#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o6b n ARG 6 N 0.00 1.37 -0.87 0.54 0.00 -1.26 -4.90 116.66 111.54 2o6b n ARG 6 Ca 0.00 0.40 -0.35 0.00 -0.00 0.00 0.00 57.85 57.90 2o6b n ARG 6 Cb 0.00 -2.63 0.09 0.00 -0.00 0.00 0.00 32.46 29.92 2o6b n ARG 6 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 2o6b n PRO 7 N 8.06 -0.38 -4.00 2.89 -0.02 -1.26 -4.69 135.00 135.60 2o6b n PRO 7 Ca 0.36 -0.09 -0.11 0.00 -2.02 0.00 0.00 63.50 61.65 2o6b n PRO 7 Cb 0.28 -1.41 -0.11 0.00 -0.02 0.00 0.00 33.50 32.23 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 3.31 2.22 0.21 2.45 1.43 -1.26 -1.55 118.68 125.48 2o6b s LEU 8 Ca 0.48 -0.47 -0.11 0.00 -1.03 0.00 0.00 54.13 53.00 2o6b s LEU 8 Cb -0.13 0.00 0.27 0.00 0.03 0.00 0.00 46.19 46.36 2o6b s LEU 8 CO 0.72 -0.24 1.68 -0.09 0.23 0.00 0.00 176.35 178.65 2o6b h ARG 9 N 4.75 0.15 0.00 1.70 2.43 -1.82 -0.89 114.38 120.71 2o6b h ARG 9 Ca -0.32 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.84 2o6b h ARG 9 Cb 1.21 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 2o6b h ARG 9 CO 0.42 0.10 0.00 -0.85 -1.51 0.00 0.00 179.97 178.13 2o6b n GLU 10 N -5.23 0.18 0.00 0.20 0.00 -1.26 -2.03 120.64 112.50 2o6b n GLU 10 Ca 0.08 0.16 0.16 0.00 0.00 0.00 0.00 57.16 57.56 2o6b n GLU 10 Cb 0.33 -1.50 0.92 0.00 0.00 0.00 0.00 31.44 31.19 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 -1.31 1.02 -4.92 3.44 6.02 -0.34 -4.86 117.38 116.44 2o6b n GLN 11 Ca 0.06 -0.05 -0.26 0.00 -0.01 0.00 0.00 57.00 56.74 2o6b n GLN 11 Cb 0.12 -1.50 -0.16 0.00 1.02 0.00 0.00 30.24 29.72 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 -2.02 1.75 -0.05 1.08 1.51 -0.86 -4.94 117.35 113.81 2o6b s TYR 12 Ca 0.47 -0.39 -0.05 0.00 -1.01 0.00 0.00 57.07 56.09 2o6b s TYR 12 Cb 0.22 -1.14 -0.28 0.00 -0.11 0.00 0.00 41.96 40.65 2o6b s TYR 12 CO 0.37 -0.08 0.63 1.37 -1.11 0.00 0.00 175.55 176.73 2o6b h LEU 13 N 5.85 0.42 -8.70 -1.29 -0.00 -1.50 -3.46 115.31 106.63 2o6b h LEU 13 Ca -0.36 -0.73 -0.66 0.00 -0.00 0.00 0.00 57.88 56.13 2o6b h LEU 13 Cb 1.15 -0.14 -0.26 0.00 -0.00 0.00 0.00 40.66 41.42 2o6b h LEU 13 CO 0.48 1.63 -0.87 -2.28 -0.00 0.00 0.00 178.44 177.40 2o6b s HIS 14 N -2.59 2.18 -0.22 0.17 5.65 -0.18 -4.97 115.29 115.33 2o6b s HIS 14 Ca -0.15 -0.40 0.00 0.00 0.25 0.00 0.00 55.06 54.76 2o6b s HIS 14 Cb 0.06 -1.30 0.06 0.00 -1.18 0.00 0.00 32.58 30.22 2o6b s HIS 14 CO 0.82 0.13 -0.04 -0.06 -0.65 0.00 0.00 174.74 174.94 2o6b s PHE 15 N -0.82 2.11 -0.23 3.88 0.40 -1.26 -1.14 117.98 120.92 2o6b s PHE 15 Ca 0.11 -1.55 -0.13 0.00 -0.60 0.00 0.00 56.93 54.76 2o6b s PHE 15 Cb -0.10 -1.47 -0.04 0.00 0.51 0.00 0.00 43.02 41.92 2o6b s PHE 15 CO 0.02 -0.73 0.27 -0.65 0.70 0.00 0.00 175.22 174.83 2o6b s GLN 16 N 1.49 4.10 0.14 0.44 -1.52 -0.57 -4.90 119.66 118.85 2o6b s GLN 16 Ca -0.04 -0.06 -0.25 0.00 -1.95 0.00 0.00 55.36 53.06 2o6b s GLN 16 Cb -0.18 -3.55 -0.08 0.00 -0.22 0.00 0.00 33.01 28.98 2o6b s GLN 16 CO -0.07 -0.02 0.76 -1.25 -0.25 0.00 0.00 175.29 174.47 2o6b s PRO 17 N 1.27 4.53 -0.06 2.91 0.05 -1.26 0.14 135.00 142.58 2o6b s PRO 17 Ca 0.13 1.11 0.00 0.00 0.05 0.00 0.00 61.00 62.30 2o6b s PRO 17 Cb -0.14 -3.27 0.02 0.00 0.05 0.00 0.00 34.50 31.16 2o6b s PRO 17 CO 0.07 0.54 -0.04 0.42 0.05 0.00 0.00 177.00 178.03 2o6b s ILE 18 N -0.99 0.59 0.12 0.56 1.01 -1.22 -4.95 121.20 116.32 2o6b s ILE 18 Ca 0.36 -0.10 -0.31 0.00 0.00 0.00 0.00 60.65 60.59 2o6b s ILE 18 Cb -0.22 -0.64 -0.08 0.00 0.01 0.00 0.00 42.46 41.53 2o6b s ILE 18 CO 0.25 0.26 1.35 -0.94 0.00 0.00 0.00 174.94 175.86 2o6b s SER 19 N 1.24 6.87 0.83 3.58 1.04 -1.26 -4.27 113.70 121.74 2o6b s SER 19 Ca -0.06 2.29 -0.12 0.00 0.48 0.00 0.00 55.95 58.55 2o6b s SER 19 Cb -0.14 -2.59 0.09 0.00 0.10 0.00 0.00 66.02 63.48 2o6b s SER 19 CO -0.02 -0.60 1.11 0.42 0.98 0.00 0.00 173.24 175.13 2o6b s THR 20 N 0.93 2.68 0.07 2.02 -4.23 -1.26 -5.07 115.64 110.78 2o6b s THR 20 Ca 0.62 0.22 0.03 0.00 -1.18 0.00 0.00 61.69 61.38 2o6b s THR 20 Cb -0.36 -2.99 -0.03 0.00 1.34 0.00 0.00 72.50 70.46 2o6b s THR 20 CO 0.31 -0.29 -0.09 -0.13 -0.54 0.00 0.00 174.62 173.88 2o6b s ARG 21 N -5.22 0.73 0.10 3.99 0.52 -1.26 -5.03 118.95 112.77 2o6b s ARG 21 Ca 0.62 -1.02 -0.30 0.00 -0.52 0.00 0.00 55.73 54.50 2o6b s ARG 21 Cb -0.14 -0.43 -0.13 0.00 0.52 0.00 0.00 34.95 34.77 2o6b s ARG 21 CO 0.54 0.07 1.62 2.35 0.02 0.00 0.00 175.30 179.89 2o6b h TRP 22 N 3.89 -0.88 0.00 -0.53 2.91 -1.98 0.02 115.95 119.37 2o6b h TRP 22 Ca -0.37 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.66 2o6b h TRP 22 Cb 1.19 0.34 0.00 