#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o6t n PRO 5 N 0.00 4.24 -0.43 0.00 -0.04 -1.26 -5.03 135.00 132.48 2o6t n PRO 5 Ca 0.00 -4.65 -0.29 0.00 -0.04 0.00 0.00 63.50 58.52 2o6t n PRO 5 Cb 0.00 -2.35 0.27 0.00 -0.04 0.00 0.00 33.50 31.38 2o6t n PRO 5 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2o6t n ARG 6 N -0.20 -2.98 -1.88 0.54 1.85 -1.26 -4.85 116.66 107.87 2o6t n ARG 6 Ca 0.41 -0.85 -0.33 0.00 -1.00 0.00 0.00 57.85 56.08 2o6t n ARG 6 Cb 0.34 -2.09 0.03 0.00 -1.05 0.00 0.00 32.46 29.69 2o6t n ARG 6 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 2o6t s PRO 7 N -4.42 3.08 0.13 2.89 0.02 -1.26 -4.86 135.00 130.57 2o6t s PRO 7 Ca 0.68 1.24 0.10 0.00 0.02 0.00 0.00 61.00 63.04 2o6t s PRO 7 Cb -0.23 -2.00 -0.04 0.00 0.02 0.00 0.00 34.50 32.25 2o6t s PRO 7 CO 0.64 -1.01 -0.24 -0.51 -0.33 0.00 0.00 177.00 175.56 2o6t s LEU 8 N -4.76 2.46 0.31 -5.54 1.43 -1.26 -2.86 118.68 108.46 2o6t s LEU 8 Ca 0.64 -0.68 0.05 0.00 -1.03 0.00 0.00 54.13 53.11 2o6t s LEU 8 Cb -0.17 -1.34 0.67 0.00 0.03 0.00 0.00 46.19 45.38 2o6t s LEU 8 CO 0.41 0.18 1.84 -0.09 0.23 0.00 0.00 176.35 178.91 2o6t h ARG 9 N 3.81 0.83 0.00 1.70 2.43 -1.82 -0.95 114.38 120.39 2o6t h ARG 9 Ca -0.51 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.61 2o6t h ARG 9 Cb 1.17 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 2o6t h ARG 9 CO 0.42 0.55 0.00 -0.85 -1.51 0.00 0.00 179.97 178.58 2o6t n GLU 10 N -4.61 0.85 0.00 0.20 0.00 -1.26 -1.70 120.64 114.11 2o6t n GLU 10 Ca 0.19 0.00 0.14 0.00 0.00 0.00 0.00 57.16 57.49 2o6t n GLU 10 Cb 0.42 -1.27 0.60 0.00 0.00 0.00 0.00 31.44 31.19 2o6t n GLU 10 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 2o6t n GLN 11 N -0.77 1.04 -4.37 3.44 6.02 -0.36 -4.90 117.38 117.47 2o6t n GLN 11 Ca 0.11 -0.44 -0.24 0.00 -0.01 0.00 0.00 57.00 56.42 2o6t n GLN 11 Cb 0.05 -1.49 -0.09 0.00 1.02 0.00 0.00 30.24 29.74 2o6t n GLN 11 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 2o6t s TYR 12 N -2.27 2.52 0.00 1.08 1.51 -0.69 -4.86 117.35 114.64 2o6t s TYR 12 Ca 0.34 -0.31 0.00 0.00 -1.01 0.00 0.00 57.07 56.09 2o6t s TYR 12 Cb 0.20 -1.18 0.00 0.00 -0.11 0.00 0.00 41.96 40.87 2o6t s TYR 12 CO 0.42 0.63 0.00 1.28 -1.11 0.00 0.00 175.55 176.77 2o6t n LEU 13 N -0.81 0.00 -3.96 -1.29 7.99 -0.09 -4.93 117.00 113.91 2o6t n LEU 13 Ca -0.05 -0.19 -0.13 0.00 -0.01 0.00 0.00 56.01 55.63 2o6t n LEU 13 Cb 0.60 0.00 -0.13 0.00 -0.11 0.00 0.00 43.42 43.78 2o6t n LEU 13 CO 0.40 0.00 -0.38 -2.28 -1.51 0.00 0.00 177.39 173.62 2o6t s HIS 14 N -1.51 0.34 -0.06 -1.77 2.46 -0.77 -4.98 115.29 109.00 2o6t s HIS 14 Ca 0.00 -0.22 0.03 0.00 0.47 0.00 0.00 55.06 55.33 2o6t s HIS 14 Cb 0.00 -0.22 0.01 0.00 -0.13 0.00 0.00 32.58 32.24 2o6t s HIS 14 CO 0.00 -0.05 -0.12 -0.06 -2.47 0.00 0.00 174.74 172.03 2o6t s PHE 15 N -0.57 1.43 -0.15 3.88 0.40 -1.25 -0.30 117.98 121.43 2o6t s PHE 15 Ca -0.04 -0.50 -0.01 0.00 -0.60 0.00 0.00 56.93 55.79 2o6t s PHE 15 Cb -0.04 -1.04 0.04 0.00 0.51 0.00 0.00 43.02 42.49 2o6t s PHE 15 CO -0.00 -0.24 -0.06 -1.14 0.70 0.00 0.00 175.22 174.48 2o6t s GLN 16 N 0.54 1.42 0.27 0.44 0.74 0.48 -4.92 119.66 118.63 2o6t s GLN 16 Ca -0.12 -0.41 -0.30 0.00 0.05 0.00 0.00 55.36 54.58 2o6t s GLN 16 Cb -0.15 -1.84 -0.10 0.00 1.10 0.00 0.00 33.01 32.02 2o6t s GLN 16 CO 0.03 -0.38 1.44 -1.25 -0.55 0.00 0.00 175.29 174.59 2o6t s PRO 17 N 1.67 4.25 -0.08 1.67 0.04 -1.26 0.26 135.00 141.56 2o6t s PRO 17 Ca 0.02 2.33 0.01 0.00 0.04 0.00 0.00 61.00 63.41 2o6t s PRO 17 Cb -0.14 -3.09 0.02 0.00 0.04 0.00 0.00 34.50 31.33 2o6t s PRO 17 CO -0.08 -0.42 -0.10 0.42 0.04 0.00 0.00 177.00 176.86 2o6t s ILE 18 N -0.20 1.06 0.18 0.56 1.01 -1.02 -4.91 121.20 117.89 2o6t s ILE 18 Ca 0.58 -0.40 -0.30 0.00 0.00 0.00 0.00 60.65 60.53 2o6t s ILE 18 Cb -0.42 -1.01 -0.08 0.00 0.01 0.00 0.00 42.46 40.96 2o6t s ILE 18 CO 0.46 0.35 1.15 -0.94 0.00 0.00 0.00 174.94 175.95 2o6t s SER 19 N 1.00 7.18 0.51 3.58 1.04 -1.26 -4.06 113.70 121.69 2o6t s SER 19 Ca -0.08 2.15 -0.20 0.00 0.48 0.00 0.00 55.95 58.30 2o6t s SER 19 Cb -0.15 -2.60 -0.07 0.00 0.10 0.00 0.00 66.02 63.29 2o6t s SER 19 CO -0.00 -0.30 1.07 0.42 0.98 0.00 0.00 173.24 175.41 2o6t s THR 20 N -0.13 3.57 0.30 2.02 -4.23 -1.26 -5.06 115.64 110.85 2o6t s THR 20 Ca 0.51 0.97 0.10 0.00 -1.18 0.00 0.00 61.69 62.09 2o6t s THR 20 Cb -0.31 -3.39 -0.05 0.00 1.34 0.00 0.00 72.50 70.09 2o6t s THR 20 CO 0.36 -0.22 -0.08 -0.13 -0.54 0.00 0.00 174.62 174.00 2o6t s ARG 21 N -3.28 1.95 0.16 3.99 0.52 -1.26 -4.99 118.95 116.05 2o6t s ARG 21 Ca 0.69 -1.70 -0.18 0.00 -0.52 0.00 0.00 55.73 54.02 2o6t s ARG 21 Cb -0.19 -1.90 0.07 0.00 0.52 0.00 0.00 34.95 33.45 2o6t s ARG 21 CO 0.23 0.27 1.66 2.35 0.02 0.00 0.00 175.30 179.83 2o6t h TRP 