#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yto n PHE 1 N 0.00 1.83 -2.77 -1.40 7.35 -1.26 -5.01 117.46 116.20 1yto n PHE 1 Ca 0.00 -1.97 -0.42 0.00 -0.76 0.00 0.00 57.45 54.29 1yto n PHE 1 Cb 0.00 -0.30 -0.03 0.00 0.35 0.00 0.00 39.48 39.50 1yto n PHE 1 CO 0.00 0.00 0.00 -0.80 -0.76 0.00 0.00 176.76 175.20 1yto s ASN 2 N -3.47 6.90 0.00 -2.13 0.01 -1.26 -5.03 114.94 109.96 1yto s ASN 2 Ca 0.45 1.06 -0.01 0.00 -0.71 0.00 0.00 52.86 53.65 1yto s ASN 2 Cb 0.39 -2.49 -0.04 0.00 0.41 0.00 0.00 41.25 39.52 1yto s ASN 2 CO -0.00 -0.68 0.12 -0.76 -1.51 0.00 0.00 177.10 174.26 1yto s LEU 3 N 3.20 4.07 0.67 0.60 1.43 -1.26 -0.74 118.68 126.65 1yto s LEU 3 Ca 0.40 0.21 -0.05 0.00 -1.03 0.00 0.00 54.13 53.66 1yto s LEU 3 Cb -0.14 -2.42 0.06 0.00 0.03 0.00 0.00 46.19 43.72 1yto s LEU 3 CO 0.10 0.26 0.96 -2.16 0.23 0.00 0.00 176.35 175.74 1yto s PRO 4 N -1.86 2.25 0.62 1.29 0.04 -1.26 -4.67 135.00 131.40 1yto s PRO 4 Ca 0.25 -0.41 -0.19 0.00 0.04 0.00 0.00 61.00 60.69 1yto s PRO 4 Cb -0.12 -2.25 -0.02 0.00 0.04 0.00 0.00 34.50 32.15 1yto s PRO 4 CO 0.16 -1.13 1.31 -2.14 0.04 0.00 0.00 177.00 175.24 1yto s PRO 5 N -5.13 2.74 0.29 0.56 0.02 -1.26 -4.90 135.00 127.31 1yto s PRO 5 Ca 0.60 2.10 -0.29 0.00 0.02 0.00 0.00 61.00 63.42 1yto s PRO 5 Cb -0.10 -1.96 -0.13 0.00 0.02 0.00 0.00 34.50 32.32 1yto s PRO 5 CO 0.43 -1.46 1.27 0.41 -0.33 0.00 0.00 177.00 177.32 1yto n GLY 6 N 0.83 0.46 2.71 0.52 0.00 -1.26 -4.95 105.19 103.50 1yto n GLY 6 Ca 0.14 0.39 -0.05 0.00 0.00 0.00 0.00 46.02 46.50 1yto n GLY 6 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1yto n ASN 7 N 1.41 -0.09 -0.00 1.61 0.23 -1.26 -4.92 115.26 112.24 1yto n ASN 7 Ca 0.09 -2.39 0.02 0.00 -0.53 0.00 0.00 54.58 51.76 1yto n ASN 7 Cb 0.33 0.17 -0.03 0.00 -2.08 0.00 0.00 39.78 38.18 1yto n ASN 7 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 1yto n TYR 8 N -0.64 0.00 0.13 -2.53 4.01 -1.26 -4.65 117.16 112.23 1yto n TYR 8 Ca -0.00 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.65 1yto n TYR 8 Cb 0.84 -0.03 -0.05 0.00 -0.31 0.00 0.00 39.34 39.79 1yto n TYR 8 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 1yto h LYS 9 N 0.00 -0.46 -6.14 -0.72 6.56 -1.91 -3.45 116.57 110.45 1yto h LYS 9 Ca 0.00 0.03 -0.53 0.00 -1.06 0.00 0.00 60.65 59.09 1yto h LYS 9 Cb 0.13 0.11 -0.07 0.00 -0.57 0.00 0.00 32.23 31.83 1yto h LYS 9 CO 0.00 -0.31 -0.54 0.15 -2.06 0.00 0.00 179.45 176.69 1yto s LYS 10 N -4.41 2.47 0.68 3.15 1.02 -1.26 -5.09 119.74 116.30 1yto s LYS 10 Ca -0.09 -1.44 -0.16 0.00 0.02 0.00 0.00 55.97 54.30 1yto s LYS 10 Cb 0.02 -2.26 0.01 0.00 -0.52 0.00 0.00 37.83 35.09 1yto s LYS 10 CO 0.30 0.17 1.18 -1.25 -0.92 0.00 0.00 175.35 174.83 1yto s PRO 11 N -3.84 2.53 0.28 -1.68 0.04 -1.26 -4.76 135.00 126.30 1yto s PRO 11 Ca 0.37 1.68 0.02 0.00 0.04 0.00 0.00 61.00 63.11 1yto s PRO 11 Cb -0.04 -1.89 -0.05 0.00 0.04 0.00 0.00 34.50 32.56 1yto s PRO 11 CO 0.23 -1.52 0.12 0.15 0.04 0.00 0.00 177.00 176.02 1yto s LYS 12 N -3.80 1.49 0.04 4.56 -0.14 0.92 -4.10 119.74 118.71 1yto s LYS 12 Ca 0.73 -1.83 0.04 0.00 -1.36 0.00 0.00 55.97 53.55 1yto s LYS 12 Cb -0.27 -0.21 -0.04 0.00 -1.68 0.00 0.00 37.83 35.63 1yto s LYS 12 CO 0.41 -0.36 -0.06 -0.51 -0.76 0.00 0.00 175.35 174.08 1yto s LEU 13 N -3.34 3.22 -0.44 3.17 1.43 0.98 -0.67 118.68 123.03 1yto s LEU 13 Ca 0.37 -0.19 -0.04 0.00 -1.03 0.00 0.00 54.13 53.23 1yto s LEU 13 Cb 0.07 -1.91 0.12 0.00 