0.00 -0.51 0.00 0.00 29.16 30.18 2o6b h TRP 22 CO 0.63 -0.47 0.00 1.58 -1.03 0.00 0.00 178.44 179.15 2o6b n HIS 23 N -5.44 0.00 0.06 2.65 -0.00 -1.26 -3.17 115.22 108.05 2o6b n HIS 23 Ca -0.10 -0.40 -0.20 0.00 0.46 0.00 0.00 57.72 57.48 2o6b n HIS 23 Cb 0.34 -0.22 -0.14 0.00 -0.12 0.00 0.00 29.99 29.85 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 0.10 0.55 -2.67 0.26 3.32 -1.39 -3.45 116.42 113.13 2o6b h ASP 24 Ca 0.00 -0.91 -0.52 0.00 0.02 0.00 0.00 57.03 55.62 2o6b h ASP 24 Cb 0.87 -0.18 0.05 0.00 0.22 0.00 0.00 39.33 40.30 2o6b h ASP 24 CO 0.00 1.41 1.00 0.20 -1.72 0.00 0.00 179.24 180.14 2o6b s ASN 25 N -7.03 6.45 0.65 6.45 0.01 -1.19 -1.40 114.94 118.87 2o6b s ASN 25 Ca -0.13 2.77 -0.01 0.00 -0.71 0.00 0.00 52.86 54.78 2o6b s ASN 25 Cb 0.02 -2.59 0.03 0.00 0.41 0.00 0.00 41.25 39.12 2o6b s ASN 25 CO 0.85 -0.94 0.19 -0.90 -1.51 0.00 0.00 177.10 174.79 2o6b n ASP 26 N 4.42 0.15 -0.17 -1.22 5.75 -0.46 -4.82 116.55 120.21 2o6b n ASP 26 Ca 0.16 -1.16 0.08 0.00 -0.01 0.00 0.00 54.79 53.86 2o6b n ASP 26 Cb 0.37 -0.14 0.39 0.00 -1.03 0.00 0.00 41.12 40.71 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 -0.68 0.98 -0.81 2.12 2.10 -1.95 -2.34 117.51 116.93 2o6b h ILE 27 Ca -0.06 -0.23 -0.42 0.00 1.08 0.00 0.00 64.86 65.22 2o6b h ILE 27 Cb 0.21 0.24 -0.16 0.00 -1.09 0.00 0.00 36.82 36.03 2o6b h ILE 27 CO 0.06 0.12 0.31 -1.22 -1.08 0.00 0.00 178.15 176.35 2o6b n TYR 28 N -4.49 1.40 0.00 2.19 4.01 -1.26 -4.88 117.16 114.14 2o6b n TYR 28 Ca 0.11 -1.89 0.00 0.00 -0.16 0.00 0.00 57.90 55.96 2o6b n TYR 28 Cb 0.28 -1.30 0.00 0.00 -0.31 0.00 0.00 39.34 38.01 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 0.92 2.01 3.22 2.72 0.00 -0.88 -4.95 105.19 108.24 2o6b n GLY 29 Ca 0.43 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.25 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 -1.74 1.43 -0.22 1.61 3.76 -1.26 -4.78 115.29 114.09 2o6b s HIS 30 Ca 0.00 -0.47 -0.39 0.00 -0.15 0.00 0.00 55.06 54.05 2o6b s HIS 30 Cb 0.00 -0.78 -0.16 0.00 1.11 0.00 0.00 32.58 32.75 2o6b s HIS 30 CO 0.00 0.13 1.69 0.28 -0.85 0.00 0.00 174.74 175.99 2o6b n VAL 31 N 1.04 0.27 -1.58 -0.90 0.31 0.82 -1.35 118.33 116.95 2o6b n VAL 31 Ca -0.19 -0.05 -0.41 0.00 -0.01 0.00 0.00 64.34 63.68 2o6b n VAL 31 Cb 0.55 -1.20 0.01 0.00 -0.91 0.00 0.00 33.84 32.29 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 5.03 0.76 -0.02 4.52 4.05 -0.49 -4.81 115.26 124.29 2o6b n ASN 32 Ca 0.25 0.99 0.08 0.00 0.45 0.00 0.00 54.58 56.36 2o6b n ASN 32 Cb 0.15 -1.30 0.48 0.00 1.23 0.00 0.00 39.78 40.33 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 1.31 0.39 -0.93 1.20 7.08 -1.92 -2.15 115.58 120.56 2o6b h ASN 33 Ca -0.44 -0.00 0.04 0.00 -3.08 0.00 0.00 56.30 52.82 2o6b h ASN 33 Cb 1.35 -0.09 -0.06 0.00 -2.08 0.00 0.00 38.32 37.45 2o6b h ASN 33 CO 0.55 0.26 0.60 0.58 -2.08 0.00 0.00 177.43 177.34 2o6b h VAL 34 N 0.44 1.13 -0.32 6.14 2.07 -1.98 -2.96 116.25 120.77 2o6b h VAL 34 Ca 0.20 -0.39 0.09 0.00 0.82 0.00 0.00 66.70 67.42 2o6b h VAL 34 Cb 0.24 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 29.89 2o6b h VAL 34 CO -0.05 0.21 0.33 0.74 0.02 0.00 0.00 177.57 178.81 2o6b h THR 35 N 1.14 0.46 -0.09 2.57 2.02 -1.73 -0.70 112.91 116.58 2o6b h THR 35 Ca 0.38 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.56 2o6b h THR 35 Cb 0.05 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 2o6b h THR 35 CO -0.13 0.00 0.03 1.88 0.37 0.00 0.00 175.52 177.66 2o6b h TYR 36 N 0.00 0.05 -0.97 3.16 -1.99 -1.65 0.90 116.97 116.48 2o6b h TYR 36 Ca 0.15 0.00 0.12 0.00 2.00 0.00 0.00 58.73 61.00 2o6b h TYR 36 Cb 0.81 -0.01 -0.08 0.00 2.00 0.00 0.00 36.73 39.44 2o6b h TYR 36 CO 0.00 0.03 0.60 1.88 -0.00 0.00 0.00 178.16 180.67 2o6b h TYR 37 N 0.07 1.08 -0.13 4.88 -1.99 -1.32 0.17 116.97 119.74 2o6b h TYR 37 Ca 0.04 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.80 2o6b h TYR 37 Cb 0.02 -0.34 -0.01 0.00 2.00 0.00 0.00 36.73 38.40 2o6b h TYR 37 CO -0.10 0.42 0.08 0.00 -0.00 0.00 0.00 178.16 178.57 2o6b h ALA 38 N 1.53 0.16 -0.63 3.88 0.00 -1.23 -0.53 119.26 122.45 2o6b h ALA 38 Ca 0.48 -0.01 0.17 0.00 0.00 0.00 0.00 54.91 55.55 2o6b h ALA 38 Cb 0.47 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2o6b h ALA 38 CO -0.27 -0.35 0.45 0.74 0.00 0.00 0.00 179.25 179.81 2o6b h PHE 39 N 0.17 0.09 0.00 0.00 0.04 0.75 -1.87 116.94 116.12 2o6b h PHE 39 Ca 0.05 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.82 2o6b h PHE 39 Cb -0.01 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.11 2o6b h PHE 39 CO -0.07 0.03 0.00 1.19 -0.60 0.00 0.00 178.31 178.86 2o6b n PHE 40 N -4.38 0.00 0.35 -0.55 3.72 0.44 -1.99 117.46 115.05 2o6b n PHE 40 Ca 0.12 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.61 2o6b n PHE 40 Cb 0.65 -0.37 0.39 0.00 -0.94 0.00 0.00 39.48 39.21 2o6b n PHE 40 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2o6b n ASP 41 N -1.60 0.36 0.04 4.37 5.75 -1.10 -0.76 116.55 123.61 2o6b n ASP 41 Ca 0.00 0.61 -0.01 0.00 -0.01 0.00 0.00 54.79 55.37 2o6b n ASP 41 Cb 0.00 -0.68 -0.01 0.00 -1.03 0.00 0.00 41.12 39.40 2o6b n ASP 41 CO 0.00 0.00 0.00 0.74 -0.11 0.00 0.00 177.20 177.83 2o6b h THR 42 N 0.00 0.00 -0.68 2.12 2.02 -1.41 -2.10 112.91 112.86 2o6b h THR 42 Ca 0.00 -0.02 0.12 0.00 0.77 0.00 0.00 66.41 67.28 2o6b h THR 42 Cb 0.23 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.52 2o6b h THR 42 CO 0.00 0.00 -0.22 0.00 0.37 0.00 0.00 175.52 175.67 2o6b n ALA 43 N -2.06 0.02 -0.55 6.16 0.00 -0.15 -0.24 120.51 123.70 2o6b n ALA 43 Ca -0.01 0.71 0.00 0.00 0.00 0.00 0.00 53.44 54.14 2o6b n ALA 43 Cb 0.04 -0.37 0.00 0.00 0.00 0.00 0.00 19.45 19.12 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 -5.05 0.00 -0.43 0.00 0.31 0.06 -2.70 118.33 110.53 2o6b n VAL 44 Ca 0.09 1.10 0.35 0.00 -0.01 0.00 0.00 64.34 65.87 2o6b n VAL 44 Cb 0.30 -2.03 0.65 0.00 -0.91 0.00 0.00 33.84 31.85 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 0.23 -0.12 4.52 2.35 -1.19 0.94 115.58 122.30 2o6b h ASN 45 Ca 0.00 0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2o6b h ASN 45 Cb 0.00 0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 2o6b h ASN 45 CO 0.00 -0.07 0.07 0.74 -1.65 0.00 0.00 177.43 176.52 2o6b h THR 46 N 0.13 1.08 0.79 2.81 2.02 -0.62 0.50 112.91 119.62 2o6b h THR 46 Ca 0.74 -0.23 -0.04 0.00 0.77 0.00 0.00 66.41 67.66 2o6b h THR 46 Cb 2.42 1.01 0.01 0.00 -1.74 0.00 0.00 68.15 69.85 2o6b h THR 46 CO -0.28 0.08 -0.38 0.22 0.37 0.00 0.00 175.52 175.53 2o6b h TYR 47 N 0.11 -0.98 -0.76 3.16 3.20 0.11 -2.04 116.97 119.77 2o6b h TYR 47 Ca 0.04 -0.02 0.15 0.00 3.14 0.00 0.00 58.73 62.04 2o6b h TYR 47 Cb 0.06 0.32 -0.14 0.00 1.54 0.00 0.00 36.73 38.51 2o6b h TYR 47 CO -0.05 -0.60 -0.18 1.28 -1.64 0.00 0.00 178.16 176.97 2o6b n LEU 48 N -5.53 -0.27 -0.05 2.82 4.77 -0.27 -0.94 117.00 117.53 2o6b n LEU 48 Ca -0.15 1.31 -0.11 0.00 -0.03 0.00 0.00 56.01 57.03 2o6b n LEU 48 Cb 0.43 -0.40 -0.05 0.00 -2.33 0.00 0.00 43.42 41.07 2o6b n LEU 48 CO 0.38 -1.26 0.85 0.40 -1.33 0.00 0.00 177.39 176.44 2o6b h ILE 49 N 0.00 1.16 -0.00 -0.08 5.03 0.56 0.12 117.51 124.29 2o6b h ILE 49 Ca 0.37 -0.48 0.00 0.00 -0.12 0.00 0.00 64.86 64.63 2o6b h ILE 49 Cb 0.57 1.13 0.00 0.00 -3.03 0.00 0.00 36.82 35.49 2o6b h ILE 49 CO -0.78 0.15 -0.17 -0.62 -0.68 0.00 0.00 178.15 176.05 2o6b n GLU 50 N -4.85 0.09 0.00 2.37 1.02 -0.49 -3.69 120.64 115.09 2o6b n GLU 50 Ca -0.04 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 2o6b n GLU 50 Cb 0.12 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 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 -1.43 4.62 0.01 3.49 5.12 -0.12 -4.74 116.66 123.61 2o6b n ARG 51 Ca 0.08 0.00 0.12 0.00 -1.93 0.00 0.00 57.85 56.11 2o6b n ARG 51 Cb 0.33 -0.45 0.15 0.00 -1.16 0.00 0.00 32.46 31.33 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 0.06 -1.22 2.28 -0.13 0.00 0.38 -4.52 105.19 102.03 2o6b n GLY 52 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 1.46 2.10 3.68 -0.02 0.00 -1.09 -3.28 105.19 108.04 2o6b n GLY 53 Ca 0.04 -0.40 -0.55 0.00 0.00 0.00 0.00 46.02 45.11 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 2.36 -2.25 0.99 0.00 -1.26 -4.89 117.00 111.95 2o6b n LEU 54 Ca 0.00 1.07 -0.01 0.00 0.00 0.00 0.00 56.01 57.08 2o6b n LEU 54 Cb 0.00 -1.19 0.00 0.00 0.00 0.00 0.00 43.42 42.23 2o6b n LEU 54 CO 0.00 -0.52 0.15 -0.67 0.00 0.00 0.00 177.39 176.35 2o6b n ASP 55 N 4.81 -4.86 -0.13 1.96 2.03 -1.26 -3.47 116.55 115.63 2o6b n ASP 55 Ca 0.24 0.01 -0.19 0.00 0.52 0.00 0.00 54.79 55.37 2o6b n ASP 55 Cb 0.17 -3.12 -0.11 0.00 -0.72 0.00 0.00 41.12 37.33 2o6b n ASP 55 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 2o6b n ILE 56 N -1.23 1.45 0.33 5.18 -5.35 -1.26 -0.72 119.36 117.77 2o6b n ILE 56 Ca 0.01 -0.53 -0.17 0.00 -0.27 0.00 0.00 62.75 61.79 2o6b n ILE 56 Cb 0.46 -1.47 -0.09 0.00 -1.74 0.00 0.00 39.64 36.80 2o6b n ILE 56 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 2o6b h GLN 57 N -0.15 -0.96 0.16 6.28 1.08 -1.97 -3.34 115.11 116.20 2o6b h GLN 57 Ca -0.58 0.07 -0.31 0.00 -1.45 0.00 0.00 58.65 56.37 2o6b h GLN 57 Cb 1.83 0.22 