.98 -0.00 115.95 119.96 2o6b h TRP 22 Ca -0.37 0.01 -0.11 0.00 1.13 0.00 0.00 58.89 59.55 2o6b h TRP 22 Cb 1.19 0.10 -0.07 0.00 -0.51 0.00 0.00 29.16 29.87 2o6b h TRP 22 CO 0.64 -0.12 0.14 1.58 -1.03 0.00 0.00 178.44 179.65 2o6b n HIS 23 N -5.21 0.75 0.01 2.65 -0.00 -1.26 -3.26 115.22 108.90 2o6b n HIS 23 Ca -0.04 -0.74 -0.18 0.00 0.46 0.00 0.00 57.72 57.22 2o6b n HIS 23 Cb 0.14 -0.39 -0.14 0.00 -0.12 0.00 0.00 29.99 29.48 2o6b n HIS 23 CO 0.00 0.00 0.00 -0.44 0.46 0.00 0.00 176.34 176.36 2o6b h ASP 24 N 0.39 0.33 -2.83 0.26 3.32 -1.40 -3.45 116.42 113.05 2o6b h ASP 24 Ca 0.14 -0.94 -0.57 0.00 0.02 0.00 0.00 57.03 55.68 2o6b h ASP 24 Cb 1.39 -0.11 0.08 0.00 0.22 0.00 0.00 39.33 40.91 2o6b h ASP 24 CO 0.26 1.24 0.70 0.59 -1.72 0.00 0.00 179.24 180.31 2o6b n ASN 25 N -4.29 3.08 -2.39 6.45 3.02 -1.20 -1.64 115.26 118.29 2o6b n ASN 25 Ca -0.12 1.14 -0.04 0.00 -0.03 0.00 0.00 54.58 55.53 2o6b n ASN 25 Cb 0.70 -1.48 0.02 0.00 -0.61 0.00 0.00 39.78 38.41 2o6b n ASN 25 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2o6b n ASP 26 N 2.22 0.20 -0.35 6.41 5.75 -0.53 -4.77 116.55 125.48 2o6b n ASP 26 Ca 0.11 -1.17 0.07 0.00 -0.01 0.00 0.00 54.79 53.79 2o6b n ASP 26 Cb 0.33 -0.11 0.25 0.00 -1.03 0.00 0.00 41.12 40.56 2o6b n ASP 26 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 2o6b h ILE 27 N -0.46 0.93 -0.36 2.12 2.10 -1.94 -2.48 117.51 117.42 2o6b h ILE 27 Ca -0.05 -0.34 -0.29 0.00 1.08 0.00 0.00 64.86 65.26 2o6b h ILE 27 Cb 0.19 -0.13 -0.11 0.00 -1.09 0.00 0.00 36.82 35.68 2o6b h ILE 27 CO 0.06 0.18 -0.12 -1.22 -1.08 0.00 0.00 178.15 175.96 2o6b n TYR 28 N -4.59 0.54 -0.37 2.19 4.01 -1.26 -4.88 117.16 112.80 2o6b n TYR 28 Ca 0.18 -1.65 0.00 0.00 -0.16 0.00 0.00 57.90 56.28 2o6b n TYR 28 Cb 0.34 -1.51 0.00 0.00 -0.31 0.00 0.00 39.34 37.86 2o6b n TYR 28 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2o6b n GLY 29 N 1.94 0.37 3.22 2.72 0.00 -0.93 -4.92 105.19 107.58 2o6b n GLY 29 Ca 0.45 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.30 2o6b n GLY 29 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2o6b s HIS 30 N -1.55 1.26 -0.22 1.61 3.76 -1.26 -4.83 115.29 114.06 2o6b s HIS 30 Ca 0.00 -0.60 -0.39 0.00 -0.15 0.00 0.00 55.06 53.92 2o6b s HIS 30 Cb 0.00 -0.67 -0.15 0.00 1.11 0.00 0.00 32.58 32.87 2o6b s HIS 30 CO 0.00 0.09 1.72 0.28 -0.85 0.00 0.00 174.74 175.97 2o6b n VAL 31 N 0.51 0.30 -1.68 -0.90 0.31 0.07 -1.45 118.33 115.49 2o6b n VAL 31 Ca -0.15 -0.05 -0.42 0.00 -0.01 0.00 0.00 64.34 63.70 2o6b n VAL 31 Cb 0.57 -1.25 -0.00 0.00 -0.91 0.00 0.00 33.84 32.26 2o6b n VAL 31 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2o6b n ASN 32 N 5.19 2.49 0.28 4.52 4.05 -0.65 -4.81 115.26 126.33 2o6b n ASN 32 Ca 0.25 1.17 0.13 0.00 0.45 0.00 0.00 54.58 56.58 2o6b n ASN 32 Cb 0.15 -1.46 0.82 0.00 1.23 0.00 0.00 39.78 40.52 2o6b n ASN 32 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 2o6b h ASN 33 N 2.32 0.00 -0.39 1.20 7.08 -1.93 0.61 115.58 124.47 2o6b h ASN 33 Ca -0.46 0.00 -0.05 0.00 -3.08 0.00 0.00 56.30 52.71 2o6b h ASN 33 Cb 1.29 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 37.51 2o6b h ASN 33 CO 0.61 0.03 0.07 0.58 -2.08 0.00 0.00 177.43 176.65 2o6b h VAL 34 N 0.00 1.22 0.00 6.14 2.07 -1.99 -3.12 116.25 120.57 2o6b h VAL 34 Ca -0.00 -0.83 -0.00 0.00 0.82 0.00 0.00 66.70 66.68 2o6b h VAL 34 Cb 0.08 0.79 -0.00 0.00 -1.52 0.00 0.00 31.29 30.63 2o6b h VAL 34 CO 0.00 0.30 -0.02 0.74 0.02 0.00 0.00 177.57 178.62 2o6b h THR 35 N 0.70 0.62 -0.53 2.57 2.02 -1.22 -1.46 112.91 115.61 2o6b h THR 35 Ca 0.15 -0.07 0.01 0.00 0.77 0.00 0.00 66.41 67.27 2o6b h THR 35 Cb 0.33 1.