0.03 0.00 0.00 46.19 44.49 1yto s LEU 13 CO 0.15 0.24 0.25 -0.76 0.23 0.00 0.00 176.35 176.46 1yto s LEU 14 N -1.76 5.35 -0.42 1.79 1.43 -1.26 -0.86 118.68 122.95 1yto s LEU 14 Ca 0.20 -2.07 -0.21 0.00 -1.03 0.00 0.00 54.13 51.02 1yto s LEU 14 Cb -0.11 -1.87 0.02 0.00 0.03 0.00 0.00 46.19 44.26 1yto s LEU 14 CO 0.11 -0.56 0.69 -0.47 0.23 0.00 0.00 176.35 176.35 1yto s TYR 15 N 1.10 3.06 0.46 0.29 5.04 -0.39 -1.14 117.35 125.77 1yto s TYR 15 Ca 0.08 0.11 -0.21 0.00 -2.44 0.00 0.00 57.07 54.61 1yto s TYR 15 Cb -0.23 -3.41 -0.09 0.00 0.35 0.00 0.00 41.96 38.58 1yto s TYR 15 CO -0.03 -0.86 1.03 0.00 -1.34 0.00 0.00 175.55 174.35 1yto h SER 17 N 1.84 0.00 0.28 0.00 0.02 -0.98 -2.05 113.55 112.66 1yto h SER 17 Ca -0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 1yto h SER 17 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 1yto h SER 17 CO 0.60 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 176.88 1yto n ASN 18 N -2.60 0.00 0.00 3.07 3.02 -1.26 -4.87 115.26 112.62 1yto n ASN 18 Ca -0.00 -0.39 0.00 0.00 -0.03 0.00 0.00 54.58 54.16 1yto n ASN 18 Cb 0.15 -0.17 0.00 0.00 -0.61 0.00 0.00 39.78 39.16 1yto n ASN 18 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yto n GLY 20 N 0.78 0.76 3.51 7.41 0.00 -0.77 -4.85 105.19 112.03 1yto n GLY 20 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 1yto n GLY 20 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1yto s HIS 21 N -2.00 2.56 -0.14 1.61 3.76 -1.24 -4.39 115.29 115.46 1yto s HIS 21 Ca 0.00 -0.25 -0.14 0.00 -0.15 0.00 0.00 55.06 54.52 1yto s HIS 21 Cb 0.00 -1.34 -0.05 0.00 1.11 0.00 0.00 32.58 32.30 1yto s HIS 21 CO 0.00 0.41 0.32 -0.06 -0.85 0.00 0.00 174.74 174.57 1yto s PHE 22 N -1.26 3.50 0.24 1.40 0.08 0.24 -0.35 117.98 121.84 1yto s PHE 22 Ca 0.19 0.67 -0.31 0.00 0.12 0.00 0.00 56.93 57.61 1yto s PHE 22 Cb -0.10 -2.34 -0.13 0.00 -0.57 0.00 0.00 43.02 39.88 1yto s PHE 22 CO 0.11 0.30 1.54 -0.11 -0.10 0.00 0.00 175.22 176.97 1yto n LEU 23 N 3.32 3.68 -3.99 -0.37 7.94 -0.29 -2.29 117.00 124.99 1yto n LEU 23 Ca -0.12 1.12 -0.22 0.00 -1.11 0.00 0.00 56.01 55.69 1yto n LEU 23 Cb 0.52 -1.51 -0.16 0.00 0.53 0.00 0.00 43.42 42.80 1yto n LEU 23 CO 0.40 -0.14 -0.44 -0.60 -1.11 0.00 0.00 177.39 175.49 1yto s ARG 24 N -0.03 1.22 -0.28 1.96 3.52 0.11 -4.46 118.95 120.99 1yto s ARG 24 Ca 0.69 -0.31 -0.02 0.00 -0.13 0.00 0.00 55.73 55.97 1yto s ARG 24 Cb -0.58 -1.09 0.04 0.00 -1.56 0.00 0.00 34.95 31.77 1yto s ARG 24 CO 0.45 0.05 -0.03 0.42 -0.81 0.00 0.00 175.30 175.38 1yto s ILE 25 N 0.51 2.92 0.46 4.11 1.01 -0.95 -1.71 121.20 127.55 1yto s ILE 25 Ca -0.09 -1.26 -0.15 0.00 0.00 0.00 0.00 60.65 59.15 1yto s ILE 25 Cb -0.13 -2.61 -0.08 0.00 0.01 0.00 0.00 42.46 39.66 1yto s ILE 25 CO 0.02 0.01 0.90 -0.76 0.00 0.00 0.00 174.94 175.10 1yto s LEU 26 N 1.27 3.75 0.59 2.97 1.43 0.98 -4.77 118.68 124.90 1yto s LEU 26 Ca -0.03 1.43 0.30 0.00 -1.03 0.00 0.00 54.13 54.79 1yto s LEU 26 Cb -0.19 -4.33 1.83 0.00 0.03 0.00 0.00 46.19 43.53 1yto s LEU 26 CO -0.02 -0.48 2.25 -0.65 0.23 0.00 0.00 176.35 177.68 1yto h PRO 27 N 1.21 0.00 -0.95 1.29 0.11 -1.99 -1.58 132.00 130.08 1yto h PRO 27 Ca -0.47 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.59 1yto h PRO 27 Cb 1.18 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 1yto h PRO 27 CO 0.62 0.00 0.07 -0.40 -0.21 0.00 0.00 178.00 178.08 1yto n ASP 28 N -3.83 2.56 -0.90 -2.05 5.75 -1.26 -4.82 116.55 