0.01 0.00 -0.05 0.00 0.00 27.48 29.49 2o6b h GLN 57 CO -0.14 -0.64 -1.49 0.78 -0.95 0.00 0.00 178.83 176.38 2o6b h GLY 58 N -1.00 0.38 -6.24 3.46 0.00 -2.00 -3.49 103.07 94.18 2o6b h GLY 58 Ca -0.08 -0.98 -0.79 0.00 0.00 0.00 0.00 47.33 45.48 2o6b h GLY 58 CO 0.03 0.86 0.39 0.61 0.00 0.00 0.00 176.54 178.43 2o6b n GLY 59 N 1.68 0.09 0.24 4.60 0.00 0.10 -4.87 105.19 107.03 2o6b n GLY 59 Ca -0.16 0.84 0.13 0.00 0.00 0.00 0.00 46.02 46.83 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 4.24 0.00 -5.46 1.61 4.39 -1.94 -3.43 114.58 113.99 2o6b h GLU 60 Ca -0.48 0.00 -0.65 0.00 0.34 0.00 0.00 59.36 58.57 2o6b h GLU 60 Cb 1.39 0.00 -0.22 0.00 -0.10 0.00 0.00 28.75 29.82 2o6b h GLU 60 CO 0.80 0.14 -0.68 0.54 -1.16 0.00 0.00 179.01 178.64 2o6b s VAL 61 N -3.65 3.77 0.03 3.13 0.11 -1.26 0.03 120.40 122.56 2o6b s VAL 61 Ca 0.01 -0.41 0.01 0.00 -2.93 0.00 0.00 61.98 58.66 2o6b s VAL 61 Cb 0.10 -2.63 -0.02 0.00 -1.53 0.00 0.00 36.38 32.30 2o6b s VAL 61 CO 0.60 0.52 -0.05 0.27 -3.33 0.00 0.00 175.10 173.12 2o6b s ILE 62 N 0.12 0.27 0.07 7.04 -4.36 -0.88 -4.86 121.20 118.60 2o6b s ILE 62 Ca -0.02 -1.01 -0.09 0.00 -0.26 0.00 0.00 60.65 59.28 2o6b s ILE 62 Cb -0.14 -0.43 -0.06 0.00 1.25 0.00 0.00 42.46 43.08 2o6b s ILE 62 CO 0.03 -0.48 0.37 -0.83 0.24 0.00 0.00 174.94 174.28 2o6b s GLY 63 N -1.56 2.32 0.07 6.27 0.00 -1.26 -1.27 107.32 111.89 2o6b s GLY 63 Ca -0.13 -0.43 0.08 0.00 0.00 0.00 0.00 44.72 44.24 2o6b s GLY 63 CO -0.01 -0.22 -0.21 1.08 0.00 0.00 0.00 173.10 173.74 2o6b s LEU 64 N -1.93 2.22 -0.34 0.66 1.43 -0.05 -4.89 118.68 115.78 2o6b s LEU 64 Ca 0.32 -0.59 -0.17 0.00 -1.03 0.00 0.00 54.13 52.67 2o6b s LEU 64 Cb -0.14 -0.94 -0.01 0.00 0.03 0.00 0.00 46.19 45.13 2o6b s LEU 64 CO 0.18 0.12 0.45 -0.69 0.23 0.00 0.00 176.35 176.64 2o6b s VAL 65 N -0.95 5.08 -0.12 -1.59 1.01 -1.26 -1.10 120.40 121.47 2o6b s VAL 65 Ca 0.07 0.26 0.20 0.00 0.00 0.00 0.00 61.98 62.51 2o6b s VAL 65 Cb -0.09 -3.90 -0.26 0.00 0.00 0.00 0.00 36.38 32.13 2o6b s VAL 65 CO 0.03 -0.14 0.38 1.33 0.00 0.00 0.00 175.10 176.70 2o6b n VAL 66 N 5.33 0.77 -3.60 2.92 0.24 -0.99 -4.98 118.33 118.02 2o6b n VAL 66 Ca -0.06 -0.68 -0.11 0.00 -2.04 0.00 0.00 64.34 61.45 2o6b n VAL 66 Cb 0.49 -0.31 -0.04 0.00 -1.47 0.00 0.00 33.84 32.50 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 -5.14 -0.30 0.27 -1.34 1.04 -1.26 -5.07 113.70 101.90 2o6b s SER 67 Ca -0.08 -0.21 -0.16 0.00 0.48 0.00 0.00 55.95 55.98 2o6b s SER 67 Cb 0.10 0.49 0.01 0.00 0.10 0.00 0.00 66.02 66.71 2o6b s SER 67 CO 0.86 -0.84 0.59 -0.94 0.98 0.00 0.00 173.24 173.89 2o6b s SER 68 N -2.66 -0.16 0.05 7.02 1.04 -1.26 -2.39 113.70 115.33 2o6b s SER 68 Ca 0.01 -0.80 -0.27 0.00 0.48 0.00 0.00 55.95 55.38 2o6b s SER 68 Cb 0.01 0.66 0.09 0.00 0.10 0.00 0.00 66.02 66.88 2o6b s SER 68 CO -0.11 -1.25 0.82 -0.94 0.98 0.00 0.00 173.24 172.74 2o6b s SER 69 N -2.98 -0.41 -0.18 7.02 1.04 -0.82 -5.01 113.70 112.37 2o6b s SER 69 Ca 0.17 -0.03 -0.22 0.00 0.48 0.00 0.00 55.95 56.35 2o6b s SER 69 Cb -0.03 0.45 0.06 0.00 0.10 0.00 0.00 66.02 66.60 2o6b s SER 69 CO 0.08 -0.73 0.60 0.00 0.98 0.00 0.00 173.24 174.16 2o6b s ASP 71 N -0.06 3.37 -0.15 0.00 1.11 -0.19 -4.99 116.67 115.76 2o6b s ASP 71 Ca -0.03 -0.39 -0.02 0.00 0.18 0.00 0.00 52.55 52.28 2o6b s ASP 71 Cb -0.04 -0.64 -0.02 0.00 1.07 0.00 0.00 42.92 43.29 2o6b s ASP 71 CO 0.03 0.31 -0.07 -0.31 1.18 0.00 0.00 175.17 176.30 2o6b s TYR 72 N -0.51 2.94 -0.08 4.23 1.51 -1.26 -1.42 117.35 122.75 2o6b s TYR 72 Ca 0.07 -0.48 -0.07 0.00 -1.01 0.00 0.00 57.07 55.59 2o6b s TYR 72 Cb -0.11 -1.93 -0.04 0.00 -0.11 0.00 0.00 41.96 39.77 2o6b s TYR 72 CO 0.01 -0.14 -0.15 1.19 -1.11 0.00 0.00 175.55 175.34 2o6b n PHE 73 N 3.64 0.00 -4.33 2.71 3.72 -0.33 -5.00 117.46 117.87 2o6b n PHE 73 Ca -0.18 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.03 2o6b n PHE 73 Cb 0.52 -0.35 -0.13 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 -2.28 1.12 0.43 4.37 0.00 0.48 -5.04 121.76 120.83 2o6b s ALA 74 Ca -0.15 -0.81 -0.16 0.00 0.00 0.00 0.00 51.96 50.84 2o6b s ALA 74 Cb 0.05 -0.16 -0.09 0.00 0.00 0.00 0.00 23.12 22.92 2o6b s ALA 74 CO 0.20 0.20 0.88 -2.14 0.00 0.00 0.00 175.76 174.90 2o6b s PRO 75 N -1.14 4.01 0.05 0.00 0.02 -1.26 -4.54 135.00 132.14 2o6b s PRO 75 Ca 0.01 0.84 0.02 0.00 0.02 0.00 0.00 61.00 61.89 2o6b s PRO 75 Cb -0.08 -2.26 -0.03 0.00 0.02 0.00 0.00 34.50 32.15 2o6b s PRO 75 CO 0.01 -0.06 -0.08 0.08 -0.33 0.00 0.00 177.00 176.62 2o6b s VAL 76 N -2.30 0.58 -0.04 3.83 1.01 -1.26 -5.06 120.40 117.16 2o6b s VAL 76 Ca 0.57 -1.19 -0.04 0.00 0.00 0.00 0.00 61.98 61.32 2o6b s VAL 76 Cb -0.10 -0.76 0.01 0.00 0.00 0.00 0.00 36.38 35.54 2o6b s VAL 76 CO 0.23 -0.43 0.11 0.00 0.00 0.00 0.00 175.10 175.01 2o6b s ALA 77 N -1.64 -0.26 0.27 5.51 0.00 -1.26 -0.13 121.76 124.25 2o6b s ALA 77 Ca -0.07 0.32 -0.30 0.00 0.00 0.00 0.00 51.96 51.92 2o6b s ALA 77 Cb -0.08 -0.19 -0.13 0.00 0.00 0.00 0.00 23.12 22.71 2o6b s ALA 77 CO -0.00 -0.06 1.27 0.34 0.00 0.00 0.00 175.76 177.31 2o6b n PHE 78 N 3.09 1.92 -0.81 0.00 7.35 -1.26 -0.54 117.46 127.22 2o6b n PHE 78 Ca -0.13 0.55 0.07 0.00 -0.76 0.00 0.00 57.45 57.17 2o6b n PHE 78 Cb 0.59 -2.39 0.39 0.00 0.35 0.00 0.00 39.48 38.42 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 1.34 4.70 -0.65 -7.13 -0.04 -1.26 -4.97 135.00 126.98 2o6b n PRO 79 Ca 0.10 -3.03 -0.30 0.00 -0.04 0.00 0.00 63.50 60.22 2o6b n PRO 79 Cb 0.32 -2.22 0.19 0.00 -0.04 0.00 0.00 33.50 31.75 2o6b n PRO 79 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2o6b s GLN 80 N -2.64 0.51 -0.99 0.54 -0.21 0.30 -4.87 119.66 112.31 2o6b s GLN 80 Ca 0.53 1.38 -0.09 0.00 0.02 0.00 0.00 55.36 57.19 2o6b s GLN 80 Cb 0.40 -1.68 0.25 0.00 1.00 0.00 0.00 33.01 32.98 2o6b s GLN 80 CO 0.16 -2.93 0.95 0.50 -2.12 0.00 0.00 175.29 171.85 2o6b s ARG 81 N -4.60 3.85 0.97 2.91 3.52 -1.26 -4.41 118.95 119.93 2o6b s ARG 81 Ca 0.67 -3.00 -0.12 0.00 -0.13 0.00 0.00 55.73 53.15 2o6b s ARG 81 Cb -0.23 -4.41 0.17 0.00 -1.56 0.00 0.00 34.95 28.92 2o6b s ARG 81 CO 0.60 -1.25 1.09 0.96 -0.81 0.00 0.00 175.30 175.88 2o6b s ILE 82 N -0.85 2.28 -0.27 4.11 -5.25 -1.26 -2.63 121.20 117.32 2o6b s ILE 82 Ca 0.26 0.09 -0.26 0.00 -0.99 0.00 0.00 60.65 59.76 2o6b s ILE 82 Cb -0.10 -2.57 0.14 0.00 2.95 0.00 0.00 42.46 42.88 2o6b s ILE 82 CO -0.09 -0.12 1.11 -0.70 -1.79 0.00 0.00 174.94 173.35 2o6b s GLU 83 N -4.94 0.42 -0.20 0.37 2.12 -0.33 -3.40 118.70 112.75 2o6b s GLU 83 Ca 0.65 0.44 -0.02 0.00 0.36 0.00 0.00 54.97 56.40 2o6b s GLU 83 Cb -0.19 0.21 0.00 0.00 0.26 0.00 0.00 34.13 34.41 2o6b s GLU 83 CO 0.58 -0.06 -0.11 -1.64 -0.54 0.00 0.00 175.26 173.48 2o6b s MET 84 N 0.03 3.21 0.42 4.30 -1.94 0.37 0.56 119.30 126.24 2o6b s MET 84 Ca 0.04 -0.71 -0.21 0.00 -1.71 0.00 0.00 55.69 53.09 2o6b s MET 84 Cb -0.04 -2.81 -0.11 0.00 2.01 0.00 0.00 34.83 33.88 2o6b s MET 84 CO -0.07 -0.19 0.94 0.20 -0.01 0.00 0.00 175.02 175.89 2o6b s GLY 85 N 1.37 2.41 -0.13 -0.03 0.00 0.37 -1.51 107.32 109.81 2o6b s GLY 85 Ca 0.05 0.39 -0.10 0.00 0.00 0.00 0.00 44.72 45.06 2o6b s GLY 85 CO -0.07 0.68 0.33 -2.27 0.00 0.00 0.00 173.10 171.77 2o6b s LEU 86 N -3.10 0.58 -0.10 0.66 2.96 -0.29 -1.77 118.68 117.61 2o6b s LEU 86 Ca 0.61 0.68 -0.31 0.00 -0.22 0.00 0.00 54.13 54.89 2o6b s LEU 86 Cb -0.10 1.11 0.10 0.00 0.50 0.00 0.00 46.19 47.80 2o6b s LEU 86 CO 0.14 -0.13 0.82 -0.60 -1.32 0.00 0.00 176.35 175.26 2o6b s ARG 87 N 0.49 0.85 -0.05 1.98 3.52 -0.94 -1.01 118.95 123.79 2o6b s ARG 87 Ca -0.03 0.21 -0.18 0.00 -0.13 0.00 0.00 55.73 55.61 2o6b s ARG 87 Cb -0.04 0.40 -0.05 0.00 -1.56 0.00 0.00 34.95 33.70 2o6b s ARG 87 CO -0.03 -0.27 0.49 0.08 -0.81 0.00 0.00 175.30 174.76 2o6b s VAL 88 N -1.15 5.07 0.00 7.11 1.01 -1.13 0.80 120.40 132.10 2o6b s VAL 88 Ca -0.07 0.99 0.00 0.00 0.00 0.00 0.00 61.98 62.90 2o6b s VAL 88 Cb -0.00 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.56 2o6b s VAL 88 CO 0.06 0.42 0.00 0.00 0.00 0.00 0.00 175.10 175.59 2o6b n ALA 89 N 2.90 0.00 -0.57 5.51 0.00 0.17 -3.77 120.51 124.75 2o6b n ALA 89 Ca -0.09 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.05 2o6b n ALA 89 Cb 0.52 0.00 0.22 0.00 0.00 0.00 0.00 19.45 20.19 2o6b n ALA 89 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2o6b n ARG 90 N 0.00 -2.10 -3.02 0.00 0.00 -1.26 -4.84 116.66 105.43 2o6b n ARG 90 Ca 0.00 -0.59 0.03 0.00 -0.00 0.00 0.00 57.85 57.29 2o6b n ARG 90 Cb 0.00 -1.94 0.00 0.00 -0.00 0.00 0.00 32.46 30.52 2o6b n ARG 90 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 2o6b s LEU 91 N -4.42 -0.77 0.00 2.89 2.96 -1.26 -3.07 118.68 115.01 2o6b s LEU 91 Ca 0.63 -0.16 0.00 0.00 -0.22 0.00 0.00 54.13 54.37 2o6b s LEU 91 Cb -0.19 1.20 0.00 0.00 0.50 0.00 0.00 46.19 47.70 2o6b s LEU 91 CO 0.66 -0.11 0.00 0.61 -1.32 0.00 0.00 176.35 176.19 2o6b n GLY 92 N 4.51 -0.46 0.00 7.98 0.00 -0.54 -4.99 105.19 111.70 2o6b n GLY 92 Ca 0.08 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.83 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 1.90 -0.49 1.61 6.94 -1.26 -4.52 115.26 119.44 2o6b n ASN 93 Ca 0.00 -0.20 0.05 0.00 -0.02 0.00 0.00 54.58 54.41 2o6b n