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.75 2o6b h THR 35 CO 0.01 0.02 0.35 1.88 0.37 0.00 0.00 175.52 178.14 2o6b h TYR 36 N 0.00 0.66 -0.92 3.16 -1.99 -1.65 -0.72 116.97 115.50 2o6b h TYR 36 Ca -0.00 0.02 0.09 0.00 2.00 0.00 0.00 58.73 60.84 2o6b h TYR 36 Cb 0.04 -0.22 -0.07 0.00 2.00 0.00 0.00 36.73 38.47 2o6b h TYR 36 CO 0.00 0.41 0.57 1.88 -0.00 0.00 0.00 178.16 181.02 2o6b h TYR 37 N 0.71 1.03 -0.73 4.88 -1.99 -1.45 0.86 116.97 120.28 2o6b h TYR 37 Ca 0.19 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.95 2o6b h TYR 37 Cb -0.08 -0.33 -0.04 0.00 2.00 0.00 0.00 36.73 38.29 2o6b h TYR 37 CO -0.04 0.46 0.44 0.00 -0.00 0.00 0.00 178.16 179.02 2o6b h ALA 38 N 1.47 0.93 -0.31 3.88 0.00 -1.29 -0.20 119.26 123.75 2o6b h ALA 38 Ca 0.43 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.31 2o6b h ALA 38 Cb 0.33 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2o6b h ALA 38 CO -0.23 0.41 0.21 0.74 0.00 0.00 0.00 179.25 180.38 2o6b h PHE 39 N 1.00 0.18 0.00 0.00 0.04 0.17 -1.78 116.94 116.55 2o6b h PHE 39 Ca 0.26 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.04 2o6b h PHE 39 Cb -0.03 -0.06 0.00 0.00 2.20 0.00 0.00 35.95 38.06 2o6b h PHE 39 CO -0.01 0.10 0.00 1.19 -0.60 0.00 0.00 178.31 178.99 2o6b n PHE 40 N -4.48 0.00 0.26 -0.55 3.72 0.16 -1.87 117.46 114.71 2o6b n PHE 40 Ca 0.04 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.56 2o6b n PHE 40 Cb 0.26 -0.32 0.59 0.00 -0.94 0.00 0.00 39.48 39.07 2o6b n PHE 40 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 2o6b h ASP 41 N 0.00 0.00 0.45 4.37 3.04 -1.53 0.13 116.42 122.89 2o6b h ASP 41 Ca 0.00 0.00 -0.02 0.00 -3.24 0.00 0.00 57.03 53.77 2o6b h ASP 41 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.29 2o6b h ASP 41 CO 0.00 0.00 -0.22 0.74 -2.04 0.00 0.00 179.24 177.72 2o6b h THR 42 N 0.00 0.00 -0.96 1.15 2.02 -1.39 -1.77 112.91 111.95 2o6b h THR 42 Ca 0.00 -0.05 0.30 0.00 0.77 0.00 0.00 66.41 67.43 2o6b h THR 42 Cb 0.15 0.00 -0.18 0.00 -1.74 0.00 0.00 68.15 66.38 2o6b h THR 42 CO 0.00 0.00 0.13 0.00 0.37 0.00 0.00 175.52 176.02 2o6b n ALA 43 N -2.34 0.60 -0.01 6.16 0.00 0.31 -0.51 120.51 124.72 2o6b n ALA 43 Ca -0.08 1.02 0.00 0.00 0.00 0.00 0.00 53.44 54.39 2o6b n ALA 43 Cb 0.24 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 18.89 2o6b n ALA 43 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2o6b n VAL 44 N -5.38 0.00 -0.24 0.00 0.31 -0.38 -2.97 118.33 109.67 2o6b n VAL 44 Ca 0.26 0.94 0.28 0.00 -0.01 0.00 0.00 64.34 65.81 2o6b n VAL 44 Cb 0.85 -1.94 0.67 0.00 -0.91 0.00 0.00 33.84 32.51 2o6b n VAL 44 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 2o6b h ASN 45 N 0.00 0.13 -0.16 4.52 2.35 -1.03 1.02 115.58 122.41 2o6b h ASN 45 Ca 0.00 0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2o6b h ASN 45 Cb 0.00 -0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 2o6b h ASN 45 CO 0.00 0.04 0.09 0.74 -1.65 0.00 0.00 177.43 176.64 2o6b h THR 46 N 0.12 1.10 0.54 2.81 2.02 -0.87 0.68 112.91 119.31 2o6b h THR 46 Ca 0.49 -0.28 -0.03 0.00 0.77 0.00 0.00 66.41 67.37 2o6b h THR 46 Cb 1.73 0.99 0.01 0.00 -1.74 0.00 0.00 68.15 69.14 2o6b h THR 46 CO -0.08 0.09 -0.26 0.22 0.37 0.00 0.00 175.52 175.87 2o6b h TYR 47 N 0.16 -0.67 -0.98 3.16 3.20 0.11 -1.81 116.97 120.13 2o6b h TYR 47 Ca 0.06 -0.02 0.33 0.00 3.14 0.00 0.00 58.73 62.24 2o6b h TYR 47 Cb 0.08 0.22 -0.16 0.00 1.54 0.00 0.00 36.73 38.41 2o6b h TYR 47 CO -0.04 -0.38 0.48 -0.07 -1.64 0.00 0.00 178.16 176.52 2o6b h LEU 48 N -0.83 0.34 -0.07 2.82 3.38 -0.75 -1.16 115.31 119.04 2o6b h LEU 48 Ca -0.07 0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2o6b h LEU 48 Cb 0.60 0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 2o6b h LEU 48 CO 0.12 -0.22 0.00 0.40 0.09 0.00 0.00 178.44 178.84 2o6b h ILE 49 N 0.22 1.25 -0.00 1.22 5.03 0.99 -0.88 117.51 125.34 2o6b h ILE 49 Ca 0.73 -0.77 0.00 0.00 -0.12 0.00 0.00 64.86 64.70 2o6b h ILE 49 Cb 1.69 1.62 0.00 0.00 -3.03 0.00 0.00 36.82 37.10 2o6b h ILE 49 CO -0.67 0.21 -0.15 -0.62 -0.68 0.00 0.00 178.15 176.25 2o6b n GLU 50 N -4.86 0.31 0.00 2.37 1.02 -0.74 -3.80 120.64 114.94 2o6b n GLU 50 Ca -0.07 -0.09 0.00 0.00 -0.02 0.00 0.00 57.16 56.98 2o6b n GLU 50 Cb 0.19 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 2o6b n GLU 50 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2o6b n ARG 51 N -1.26 3.19 0.04 3.49 5.12 -0.50 -4.74 116.66 122.00 2o6b n ARG 51 Ca 0.10 0.00 0.11 0.00 -1.93 0.00 0.00 57.85 56.14 2o6b n ARG 51 Cb 0.31 -0.49 0.06 0.00 -1.16 0.00 0.00 32.46 