112.00 1yto n ASP 28 Ca -0.03 -2.26 -0.12 0.00 -0.01 0.00 0.00 54.79 52.37 1yto n ASP 28 Cb 0.10 -0.55 -0.05 0.00 -1.03 0.00 0.00 41.12 39.58 1yto n ASP 28 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1yto n GLY 29 N 0.14 1.21 3.86 6.12 0.00 -0.60 -4.98 105.19 110.94 1yto n GLY 29 Ca 0.09 -0.18 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 1yto n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yto s THR 30 N -2.22 5.30 -0.05 2.61 2.01 -1.23 -2.04 115.64 120.02 1yto s THR 30 Ca 0.00 0.48 0.05 0.00 0.31 0.00 0.00 61.69 62.54 1yto s THR 30 Cb 0.00 -3.53 -0.01 0.00 0.01 0.00 0.00 72.50 68.97 1yto s THR 30 CO 0.00 0.60 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.62 1yto s VAL 31 N -1.05 1.81 0.00 3.82 1.01 -1.26 -0.01 120.40 124.72 1yto s VAL 31 Ca 0.19 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.24 1yto s VAL 31 Cb -0.14 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 34.70 1yto s VAL 31 CO 0.08 0.51 0.00 -0.90 0.00 0.00 0.00 175.10 174.79 1yto n ASP 32 N 3.02 0.00 -4.51 3.32 5.75 -0.69 -4.31 116.55 119.12 1yto n ASP 32 Ca -0.18 -0.40 -0.25 0.00 -0.01 0.00 0.00 54.79 53.95 1yto n ASP 32 Cb 0.52 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 40.51 1yto n ASP 32 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1yto s GLY 33 N -0.63 2.07 -0.02 6.12 0.00 0.11 0.05 107.32 115.01 1yto s GLY 33 Ca 0.00 -2.01 -0.22 0.00 0.00 0.00 0.00 44.72 42.49 1yto s GLY 33 CO 0.00 -1.99 0.47 -1.08 0.00 0.00 0.00 173.10 170.50 1yto s THR 34 N -2.64 0.03 -0.34 0.90 -1.32 -0.97 -4.80 115.64 106.52 1yto s THR 34 Ca 0.31 -0.29 0.22 0.00 -1.21 0.00 0.00 61.69 60.73 1yto s THR 34 Cb 0.01 -0.82 -0.18 0.00 -1.51 0.00 0.00 72.50 70.00 1yto s THR 34 CO 0.15 -0.16 0.81 0.54 -2.21 0.00 0.00 174.62 173.76 1yto n ARG 35 N 1.00 0.48 -2.32 7.08 1.74 -1.26 0.82 116.66 124.19 1yto n ARG 35 Ca -0.20 -0.05 -0.43 0.00 -0.77 0.00 0.00 57.85 56.40 1yto n ARG 35 Cb 0.57 -1.61 -0.02 0.00 -1.02 0.00 0.00 32.46 30.38 1yto n ARG 35 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1yto s ASP 36 N -4.40 6.28 0.29 0.55 2.15 -1.26 -4.87 116.67 115.41 1yto s ASP 36 Ca -0.01 0.84 0.25 0.00 0.43 0.00 0.00 52.55 54.06 1yto s ASP 36 Cb 0.13 -2.54 1.01 0.00 -0.30 0.00 0.00 42.92 41.22 1yto s ASP 36 CO 0.85 -1.48 1.75 0.03 -0.17 0.00 0.00 175.17 176.15 1yto h ARG 37 N 10.94 0.00 -0.00 4.34 3.08 -2.01 -2.79 114.38 127.93 1yto h ARG 37 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.77 1yto h ARG 37 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.16 1yto h ARG 37 CO 1.09 0.00 -0.03 -1.13 -1.07 0.00 0.00 179.97 178.82 1yto n SER 38 N -2.34 0.49 -4.78 7.04 3.41 -1.26 -4.89 113.62 111.29 1yto n SER 38 Ca 0.02 -0.93 -0.41 0.00 -0.26 0.00 0.00 58.87 57.29 1yto n SER 38 Cb 0.26 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 1yto n SER 38 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1yto n ASP 39 N -0.73 3.76 -0.06 4.04 -0.08 -1.06 -4.90 116.55 117.52 1yto n ASP 39 Ca 0.19 1.21 0.13 0.00 -1.51 0.00 0.00 54.79 54.82 1yto n ASP 39 Cb 0.22 -1.62 0.47 0.00 2.34 0.00 0.00 41.12 42.53 1yto n ASP 39 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1yto n GLN 40 N 0.33 0.30 -0.34 -0.67 1.13 -1.26 -3.93 117.38 112.94 1yto n GLN 40 Ca 0.02 -0.12 0.08 0.00 -1.94 0.00 0.00 57.00 55.04 1yto n GLN 40 Cb 0.39 -1.50 0.25 0.00 0.11 0.00 0.00 30.24 29.50 1yto n GLN 40 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1yto