ASN 93 Cb 0.00 0.79 0.13 0.00 -2.36 0.00 0.00 39.78 38.34 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 -0.98 2.82 -3.74 0.53 3.41 -1.24 0.13 113.62 114.55 2o6b n SER 94 Ca 0.00 -2.24 -0.13 0.00 -0.26 0.00 0.00 58.87 56.24 2o6b n SER 94 Cb 0.00 -0.24 -0.09 0.00 -0.26 0.00 0.00 64.21 63.62 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 -1.28 -0.29 0.22 4.04 0.15 -1.26 -1.68 113.70 113.60 2o6b s SER 95 Ca 0.21 0.35 -0.13 0.00 0.70 0.00 0.00 55.95 57.08 2o6b s SER 95 Cb 0.14 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 64.93 2o6b s SER 95 CO 0.10 -0.35 0.45 0.54 1.20 0.00 0.00 173.24 175.18 2o6b s VAL 96 N -0.79 0.02 -0.05 4.45 0.11 0.38 -1.47 120.40 123.05 2o6b s VAL 96 Ca -0.09 -1.25 -0.02 0.00 -2.93 0.00 0.00 61.98 57.69 2o6b s VAL 96 Cb -0.04 -1.97 0.04 0.00 -1.53 0.00 0.00 36.38 32.88 2o6b s VAL 96 CO 0.03 -0.10 0.09 -1.58 -3.33 0.00 0.00 175.10 170.22 2o6b s GLN 97 N -3.97 -0.04 0.30 1.54 0.74 -1.17 -1.37 119.66 115.69 2o6b s GLN 97 Ca 0.18 0.43 0.05 0.00 0.05 0.00 0.00 55.36 56.07 2o6b s GLN 97 Cb 0.00 -0.41 -0.02 0.00 1.10 0.00 0.00 33.01 33.68 2o6b s GLN 97 CO 0.04 -0.31 0.43 0.71 -0.55 0.00 0.00 175.29 175.61 2o6b s TYR 98 N 2.11 3.29 -0.12 1.67 1.51 0.79 0.46 117.35 127.06 2o6b s TYR 98 Ca 0.03 -0.09 -0.01 0.00 -1.01 0.00 0.00 57.07 55.99 2o6b s TYR 98 Cb -0.12 -1.81 0.04 0.00 -0.11 0.00 0.00 41.96 39.96 2o6b s TYR 98 CO -0.04 0.19 -0.02 -1.21 -1.11 0.00 0.00 175.55 173.35 2o6b s GLU 99 N -4.10 1.03 0.11 -0.62 0.41 0.24 -2.72 118.70 113.04 2o6b s GLU 99 Ca 0.40 -0.21 0.06 0.00 -0.41 0.00 0.00 54.97 54.81 2o6b s GLU 99 Cb -0.09 -1.54 -0.04 0.00 -1.78 0.00 0.00 34.13 30.67 2o6b s GLU 99 CO 0.31 -0.38 -0.03 -0.51 -0.49 0.00 0.00 175.26 174.16 2o6b s LEU 100 N 1.81 3.33 -0.06 1.80 2.01 0.23 -2.22 118.68 125.58 2o6b s LEU 100 Ca 0.03 -0.27 -0.07 0.00 0.01 0.00 0.00 54.13 53.83 2o6b s LEU 100 Cb -0.14 -2.07 0.02 0.00 0.01 0.00 0.00 46.19 44.01 2o6b s LEU 100 CO -0.07 0.16 0.19 0.00 1.01 0.00 0.00 176.35 177.64 2o6b s ALA 101 N -1.34 -0.46 -0.18 4.21 0.00 -0.73 -0.31 121.76 122.95 2o6b s ALA 101 Ca 0.25 0.41 -0.08 0.00 0.00 0.00 0.00 51.96 52.55 2o6b s ALA 101 Cb -0.11 -0.23 -0.04 0.00 0.00 0.00 0.00 23.12 22.74 2o6b s ALA 101 CO 0.17 -0.12 0.08 -1.17 0.00 0.00 0.00 175.76 174.72 2o6b s LEU 102 N -0.23 3.93 -0.06 0.00 2.96 -0.15 0.14 118.68 125.28 2o6b s LEU 102 Ca -0.03 0.15 0.06 0.00 -0.22 0.00 0.00 54.13 54.09 2o6b s LEU 102 Cb -0.03 -1.99 -0.01 0.00 0.50 0.00 0.00 46.19 44.66 2o6b s LEU 102 CO 0.01 0.21 -0.25 -0.36 -1.32 0.00 0.00 176.35 174.64 2o6b s PHE 103 N 0.19 2.39 0.46 5.38 0.40 0.19 -0.74 117.98 126.25 2o6b s PHE 103 Ca 0.06 -0.71 -0.23 0.00 -0.60 0.00 0.00 56.93 55.44 2o6b s PHE 103 Cb -0.12 -1.57 -0.07 0.00 0.51 0.00 0.00 43.02 41.77 2o6b s PHE 103 CO 0.00 -0.22 1.15 -1.17 0.70 0.00 0.00 175.22 175.69 2o6b s LEU 104 N -0.14 4.00 -0.04 -0.37 2.96 -1.26 -1.18 118.68 122.64 2o6b s LEU 104 Ca -0.04 2.28 -0.23 0.00 -0.22 0.00 0.00 54.13 55.91 2o6b s LEU 104 Cb -0.14 -4.27 -0.04 0.00 0.50 0.00 0.00 46.19 42.24 2o6b s LEU 104 CO 0.04 -0.92 0.70 -1.61 -1.32 0.00 0.00 176.35 173.25 2o6b s GLU 105 N -2.74 4.44 -0.03 1.98 2.02 -1.08 -2.55 118.70 120.73 2o6b s GLU 105 Ca 0.64 0.91 -0.19 0.00 0.02 0.00 0.00 54.97 56.34 2o6b s GLU 105 Cb -0.28 -3.42 -0.05 0.00 0.10 0.00 0.00 34.13 30.48 2o6b s GLU 105 CO 0.33 0.13 0.54 0.20 0.02 0.00 0.00 175.26 176.49 2o6b s GLY 106 N 0.55 2.54 -0.06 -1.39 0.00 -1.26 -4.97 107.32 102.73 2o6b s GLY 106 Ca 0.37 -0.06 -0.11 0.00 0.00 0.00 0.00 44.72 44.92 2o6b s GLY 106 CO 0.19 0.68 0.27 1.20 0.00 0.00 0.00 173.10 175.44 2o6b s GLN 107 N -0.10 0.47 0.14 2.90 -1.52 -1.06 -5.05 119.66 115.44 2o6b s GLN 107 Ca 0.29 0.08 0.12 0.00 -1.95 0.00 0.00 55.36 53.90 2o6b s GLN 107 Cb -0.17 0.22 -0.11 0.00 -0.22 0.00 0.00 33.01 32.73 2o6b s GLN 107 CO 0.15 -0.10 1.16 0.00 -0.25 0.00 0.00 175.29 176.25 2o6b h ARG 108 N 4.85 0.00 -6.16 2.91 3.08 -1.96 -3.45 114.38 113.64 2o6b h ARG 108 Ca -0.28 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.22 2o6b h ARG 108 Cb 1.19 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.19 2o6b h ARG 108 CO 0.36 0.63 0.10 -1.21 -1.07 0.00 0.00 179.97 178.78 2o6b s GLU 109 N -2.82 4.44 0.51 0.04 2.02 -1.26 -2.63 118.70 118.99 2o6b s GLU 109 Ca 0.00 0.93 -0.23 0.00 0.02 0.00 0.00 54.97 55.70 2o6b s GLU 109 Cb 0.09 -3.39 -0.06 0.00 0.10 0.00 0.00 34.13 30.87 2o6b s GLU 109 CO 0.79 0.23 1.32 0.00 0.02 0.00 0.00 175.26 177.62 2o6b s ALA 110 N 0.20 2.92 -0.13 5.21 0.00 -0.60 -4.61 121.76 124.76 2o6b s