22 N 2.02 -0.27 -0.03 -0.53 2.91 -1.98 0.10 115.95 118.18 2o6t h TRP 22 Ca -0.42 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.63 2o6t h TRP 22 Cb 1.25 0.18 0.00 0.00 -0.51 0.00 0.00 29.16 30.08 2o6t h TRP 22 CO 0.75 -0.19 0.00 1.58 -1.03 0.00 0.00 178.44 179.55 2o6t n HIS 23 N -5.31 0.04 -0.05 2.65 -0.00 -1.26 -3.19 115.22 108.10 2o6t n HIS 23 Ca 0.01 -0.02 0.03 0.00 0.46 0.00 0.00 57.72 58.20 2o6t n HIS 23 Cb 0.22 0.00 0.38 0.00 -0.12 0.00 0.00 29.99 30.47 2o6t n HIS 23 CO 0.00 0.00 0.00 -0.44 0.46 0.00 0.00 176.34 176.36 2o6t h ASP 24 N 0.24 0.57 -3.80 0.26 3.32 -1.36 -3.42 116.42 112.23 2o6t h ASP 24 Ca 0.00 -0.01 -0.50 0.00 0.02 0.00 0.00 57.03 56.54 2o6t h ASP 24 Cb 0.05 -0.14 0.01 0.00 0.22 0.00 0.00 39.33 39.47 2o6t h ASP 24 CO 0.00 0.41 0.43 0.20 -1.72 0.00 0.00 179.24 178.57 2o6t s ASN 25 N -6.60 7.37 0.19 6.45 0.01 -1.19 -1.17 114.94 120.00 2o6t s ASN 25 Ca -0.09 2.16 0.02 0.00 -0.71 0.00 0.00 52.86 54.24 2o6t s ASN 25 Cb 0.17 -2.62 0.02 0.00 0.41 0.00 0.00 41.25 39.23 2o6t s ASN 25 CO 0.74 -0.06 0.15 -0.90 -1.51 0.00 0.00 177.10 175.53 2o6t n ASP 26 N 1.23 1.57 -0.33 -1.22 5.68 -0.64 -4.83 116.55 118.01 2o6t n ASP 26 Ca -0.01 -1.66 0.21 0.00 -0.50 0.00 0.00 54.79 52.82 2o6t n ASP 26 Cb 0.46 -0.02 0.43 0.00 -1.14 0.00 0.00 41.12 40.84 2o6t n ASP 26 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 2o6t h ILE 27 N 0.53 0.34 0.00 2.12 2.10 -1.97 1.30 117.51 121.93 2o6t h ILE 27 Ca -0.12 -0.12 0.00 0.00 1.08 0.00 0.00 64.86 65.70 2o6t h ILE 27 Cb 0.45 -0.03 0.00 0.00 -1.09 0.00 0.00 36.82 36.14 2o6t h ILE 27 CO 0.19 0.06 0.00 -1.22 -1.08 0.00 0.00 178.15 176.10 2o6t n TYR 28 N -5.06 0.00 -0.01 2.19 4.01 -1.26 -4.93 117.16 112.11 2o6t n TYR 28 Ca 0.29 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.03 2o6t n TYR 28 Cb 0.89 -0.28 0.00 0.00 -0.31 0.00 0.00 39.34 39.64 2o6t n TYR 28 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2o6t n GLY 29 N 0.94 0.31 3.58 2.72 0.00 0.45 -5.07 105.19 108.12 2o6t n GLY 29 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.90 2o6t n GLY 29 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2o6t s HIS 30 N -2.01 2.47 0.07 1.61 3.76 -1.26 -4.75 115.29 115.18 2o6t s HIS 30 Ca 0.00 -0.44 -0.33 0.00 -0.15 0.00 0.00 55.06 54.14 2o6t s HIS 30 Cb 0.00 -1.38 -0.12 0.00 1.11 0.00 0.00 32.58 32.19 2o6t s HIS 30 CO 0.00 0.55 1.77 0.28 -0.85 0.00 0.00 174.74 176.49 2o6t n VAL 31 N -0.85 0.33 -1.64 -0.90 0.31 0.70 -1.62 118.33 114.65 2o6t n VAL 31 Ca -0.05 -0.06 -0.38 0.00 -0.01 0.00 0.00 64.34 63.85 2o6t n VAL 31 Cb 0.62 -1.86 0.05 0.00 -0.91 0.00 0.00 33.84 31.74 2o6t n VAL 31 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2o6t n ASN 32 N 5.30 1.13 -0.02 4.52 2.85 -0.32 -4.82 115.26 123.90 2o6t n ASN 32 Ca 0.19 0.84 0.04 0.00 -0.11 0.00 0.00 54.58 55.54 2o6t n ASN 32 Cb 0.32 -1.43 0.42 0.00 1.24 0.00 0.00 39.78 40.33 2o6t n ASN 32 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 2o6t h ASN 33 N 0.63 0.49 -0.24 1.20 -1.07 -1.92 -1.97 115.58 112.70 2o6t h ASN 33 Ca -0.49 -0.01 -0.05 0.00 0.07 0.00 0.00 56.30 55.82 2o6t h ASN 33 Cb 1.35 -0.12 -0.02 0.00 -2.07 0.00 0.00 38.32 37.46 2o6t h ASN 33 CO 0.52 0.35 0.01 0.58 0.07 0.00 0.00 177.43 178.96 2o6t h VAL 34 N 0.58 1.19 -0.29 6.14 2.07 -1.99 -3.02 116.25 120.94 2o6t h VAL 34 Ca 0.16 -0.76 -0.05 0.00 0.82 0.00 0.00 66.70 66.88 2o6t h VAL 34 Cb -0.05 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 2o6t h VAL 34 CO -0.04 0.26 -0.03 0.74 0.02 0.00 0.00 177.57 178.53 2o6t h THR 35 N 0.51 1.19 -0.74 2.57 2.02 -1.71 -1.29 112.91 115.45 2o6t h THR 35 Ca 0.11 -0.76 0.14 0.00 0.77 0.00 0.00 66.41 66.67 2o6t h THR 35 Cb 0.31 1.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.68 2o6t h THR 35 CO 0.01 0.25 0.49 1.88 0.37 0.00 0.00 175.52 178.52 2o6t h TYR 36 N 0.42 0.49 -0.10 3.16 -1.99 -1.61 0.13 116.97 117.47 2o6t h TYR 36 Ca 0.09 0.01 -0.13 0.00 2.00 0.00 0.00 58.73 60.71 2o6t h TYR 36 Cb 0.33 -0.15 -0.01 0.00 2.00 0.00 0.00 36.73 38.89 2o6t h TYR 36 CO 0.01 0.19 -0.50 1.88 -0.00 0.00 0.00 178.16 179.74 2o6t h TYR 37 N 0.42 0.32 -0.52 4.88 -1.99 -1.39 -0.55 116.97 118.15 2o6t h TYR 37 Ca 0.36 -0.10 -0.07 0.00 2.00 0.00 0.00 58.73 60.91 2o6t h TYR 37 Cb 0.80 -0.06 -0.02 0.00 2.00 0.00 0.00 36.73 39.44 2o6t h TYR 37 CO -0.00 0.71 0.02 0.00 -0.00 0.00 0.00 178.16 178.89 2o6t h ALA 38 N 1.27 1.06 -0.54 3.88 0.00 -0.76 0.21 119.26 124.37 2o6t h ALA 38 Ca 0.01 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.55 2o6t h ALA 38 Cb 0.96 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2o6t h ALA 38 CO 0.08 0.59 -0.05 0.74 0.00 0.00 0.00 179.25 180.61 2o6t h PHE 39 N 0.80 1.07 0.38 0.00 0.04 -0.83 -1.65 116.94 116.75 2o6t h PHE 39 Ca 0.16 -0.19 -0.01 0.00 2.80 0.00 0.00 57.97 60.73 2o6t h PHE 39 Cb 0.45 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 38.31 2o6t h PHE 39 CO 0.03 0.97 -0.30 0.74 -0.60 0.00 0.00 178.31 179.15 2o6t h PHE 40 N 0.88 -0.81 -0.96 -0.55 0.04 -0.24 -0.78 116.94 114.52 2o6t h PHE 40 Ca 0.15 -0.00 0.08 0.00 2.80 0.00 0.00 57.97 61.01 2o6t h PHE 40 Cb 0.59 0.30 -0.07 0.00 2.20 0.00 0.00 35.95 38.97 2o6t h PHE 40 CO 0.04 -0.45 0.61 0.22 -0.60 0.00 0.00 178.31 178.13 2o6t h ASP 41 N -0.68 0.93 -0.48 2.17 3.58 -0.92 -1.36 116.42 119.67 2o6t h ASP 41 Ca -0.03 0.03 -0.12 0.00 0.42 0.00 0.00 57.03 57.33 2o6t h ASP 41 Cb 0.60 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.47 2o6t h ASP 41 CO -0.01 0.56 -0.16 0.74 -2.88 0.00 0.00 179.24 177.49 2o6t h THR 42 N 1.05 1.27 -0.21 2.25 2.02 -1.09 -2.28 112.91 115.92 2o6t h THR 42 Ca 0.44 -1.31 -0.05 0.00 0.77 0.00 0.00 66.41 66.27 2o6t h THR 42 Cb 0.29 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 2o6t h THR 42 CO -0.21 0.45 -0.05 0.00 0.37 0.00 0.00 175.52 176.08 2o6t h ALA 43 N 0.88 0.30 0.18 6.16 0.00 -0.27 -1.54 119.26 124.97 2o6t h ALA 43 Ca 0.12 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2o6t h ALA 43 Cb 0.72 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2o6t h ALA 43 CO 0.06 0.08 -0.09 0.28 0.00 0.00 0.00 179.25 179.58 2o6t h VAL 44 N 0.14 0.89 -0.42 0.00 2.07 -1.29 -2.51 116.25 115.14 2o6t h VAL 44 Ca 0.05 -0.36 -0.12 0.00 0.82 0.00 0.00 66.70 67.09 2o6t h VAL 44 Cb 0.51 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 2o6t h VAL 44 CO 0.02 0.08 -0.24 0.78 0.02 0.00 0.00 177.57 178.24 2o6t h ASN 45 N -0.42 0.88 -0.66 0.57 2.35 -1.46 0.17 115.58 117.01 2o6t h ASN 45 Ca -0.03 -0.33 0.10 0.00 -0.55 0.00 0.00 56.30 55.49 2o6t h ASN 45 Cb 0.33 -0.24 -0.08 0.00 0.05 0.00 0.00 38.32 38.38 2o6t h ASN 45 CO 0.04 1.08 0.27 0.74 -1.65 0.00 0.00 177.43 177.91 2o6t h THR 46 N 0.74 0.77 -0.17 2.81 2.02 -1.34 -0.08 112.91 117.68 2o6t h THR 46 Ca 0.10 -0.16 -0.03 0.00 0.77 0.00 0.00 66.41 67.09 2o6t h THR 46 Cb 0.78 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 2o6t h THR 46 CO 0.06 0.08 0.00 0.22 0.37 0.00 0.00 175.52 176.26 2o6t h TYR 47 N 0.46 0.32 -1.00 3.16 3.20 -0.81 -1.92 116.97 120.38 2o6t h TYR 47 Ca 0.33 -0.05 0.18 0.00 3.14 0.00 0.00 58.73 62.33 2o6t h TYR 47 Cb 0.41 -0.08 -0.10 0.00 1.54 0.00 0.00 36.73 38.50 2o6t h TYR 47 CO -0.15 0.50 0.61 -0.07 -1.64 0.00 0.00 178.16 177.41 2o6t h LEU 48 N 0.04 0.81 -0.00 2.82 3.38 -0.36 0.12 115.31 122.12 2o6t h LEU 48 Ca 0.05 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 2o6t h LEU 48 Cb 0.37 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2o6t h LEU 48 CO 0.01 0.31 -0.02 0.40 0.09 0.00 0.00 178.44 179.23 2o6t h ILE 49 N 0.80 1.55 0.24 1.22 2.04 -0.92 -1.84 117.51 120.60 2o6t h ILE 49 Ca 0.57 -1.65 -0.33 0.00 1.00 0.00 0.00 64.86 64.45 2o6t h ILE 49 Cb 0.83 2.66 0.04 0.00 -0.74 0.00 0.00 36.82 39.61 2o6t h ILE 49 CO -0.36 0.43 -1.45 -0.33 0.00 0.00 0.00 178.15 176.43 2o6t h GLU 50 N -0.67 0.52 0.00 2.37 5.08 -1.16 -2.75 114.58 117.97 2o6t h GLU 50 Ca -0.00 -0.87 -0.24 0.00 -1.00 0.00 0.00 59.36 57.24 2o6t h GLU 50 Cb 0.71 0.32 -0.05 0.00 0.50 0.00 0.00 28.75 30.24 2o6t h GLU 50 CO 0.00 1.42 -2.07 0.54 -1.00 0.00 0.00 179.01 177.90 2o6t n ARG 51 N -3.70 1.16 0.00 2.33 5.12 0.42 -4.59 116.66 117.39 2o6t n ARG 51 Ca -0.16 -0.04 0.10 0.00 -1.93 0.00 0.00 57.85 55.82 2o6t n ARG 51 Cb 1.10 -1.42 -0.06 0.00 -1.16 0.00 0.00 32.46 30.91 2o6t n ARG 51 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2o6t n GLY 52 N 1.89 -0.41 2.83 -0.13 0.00 -0.76 -4.72 105.19 103.89 2o6t n GLY 52 Ca -0.22 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.21 2o6t n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o6t n GLY 53 N 1.42 1.18 3.57 -0.02 0.00 -0.79 -3.87 105.19 106.68 2o6t n GLY 53 Ca 0.06 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.57 2o6t n GLY 53 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2o6t n LEU 54 N 0.00 1.33 -4.11 0.99 7.94 -0.81 -4.93 117.00 117.41 2o6t n LEU 54 Ca 0.00 1.13 -0.36 0.00 -1.11 0.00 0.00 56.01 55.67 2o6t n LEU 54 Cb 0.00 -1.17 -0.11 0.00 0.53 0.00 0.00 43.42 42.67 2o6t n LEU 54 CO 0.00 -1.32 -0.09 -0.62 -1.11 0.00 0.00 177.39 174.25 2o6t s ASP 55 N 0.14 5.25 0.28 1.96 2.15 -1.26 -4.53 116.67 120.66 2o6t s ASP 55 Ca 0.79 -2.32 0.25 0.00 0.43 0.00 0.00 52.55 51.69 2o6t s ASP 55 Cb -0.93 -1.84 1.00 0.00 -0.30 0.00 0.00 42.92 40.84 2o6t s ASP 55 CO 0.51 -0.49 1.74 0.16 -0.17 0.00 0.00 175.17 176.92 2o6t h ILE 56 N 5.98 0.00 0.06 4.11 3.07 -1.94 0.23 117.51 129.02 2o6t h ILE 56 Ca -0.09 -0.27 -0.27 0.00 1.55 0.00 0.00 64.86 65.77 2o6t h ILE 56 Cb 1.01 1.05 -0.02 0.00 -0.27 0.00 0.00 36.82 38.59 