n HIS 41 N -1.24 0.85 0.74 1.08 8.25 -1.26 -4.39 115.22 119.25 1yto n HIS 41 Ca 0.09 -0.55 0.10 0.00 -0.26 0.00 0.00 57.72 57.10 1yto n HIS 41 Cb 0.32 -0.08 0.10 0.00 1.12 0.00 0.00 29.99 31.44 1yto n HIS 41 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 1yto n ILE 42 N 0.87 0.07 -2.86 1.59 -5.35 -1.25 -2.24 119.36 110.19 1yto n ILE 42 Ca 0.19 -0.53 -0.43 0.00 -0.27 0.00 0.00 62.75 61.71 1yto n ILE 42 Cb 0.61 1.35 -0.04 0.00 -1.74 0.00 0.00 39.64 39.82 1yto n ILE 42 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1yto s GLN 43 N -1.60 3.74 0.02 6.28 1.11 -1.26 -4.42 119.66 123.52 1yto s GLN 43 Ca 0.24 0.39 0.07 0.00 0.01 0.00 0.00 55.36 56.07 1yto s GLN 43 Cb 0.17 -3.83 -0.03 0.00 -1.01 0.00 0.00 33.01 28.31 1yto s GLN 43 CO 0.25 -0.98 -0.21 -0.51 0.01 0.00 0.00 175.29 173.85 1yto s LEU 44 N 3.40 2.41 -0.33 2.90 1.43 0.16 -1.79 118.68 126.87 1yto s LEU 44 Ca 0.35 -0.45 -0.06 0.00 -1.03 0.00 0.00 54.13 52.95 1yto s LEU 44 Cb -0.12 -1.43 0.04 0.00 0.03 0.00 0.00 46.19 44.71 1yto s LEU 44 CO 0.20 0.28 0.08 -1.58 0.23 0.00 0.00 176.35 175.56 1yto s GLN 45 N -1.15 2.62 0.18 1.70 2.00 0.13 -0.06 119.66 125.08 1yto s GLN 45 Ca 0.13 -1.17 -0.12 0.00 -2.00 0.00 0.00 55.36 52.19 1yto s GLN 45 Cb -0.10 -3.40 -0.07 0.00 0.80 0.00 0.00 33.01 30.24 1yto s GLN 45 CO 0.03 -0.64 0.55 -0.51 -0.50 0.00 0.00 175.29 174.21 1yto s LEU 46 N 1.38 4.27 -0.02 3.68 1.02 -1.26 -1.87 118.68 125.88 1yto s LEU 46 Ca -0.02 1.01 -0.06 0.00 0.02 0.00 0.00 54.13 55.07 1yto s LEU 46 Cb -0.19 -3.43 0.01 0.00 0.02 0.00 0.00 46.19 42.59 1yto s LEU 46 CO 0.02 0.03 0.15 -0.94 0.02 0.00 0.00 176.35 175.63 1yto s SER 47 N -1.98 -0.05 -0.29 2.29 1.04 -0.54 -4.58 113.70 109.58 1yto s SER 47 Ca 0.42 0.01 -0.13 0.00 0.48 0.00 0.00 55.95 56.73 1yto s SER 47 Cb -0.13 0.26 -0.04 0.00 0.10 0.00 0.00 66.02 66.21 1yto s SER 47 CO 0.20 -0.24 0.26 0.00 0.98 0.00 0.00 173.24 174.44 1yto s ALA 48 N -0.77 3.53 0.10 5.32 0.00 -1.26 -0.51 121.76 128.17 1yto s ALA 48 Ca -0.09 -1.09 -0.07 0.00 0.00 0.00 0.00 51.96 50.72 1yto s ALA 48 Cb -0.05 -2.60 -0.18 0.00 0.00 0.00 0.00 23.12 20.29 1yto s ALA 48 CO 0.01 -0.70 1.22 1.49 0.00 0.00 0.00 175.76 177.78 1yto h GLU 49 N 8.35 0.45 -3.69 0.00 4.57 -1.55 -3.47 114.58 119.25 1yto h GLU 49 Ca -0.33 -0.55 -0.08 0.00 -1.18 0.00 0.00 59.36 57.22 1yto h GLU 49 Cb 1.17 0.17 -0.12 0.00 -0.16 0.00 0.00 28.75 29.81 1yto h GLU 49 CO 0.60 1.20 -0.23 -1.12 -1.18 0.00 0.00 179.01 178.28 1yto s SER 50 N -7.18 -0.04 -0.13 1.04 0.01 -1.23 -5.03 113.70 101.15 1yto s SER 50 Ca -0.06 -0.67 -0.36 0.00 1.31 0.00 0.00 55.95 56.17 1yto s SER 50 Cb 0.08 0.45 -0.13 0.00 0.21 0.00 0.00 66.02 66.62 1yto s SER 50 CO 0.89 -0.88 1.82 0.52 0.41 0.00 0.00 173.24 176.00 1yto n VAL 51 N -0.21 0.47 -0.98 3.43 0.31 -1.26 -0.30 118.33 119.79 1yto n VAL 51 Ca -0.11 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 1yto n VAL 51 Cb 0.63 -1.66 0.00 0.00 -0.91 0.00 0.00 33.84 31.90 1yto n VAL 51 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1yto n GLY 52 N 4.27 1.03 3.46 2.92 0.00 -1.26 -5.00 105.19 110.60 1yto n GLY 52 Ca 0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.92 1yto n GLY 52 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yto s GLU 53 N -0.00 3.60 0.18 1.61 2.02 0.59 -0.78 118.70 125.93 1yto s GLU 53 Ca 0.00 -0.55 0.02 0.00 0.02 0.00 0.00 54.97 54.46 1yto s GLU 53 Cb 0.00 -2.90 -0.05 0.00 