ALA 110 Ca 0.37 1.26 -0.19 0.00 0.00 0.00 0.00 51.96 53.40 2o6b s ALA 110 Cb -0.19 -3.53 -0.25 0.00 0.00 0.00 0.00 23.12 19.15 2o6b s ALA 110 CO 0.20 -1.18 0.50 0.00 0.00 0.00 0.00 175.76 175.29 2o6b s ALA 112 N -2.41 1.25 -0.24 0.00 0.00 -1.25 -0.39 121.76 118.72 2o6b s ALA 112 Ca -0.22 -1.75 -0.26 0.00 0.00 0.00 0.00 51.96 49.74 2o6b s ALA 112 Cb 0.04 1.36 0.09 0.00 0.00 0.00 0.00 23.12 24.61 2o6b s ALA 112 CO 0.71 -0.67 0.82 0.00 0.00 0.00 0.00 175.76 176.62 2o6b s ALA 113 N -3.69 -1.84 0.12 0.00 0.00 -0.51 -0.97 121.76 114.86 2o6b s ALA 113 Ca 0.37 1.88 -0.06 0.00 0.00 0.00 0.00 51.96 54.15 2o6b s ALA 113 Cb 0.03 -1.09 0.02 0.00 0.00 0.00 0.00 23.12 22.09 2o6b s ALA 113 CO 0.19 -0.31 0.29 0.41 0.00 0.00 0.00 175.76 176.34 2o6b n GLY 114 N 2.23 1.54 3.27 0.00 0.00 0.58 -1.02 105.19 111.78 2o6b n GLY 114 Ca -0.14 -1.08 -0.12 0.00 0.00 0.00 0.00 46.02 44.68 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 -2.03 0.82 0.33 1.61 1.70 -0.89 0.74 118.95 121.23 2o6b s ARG 115 Ca 0.06 -0.43 -0.18 0.00 -0.47 0.00 0.00 55.73 54.71 2o6b s ARG 115 Cb -0.02 0.36 0.04 0.00 -0.57 0.00 0.00 34.95 34.76 2o6b s ARG 115 CO 0.04 -0.26 0.74 -0.59 -1.08 0.00 0.00 175.30 174.15 2o6b s PHE 116 N -2.39 -0.01 -0.10 5.89 -0.12 -1.10 -1.94 117.98 118.21 2o6b s PHE 116 Ca -0.06 -0.54 0.02 0.00 -0.05 0.00 0.00 56.93 56.29 2o6b s PHE 116 Cb -0.01 0.74 0.02 0.00 -0.63 0.00 0.00 43.02 43.14 2o6b s PHE 116 CO -0.02 -1.39 -0.13 0.08 -0.05 0.00 0.00 175.22 173.71 2o6b s VAL 117 N -3.16 1.33 -0.00 -2.49 1.01 -1.01 -0.15 120.40 115.94 2o6b s VAL 117 Ca 0.14 -0.55 -0.10 0.00 0.00 0.00 0.00 61.98 61.47 2o6b s VAL 117 Cb -0.05 -1.24 -0.05 0.00 0.00 0.00 0.00 36.38 35.04 2o6b s VAL 117 CO 0.09 0.41 0.33 -1.00 0.00 0.00 0.00 175.10 174.93 2o6b s HIS 118 N 1.02 3.64 -0.17 5.22 3.76 -0.47 -2.35 115.29 125.93 2o6b s HIS 118 Ca -0.07 0.76 0.00 0.00 -0.15 0.00 0.00 55.06 55.61 2o6b s HIS 118 Cb -0.15 -2.13 0.04 0.00 1.11 0.00 0.00 32.58 31.45 2o6b s HIS 118 CO -0.01 0.62 -0.09 0.08 -0.85 0.00 0.00 174.74 174.49 2o6b s VAL 119 N -1.20 1.40 0.08 -0.90 1.01 -0.26 -0.47 120.40 120.06 2o6b s VAL 119 Ca 0.25 -0.76 -0.26 0.00 0.00 0.00 0.00 61.98 61.20 2o6b s VAL 119 Cb -0.14 -1.48 -0.06 0.00 0.00 0.00 0.00 36.38 34.70 2o6b s VAL 119 CO 0.13 0.22 0.82 -0.36 0.00 0.00 0.00 175.10 175.91 2o6b s PHE 120 N 1.52 3.78 0.19 5.22 0.40 -0.68 -0.87 117.98 127.53 2o6b s PHE 120 Ca 0.01 1.59 0.01 0.00 -0.60 0.00 0.00 56.93 57.93 2o6b s PHE 120 Cb -0.15 -2.88 -0.05 0.00 0.51 0.00 0.00 43.02 40.45 2o6b s PHE 120 CO -0.08 0.28 0.05 0.14 0.70 0.00 0.00 175.22 176.31 2o6b s VAL 121 N -0.17 0.48 -0.00 -0.44 -7.23 -0.39 -2.50 120.40 110.14 2o6b s VAL 121 Ca 0.41 -1.98 -0.30 0.00 -1.81 0.00 0.00 61.98 58.30 2o6b s VAL 121 Cb -0.22 -2.28 -0.04 0.00 0.56 0.00 0.00 36.38 34.40 2o6b s VAL 121 CO 0.25 -0.30 1.10 -0.70 -0.31 0.00 0.00 175.10 175.14 2o6b s GLU 122 N -3.99 4.46 0.10 4.82 -6.30 -0.46 -2.08 118.70 115.25 2o6b s GLU 122 Ca 0.29 1.58 -0.33 0.00 -2.50 0.00 0.00 54.97 54.01 2o6b s GLU 122 Cb 0.07 -3.45 -0.14 0.00 0.00 0.00 0.00 34.13 30.61 2o6b s GLU 122 CO 0.07 -0.23 1.53 -0.09 0.02 0.00 0.00 175.26 176.56 2o6b h ARG 123 N 6.97 -0.65 0.35 4.30 2.43 -0.70 0.15 114.38 127.22 2o6b h ARG 123 Ca -0.38 0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 58.82 2o6b h ARG 123 Cb 1.20 0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.87 2o6b h ARG 123 CO 0.81 -0.44 -0.46 0.00 -1.51 0.00 0.00 179.97 178.38 2o6b h ARG 124 N -0.68 -0.80 0.00 0.20 -0.00 -1.92 -3.01 114.38 108.16 2o6b h ARG 124 Ca 0.00 0.05 0.00 0.00 -0.50 0.00 0.00 59.98 59.54 2o6b h ARG 124 Cb 0.71 0.18 0.00 0.00 0.00 0.00 0.00 29.97 30.86 2o6b h ARG 124 CO -0.32 -0.54 0.00 0.66 0.00 0.00 0.00 179.97 179.77 2o6b h SER 125 N -0.84 0.00 -1.74 7.04 4.64 -1.96 -3.46 113.55 117.24 2o6b h SER 125 Ca -0.04 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.08 2o6b h SER 125 Cb 0.75 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.77 2o6b h SER 125 CO -0.12 0.00 -0.18 -1.54 -0.87 0.00 0.00 176.83 174.12 2o6b n SER 126 N -2.51 -2.60 -4.74 4.97 3.41 0.52 -4.96 113.62 107.72 2o6b n SER 126 Ca 0.03 0.24 -0.39 0.00 -0.26 0.00 0.00 58.87 58.50 2o6b n SER 126 Cb 0.35 -2.54 -0.05 0.00 -0.26 0.00 0.00 64.21 61.71 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 -2.99 4.35 0.88 4.33 3.00 -1.25 -4.74 118.95 122.53 2o6b s ARG 127 Ca 0.00 0.66 -0.15 0.00 0.00 0.00 0.00 55.73 56.24 2o6b s ARG 127 Cb 0.00 -3.40 -0.05 0.00 0.00 0.00 0.00 34.95 31.49 2o6b s ARG 127 CO 0.00 0.21 0.01 -2.30 