31.17 2o6b n ARG 51 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2o6b n GLY 52 N 0.22 -1.29 0.72 -0.13 0.00 -0.35 -4.56 105.19 99.81 2o6b n GLY 52 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.68 2o6b n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o6b n GLY 53 N 1.33 2.76 3.68 -0.02 0.00 -1.09 -3.16 105.19 108.69 2o6b n GLY 53 Ca 0.02 -0.63 -0.46 0.00 0.00 0.00 0.00 46.02 44.94 2o6b n GLY 53 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2o6b n LEU 54 N 0.00 3.45 -1.71 0.99 0.00 -1.25 -4.90 117.00 113.58 2o6b n LEU 54 Ca 0.00 1.02 -0.02 0.00 0.00 0.00 0.00 56.01 57.01 2o6b n LEU 54 Cb 0.00 -1.43 0.01 0.00 0.00 0.00 0.00 43.42 41.99 2o6b n LEU 54 CO 0.00 -0.09 0.01 -0.90 0.00 0.00 0.00 177.39 176.40 2o6b n ASP 55 N 5.12 -2.57 -0.03 1.96 5.68 -1.26 -3.62 116.55 121.84 2o6b n ASP 55 Ca 0.19 -0.08 -0.14 0.00 -0.50 0.00 0.00 54.79 54.26 2o6b n ASP 55 Cb 0.31 -1.09 -0.14 0.00 -1.14 0.00 0.00 41.12 39.06 2o6b n ASP 55 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 2o6b n ILE 56 N -1.68 1.64 0.00 2.12 -5.35 -1.26 0.22 119.36 115.06 2o6b n ILE 56 Ca -0.01 -0.73 0.00 0.00 -0.27 0.00 0.00 62.75 61.74 2o6b n ILE 56 Cb 0.51 -1.26 0.00 0.00 -1.74 0.00 0.00 39.64 37.15 2o6b n ILE 56 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2o6b n GLN 57 N -3.19 0.00 0.00 6.28 1.13 -1.26 -3.93 117.38 116.41 2o6b n GLN 57 Ca -0.26 0.65 0.00 0.00 -1.94 0.00 0.00 57.00 55.45 2o6b n GLN 57 Cb 1.06 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.93 2o6b n GLN 57 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2o6b n GLY 58 N -0.99 0.88 3.49 1.08 0.00 -1.26 -5.05 105.19 103.34 2o6b n GLY 58 Ca 0.00 -1.13 -0.54 0.00 0.00 0.00 0.00 46.02 44.35 2o6b n GLY 58 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o6b n GLY 59 N 0.00 -0.61 0.20 -0.02 0.00 0.61 -4.90 105.19 100.47 2o6b n GLY 59 Ca 0.00 0.60 0.09 0.00 0.00 0.00 0.00 46.02 46.70 2o6b n GLY 59 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2o6b h GLU 60 N 2.55 0.00 -5.27 1.61 4.39 -1.94 -3.44 114.58 112.48 2o6b h GLU 60 Ca -0.43 0.00 -0.63 0.00 0.34 0.00 0.00 59.36 58.64 2o6b h GLU 60 Cb 1.41 0.00 -0.20 0.00 -0.10 0.00 0.00 28.75 29.86 2o6b h GLU 60 CO 0.64 0.27 -0.64 0.54 -1.16 0.00 0.00 179.01 178.66 2o6b s VAL 61 N -3.48 4.14 0.03 3.13 0.11 -1.26 0.47 120.40 123.54 2o6b s VAL 61 Ca 0.02 -0.26 0.03 0.00 -2.93 0.00 0.00 61.98 58.83 2o6b s VAL 61 Cb 0.09 -2.84 -0.02 0.00 -1.53 0.00 0.00 36.38 32.09 2o6b s VAL 61 CO 0.66 0.48 -0.09 0.27 -3.33 0.00 0.00 175.10 173.09 2o6b s ILE 62 N 0.45 0.64 0.23 7.04 -4.36 -0.95 -4.86 121.20 119.40 2o6b s ILE 62 Ca -0.02 -0.84 -0.09 0.00 -0.26 0.00 0.00 60.65 59.45 2o6b s ILE 62 Cb -0.14 -0.64 -0.07 0.00 1.25 0.00 0.00 42.46 42.86 2o6b s ILE 62 CO 0.02 -0.16 0.55 -0.83 0.24 0.00 0.00 174.94 174.76 2o6b s GLY 63 N -1.09 2.25 0.10 6.27 0.00 -1.26 -1.52 107.32 112.06 2o6b s GLY 63 Ca -0.04 -0.29 0.06 0.00 0.00 0.00 0.00 44.72 44.45 2o6b s GLY 63 CO 0.00 -0.15 -0.14 1.08 0.00 0.00 0.00 173.10 173.89 2o6b s LEU 64 N -2.86 2.34 -0.34 0.66 1.43 -0.71 -4.91 118.68 114.28 2o6b s LEU 64 Ca 0.47 -0.71 -0.12 0.00 -1.03 0.00 0.00 54.13 52.73 2o6b s LEU 64 Cb -0.11 -0.55 -0.01 0.00 0.03 0.00 0.00 46.19 45.55 2o6b s LEU 64 CO 0.22 -0.10 0.23 -0.69 0.23 0.00 0.00 176.35 176.24 2o6b s VAL 65 N -1.68 5.14 -0.16 -1.59 1.01 -1.26 -1.91 120.40 119.95 2o6b s VAL 65 Ca 0.04 -0.33 0.18 0.00 0.00 0.00 0.00 61.98 61.87 2o6b s VAL 65 Cb -0.08 -3.67 -0.26 0.00 0.00 0.00 0.00 36.38 32.37 2o6b s VAL 65 CO 0.03 -0.04 0.15 1.33 0.00 0.00 0.00 175.10 176.57 2o6b n VAL 66 N 5.09 1.08 -3.64 2.92 0.24 -1.11 -5.00 118.33 117.91 2o6b n VAL 66 Ca -0.13 -0.77 -0.13 0.00 -2.04 0.00 0.00 64.34 61.27 2o6b n VAL 66 Cb 0.49 -0.37 -0.06 0.00 -1.47 0.00 0.00 33.84 32.43 2o6b n VAL 66 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2o6b s SER 67 N -5.24 -0.33 0.21 -1.34 1.04 -1.26 -5.07 113.70 101.70 2o6b s SER 67 Ca -0.09 0.05 -0.17 0.00 0.48 0.00 0.00 55.95 56.22 2o6b s SER 67 Cb 0.07 0.45 0.02 0.00 0.10 0.00 0.00 66.02 66.66 2o6b s SER 67 CO 0.83 -0.69 0.52 -0.94 0.98 0.00 0.00 173.24 173.95 2o6b s SER 68 N -2.01 -0.21 0.10 7.02 1.04 -1.26 -2.10 113.70 116.27 2o6b s SER 68 Ca -0.05 -0.59 -0.26 0.00 0.48 0.00 0.00 55.95 55.53 2o6b s SER 68 Cb -0.01 0.59 0.08 0.00 0.10 0.00 0.00 66.02 66.78 2o6b s SER 68 CO -0.02 -1.09 0.82 -0.94 0.98 0.00 0.00 173.24 172.99 2o6b s SER 69 N -2.91 -0.36 -0.11 7.02 1.04 -0.74 -5.02 113.70 112.63 2o6b s SER 69 Ca 0.12 -0.15 -0.20 0.00 0.48 0.00 0.00 55.95 56.19 2o6b s SER 69 Cb -0.01 0.49 0.05 0.00 0.10 0.00 0.00 66.02 66.65 2o6b s SER 69 CO 0.00 -0.84 0.50 0.00 0.98 0.00 0.00 173.24 173.89 2o6b s ASP 71 N -0.53 2.86 -0.20 0.00 1.11 0.03 -4.99 116.67 114.95 2o6b s ASP 71 Ca -0.07 -0.48 -0.08 0.00 0.18 0.00 0.00 52.55 52.11 2o6b s ASP 71 Cb -0.03 -0.84 -0.04 0.00 1.07 0.00 0.00 42.92 43.08 2o6b s ASP 71 CO 0.04 0.22 0.07 -0.31 1.18 0.00 0.00 175.17 176.37 2o6b s TYR 72 N -0.07 3.23 -0.10 4.23 1.51 -1.26 -1.49 117.35 123.39 2o6b s TYR 72 Ca -0.05 0.02 -0.04 0.00 -1.01 0.00 0.00 57.07 55.99 2o6b s TYR 72 Cb -0.14 -2.12 -0.05 0.00 -0.11 0.00 0.00 41.96 39.55 2o6b s TYR 72 CO 0.04 0.07 -0.13 1.19 -1.11 0.00 0.00 175.55 175.62 2o6b n PHE 73 N 3.80 0.00 -4.05 2.71 3.72 0.06 -4.98 117.46 118.72 2o6b n PHE 73 Ca -0.16 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.13 2o6b n PHE 73 Cb 0.52 -0.37 -0.11 0.00 -0.94 0.00 0.00 39.48 38.58 2o6b n PHE 73 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2o6b s ALA 74 N -2.19 0.46 0.44 4.37 0.00 0.55 -5.04 121.76 120.35 2o6b s ALA 74 Ca -0.14 -0.79 -0.06 0.00 0.00 0.00 0.00 51.96 50.97 2o6b s ALA 74 Cb 0.05 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.23 2o6b s ALA 74 CO 0.19 -0.11 0.75 -1.25 0.00 0.00 0.00 175.76 175.34 2o6b s PRO 75 N -1.89 3.58 0.02 0.00 0.05 -1.26 -4.53 135.00 130.97 2o6b s PRO 75 Ca -0.09 0.19 -0.03 0.00 0.05 0.00 0.00 61.00 61.12 2o6b s PRO 75 Cb -0.07 -2.42 -0.01 0.00 0.05 0.00 0.00 34.50 32.04 2o6b s PRO 75 CO -0.01 -0.11 0.04 0.08 0.05 0.00 0.00 177.00 177.04 2o6b s VAL 76 N -2.59 0.11 -0.02 -0.36 1.01 -1.26 -5.06 120.40 112.22 2o6b s VAL 76 Ca 0.47 -0.90 -0.03 0.00 0.00 0.00 0.00 61.98 61.52 2o6b s VAL 76 Cb -0.10 -0.43 0.00 0.00 0.00 0.00 0.00 36.38 35.85 2o6b s VAL 76 CO 0.41 -0.50 0.07 0.00 0.00 0.00 0.00 175.10 175.08 2o6b s ALA 77 N -1.66 -0.17 0.24 5.51 0.00 -1.26 -0.75 121.76 123.67 2o6b s ALA 77 Ca -0.14 0.12 -0.31 0.00 0.00 0.00 0.00 51.96 51.63 2o6b s ALA 77 Cb -0.08 -0.08 -0.13 0.00 0.00 0.00 0.00 23.12 22.83 2o6b s ALA 77 CO -0.01 -0.06 1.50 0.34 0.00 0.00 0.00 175.76 177.53 2o6b n PHE 78 N 2.80 2.41 -0.01 0.00 7.35 -1.26 -0.03 117.46 128.73 2o6b n PHE 78 Ca -0.14 0.34 0.08 0.00 -0.76 0.00 0.00 57.45 56.97 2o6b n PHE 78 Cb 0.59 -2.52 0.27 0.00 0.35 0.00 0.00 39.48 38.17 2o6b n PHE 78 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 2o6b n PRO 79 N 2.36 2.76 -0.73 -7.13 -0.04 -1.26 -4.97 135.00 125.99 2o6b n PRO 79 Ca 0.12 -2.19 -0.32 0.00 -0.04 0.00 0.00 63.50 61.07 2o6b n PRO 79 Cb 0.33 -1.61 0.15 0.00 -0.04 0.00 0.00 33.50 32.33 2o6b n PRO 79 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2o6b n GLN 80 N 1.04 -0.40 -3.30 0.54 6.02 0.96 -4.77 117.38 117.48 2o6b n GLN 80 Ca 0.20 -0.06 -0.46 0.00 -0.01 0.00 0.00 57.00 56.67 2o6b n GLN 80 Cb 0.61 -2.12 -0.01 0.00 1.02 0.00 0.00 30.24 29.74 2o6b n GLN 80 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 2o6b s ARG 81 N -4.15 3.91 0.81 -1.09 3.52 -1.26 -4.40 118.95 116.29 2o6b s ARG 81 Ca 0.62 -2.80 -0.11 0.00 -0.13 0.00 0.00 55.73 53.32 2o6b s ARG 81 Cb -0.22 -4.54 0.08 0.00 -1.56 0.00 0.00 34.95 28.70 2o6b s ARG 81 CO 0.63 -1.31 1.09 0.96 -0.81 0.00 0.00 175.30 175.86 2o6b s ILE 82 N -0.33 3.14 -0.23 4.11 -5.25 -1.26 -2.42 121.20 118.96 2o6b s ILE 82 Ca 0.26 0.37 -0.26 0.00 -0.99 0.00 0.00 60.65 60.02 2o6b s ILE 82 Cb -0.09 -2.84 0.09 0.00 2.95 0.00 0.00 42.46 42.56 2o6b s ILE 82 CO -0.08 -0.48 0.81 -0.70 -1.79 0.00 0.00 174.94 172.69 2o6b s GLU 83 N -4.90 0.78 -0.21 0.37 2.12 -0.52 -3.26 118.70 113.07 2o6b s GLU 83 Ca 0.62 0.71 -0.03 0.00 0.36 0.00 0.00 54.97 56.63 2o6b s GLU 83 Cb -0.17 0.38 -0.00 0.00 0.26 