0.10 0.00 0.00 34.13 31.28 1yto s GLU 53 CO 0.00 0.17 0.00 0.14 0.02 0.00 0.00 175.26 175.60 1yto s VAL 54 N 0.53 0.71 -0.00 2.63 -7.23 0.65 -1.34 120.40 116.35 1yto s VAL 54 Ca -0.04 -1.99 0.08 0.00 -1.81 0.00 0.00 61.98 58.23 1yto s VAL 54 Cb -0.14 -2.16 -0.02 0.00 0.56 0.00 0.00 36.38 34.61 1yto s VAL 54 CO 0.03 -0.44 -0.25 -0.31 -0.31 0.00 0.00 175.10 173.81 1yto s TYR 55 N -3.63 2.35 -0.25 2.82 2.02 0.33 -1.66 117.35 119.33 1yto s TYR 55 Ca 0.25 -0.42 0.02 0.00 -0.37 0.00 0.00 57.07 56.56 1yto s TYR 55 Cb 0.06 -1.48 0.06 0.00 -0.40 0.00 0.00 41.96 40.20 1yto s TYR 55 CO 0.05 0.02 -0.10 0.42 -1.57 0.00 0.00 175.55 174.37 1yto s ILE 56 N -0.67 2.02 -0.03 2.71 1.01 -1.26 -1.47 121.20 123.51 1yto s ILE 56 Ca 0.11 -1.53 0.06 0.00 0.00 0.00 0.00 60.65 59.29 1yto s ILE 56 Cb -0.10 -2.16 -0.02 0.00 0.01 0.00 0.00 42.46 40.18 1yto s ILE 56 CO -0.00 -0.04 -0.22 -0.75 0.00 0.00 0.00 174.94 173.93 1yto s LYS 57 N 1.17 2.27 -0.00 2.79 2.20 -0.78 -0.24 119.74 127.14 1yto s LYS 57 Ca -0.08 -0.85 -0.30 0.00 -0.36 0.00 0.00 55.97 54.37 1yto s LYS 57 Cb -0.20 -2.16 -0.05 0.00 -1.51 0.00 0.00 37.83 33.92 1yto s LYS 57 CO -0.05 0.57 1.29 0.45 -0.36 0.00 0.00 175.35 177.25 1yto s SER 58 N -0.61 6.96 0.00 1.43 0.15 -0.05 0.21 113.70 121.78 1yto s SER 58 Ca 0.09 2.00 0.26 0.00 0.70 0.00 0.00 55.95 59.01 1yto s SER 58 Cb -0.10 -2.56 1.23 0.00 -1.71 0.00 0.00 66.02 62.87 1yto s SER 58 CO -0.00 -0.63 1.87 0.35 1.20 0.00 0.00 173.24 176.03 1yto n THR 59 N 4.49 0.18 -0.11 6.45 -2.24 -0.74 -0.27 114.28 122.05 1yto n THR 59 Ca 0.12 0.04 -0.24 0.00 -2.27 0.00 0.00 64.05 61.70 1yto n THR 59 Cb 0.45 -0.60 -0.11 0.00 -2.10 0.00 0.00 70.33 67.96 1yto n THR 59 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1yto n GLU 60 N -1.39 0.58 -0.02 -0.78 4.07 -1.26 -4.63 120.64 117.21 1yto n GLU 60 Ca 0.10 0.49 0.08 0.00 -0.06 0.00 0.00 57.16 57.76 1yto n GLU 60 Cb 0.26 -1.69 -0.16 0.00 -0.06 0.00 0.00 31.44 29.79 1yto n GLU 60 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1yto n THR 61 N -4.33 0.19 -0.87 6.31 -2.24 -1.24 -5.00 114.28 107.09 1yto n THR 61 Ca -0.37 -0.52 0.00 0.00 -2.27 0.00 0.00 64.05 60.89 1yto n THR 61 Cb 0.75 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 1yto n THR 61 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yto n GLY 62 N 1.40 0.79 3.82 3.38 0.00 0.63 -5.01 105.19 110.21 1yto n GLY 62 Ca -0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.62 1yto n GLY 62 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1yto s GLN 63 N -0.13 3.41 -0.15 1.61 -0.21 -1.26 -4.72 119.66 118.22 1yto s GLN 63 Ca 0.00 1.05 -0.04 0.00 0.02 0.00 0.00 55.36 56.39 1yto s GLN 63 Cb 0.00 -2.05 -0.03 0.00 1.00 0.00 0.00 33.01 31.93 1yto s GLN 63 CO 0.00 -0.73 -0.01 0.71 -2.12 0.00 0.00 175.29 173.15 1yto s TYR 64 N -2.69 3.10 0.41 0.91 1.51 0.11 -0.87 117.35 119.83 1yto s TYR 64 Ca 0.60 -0.13 -0.27 0.00 -1.01 0.00 0.00 57.07 56.27 1yto s TYR 64 Cb -0.14 -1.96 -0.10 0.00 -0.11 0.00 0.00 41.96 39.65 1yto s TYR 64 CO 0.41 0.09 1.41 -0.11 -1.11 0.00 0.00 175.55 176.24 1yto n LEU 65 N 3.32 4.65 -3.90 -1.29 7.94 0.67 -0.57 117.00 127.82 1yto n LEU 65 Ca -0.17 1.17 -0.09 0.00 -1.11 0.00 0.00 56.01 55.80 1yto n LEU 65 Cb 0.53 -1.58 -0.07 0.00 0.53 0.00 0.00 43.42 42.82 1yto n LEU 65 CO 0.33 -0.15 -0.04 0.00 -1.11 0.00 0.00 177.39 176.42 1yto s ALA 66 N -1.15 -0.13 -0.08 1.96 0.00 0.26 -4.35 121.76 118.26 1yto s ALA 66 Ca 