0.00 0.00 0.00 175.30 173.23 2o6b n PRO 128 N 3.35 -0.04 -3.81 3.54 -0.02 -1.26 -1.35 135.00 135.40 2o6b n PRO 128 Ca -0.06 0.02 -0.10 0.00 -2.02 0.00 0.00 63.50 61.34 2o6b n PRO 128 Cb 0.51 -1.52 -0.05 0.00 -0.02 0.00 0.00 33.50 32.42 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 -2.13 0.06 0.25 -1.45 -7.23 -1.04 -4.69 120.40 104.17 2o6b s VAL 129 Ca 0.53 -1.01 -0.30 0.00 -1.81 0.00 0.00 61.98 59.40 2o6b s VAL 129 Cb -0.25 -1.57 -0.09 0.00 0.56 0.00 0.00 36.38 35.03 2o6b s VAL 129 CO 0.70 -0.29 1.25 0.00 -0.31 0.00 0.00 175.10 176.45 2o6b s ALA 130 N -3.89 3.48 -0.09 1.32 0.00 -1.26 -3.72 121.76 117.60 2o6b s ALA 130 Ca 0.10 1.08 -0.29 0.00 0.00 0.00 0.00 51.96 52.84 2o6b s ALA 130 Cb 0.02 -3.44 -0.07 0.00 0.00 0.00 0.00 23.12 19.63 2o6b s ALA 130 CO -0.05 -0.46 2.09 -0.89 0.00 0.00 0.00 175.76 176.46 2o6b n ILE 131 N 1.83 0.56 -0.95 0.00 5.41 0.36 -4.92 119.36 121.66 2o6b n ILE 131 Ca 0.03 -0.29 -0.33 0.00 1.00 0.00 0.00 62.75 63.17 2o6b n ILE 131 Cb 0.43 -2.40 0.14 0.00 -0.71 0.00 0.00 39.64 37.11 2o6b n ILE 131 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2o6b n PRO 132 N 8.06 -0.06 -0.29 0.38 -0.04 -1.26 -4.61 135.00 137.19 2o6b n PRO 132 Ca 0.25 0.06 0.02 0.00 -0.04 0.00 0.00 63.50 63.79 2o6b n PRO 132 Cb 0.42 -2.40 0.16 0.00 -0.04 0.00 0.00 33.50 31.63 2o6b n PRO 132 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 2o6b h GLN 133 N -1.27 0.77 -0.51 0.54 5.75 -1.97 -2.39 115.11 116.03 2o6b h GLN 133 Ca -0.45 -0.05 -0.05 0.00 -0.15 0.00 0.00 58.65 57.95 2o6b h GLN 133 Cb 1.29 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 29.64 2o6b h GLN 133 CO 0.44 0.51 0.12 0.93 -2.65 0.00 0.00 178.83 178.17 2o6b h GLU 134 N 0.79 0.82 0.29 1.69 5.08 -1.90 -0.46 114.58 120.89 2o6b h GLU 134 Ca 0.38 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 2o6b h GLU 134 Cb 0.33 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 2o6b h GLU 134 CO -0.23 0.80 -0.17 -0.07 -1.00 0.00 0.00 179.01 178.33 2o6b h LEU 135 N 0.71 -0.42 -1.35 1.33 4.07 -1.43 -2.27 115.31 115.94 2o6b h LEU 135 Ca 0.16 0.02 0.46 0.00 0.08 0.00 0.00 57.88 58.60 2o6b h LEU 135 Cb 0.35 0.12 -0.13 0.00 1.08 0.00 0.00 40.66 42.08 2o6b h LEU 135 CO 0.00 -0.26 0.88 -1.14 -1.08 0.00 0.00 178.44 176.84 2o6b n ARG 136 N -3.28 -0.03 0.33 1.13 0.63 -0.94 0.18 116.66 114.68 2o6b n ARG 136 Ca -0.05 1.19 -0.14 0.00 -0.92 0.00 0.00 57.85 57.93 2o6b n ARG 136 Cb 0.17 -2.36 -0.07 0.00 0.45 0.00 0.00 32.46 30.65 2o6b n ARG 136 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 2o6b h ASP 137 N 0.00 -0.75 -0.51 6.15 5.19 -0.68 -0.91 116.42 124.90 2o6b h ASP 137 Ca 0.84 0.02 -0.06 0.00 -0.62 0.00 0.00 57.03 57.21 2o6b h ASP 137 Cb 2.76 0.19 -0.02 0.00 0.18 0.00 0.00 39.33 42.44 2o6b h ASP 137 CO -0.42 -0.36 0.11 0.00 -3.12 0.00 0.00 179.24 175.44 2o6b h ALA 138 N -1.19 1.13 0.46 3.45 0.00 -0.48 -1.35 119.26 121.28 2o6b h ALA 138 Ca -0.09 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 2o6b h ALA 138 Cb 0.69 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2o6b h ALA 138 CO 0.15 0.58 -0.45 -0.07 0.00 0.00 0.00 179.25 179.45 2o6b h LEU 139 N 0.84 -1.24 -1.12 0.00 3.38 -0.31 -2.76 115.31 114.11 2o6b h LEU 139 Ca 0.18 0.10 0.19 0.00 0.09 0.00 0.00 57.88 58.43 2o6b h LEU 139 Cb 0.35 0.41 -0.10 0.00 0.09 0.00 0.00 40.66 41.41 2o6b h LEU 139 CO 0.00 -0.60 0.61 0.00 0.09 0.00 0.00 178.44 178.55 2o6b h ALA 140 N -1.02 1.78 0.00 1.53 0.00 -1.08 0.14 119.26 120.60 2o6b h ALA 140 Ca -0.06 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2o6b h ALA 140 Cb 0.78 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2o6b h ALA 140 CO -0.05 -0.12 0.52 0.00 0.00 0.00 0.00 179.25 179.60 2o6b h ALA 141 N 1.63 1.39 0.00 0.00 0.00 -0.93 -0.67 119.26 120.68 2o6b h ALA 141 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.46 2o6b h ALA 141 Cb 0.92 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2o6b h ALA 141 CO -0.32 -0.39 -0.55 1.28 0.00 0.00 0.00 179.25 179.27 2o6b n LEU 142 N -2.11 0.41 -4.46 0.00 4.77 0.48 -5.01 117.00 111.08 2o6b n LEU 142 Ca -0.01 -0.45 -0.52 0.00 -0.03 0.00 0.00 56.01 55.00 2o6b n LEU 142 Cb 0.53 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.57 2o6b n LEU 142 CO 0.04 0.10 0.28 0.00 -1.33 0.00 0.00 177.39 176.49 2o6b n GLN 143 N -1.29 0.15 0.00 3.23 1.13 -0.26 -2.85 117.38 117.49 2o6b n GLN 143 Ca 0.01 0.05 0.00 0.00 -1.94 0.00 0.00 57.00 55.13 2o6b n GLN 143 Cb 0.16 -1.29 0.00 0.00 0.11 0.00 0.00 30.24 29.22 2o6b n GLN 143 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49