2o6t h ILE 56 CO 0.71 0.00 -1.46 1.56 -1.05 0.00 0.00 178.15 177.91 2o6t h GLN 57 N 0.00 0.13 0.00 0.16 1.08 -2.01 -3.42 115.11 111.04 2o6t h GLN 57 Ca 0.00 -0.22 0.00 0.00 -1.45 0.00 0.00 58.65 56.98 2o6t h GLN 57 Cb 0.41 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.92 2o6t h GLN 57 CO 0.00 1.11 0.00 0.41 -0.95 0.00 0.00 178.83 179.40 2o6t n GLY 58 N 1.67 -0.08 3.76 3.46 0.00 -1.19 -5.08 105.19 107.72 2o6t n GLY 58 Ca -0.30 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.33 2o6t n GLY 58 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2o6t s GLY 59 N -0.37 2.90 0.37 -0.02 0.00 0.81 -4.93 107.32 106.08 2o6t s GLY 59 Ca 0.00 1.36 0.20 0.00 0.00 0.00 0.00 44.72 46.28 2o6t s GLY 59 CO 0.00 1.92 1.62 -2.09 0.00 0.00 0.00 173.10 174.55 2o6t h GLU 60 N 2.02 0.00 -4.33 2.90 4.57 -1.96 -3.45 114.58 114.33 2o6t h GLU 60 Ca -0.51 0.00 -0.49 0.00 -1.18 0.00 0.00 59.36 57.19 2o6t h GLU 60 Cb 1.28 0.00 -0.34 0.00 -0.16 0.00 0.00 28.75 29.52 2o6t h GLU 60 CO 0.60 0.32 -0.80 0.08 -1.18 0.00 0.00 179.01 178.03 2o6t s VAL 61 N -3.27 0.95 0.13 0.32 1.01 -1.26 -0.44 120.40 117.84 2o6t s VAL 61 Ca 0.03 -0.34 0.06 0.00 0.00 0.00 0.00 61.98 61.73 2o6t s VAL 61 Cb 0.08 -0.91 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 2o6t s VAL 61 CO 0.69 0.32 -0.14 0.27 0.00 0.00 0.00 175.10 176.25 2o6t s ILE 62 N 0.96 1.33 -0.30 2.22 -4.36 -0.85 -4.85 121.20 115.35 2o6t s ILE 62 Ca -0.10 -1.78 -0.16 0.00 -0.26 0.00 0.00 60.65 58.35 2o6t s ILE 62 Cb -0.15 -1.59 -0.02 0.00 1.25 0.00 0.00 42.46 41.95 2o6t s ILE 62 CO 0.00 -0.47 0.43 -0.83 0.24 0.00 0.00 174.94 174.32 2o6t s GLY 63 N -2.58 1.86 -0.13 6.27 0.00 -1.26 -1.34 107.32 110.14 2o6t s GLY 63 Ca 0.10 -0.89 -0.07 0.00 0.00 0.00 0.00 44.72 43.87 2o6t s GLY 63 CO 0.03 1.10 0.13 1.08 0.00 0.00 0.00 173.10 175.43 2o6t s LEU 64 N 2.18 4.31 -0.13 0.66 1.43 -1.06 -4.92 118.68 121.15 2o6t s LEU 64 Ca 0.16 0.41 -0.29 0.00 -1.03 0.00 0.00 54.13 53.38 2o6t s LEU 64 Cb -0.16 -2.06 -0.01 0.00 0.03 0.00 0.00 46.19 44.00 2o6t s LEU 64 CO 0.11 0.37 1.06 -0.69 0.23 0.00 0.00 176.35 177.43 2o6t s VAL 65 N -0.82 4.65 -0.74 -1.59 1.01 -1.26 -0.12 120.40 121.52 2o6t s VAL 65 Ca 0.14 1.94 0.13 0.00 0.00 0.00 0.00 61.98 64.19 2o6t s VAL 65 Cb -0.12 -4.25 -0.12 0.00 0.00 0.00 0.00 36.38 31.89 2o6t s VAL 65 CO 0.03 -0.05 0.60 1.33 0.00 0.00 0.00 175.10 177.01 2o6t n VAL 66 N 4.81 0.00 -3.54 2.92 0.24 -0.50 -4.96 118.33 117.30 2o6t n VAL 66 Ca 0.10 -0.21 -0.07 0.00 -2.04 0.00 0.00 64.34 62.12 2o6t n VAL 66 Cb 0.47 1.03 -0.02 0.00 -1.47 0.00 0.00 33.84 33.85 2o6t n VAL 66 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2o6t s SER 67 N -2.17 -0.29 0.24 -1.34 1.04 -1.25 -5.00 113.70 104.93 2o6t s SER 67 Ca 0.06 -0.01 -0.22 0.00 0.48 0.00 0.00 55.95 56.27 2o6t s SER 67 Cb 0.10 0.31 0.03 0.00 0.10 0.00 0.00 66.02 66.57 2o6t s SER 67 CO 0.52 -0.50 0.69 -0.94 0.98 0.00 0.00 173.24 173.98 2o6t s SER 68 N -2.40 -0.35 0.16 7.02 1.04 -1.26 -1.55 113.70 116.36 2o6t s SER 68 Ca 0.07 -0.43 -0.24 0.00 0.48 0.00 0.00 55.95 55.82 2o6t s SER 68 Cb -0.01 0.69 0.06 0.00 0.10 0.00 0.00 66.02 66.86 2o6t s SER 68 CO -0.07 -1.24 0.77 -0.94 0.98 0.00 0.00 173.24 172.73 2o6t s SER 69 N -2.87 -0.36 -0.28 7.02 1.04 -0.65 -4.98 113.70 112.61 2o6t s SER 69 Ca 0.08 -0.24 -0.22 0.00 0.48 0.00 0.00 55.95 56.05 2o6t s SER 69 Cb -0.05 0.57 0.12 0.00 0.10 0.00 0.00 66.02 66.77 2o6t s SER 69 CO 0.01 -0.98 0.98 0.00 0.98 0.00 0.00 173.24 174.23 2o6t s ASP 71 N 0.65 4.03 -0.13 0.00 1.01 -0.12 -4.98 116.67 117.12 2o6t s ASP 71 Ca -0.01 -0.23 0.02 0.00 0.71 0.00 0.00 52.55 53.03 2o6t s ASP 71 Cb -0.05 -1.08 0.00 0.00 1.01 0.00 0.00 42.92 42.81 2o6t s ASP 71 CO -0.09 0.29 -0.20 -0.31 0.21 0.00 0.00 175.17 175.07 2o6t s TYR 72 N -0.41 2.68 -0.12 4.23 1.51 -1.26 -1.43 117.35 122.56 2o6t s TYR 72 Ca 0.05 -1.15 0.08 0.00 -1.01 0.00 0.00 57.07 55.03 2o6t s TYR 72 Cb -0.12 -1.81 -0.13 0.00 -0.11 0.00 0.00 41.96 39.79 2o6t s TYR 72 CO 0.02 -0.51 0.00 1.19 -1.11 0.00 0.00 175.55 175.15 2o6t n PHE 73 N 3.91 0.00 -3.64 2.71 3.01 -0.52 -5.00 117.46 117.93 2o6t n PHE 73 Ca -0.19 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.18 2o6t n PHE 73 Cb 0.52 -0.54 -0.07 0.00 -0.01 0.00 0.00 39.48 39.38 2o6t n PHE 73 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2o6t s ALA 74 N -2.27 -1.97 0.41 4.37 0.00 -0.46 -5.04 121.76 116.80 2o6t s ALA 74 Ca -0.08 2.00 -0.10 0.00 0.00 0.00 0.00 51.96 53.78 2o6t s ALA 74 Cb 0.04 -1.43 -0.06 0.00 0.00 0.00 0.00 23.12 21.67 2o6t s ALA 74 CO 0.42 -0.28 0.76 -1.25 0.00 0.00 0.00 175.76 175.41 2o6t s PRO 75 N 0.53 3.74 0.43 0.00 0.04 -1.26 -4.62 135.00 133.86 2o6t s PRO 75 Ca -0.00 0.42 0.06 0.00 0.04 0.00 0.00 61.00 61.52 2o6t s PRO 75 Cb -0.05 -2.40 -0.06 0.00 0.04 0.00 0.00 34.50 32.03 2o6t s PRO 75 CO -0.07 -0.05 0.03 0.14 0.04 0.00 0.00 177.00 177.09 2o6t s VAL 76 N -2.41 1.90 -0.06 -0.36 -7.23 -1.26 -5.02 120.40 105.96 2o6t s VAL 76 Ca 0.50 -1.96 -0.10 0.00 -1.81 0.00 0.00 61.98 58.62 2o6t s VAL 76 Cb -0.10 -2.86 0.02 0.00 0.56 0.00 0.00 36.38 34.00 2o6t s VAL 76 CO 0.33 0.00 0.24 0.00 -0.31 0.00 0.00 175.10 175.36 2o6t s ALA 77 N -2.72 -0.60 0.33 1.32 0.00 -1.26 -0.22 121.76 118.60 2o6t s ALA 77 Ca 0.31 0.45 -0.28 0.00 0.00 0.00 0.00 51.96 52.44 2o6t s ALA 77 Cb 0.08 -0.20 -0.13 0.00 0.00 0.00 0.00 23.12 22.88 2o6t s ALA 77 CO 0.16 -0.17 1.29 0.34 0.00 0.00 0.00 175.76 177.38 2o6t n PHE 78 N 2.24 2.21 -1.01 0.00 7.35 -1.26 0.15 117.46 127.14 2o6t n PHE 78 Ca -0.17 0.55 -0.24 0.00 -0.76 0.00 0.00 57.45 56.83 2o6t n PHE 78 Cb 0.57 -2.41 0.09 0.00 0.35 0.00 0.00 39.48 38.08 2o6t n PHE 78 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 2o6t n PRO 79 N 0.73 2.20 -1.26 -7.13 -0.04 -1.26 -4.99 135.00 123.26 2o6t n PRO 79 Ca 0.06 -2.48 -0.31 0.00 -0.04 0.00 0.00 63.50 60.73 2o6t n PRO 79 Cb 0.35 -1.97 0.10 0.00 -0.04 0.00 0.00 33.50 31.94 2o6t n PRO 79 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2o6t s GLN 80 N -2.84 2.12 -0.21 0.54 -0.21 0.41 -4.90 119.66 114.57 2o6t s GLN 80 Ca 0.48 1.11 -0.13 0.00 0.02 0.00 0.00 55.36 56.84 2o6t s GLN 80 Cb 0.39 -1.89 -0.05 0.00 1.00 0.00 0.00 33.01 32.47 2o6t s GLN 80 CO 0.02 -1.72 0.27 1.03 -2.12 0.00 0.00 175.29 172.77 2o6t s ARG 81 N -4.91 4.16 0.40 2.91 0.52 -1.26 -4.29 118.95 116.48 2o6t s ARG 81 Ca 0.61 -0.02 0.06 0.00 -0.52 0.00 0.00 55.73 55.86 2o6t s ARG 81 Cb -0.17 -3.50 -0.08 0.00 0.52 0.00 0.00 34.95 31.72 2o6t s ARG 81 CO 0.56 0.09 0.02 0.96 0.02 0.00 0.00 175.30 176.94 2o6t s ILE 82 N 0.96 1.88 -0.17 1.52 -4.36 -1.26 -0.39 121.20 119.39 2o6t s ILE 82 Ca 0.13 -2.00 -0.08 0.00 -0.26 0.00 0.00 60.65 58.45 2o6t s ILE 82 Cb -0.14 -2.96 0.07 0.00 1.25 0.00 0.00 42.46 40.68 2o6t s ILE 82 CO 0.05 0.00 0.38 -0.70 0.24 0.00 0.00 174.94 174.91 2o6t s GLU 83 N -3.74 0.32 0.01 0.37 2.12 0.67 -2.43 118.70 116.03 2o6t s GLU 83 Ca 0.35 0.83 -0.18 0.00 0.36 0.00 0.00 54.97 56.33 2o6t s GLU 83 Cb 0.10 0.07 -0.06 0.00 0.26 0.00 0.00 34.13 34.50 2o6t s GLU 83 CO 0.17 -0.20 0.50 -1.64 -0.54 0.00 0.00 175.26 173.56 2o6t s MET 84 N 1.88 4.13 -0.09 4.30 -1.94 0.14 -0.83 119.30 126.88 2o6t s MET 84 Ca -0.06 0.59 -0.03 0.00 -1.71 0.00 0.00 55.69 54.48 2o6t s MET 84 Cb -0.10 -3.27 -0.03 0.00 2.01 0.00 0.00 34.83 33.43 2o6t s MET 84 CO -0.12 0.57 0.03 0.20 -0.01 0.00 0.00 175.02 175.69 2o6t s GLY 85 N -0.77 1.92 -0.04 -0.03 0.00 -0.08 -0.39 107.32 107.93 2o6t s GLY 85 Ca 0.27 -0.77 0.02 0.00 0.00 0.00 0.00 44.72 44.23 2o6t s GLY 85 CO 0.16 -0.53 -0.07 -2.27 0.00 0.00 0.00 173.10 170.39 2o6t s LEU 86 N -0.92 1.54 0.08 0.66 2.96 0.59 -1.25 118.68 122.34 2o6t s LEU 86 Ca 0.14 -0.16 0.00 0.00 -0.22 0.00 0.00 54.13 53.89 2o6t s LEU 86 Cb -0.11 -0.51 -0.04 0.00 0.50 0.00 0.00 46.19 46.03 2o6t s LEU 86 CO 0.03 -0.00 -0.05 0.00 -1.32 0.00 0.00 176.35 175.01 2o6t s ARG 87 N 0.62 0.73 -0.21 1.98 1.70 0.05 -0.92 118.95 122.90 2o6t s ARG 87 Ca -0.09 -1.28 -0.07 0.00 -0.47 0.00 0.00 55.73 53.81 2o6t s ARG 87 Cb -0.12 0.01 -0.04 0.00 -0.57 0.00 0.00 34.95 34.23 2o6t s ARG 87 CO 0.01 -0.07 0.06 0.08 -1.08 0.00 0.00 175.30 174.30 2o6t s VAL 88 N -3.78 4.56 -0.04 4.99 1.01 -0.80 0.26 120.40 126.61 2o6t s VAL 88 Ca 0.10 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 61.99 2o6t s VAL 88 Cb 0.07 -3.09 -0.25 0.00 0.00 0.00 0.00 36.38 33.11 2o6t s VAL 88 CO -0.07 0.41 0.67 0.00 0.00 0.00 0.00 175.10 176.11 2o6t h ALA 89 N 7.36 0.49 -2.01 5.51 0.00 -1.32 -3.39 119.26 125.89 2o6t h ALA 89 Ca -0.37 -1.30 -0.05 0.00 0.00 0.00 0.00 54.91 53.20 2o6t h ALA 89 Cb 1.17 0.45 -0.20 0.00 0.00 0.00 0.00 17.79 19.21 2o6t h ALA 89 CO 0.64 1.34 0.14 -0.98 0.00 0.00 0.00 179.25 180.39 2o6t s ARG 90 N -2.60 0.89 -0.16 0.00 3.03 -1.23 -4.98 118.95 113.91 2o6t s ARG 90 Ca -0.11 0.79 0.01 0.00 2.03 0.00 0.00 55.73 58.45 2o6t s ARG 90 Cb 0.07 0.43 0.02 0.00 -1.03 0.00 0.00 34.95 34.44 2o6t s ARG 90 CO 0.82 -0.16 -0.18 -1.17 -1.13 0.00 0.00 175.30 173.48 2o6t s LEU 91 N -0.06 1.93 0.00 -1.89 2.96 -1.26 -1.75 118.68 118.61 2o6t s LEU 91 Ca -0.03 -0.56 0.00 0.00 -0.22 0.00 0.00 54.13 53.32 2o6t s LEU 91 Cb -0.04 -1.33 0.00 0.00 0.50 0.00 0.00 46.19 45.32 2o6t s LEU 91 CO 0.03 -0.01 0.00 0.61 -1.32 0.00 0.00 176.35 175.67 2o6t n GLY 92 N 4.55 0.33 0.12 7.98 0.00 0.22 -5.00 105.19 113.39 2o6t n GLY 92 Ca -0.19 -1.86 0.03 0.00 0.00 0.00 0.00 46.02 44.00 2o6t n GLY 92 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2o6t h ASN 93 N 0.00 0.00 0.00 1.61 -0.73 -2.00 -3.40 115.58 111.06 2o6t h ASN 93 