0.57 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.80 1yto s ALA 66 Cb -0.48 0.70 0.02 0.00 0.00 0.00 0.00 23.12 23.36 1yto s ALA 66 CO 0.61 -0.59 -0.07 1.41 0.00 0.00 0.00 175.76 177.12 1yto s MET 67 N -3.92 1.29 0.94 0.00 1.75 -0.66 -0.84 119.30 117.86 1yto s MET 67 Ca 0.12 -0.20 -0.14 0.00 -1.25 0.00 0.00 55.69 54.21 1yto s MET 67 Cb 0.04 -1.31 0.20 0.00 2.84 0.00 0.00 34.83 36.60 1yto s MET 67 CO -0.05 -0.17 1.29 0.16 -0.65 0.00 0.00 175.02 175.60 1yto s ASP 68 N 1.37 3.20 0.00 1.11 1.47 0.32 -4.84 116.67 119.30 1yto s ASP 68 Ca -0.02 0.16 0.06 0.00 1.18 0.00 0.00 52.55 53.93 1yto s ASP 68 Cb -0.14 -0.22 0.28 0.00 -0.34 0.00 0.00 42.92 42.50 1yto s ASP 68 CO -0.04 -2.67 1.06 0.35 0.68 0.00 0.00 175.17 174.56 1yto n THR 69 N -3.68 1.09 0.24 2.11 -2.24 -1.26 -1.11 114.28 109.43 1yto n THR 69 Ca 0.16 0.27 0.07 0.00 -2.27 0.00 0.00 64.05 62.28 1yto n THR 69 Cb 0.59 -1.18 0.11 0.00 -2.10 0.00 0.00 70.33 67.76 1yto n THR 69 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1yto n ASP 70 N -1.34 2.57 0.00 3.42 8.00 -1.26 -4.97 116.55 122.97 1yto n ASP 70 Ca 0.02 -1.76 0.00 0.00 0.71 0.00 0.00 54.79 53.77 1yto n ASP 70 Cb 0.05 -0.12 0.00 0.00 -0.02 0.00 0.00 41.12 41.03 1yto n ASP 70 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yto n GLY 71 N 0.77 0.73 3.81 0.44 0.00 -0.26 -4.59 105.19 106.08 1yto n GLY 71 Ca 0.11 -0.22 -0.35 0.00 0.00 0.00 0.00 46.02 45.55 1yto n GLY 71 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yto s LEU 72 N 0.00 4.09 0.28 0.99 1.43 -1.26 -0.26 118.68 123.95 1yto s LEU 72 Ca 0.00 0.32 -0.18 0.00 -1.03 0.00 0.00 54.13 53.24 1yto s LEU 72 Cb 0.00 -2.08 -0.09 0.00 0.03 0.00 0.00 46.19 44.05 1yto s LEU 72 CO 0.00 0.37 0.74 -0.76 0.23 0.00 0.00 176.35 176.93 1yto s LEU 73 N -1.18 4.20 0.23 1.79 1.43 -1.26 -0.52 118.68 123.38 1yto s LEU 73 Ca 0.17 1.38 -0.22 0.00 -1.03 0.00 0.00 54.13 54.43 1yto s LEU 73 Cb -0.12 -3.85 0.04 0.00 0.03 0.00 0.00 46.19 42.29 1yto s LEU 73 CO 0.06 -0.09 0.67 -0.72 0.23 0.00 0.00 176.35 176.50 1yto s TYR 74 N -1.75 -0.31 -0.09 0.29 1.13 -0.02 -4.42 117.35 112.18 1yto s TYR 74 Ca 0.49 -0.05 -0.14 0.00 -1.41 0.00 0.00 57.07 55.96 1yto s TYR 74 Cb -0.14 0.64 -0.05 0.00 -1.10 0.00 0.00 41.96 41.31 1yto s TYR 74 CO 0.19 -1.08 0.34 0.20 -2.51 0.00 0.00 175.55 172.69 1yto s GLY 75 N -2.86 2.33 -0.16 5.49 0.00 -0.87 -0.58 107.32 110.68 1yto s GLY 75 Ca 0.07 -0.35 0.02 0.00 0.00 0.00 0.00 44.72 44.46 1yto s GLY 75 CO -0.01 0.29 -0.21 -0.45 0.00 0.00 0.00 173.10 172.72 1yto s SER 76 N -0.22 3.16 0.52 1.64 0.15 0.27 -4.74 113.70 114.47 1yto s SER 76 Ca 0.20 -0.61 0.17 0.00 0.70 0.00 0.00 55.95 56.41 1yto s SER 76 Cb -0.14 -1.47 1.27 0.00 -1.71 0.00 0.00 66.02 63.97 1yto s SER 76 CO 0.08 0.05 2.12 0.06 1.20 0.00 0.00 173.24 176.75 1yto h GLN 77 N 7.54 0.03 -6.09 5.44 -0.00 -1.89 0.30 115.11 120.44 1yto h GLN 77 Ca -0.37 -0.00 -0.68 0.00 -0.00 0.00 0.00 58.65 57.59 1yto h GLN 77 Cb 1.17 -0.01 -0.23 0.00 -0.00 0.00 0.00 27.48 28.41 1yto h GLN 77 CO 0.59 0.02 -0.76 0.95 -0.00 0.00 0.00 178.83 179.63 1yto s THR 78 N -5.09 3.15 -0.41 1.86 -4.23 -1.26 -4.74 115.64 104.93 1yto s THR 78 Ca -0.05 -0.68 -0.29 0.00 -1.18 0.00 0.00 61.69 59.49 1yto s THR 78 Cb 0.17 -2.26 0.02 0.00 1.34 0.00 0.00 72.50 71.77 1yto s THR 78 CO 0.68 0.58 1.26 -2.16 -0.54 0.00 0.00 174.62 174.44 1yto s PRO 79 N -0.51 3.74 0.32 3.99 0.04 -1.26 -4.85 135.00 136.47 1yto s PRO 79 Ca 