0.00 0.00 34.13 34.59 2o6b s GLU 83 CO 0.56 -0.14 -0.08 -1.64 -0.54 0.00 0.00 175.26 173.43 2o6b s MET 84 N -0.04 3.28 0.45 4.30 -1.94 0.47 -0.21 119.30 125.60 2o6b s MET 84 Ca -0.01 -0.67 -0.19 0.00 -1.71 0.00 0.00 55.69 53.10 2o6b s MET 84 Cb -0.04 -2.91 -0.10 0.00 2.01 0.00 0.00 34.83 33.79 2o6b s MET 84 CO 0.01 -0.20 0.94 0.20 -0.01 0.00 0.00 175.02 175.96 2o6b s GLY 85 N 1.44 2.28 -0.17 -0.03 0.00 0.20 -1.76 107.32 109.27 2o6b s GLY 85 Ca 0.06 0.30 -0.09 0.00 0.00 0.00 0.00 44.72 44.99 2o6b s GLY 85 CO -0.05 0.57 0.41 -2.27 0.00 0.00 0.00 173.10 171.75 2o6b s LEU 86 N -3.46 -0.17 -0.22 0.66 2.96 -0.42 -2.55 118.68 115.48 2o6b s LEU 86 Ca 0.60 0.90 -0.23 0.00 -0.22 0.00 0.00 54.13 55.18 2o6b s LEU 86 Cb -0.09 1.33 0.06 0.00 0.50 0.00 0.00 46.19 47.98 2o6b s LEU 86 CO 0.19 -0.20 0.64 -0.60 -1.32 0.00 0.00 176.35 175.06 2o6b s ARG 87 N 1.60 0.78 -0.02 1.98 3.52 -1.04 -0.74 118.95 125.02 2o6b s ARG 87 Ca -0.08 0.82 -0.25 0.00 -0.13 0.00 0.00 55.73 56.08 2o6b s ARG 87 Cb -0.09 0.38 -0.04 0.00 -1.56 0.00 0.00 34.95 33.64 2o6b s ARG 87 CO -0.13 -0.11 0.78 0.08 -0.81 0.00 0.00 175.30 175.11 2o6b s VAL 88 N 0.17 4.91 0.00 7.11 1.01 -1.07 0.68 120.40 133.21 2o6b s VAL 88 Ca -0.01 1.64 0.00 0.00 0.00 0.00 0.00 61.98 63.61 2o6b s VAL 88 Cb -0.04 -4.13 0.00 0.00 0.00 0.00 0.00 36.38 32.21 2o6b s VAL 88 CO 0.02 0.26 0.00 0.00 0.00 0.00 0.00 175.10 175.38 2o6b n ALA 89 N 3.52 0.00 -0.46 5.51 0.00 0.56 -3.64 120.51 126.01 2o6b n ALA 89 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 2o6b n ALA 89 Cb 0.51 0.00 0.25 0.00 0.00 0.00 0.00 19.45 20.21 2o6b n ALA 89 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2o6b n ARG 90 N 0.00 -2.86 -2.91 0.00 0.63 -1.26 -4.83 116.66 105.43 2o6b n ARG 90 Ca 0.00 -0.82 0.03 0.00 -0.92 0.00 0.00 57.85 56.14 2o6b n ARG 90 Cb 0.00 -2.00 0.00 0.00 0.45 0.00 0.00 32.46 30.91 2o6b n ARG 90 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 2o6b s LEU 91 N -6.02 -0.28 0.00 6.15 2.96 -1.26 -3.34 118.68 116.89 2o6b s LEU 91 Ca 0.65 -0.07 0.00 0.00 -0.22 0.00 0.00 54.13 54.49 2o6b s LEU 91 Cb -0.20 0.69 0.00 0.00 0.50 0.00 0.00 46.19 47.18 2o6b s LEU 91 CO 0.63 -0.04 0.00 0.61 -1.32 0.00 0.00 176.35 176.23 2o6b n GLY 92 N 4.25 -0.67 0.00 7.98 0.00 -0.94 -5.00 105.19 110.80 2o6b n GLY 92 Ca 0.07 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.88 2o6b n GLY 92 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2o6b n ASN 93 N 0.00 0.21 -0.57 1.61 6.94 -1.26 -4.59 115.26 117.60 2o6b n ASN 93 Ca 0.00 -0.24 0.07 0.00 -0.02 0.00 0.00 54.58 54.40 2o6b n ASN 93 Cb 0.00 0.51 0.19 0.00 -2.36 0.00 0.00 39.78 38.12 2o6b n ASN 93 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 2o6b n SER 94 N -0.53 3.17 -3.56 0.53 3.41 -1.25 0.13 113.62 115.51 2o6b n SER 94 Ca 0.00 -2.73 -0.16 0.00 -0.26 0.00 0.00 58.87 55.72 2o6b n SER 94 Cb 0.00 -0.40 -0.06 0.00 -0.26 0.00 0.00 64.21 63.49 2o6b n SER 94 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2o6b s SER 95 N -1.86 -0.65 0.29 4.04 0.15 -1.26 -1.53 113.70 112.88 2o6b s SER 95 Ca 0.32 0.91 -0.11 0.00 0.70 0.00 0.00 55.95 57.76 2o6b s SER 95 Cb 0.25 0.80 0.01 0.00 -1.71 0.00 0.00 66.02 65.37 2o6b s SER 95 CO 0.08 -0.46 0.54 0.54 1.20 0.00 0.00 173.24 175.14 2o6b s VAL 96 N -0.66 0.00 -0.19 4.45 0.11 0.45 -2.22 120.40 122.34 2o6b s VAL 96 Ca -0.06 -1.37 -0.07 0.00 -2.93 0.00 0.00 61.98 57.55 2o6b s VAL 96 Cb -0.02 -2.40 0.09 0.00 -1.53 0.00 0.00 36.38 32.52 2o6b s VAL 96 CO 0.06 0.00 0.40 -1.58 -3.33 0.00 0.00 175.10 170.64 2o6b s GLN 97 N -3.53 0.30 0.24 1.54 0.74 -1.21 -2.00 119.66 115.74 2o6b s GLN 97 Ca 0.23 0.99 0.06 0.00 0.05 0.00 0.00 55.36 56.68 2o6b s GLN 97 Cb -0.02 0.27 -0.03 0.00 1.10 0.00 0.00 33.01 34.34 2o6b s GLN 97 CO 0.12 -0.26 0.30 0.71 -0.55 0.00 0.00 175.29 175.61 2o6b s TYR 98 N 2.58 3.34 -0.17 1.67 1.51 0.41 -0.32 117.35 126.38 2o6b s TYR 98 Ca -0.01 -0.04 -0.00 0.00 -1.01 0.00 0.00 57.07 56.01 2o6b s TYR 98 Cb -0.12 -1.52 0.04 0.00 -0.11 0.00 0.00 41.96 40.25 2o6b s TYR 98 CO -0.12 0.47 -0.08 -1.21 -1.11 0.00 0.00 175.55 173.50 2o6b s GLU 