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2o6t h ASN 93 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.59 2o6t h ASN 93 CO 0.00 0.47 0.00 -1.54 -0.37 0.00 0.00 177.43 175.99 2o6t n SER 94 N -3.02 0.12 -4.60 1.15 3.41 -1.26 -2.57 113.62 106.85 2o6t n SER 94 Ca -0.03 -0.58 -0.23 0.00 -0.26 0.00 0.00 58.87 57.76 2o6t n SER 94 Cb 0.75 0.11 -0.08 0.00 -0.26 0.00 0.00 64.21 64.74 2o6t n SER 94 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2o6t s SER 95 N -0.11 4.29 -0.01 4.04 1.04 -1.26 -1.03 113.70 120.65 2o6t s SER 95 Ca 0.00 -0.75 -0.02 0.00 0.48 0.00 0.00 55.95 55.66 2o6t s SER 95 Cb 0.00 -0.70 -0.00 0.00 0.10 0.00 0.00 66.02 65.42 2o6t s SER 95 CO 0.00 0.01 0.04 0.54 0.98 0.00 0.00 173.24 174.81 2o6t s VAL 96 N -2.38 0.03 -0.22 5.02 0.11 -0.45 0.70 120.40 123.21 2o6t s VAL 96 Ca 0.31 -0.23 -0.06 0.00 -2.93 0.00 0.00 61.98 59.07 2o6t s VAL 96 Cb -0.06 -0.14 -0.03 0.00 -1.53 0.00 0.00 36.38 34.62 2o6t s VAL 96 CO 0.19 -0.13 0.03 -1.58 -3.33 0.00 0.00 175.10 170.28 2o6t s GLN 97 N -0.38 3.62 0.03 1.54 0.74 -0.72 -1.32 119.66 123.18 2o6t s GLN 97 Ca -0.04 -0.50 -0.09 0.00 0.05 0.00 0.00 55.36 54.77 2o6t s GLN 97 Cb -0.03 -3.18 -0.05 0.00 1.10 0.00 0.00 33.01 30.85 2o6t s GLN 97 CO -0.00 -0.08 0.34 0.71 -0.55 0.00 0.00 175.29 175.70 2o6t s TYR 98 N 1.28 3.60 -0.10 1.67 1.51 0.35 -0.87 117.35 124.79 2o6t s TYR 98 Ca 0.04 0.72 0.04 0.00 -1.01 0.00 0.00 57.07 56.86 2o6t s TYR 98 Cb -0.15 -2.10 -0.00 0.00 -0.11 0.00 0.00 41.96 39.60 2o6t s TYR 98 CO 0.02 0.58 -0.24 -1.21 -1.11 0.00 0.00 175.55 173.59 2o6t s GLU 99 N -1.70 3.01 0.18 -0.62 2.02 0.14 -1.69 118.70 120.05 2o6t s GLU 99 Ca 0.29 -0.88 0.08 0.00 0.02 0.00 0.00 54.97 54.48 2o6t s GLU 99 Cb -0.14 -2.29 -0.04 0.00 0.10 0.00 0.00 34.13 31.75 2o6t s GLU 99 CO 0.16 0.20 -0.16 -0.51 0.02 0.00 0.00 175.26 174.97 2o6t s LEU 100 N 0.29 2.49 0.02 1.80 1.02 -0.33 -0.77 118.68 123.20 2o6t s LEU 100 Ca -0.17 -0.93 -0.07 0.00 0.02 0.00 0.00 54.13 52.97 2o6t s LEU 100 Cb -0.18 -0.75 -0.00 0.00 0.02 0.00 0.00 46.19 45.29 2o6t s LEU 100 CO 0.08 -0.10 0.14 0.00 0.02 0.00 0.00 176.35 176.49 2o6t s ALA 101 N -2.47 -0.26 -0.15 4.21 0.00 -0.38 -1.24 121.76 121.46 2o6t s ALA 101 Ca 0.19 -0.27 -0.07 0.00 0.00 0.00 0.00 51.96 51.81 2o6t s ALA 101 Cb -0.03 0.17 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 2o6t s ALA 101 CO 0.07 -0.26 0.08 -1.17 0.00 0.00 0.00 175.76 174.48 2o6t s LEU 102 N -1.69 3.99 -0.00 0.00 0.20 0.56 -0.90 118.68 120.83 2o6t s LEU 102 Ca -0.11 0.21 0.04 0.00 0.69 0.00 0.00 54.13 54.96 2o6t s LEU 102 Cb -0.05 -1.99 -0.01 0.00 -0.43 0.00 0.00 46.19 43.71 2o6t s LEU 102 CO -0.01 0.26 -0.12 -0.36 -0.29 0.00 0.00 176.35 175.84 2o6t s PHE 103 N -0.17 1.05 0.21 5.38 0.40 -0.01 -0.19 117.98 124.65 2o6t s PHE 103 Ca 0.08 -0.22 -0.30 0.00 -0.60 0.00 0.00 56.93 55.89 2o6t s PHE 103 Cb -0.12 -0.67 -0.10 0.00 0.51 0.00 0.00 43.02 42.65 2o6t s PHE 103 CO 0.01 -0.01 1.44 -0.51 0.70 0.00 0.00 175.22 176.85 2o6t s LEU 104 N -0.42 4.39 0.04 -0.37 1.43 -1.26 -0.24 118.68 122.24 2o6t s LEU 104 Ca 0.04 2.58 -0.37 0.00 -1.03 0.00 0.00 54.13 55.35 2o6t s LEU 104 Cb -0.05 -3.61 -0.17 0.00 0.03 0.00 0.00 46.19 42.39 2o6t s LEU 104 CO -0.00 -0.69 1.38 1.21 0.23 0.00 0.00 176.35 178.47 2o6t n GLU 105 N 2.84 1.10 -0.88 1.70 2.13 0.48 -0.91 120.64 127.09 2o6t n GLU 105 Ca 0.08 0.40 0.00 0.00 0.66 0.00 0.00 57.16 58.30 2o6t n GLU 105 Cb 0.40 -2.04 0.00 0.00 0.27 0.00 0.00 31.44 30.08 2o6t n GLU 105 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2o6t n GLY 106 N 2.68 0.65 3.78 8.31 0.00 -1.26 -5.03 105.19 114.32 2o6t n GLY 106 Ca 0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.95 2o6t n GLY 106 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2o6t s GLN 107 N -0.34 2.81 -0.21 1.61 1.11 -0.09 -5.06 119.66 119.49 2o6t s GLN 107 Ca 0.00 -0.92 0.09 0.00 0.01 0.00 0.00 55.36 54.54 2o6t s GLN 107 Cb 0.00 -2.59 -0.19 0.00 -1.01 0.00 0.00 33.01 29.22 2o6t s GLN 107 CO 0.00 0.47 -0.08 -2.13 0.01 0.00 0.00 175.29 173.57 2o6t n ARG 108 N -0.35 0.76 -3.43 2.91 3.00 -1.26 -4.68 116.66 113.61 2o6t n ARG 108 Ca -0.08 0.07 -0.38 0.00 -0.00 0.00 0.00 57.85 57.45 2o6t n ARG 108 Cb 0.55 -1.48 -0.06 0.00 0.00 0.00 0.00 32.46 31.47 2o6t n ARG 108 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.63 175.63 2o6t s GLU 109 N -2.47 4.01 0.29 -0.14 2.12 -1.26 -2.43 118.70 118.82 2o6t s GLU 109 Ca -0.21 0.52 -0.28 0.00 0.36 0.00 0.00 54.97 55.36 2o6t s GLU 109 Cb 0.07 -3.22 -0.09 0.00 0.26 0.00 0.00 34.13 31.14 2o6t s GLU 109 CO 0.66 0.67 0.96 0.00 -0.54 0.00 0.00 175.26 177.01 2o6t s ALA 110 N -1.09 3.26 0.12 6.30 0.00 -1.14 -4.75 121.76 124.46 2o6t s ALA 110 Ca 0.26 0.60 0.06 0.00 0.00 0.00 0.00 51.96 52.88 2o6t s