0.07 0.88 0.02 0.00 0.04 0.00 0.00 61.00 62.00 1yto s PRO 79 Cb -0.12 -3.93 -0.01 0.00 0.04 0.00 0.00 34.50 30.49 1yto s PRO 79 CO 0.02 -1.35 0.06 0.27 0.04 0.00 0.00 177.00 176.04 1yto n ASN 80 N 8.05 1.91 0.07 6.66 0.23 -1.26 -5.01 115.26 125.91 1yto n ASN 80 Ca 0.14 -2.58 0.18 0.00 -0.53 0.00 0.00 54.58 51.80 1yto n ASN 80 Cb 0.48 0.54 0.70 0.00 -2.08 0.00 0.00 39.78 39.42 1yto n ASN 80 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1yto h GLU 81 N 0.00 0.00 0.00 -3.83 5.08 -1.99 0.23 114.58 114.08 1yto h GLU 81 Ca -0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1yto h GLU 81 Cb 0.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1yto h GLU 81 CO 0.42 0.00 0.00 0.39 -1.00 0.00 0.00 179.01 178.82 1yto n GLU 82 N -4.31 0.84 0.00 2.33 1.02 -1.26 -3.10 120.64 116.16 1yto n GLU 82 Ca 0.07 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.27 1yto n GLU 82 Cb 0.50 -1.27 0.01 0.00 -0.02 0.00 0.00 31.44 30.66 1yto n GLU 82 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1yto s LEU 84 N -1.67 4.28 -0.02 0.00 1.43 -1.18 -4.49 118.68 117.04 1yto s LEU 84 Ca 0.11 0.96 0.05 0.00 -1.03 0.00 0.00 54.13 54.23 1yto s LEU 84 Cb 0.10 -2.86 -0.01 0.00 0.03 0.00 0.00 46.19 43.45 1yto s LEU 84 CO 0.29 -0.06 -0.18 -0.36 0.23 0.00 0.00 176.35 176.27 1yto s PHE 85 N 0.77 1.60 -0.38 0.29 0.08 -0.66 -1.31 117.98 118.37 1yto s PHE 85 Ca 0.31 -0.32 -0.25 0.00 0.12 0.00 0.00 56.93 56.79 1yto s PHE 85 Cb -0.16 -1.04 0.02 0.00 -0.57 0.00 0.00 43.02 41.27 1yto s PHE 85 CO 0.13 -0.04 0.90 -0.51 -0.10 0.00 0.00 175.22 175.61 1yto s LEU 86 N -0.38 4.02 -0.25 -0.37 1.43 0.13 -0.25 118.68 122.99 1yto s LEU 86 Ca 0.06 0.48 -0.19 0.00 -1.03 0.00 0.00 54.13 53.46 1yto s LEU 86 Cb -0.07 -3.21 -0.03 0.00 0.03 0.00 0.00 46.19 42.91 1yto s LEU 86 CO -0.00 -0.86 0.55 -0.70 0.23 0.00 0.00 176.35 175.56 1yto s GLU 87 N 3.45 4.09 0.14 1.70 2.12 0.04 -1.06 118.70 129.18 1yto s GLU 87 Ca 0.37 0.39 0.03 0.00 0.36 0.00 0.00 54.97 56.12 1yto s GLU 87 Cb -0.12 -3.64 -0.04 0.00 0.26 0.00 0.00 34.13 30.59 1yto s GLU 87 CO 0.19 -0.34 -0.05 1.03 -0.54 0.00 0.00 175.26 175.55 1yto s ARG 88 N 2.28 0.99 0.34 4.30 1.81 -0.25 -4.72 118.95 123.71 1yto s ARG 88 Ca 0.23 -1.43 -0.16 0.00 -1.72 0.00 0.00 55.73 52.64 1yto s ARG 88 Cb -0.16 -0.35 -0.09 0.00 -0.45 0.00 0.00 34.95 33.90 1yto s ARG 88 CO 0.09 -0.03 0.78 -1.17 -0.68 0.00 0.00 175.30 174.29 1yto s LEU 89 N -3.12 4.06 -0.00 2.53 2.96 0.08 -1.06 118.68 124.13 1yto s LEU 89 Ca 0.17 1.37 0.00 0.00 -0.22 0.00 0.00 54.13 55.45 1yto s LEU 89 Cb 0.05 -4.14 -0.00 0.00 0.50 0.00 0.00 46.19 42.60 1yto s LEU 89 CO -0.00 -0.22 -0.00 -0.70 -1.32 0.00 0.00 176.35 174.10 1yto s GLU 90 N -2.97 0.01 -1.19 1.98 2.56 -0.00 -4.82 118.70 114.28 1yto s GLU 90 Ca 0.55 -0.00 -0.02 0.00 0.00 0.00 0.00 54.97 55.49 1yto s GLU 90 Cb -0.10 -0.01 0.01 0.00 2.00 0.00 0.00 34.13 36.03 1yto s GLU 90 CO 0.17 0.00 0.15 0.39 -0.56 0.00 0.00 175.26 175.41 1yto n GLU 91 N 3.08 -2.65 -2.15 4.30 1.02 -1.26 -0.72 120.64 122.26 1yto n GLU 91 Ca -0.12 0.63 -0.15 0.00 -0.02 0.00 0.00 57.16 57.49 1yto n GLU 91 Cb 0.60 -5.27 -0.02 0.00 -0.02 0.00 0.00 31.44 26.72 1yto n GLU 91 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1yto n ASN 92 N -1.98 -4.44 0.07 1.62 4.13 -1.26 -4.65 115.26 108.76 1yto n ASN 92 Ca -0.12 0.19 0.00 0.00 1.68 0.00 0.00 54.58 56.33 1yto n ASN 92 Cb 0.60 -3.82 0.00 0.00 -1.54 0.00 0.00 39.78 35.02 1yto n