99 N -3.90 1.70 0.08 -0.62 0.41 0.21 -2.64 118.70 113.95 2o6b s GLU 99 Ca 0.34 -0.59 0.05 0.00 -0.41 0.00 0.00 54.97 54.35 2o6b s GLU 99 Cb -0.09 -2.10 -0.04 0.00 -1.78 0.00 0.00 34.13 30.12 2o6b s GLU 99 CO 0.28 -0.40 -0.03 -0.51 -0.49 0.00 0.00 175.26 174.11 2o6b s LEU 100 N 1.56 3.36 -0.04 1.80 2.01 0.30 -2.50 118.68 125.17 2o6b s LEU 100 Ca 0.01 -0.20 -0.04 0.00 0.01 0.00 0.00 54.13 53.91 2o6b s LEU 100 Cb -0.15 -2.08 0.01 0.00 0.01 0.00 0.00 46.19 43.98 2o6b s LEU 100 CO -0.08 0.19 0.11 0.00 1.01 0.00 0.00 176.35 177.58 2o6b s ALA 101 N -1.25 -0.27 -0.19 4.21 0.00 -1.06 0.93 121.76 124.13 2o6b s ALA 101 Ca 0.24 0.23 -0.09 0.00 0.00 0.00 0.00 51.96 52.34 2o6b s ALA 101 Cb -0.11 -0.14 -0.05 0.00 0.00 0.00 0.00 23.12 22.82 2o6b s ALA 101 CO 0.16 -0.08 0.10 -1.17 0.00 0.00 0.00 175.76 174.77 2o6b s LEU 102 N -0.20 4.04 -0.07 0.00 2.96 -0.27 0.58 118.68 125.73 2o6b s LEU 102 Ca -0.03 0.18 0.06 0.00 -0.22 0.00 0.00 54.13 54.12 2o6b s LEU 102 Cb -0.02 -2.03 -0.01 0.00 0.50 0.00 0.00 46.19 44.63 2o6b s LEU 102 CO 0.00 0.19 -0.25 -0.36 -1.32 0.00 0.00 176.35 174.62 2o6b s PHE 103 N 0.28 2.47 0.48 5.38 0.40 0.70 -0.15 117.98 127.54 2o6b s PHE 103 Ca 0.06 -0.79 -0.23 0.00 -0.60 0.00 0.00 56.93 55.37 2o6b s PHE 103 Cb -0.12 -1.62 -0.07 0.00 0.51 0.00 0.00 43.02 41.72 2o6b s PHE 103 CO -0.01 -0.26 1.20 -1.17 0.70 0.00 0.00 175.22 175.69 2o6b s LEU 104 N -0.05 3.98 0.08 -0.37 2.96 -1.26 -1.44 118.68 122.57 2o6b s LEU 104 Ca -0.07 2.40 -0.31 0.00 -0.22 0.00 0.00 54.13 55.93 2o6b s LEU 104 Cb -0.15 -4.25 -0.07 0.00 0.50 0.00 0.00 46.19 42.23 2o6b s LEU 104 CO 0.05 -1.05 1.36 -1.61 -1.32 0.00 0.00 176.35 173.78 2o6b s GLU 105 N -2.74 4.33 -1.02 1.98 2.02 -1.02 -2.48 118.70 119.77 2o6b s GLU 105 Ca 0.65 1.99 -0.06 0.00 0.02 0.00 0.00 54.97 57.57 2o6b s GLU 105 Cb -0.31 -3.35 -0.06 0.00 0.10 0.00 0.00 34.13 30.52 2o6b s GLU 105 CO 0.37 -0.44 0.89 0.41 0.02 0.00 0.00 175.26 176.52 2o6b n GLY 106 N 3.48 -1.17 2.98 -1.39 0.00 -1.26 -5.02 105.19 102.81 2o6b n GLY 106 Ca 0.11 0.57 -0.12 0.00 0.00 0.00 0.00 46.02 46.58 2o6b n GLY 106 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2o6b s GLN 107 N -4.35 0.14 0.11 1.61 -1.52 -1.04 -5.04 119.66 109.57 2o6b s GLN 107 Ca 0.41 0.07 0.09 0.00 -1.95 0.00 0.00 55.36 53.99 2o6b s GLN 107 Cb -0.06 0.06 -0.18 0.00 -0.22 0.00 0.00 33.01 32.61 2o6b s GLN 107 CO 0.75 -0.02 1.18 0.00 -0.25 0.00 0.00 175.29 176.95 2o6b h ARG 108 N 5.85 0.00 -5.98 2.91 3.08 -1.96 -3.45 114.38 114.84 2o6b h ARG 108 Ca -0.25 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.23 2o6b h ARG 108 Cb 1.20 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 31.19 2o6b h ARG 108 CO 0.45 0.83 0.00 -1.21 -1.07 0.00 0.00 179.97 178.97 2o6b s GLU 109 N -2.73 4.38 0.57 0.04 2.02 -1.26 -2.59 118.70 119.13 2o6b s GLU 109 Ca 0.00 0.73 -0.20 0.00 0.02 0.00 0.00 54.97 55.52 2o6b s GLU 109 Cb 0.09 -3.41 -0.04 0.00 0.10 0.00 0.00 34.13 30.87 2o6b s GLU 109 CO 0.81 0.18 1.29 0.00 0.02 0.00 0.00 175.26 177.56 2o6b s ALA 110 N 0.45 2.66 -0.13 5.21 0.00 -0.71 -4.64 121.76 124.60 2o6b s ALA 110 Ca 0.33 1.18 -0.11 0.00 0.00 0.00 0.00 51.96 53.36 2o6b s ALA 110 Cb -0.17 -3.52 -0.26 0.00 0.00 0.00 0.00 23.12 19.18 2o6b s ALA 110 CO 0.16 -1.30 0.40 0.00 0.00 0.00 0.00 175.76 175.02 2o6b s ALA 112 N -2.51 1.22 -0.26 0.00 0.00 -1.24 -0.33 121.76 118.63 2o6b s ALA 112 Ca -0.22 -1.73 -0.26 0.00 0.00 0.00 0.00 51.96 49.75 2o6b s ALA 112 Cb 0.06 1.34 0.09 0.00 0.00 0.00 0.00 23.12 24.62 2o6b s ALA 112 CO 0.75 -0.69 0.86 0.00 0.00 0.00 0.00 175.76 176.68 2o6b s ALA 113 N -3.63 -1.87 0.27 0.00 0.00 -0.56 -1.11 121.76 114.87 2o6b s ALA 113 Ca 0.36 1.90 -0.13 0.00 0.00 0.00 0.00 51.96 54.10 2o6b s ALA 113 Cb 0.03 -1.19 0.05 0.00 0.00 0.00 0.00 23.12 22.00 2o6b s ALA 113 CO 0.20 -0.30 0.65 0.41 0.00 0.00 0.00 175.76 176.72 2o6b n GLY 114 N 2.29 1.10 3.18 0.00 0.00 0.26 -0.79 105.19 111.24 2o6b n GLY 114 Ca -0.13 -1.18 -0.10 0.00 0.00 0.00 0.00 46.02 44.61 2o6b n GLY 114 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2o6b s ARG 115 N -2.06 0.69 0.29 1.61 1.70 -0.75 