ALA 110 Cb -0.18 -3.21 -0.22 0.00 0.00 0.00 0.00 23.12 19.52 2o6t s ALA 110 CO 0.15 0.14 1.26 0.00 0.00 0.00 0.00 175.76 177.31 2o6t s ALA 112 N -2.70 -1.79 -0.16 0.00 0.00 -1.24 -1.35 121.76 114.52 2o6t s ALA 112 Ca 0.01 0.79 -0.18 0.00 0.00 0.00 0.00 51.96 52.58 2o6t s ALA 112 Cb 0.10 0.47 0.05 0.00 0.00 0.00 0.00 23.12 23.73 2o6t s ALA 112 CO 0.83 -0.78 0.49 0.00 0.00 0.00 0.00 175.76 176.29 2o6t s ALA 113 N -3.14 -1.21 0.00 0.00 0.00 -0.52 -0.32 121.76 116.56 2o6t s ALA 113 Ca 0.07 1.29 0.00 0.00 0.00 0.00 0.00 51.96 53.32 2o6t s ALA 113 Cb -0.01 -0.68 0.00 0.00 0.00 0.00 0.00 23.12 22.43 2o6t s ALA 113 CO -0.06 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 175.87 2o6t n GLY 114 N 2.57 3.15 3.09 0.00 0.00 -0.37 -0.94 105.19 112.68 2o6t n GLY 114 Ca -0.14 -0.82 -0.11 0.00 0.00 0.00 0.00 46.02 44.94 2o6t n GLY 114 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2o6t s ARG 115 N 0.87 0.41 0.08 1.61 0.52 -0.84 -1.18 118.95 120.41 2o6t s ARG 115 Ca 0.00 -0.25 -0.16 0.00 -0.52 0.00 0.00 55.73 54.80 2o6t s ARG 115 Cb 0.00 0.17 0.03 0.00 0.52 0.00 0.00 34.95 35.67 2o6t s ARG 115 CO 0.00 -0.09 0.37 -0.59 0.02 0.00 0.00 175.30 175.00 2o6t s PHE 116 N -1.04 -0.18 -0.09 -0.53 -0.12 -0.68 -1.64 117.98 113.71 2o6t s PHE 116 Ca -0.11 -0.01 0.03 0.00 -0.05 0.00 0.00 56.93 56.78 2o6t s PHE 116 Cb -0.06 0.18 -0.01 0.00 -0.63 0.00 0.00 43.02 42.50 2o6t s PHE 116 CO 0.01 -0.60 -0.20 0.08 -0.05 0.00 0.00 175.22 174.47 2o6t s VAL 117 N -3.07 2.50 -0.05 -2.49 1.01 -0.59 -0.50 120.40 117.21 2o6t s VAL 117 Ca -0.01 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 61.06 2o6t s VAL 117 Cb 0.01 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 2o6t s VAL 117 CO -0.07 0.55 0.09 -1.00 0.00 0.00 0.00 175.10 174.68 2o6t s HIS 118 N 0.09 3.37 -0.14 5.22 3.76 -0.44 -1.41 115.29 125.74 2o6t s HIS 118 Ca -0.09 0.30 0.01 0.00 -0.15 0.00 0.00 55.06 55.12 2o6t s HIS 118 Cb -0.15 -1.80 0.02 0.00 1.11 0.00 0.00 32.58 31.75 2o6t s HIS 118 CO 0.06 0.59 -0.15 0.08 -0.85 0.00 0.00 174.74 174.46 2o6t s VAL 119 N -1.12 1.61 -0.32 -0.90 1.01 0.82 -1.35 120.40 120.16 2o6t s VAL 119 Ca 0.20 -0.67 -0.24 0.00 0.00 0.00 0.00 61.98 61.27 2o6t s VAL 119 Cb -0.12 -1.49 0.00 0.00 0.00 0.00 0.00 36.38 34.78 2o6t s VAL 119 CO 0.10 0.46 0.83 -0.36 0.00 0.00 0.00 175.10 176.14 2o6t s PHE 120 N 1.32 3.18 0.37 5.22 0.40 -0.20 -2.55 117.98 125.72 2o6t s PHE 120 Ca 0.02 0.82 0.08 0.00 -0.60 0.00 0.00 56.93 57.25 2o6t s PHE 120 Cb -0.13 -3.32 -0.05 0.00 0.51 0.00 0.00 43.02 40.02 2o6t s PHE 120 CO -0.08 -0.63 0.09 0.14 0.70 0.00 0.00 175.22 175.44 2o6t s VAL 121 N 3.09 2.58 -0.01 -0.44 -7.23 -0.45 -1.24 120.40 116.70 2o6t s VAL 121 Ca 0.34 -1.84 -0.30 0.00 -1.81 0.00 0.00 61.98 58.37 2o6t s VAL 121 Cb -0.14 -2.90 -0.05 0.00 0.56 0.00 0.00 36.38 33.85 2o6t s VAL 121 CO 0.14 -0.13 1.29 -0.70 -0.31 0.00 0.00 175.10 175.40 2o6t s GLU 122 N -3.80 4.33 0.21 4.82 2.12 0.75 -2.00 118.70 125.13 2o6t s GLU 122 Ca 0.37 1.83 -0.10 0.00 0.36 0.00 0.00 54.97 57.43 2o6t s GLU 122 Cb 0.01 -3.53 0.30 0.00 0.26 0.00 0.00 34.13 31.18 2o6t s GLU 122 CO 0.21 -0.48 1.69 -0.09 -0.54 0.00 0.00 175.26 176.05 2o6t h ARG 123 N 7.52 0.20 0.02 4.30 2.43 -1.05 0.11 114.38 127.91 2o6t h ARG 123 Ca -0.37 -0.01 -0.22 0.00 -0.81 0.00 0.00 59.98 58.57 2o6t h ARG 123 Cb 1.18 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.67 2o6t h ARG 123 CO 0.88 0.13 -0.95 0.00 -1.51 0.00 0.00 179.97 178.53 2o6t h ARG 124 N 0.21 0.25 0.00 0.20 3.08 -1.92 -3.35 114.38 112.84 2o6t h ARG 124 Ca 0.32 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 60.08 2o6t h ARG 124 Cb 0.50 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.64 2o6t h ARG 124 CO -0.44 1.03 -1.56 -1.13 -1.07 0.00 0.00 179.97 176.79 2o6t n SER 125 N -3.65 0.36 -0.53 7.04 3.41 -0.97 -4.94 113.62 114.35 2o6t n SER 125 Ca -0.05 0.09 -0.07 0.00 -0.26 0.00 0.00 58.87 58.58 2o6t n SER 125 Cb 0.85 1.34 -0.03 0.00 -0.26 0.00 0.00 64.21 66.11 2o6t n SER 125 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2o6t n SER 126 N -2.38 -4.89 -4.75 4.04 7.64 0.35 -4.99 113.62 108.64 2o6t n SER 126 Ca -0.02 0.17 -0.39 0.00 1.01 0.00 0.00 58.87 59.64 2o6t n SER 126 Cb 0.55 -3.00 -0.05 0.00 -1.01 0.00 0.00 64.21 60.69 2o6t n SER 126 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2o6t s ARG 127 N -2.26 4.36 0.29 1.43 0.52 -1.26 -4.76 118.95 117.28 2o6t s ARG 127 Ca 0.00 0.76 -0.30 0.00 -0.52 0.00 0.00 55.73 55.67 2o6t s ARG 127 Cb 0.00 -3.38 -0.12 0.00 0.52 0.00 0.00 34.95 31.97 2o6t s ARG 127 CO 0.00 0.27 1.50 -2.30 0.02 0.00 0.00 175.30 174.78 2o6t n PRO 128 N 3.09 2.44 -4.28 3.54 -0.02 -1.26 -0.18 135.00 138.33 2o6t n PRO 128 Ca -0.05 0.87 -0.15 0.00 -2.02 0.00 0.00 63.50 62.15 2o6t n PRO 128 Cb 0.51 -2.59 -0.10 0.00 -0.02 0.00 0.00 33.50 31.30 2o6t n PRO 128 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2o6t s VAL 129 N -0.26 0.62 0.29 -1.45 0.11 -0.37 -4.84 120.40 114.50 2o6t s VAL 129 Ca 0.63 -1.99 -0.30 0.00 -2.93 0.00 0.00 61.98 57.39 2o6t s VAL 129 Cb -0.55 -2.37 -0.12 0.00 -1.53 0.00 0.00 36.38 31.82 2o6t s VAL 129 CO 0.52 -0.25 1.61 0.00 -3.33 0.00 0.00 175.10 173.65 2o6t n ALA 130 N -0.35 2.57 -1.68 1.54 0.00 -1.26 -4.39 120.51 116.95 2o6t n ALA 130 Ca -0.03 0.37 -0.46 0.00 0.00 0.00 0.00 53.44 53.32 2o6t n ALA 130 Cb 0.65 -2.47 -0.04 0.00 0.00 0.00 0.00 19.45 17.59 2o6t n ALA 130 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2o6t n ILE 131 N 2.25 0.60 -1.64 0.00 5.41 -1.06 -4.88 119.36 120.03 2o6t n ILE 131 Ca 0.09 -0.11 -0.43 0.00 1.00 0.00 0.00 62.75 63.31 2o6t n ILE 131 Cb 0.37 -2.01 -0.00 0.00 -0.71 0.00 0.00 39.64 37.29 2o6t n ILE 131 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2o6t n PRO 132 N 6.69 1.63 -0.26 0.38 -0.02 -1.26 -4.70 135.00 137.45 2o6t n PRO 132 Ca 0.21 0.57 0.01 0.00 -2.02 0.00 0.00 63.50 62.28 2o6t n PRO 132 Cb 0.33 -2.09 0.08 0.00 -0.02 0.00 0.00 33.50 31.80 2o6t n PRO 132 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2o6t h GLN 133 N 2.01 -0.01 -0.84 -0.52 5.75 -1.99 -0.41 115.11 119.10 2o6t h GLN 133 Ca -0.44 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.05 2o6t h GLN 133 Cb 1.32 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.83 2o6t h GLN 133 CO 0.60 -0.01 0.47 0.93 -2.65 0.00 0.00 178.83 178.17 2o6t h GLU 134 N -0.01 1.17 -0.21 1.69 3.07 -1.90 0.92 114.58 119.30 2o6t h GLU 134 Ca 0.35 -0.13 -0.06 0.00 -0.50 0.00 0.00 59.36 59.03 2o6t h GLU 134 Cb 0.55 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 28.22 2o6t h GLU 134 CO -0.77 0.84 -0.08 -0.07 -1.40 0.00 0.00 179.01 177.53 2o6t h LEU 135 N 1.18 0.44 -1.03 1.33 3.38 -1.22 -2.73 115.31 116.66 2o6t h LEU 135 Ca 0.30 -0.39 0.11 0.00 0.09 0.00 0.00 57.88 57.99 2o6t h LEU 135 Cb 0.01 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 40.55 2o6t h LEU 135 CO -0.05 0.74 0.63 0.03 0.09 0.00 0.00 178.44 179.88 2o6t h ARG 136 N 0.15 0.97 -0.40 1.13 3.08 -0.86 0.23 114.38 118.68 2o6t h ARG 136 Ca 0.05 -0.06 -0.07 0.00 0.07 0.00 0.00 59.98 59.97 2o6t h ARG 136 Cb 0.56 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 2o6t h ARG 136 CO 0.03 0.64 -0.05 -0.44 -1.07 0.00 0.00 179.97 179.08 2o6t h ASP 137 N 1.00 0.64 0.68 7.04 3.32 -0.74 -2.03 116.42 126.32 2o6t h ASP 137 Ca 0.48 -0.16 -0.26 0.00 0.02 0.00 0.00 57.03 57.11 2o6t h ASP 137 Cb 0.46 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.81 2o6t h ASP 137 CO -0.25 0.74 -1.39 0.00 -1.72 0.00 0.00 179.24 176.63 2o6t h ALA 138 N 1.33 0.47 -0.30 3.45 0.00 -0.99 -3.23 119.26 119.99 2o6t h ALA 138 Ca 0.12 -1.15 -0.02 0.00 0.00 0.00 0.00 54.91 53.86 2o6t h ALA 138 Cb 0.46 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2o6t h ALA 138 CO 0.02 1.33 0.10 -0.07 0.00 0.00 0.00 179.25 180.63 2o6t h LEU 139 N 0.02 0.38 -1.34 0.00 3.38 -0.52 -2.91 115.31 114.33 2o6t h LEU 139 Ca -0.17 -0.04 0.09 0.00 0.09 0.00 0.00 57.88 57.86 2o6t h LEU 139 Cb 1.92 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 42.52 2o6t h LEU 139 CO 0.12 0.37 0.52 0.00 0.09 0.00 0.00 178.44 179.55 2o6t h ALA 140 N 1.69 1.75 0.00 1.53 0.00 -1.38 0.48 119.26 123.33 2o6t h ALA 140 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2o6t h ALA 140 Cb 0.13 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2o6t h ALA 140 CO -0.01 0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.33 2o6t h ALA 141 N 1.60 1.00 -0.02 0.00 0.00 -1.63 -2.56 119.26 117.65 2o6t h ALA 141 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.28 2o6t h ALA 141 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2o6t h ALA 141 CO -0.14 0.00 -0.18 1.28 0.00 0.00 0.00 179.25 180.21 2o6t n LEU 142 N -2.68 1.97 -4.80 0.00 4.77 0.16 -4.95 117.00 111.48 2o6t n LEU 142 Ca -0.02 -0.87 -0.34 0.00 -0.03 0.00 0.00 56.01 54.75 2o6t n LEU 142 Cb 0.06 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.13 2o6t n LEU 142 CO 0.15 0.36 0.71 -1.10 -1.33 0.00 0.00 177.39 176.19 2o6t s GLN 143 N -1.66 3.74 -0.23 3.23 -0.21 -0.92 -1.90 119.66 121.69 2o6t s GLN 143 Ca 0.16 1.30 0.14 0.00 0.02 0.00 0.00 55.36 56.98 2o6t s GLN 143 Cb 0.13 -2.09 0.54 0.00 1.00 0.00 0.00 33.01 32.60 2o6t s GLN 143 CO 0.31 -0.48 1.47 0.43 -2.12 0.00 0.00 175.29 174.91 2o6t n SER 144 N -1.18 3.51 0.00 5.90 7.64 -1.26 -4.98 113.62 123.25 2o6t n SER 144 Ca 0.09 -3.28 0.15 0.00 1.01 0.00 0.00 58.87 56.84 2o6t n SER 144 Cb 0.53 -0.59 0.88 0.00 -1.01 0.00 0.00 64.21 64.01 2o6t n SER 144 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83