0.11 118.95 120.54 2o6b s ARG 115 Ca 0.14 -0.62 -0.19 0.00 -0.47 0.00 0.00 55.73 54.58 2o6b s ARG 115 Cb -0.03 0.29 0.02 0.00 -0.57 0.00 0.00 34.95 34.65 2o6b s ARG 115 CO 0.08 -0.20 0.69 -0.59 -1.08 0.00 0.00 175.30 174.20 2o6b s PHE 116 N -2.54 -0.06 -0.13 5.89 -0.12 -1.08 -1.80 117.98 118.15 2o6b s PHE 116 Ca -0.05 -0.41 0.01 0.00 -0.05 0.00 0.00 56.93 56.43 2o6b s PHE 116 Cb -0.01 0.64 0.02 0.00 -0.63 0.00 0.00 43.02 43.04 2o6b s PHE 116 CO -0.04 -1.24 -0.15 0.08 -0.05 0.00 0.00 175.22 173.82 2o6b s VAL 117 N -3.72 1.55 0.19 -2.49 1.01 -0.89 -0.44 120.40 115.60 2o6b s VAL 117 Ca 0.13 -0.65 -0.17 0.00 0.00 0.00 0.00 61.98 61.30 2o6b s VAL 117 Cb -0.05 -1.43 -0.08 0.00 0.00 0.00 0.00 36.38 34.82 2o6b s VAL 117 CO 0.08 0.45 0.64 -1.00 0.00 0.00 0.00 175.10 175.27 2o6b s HIS 118 N 1.21 3.61 -0.16 5.22 3.76 -0.85 -2.77 115.29 125.33 2o6b s HIS 118 Ca -0.01 1.22 -0.01 0.00 -0.15 0.00 0.00 55.06 56.11 2o6b s HIS 118 Cb -0.14 -2.49 0.04 0.00 1.11 0.00 0.00 32.58 31.10 2o6b s HIS 118 CO -0.06 0.37 -0.02 0.08 -0.85 0.00 0.00 174.74 174.26 2o6b s VAL 119 N -1.52 0.86 0.21 -0.90 1.01 -0.80 -0.41 120.40 118.85 2o6b s VAL 119 Ca 0.41 -0.50 -0.27 0.00 0.00 0.00 0.00 61.98 61.62 2o6b s VAL 119 Cb -0.16 -1.11 -0.09 0.00 0.00 0.00 0.00 36.38 35.03 2o6b s VAL 119 CO 0.20 0.07 0.85 -0.36 0.00 0.00 0.00 175.10 175.86 2o6b s PHE 120 N 1.74 3.92 0.16 5.22 0.40 -0.58 -1.73 117.98 127.10 2o6b s PHE 120 Ca 0.01 1.75 -0.01 0.00 -0.60 0.00 0.00 56.93 58.08 2o6b s PHE 120 Cb -0.15 -2.86 -0.04 0.00 0.51 0.00 0.00 43.02 40.48 2o6b s PHE 120 CO -0.07 0.47 0.08 0.14 0.70 0.00 0.00 175.22 176.53 2o6b s VAL 121 N -1.21 0.15 0.10 -0.44 -7.23 -0.58 -2.56 120.40 108.64 2o6b s VAL 121 Ca 0.39 -1.95 -0.30 0.00 -1.81 0.00 0.00 61.98 58.31 2o6b s VAL 121 Cb -0.24 -2.22 -0.06 0.00 0.56 0.00 0.00 36.38 34.43 2o6b s VAL 121 CO 0.28 -0.31 0.98 -0.70 -0.31 0.00 0.00 175.10 175.04 2o6b s GLU 122 N -4.07 4.67 0.08 4.82 -6.30 -0.93 -2.23 118.70 114.74 2o6b s GLU 122 Ca 0.29 1.47 -0.36 0.00 -2.50 0.00 0.00 54.97 53.87 2o6b s GLU 122 Cb 0.07 -3.38 -0.19 0.00 0.00 0.00 0.00 34.13 30.64 2o6b s GLU 122 CO 0.06 0.17 1.57 -0.09 0.02 0.00 0.00 175.26 176.99 2o6b h ARG 123 N 5.68 -1.09 0.06 4.30 2.43 -0.30 0.16 114.38 125.63 2o6b h ARG 123 Ca -0.43 0.07 0.02 0.00 -0.81 0.00 0.00 59.98 58.83 2o6b h ARG 123 Cb 1.21 0.25 -0.03 0.00 -0.42 0.00 0.00 29.97 30.98 2o6b h ARG 123 CO 0.72 -0.73 -0.17 0.00 -1.51 0.00 0.00 179.97 178.28 2o6b h ARG 124 N -1.13 -0.30 0.00 0.20 -0.00 -1.93 -3.15 114.38 108.07 2o6b h ARG 124 Ca -0.09 0.02 -0.08 0.00 -0.50 0.00 0.00 59.98 59.33 2o6b h ARG 124 Cb 0.93 0.07 -0.01 0.00 0.00 0.00 0.00 29.97 30.95 2o6b h ARG 124 CO 0.06 -0.20 -0.40 0.66 0.00 0.00 0.00 179.97 180.09 2o6b h SER 125 N -0.31 0.00 -2.51 7.04 4.64 -1.95 -3.47 113.55 116.99 2o6b h SER 125 Ca 0.04 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.05 2o6b h SER 125 Cb 0.35 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.38 2o6b h SER 125 CO -0.12 0.40 -0.33 -1.54 -0.87 0.00 0.00 176.83 174.36 2o6b n SER 126 N -3.22 -4.25 -4.73 4.97 3.41 0.56 -4.98 113.62 105.38 2o6b n SER 126 Ca 0.02 0.24 -0.35 0.00 -0.26 0.00 0.00 58.87 58.52 2o6b n SER 126 Cb 0.68 -3.72 -0.08 0.00 -0.26 0.00 0.00 64.21 60.83 2o6b n SER 126 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2o6b s ARG 127 N -4.21 4.20 1.00 4.33 3.00 -1.25 -4.82 118.95 121.20 2o6b s ARG 127 Ca 0.00 -0.18 -0.19 0.00 0.00 0.00 0.00 55.73 55.36 2o6b s ARG 127 Cb 0.00 -3.42 -0.15 0.00 0.00 0.00 0.00 34.95 31.38 2o6b s ARG 127 CO 0.00 0.29 -0.92 -2.30 0.00 0.00 0.00 175.30 172.37 2o6b n PRO 128 N 3.53 -0.03 -3.60 3.54 -0.02 -1.26 -2.18 135.00 134.97 2o6b n PRO 128 Ca -0.15 -0.01 -0.11 0.00 -2.02 0.00 0.00 63.50 61.21 2o6b n PRO 128 Cb 0.52 -1.04 -0.04 0.00 -0.02 0.00 0.00 33.50 32.92 2o6b n PRO 128 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2o6b s VAL 129 N -2.02 0.05 0.37 -1.45 -7.23 -1.06 -4.58 120.40 104.48 2o6b s VAL 129 Ca 0.40 -0.48 -0.27 0.00 -1.81 0.00 0.00 61.98 59.82 2o6b s VAL 129 Cb -0.12 -1.21 -0.09 0.00 0.56 0.00 0.00 36.38 35.52 2o6b s VAL 129 CO 0.78 -0.21 1.28 0.00 -0.31 0.00 0.00 175.10 176.65 2o6b s ALA 130 N -3.80 3.34 -0.11 1.32 0.00 -1.26 -3.77 121.76 117.48 2o6b s ALA 130 Ca 0.04 1.20 -0.29 0.00 0.00 0.00 0.00 51.96 52.91 2o6b s ALA 130 Cb 0.01 -3.47 -0.06 0.00 0.00 0.00 0.00 23.12 19.60 2o6b s ALA 130 CO -0.11 -0.70 1.90 0.42 0.00 0.00 0.00 175.76 177.27 2o6b s ILE 131 N -1.23 3.27 0.88 0.00 1.01 0.34 -4.92 121.20 120.55 2o6b s ILE 131 Ca 0.53 0.31 -0.11 0.00 0.00 0.00 0.00 60.65 61.39 2o6b s ILE 131 Cb -0.38 -3.26 0.13 0.00 0.01 0.00 0.00 42.46 38.96 2o6b s ILE 131 CO 0.49 -0.09 1.17 -2.16 0.00 0.00 0.00 174.94 174.35 2o6b s PRO 132 N 4.95 1.20 0.23 2.79 0.04 -1.26 -4.59 135.00 138.36 2o6b s PRO 132 Ca 0.85 1.64 -0.07 0.00 0.04 0.00 0.00 61.00 63.46 2o6b s PRO 132 Cb -0.34 -1.74 0.37 0.00 0.04 0.00 0.00 34.50 32.83 2o6b s PRO 132 CO 0.35 -2.51 1.73 0.37 0.04 0.00 0.00 177.00 176.98 2o6b h GLN 133 N -1.55 0.39 -0.64 4.56 5.75 -1.97 -2.21 115.11 119.44 2o6b h GLN 133 Ca -0.44 -0.02 -0.06 0.00 -0.15 0.00 0.00 58.65 57.97 2o6b h GLN 133 Cb 1.28 -0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.71 2o6b h GLN 133 CO 0.43 0.26 0.16 0.93 -2.65 0.00 0.00 178.83 177.96 2o6b h GLU 134 N 0.41 1.01 0.67 1.69 5.08 -1.89 0.15 114.58 121.70 2o6b h GLU 134 Ca 0.36 -0.24 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 2o6b h GLU 134 Cb 0.51 -0.13 0.01 0.00 0.50 0.00 0.00 28.75 29.64 2o6b h GLU 134 CO -0.37 0.92 -0.32 -0.07 -1.00 0.00 0.00 179.01 178.16 2o6b h LEU 135 N 0.93 -0.76 -1.04 1.33 4.07 -1.44 -2.04 115.31 116.36 2o6b h LEU 135 Ca 0.20 0.03 0.40 0.00 0.08 0.00 0.00 57.88 58.59 2o6b h LEU 135 Cb 0.35 0.20 -0.17 0.00 1.08 0.00 0.00 40.66 42.12 2o6b h LEU 135 CO 0.00 -0.53 0.58 -0.09 -1.08 0.00 0.00 178.44 177.32 2o6b h ARG 136 N -0.93 0.07 0.69 1.13 2.43 -1.35 1.30 114.38 117.72 2o6b h ARG 136 Ca -0.09 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.04 2o6b h ARG 136 Cb 0.69 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 30.23 2o6b h ARG 136 CO 0.15 0.05 -0.33 -0.44 -1.51 0.00 0.00 179.97 177.89 2o6b h ASP 137 N 0.07 -0.78 -0.59 -3.80 5.19 -0.43 -0.60 116.42 115.49 2o6b h ASP 137 Ca 0.83 0.03 -0.05 0.00 -0.62 0.00 0.00 57.03 57.21 2o6b h ASP 137 Cb 2.18 0.20 -0.03 0.00 0.18 0.00 0.00 39.33 41.86 2o6b h ASP 137 CO -0.70 -0.48 0.17 0.00 -3.12 0.00 0.00 179.24 175.11 2o6b h ALA 138 N -1.42 1.13 0.28 3.45 0.00 -0.46 -1.67 119.26 120.57 2o6b h ALA 138 Ca -0.09 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.61 2o6b h ALA 138 Cb 0.71 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 2o6b h ALA 138 CO 0.16 0.59 -0.41 -0.07 0.00 0.00 0.00 179.25 179.52 2o6b h LEU 139 N 0.92 -1.14 -1.29 0.00 3.38 0.16 -2.47 115.31 114.87 2o6b h LEU 139 Ca 0.20 0.11 0.16 0.00 0.09 0.00 0.00 57.88 58.44 2o6b h LEU 139 Cb 0.30 0.40 -0.07 0.00 0.09 0.00 0.00 40.66 41.38 2o6b h LEU 139 CO -0.00 -0.52 0.58 0.00 0.09 0.00 0.00 178.44 178.59 2o6b h ALA 140 N -0.32 1.87 0.00 1.53 0.00 -0.98 0.16 119.26 121.53 2o6b h ALA 140 Ca -0.01 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2o6b h ALA 140 Cb 0.70 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2o6b h ALA 140 CO -0.14 -0.13 0.18 0.00 0.00 0.00 0.00 179.25 179.16 2o6b n ALA 141 N -2.44 0.64 0.23 0.00 0.00 -0.64 -1.41 120.51 116.89 2o6b n ALA 141 Ca 0.18 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.64 2o6b n ALA 141 Cb 0.51 -0.64 -0.03 0.00 0.00 0.00 0.00 19.45 19.29 2o6b n ALA 141 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2o6b n LEU 142 N -1.32 0.23 -4.47 0.00 4.77 0.04 -5.02 117.00 111.22 2o6b n LEU 142 Ca 0.00 -0.50 -0.47 0.00 -0.03 0.00 0.00 56.01 55.01 2o6b n LEU 142 Cb 0.18 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.24 2o6b n LEU 142 CO 0.00 0.06 0.22 0.00 -1.33 0.00 0.00 177.39 176.34 2o6b n GLN 143 N -1.12 0.50 0.00 3.23 1.13 -0.50 -2.59 117.38 118.03 2o6b n GLN 143 Ca 0.01 0.18 0.00 0.00 -1.94 0.00 0.00 57.00 55.25 2o6b n GLN 143 Cb 0.08 -1.33 0.00 0.00 0.11 0.00 0.00 30.24 29.10 2o6b n GLN 143 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49