ASN 92 CO 0.00 0.00 0.00 1.57 0.28 0.00 0.00 177.26 179.11 1yto n HIS 93 N -3.15 -2.12 -2.34 3.10 -0.00 0.10 -5.15 115.22 105.67 1yto n HIS 93 Ca -0.17 0.39 -0.24 0.00 -0.00 0.00 0.00 57.72 57.69 1yto n HIS 93 Cb 0.60 1.17 0.06 0.00 -0.00 0.00 0.00 29.99 31.82 1yto n HIS 93 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.34 177.05 1yto s TYR 94 N -2.00 2.84 -0.09 1.57 1.51 -0.52 -4.83 117.35 115.84 1yto s TYR 94 Ca 0.00 0.28 -0.01 0.00 -1.01 0.00 0.00 57.07 56.33 1yto s TYR 94 Cb 0.00 -3.07 -0.03 0.00 -0.11 0.00 0.00 41.96 38.75 1yto s TYR 94 CO 0.00 -1.28 -0.03 -0.80 -1.11 0.00 0.00 175.55 172.33 1yto s ASN 95 N -4.50 4.97 0.09 2.29 -0.87 0.11 -0.82 114.94 116.20 1yto s ASN 95 Ca 0.60 0.05 0.05 0.00 -1.57 0.00 0.00 52.86 51.99 1yto s ASN 95 Cb -0.10 -1.39 -0.03 0.00 -0.02 0.00 0.00 41.25 39.70 1yto s ASN 95 CO 0.43 0.35 -0.13 0.42 -2.57 0.00 0.00 177.10 175.60 1yto s THR 96 N -0.71 1.12 -0.12 1.60 -4.23 -0.22 -0.80 115.64 112.28 1yto s THR 96 Ca 0.11 -1.51 -0.00 0.00 -1.18 0.00 0.00 61.69 59.11 1yto s THR 96 Cb -0.11 -1.27 0.03 0.00 1.34 0.00 0.00 72.50 72.48 1yto s THR 96 CO 0.02 -0.37 -0.07 -0.31 -0.54 0.00 0.00 174.62 173.35 1yto s TYR 97 N -1.82 1.50 -0.12 3.99 2.02 -1.26 -1.09 117.35 120.58 1yto s TYR 97 Ca 0.03 -0.77 -0.03 0.00 -0.37 0.00 0.00 57.07 55.93 1yto s TYR 97 Cb -0.07 -1.24 -0.03 0.00 -0.40 0.00 0.00 41.96 40.22 1yto s TYR 97 CO 0.02 -0.52 -0.01 0.42 -1.57 0.00 0.00 175.55 173.89 1yto s ILE 98 N 1.70 4.20 0.04 2.71 1.01 -0.22 -1.14 121.20 129.50 1yto s ILE 98 Ca 0.05 -0.27 -0.33 0.00 0.00 0.00 0.00 60.65 60.10 1yto s ILE 98 Cb -0.13 -2.80 -0.11 0.00 0.01 0.00 0.00 42.46 39.43 1yto s ILE 98 CO -0.08 0.55 1.83 -0.24 0.00 0.00 0.00 174.94 177.01 1yto n SER 99 N 2.72 3.68 0.43 3.58 2.88 -0.33 0.17 113.62 126.75 1yto n SER 99 Ca -0.18 0.98 -0.17 0.00 -1.33 0.00 0.00 58.87 58.17 1yto n SER 99 Cb 0.53 -1.46 -0.08 0.00 -0.75 0.00 0.00 64.21 62.45 1yto n SER 99 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1yto h LYS 100 N 8.69 -1.07 -0.89 -1.46 3.64 -1.52 0.31 116.57 124.26 1yto h LYS 100 Ca -0.48 0.07 0.24 0.00 -1.27 0.00 0.00 60.65 59.22 1yto h LYS 100 Cb 1.25 0.24 -0.14 0.00 -0.41 0.00 0.00 32.23 33.17 1yto h LYS 100 CO 0.94 -0.71 0.28 -0.22 -2.27 0.00 0.00 179.45 177.47 1yto h LYS 101 N -1.28 0.23 -0.69 1.90 3.64 -1.77 0.32 116.57 118.92 1yto h LYS 101 Ca -0.11 -0.01 -0.31 0.00 -1.27 0.00 0.00 60.65 58.94 1yto h LYS 101 Cb 0.86 -0.05 -0.19 0.00 -0.41 0.00 0.00 32.23 32.44 1yto h LYS 101 CO 0.19 0.15 0.30 0.72 -2.27 0.00 0.00 179.45 178.54 1yto n HIS 102 N -5.19 2.17 0.10 1.91 8.25 -1.13 -4.72 115.22 116.60 1yto n HIS 102 Ca 0.22 -1.58 0.11 0.00 -0.26 0.00 0.00 57.72 56.22 1yto n HIS 102 Cb 0.71 -0.71 0.59 0.00 1.12 0.00 0.00 29.99 31.71 1yto n HIS 102 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1yto h ALA 103 N 1.39 2.08 0.00 -1.41 0.00 0.19 -1.59 119.26 119.92 1yto h ALA 103 Ca 0.39 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.28 1yto h ALA 103 Cb 2.28 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 20.04 1yto h ALA 103 CO 0.74 -0.14 -0.01 1.05 0.00 0.00 0.00 179.25 180.89 1yto h GLU 104 N 0.16 0.00 -0.02 0.00 9.09 -1.84 -2.23 114.58 119.74 1yto h GLU 104 Ca 0.13 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.54 1yto h GLU 104 Cb 0.33 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.43 1yto h GLU 104 CO -0.02 0.01 -0.02 1.63 0.05 0.00 0.00 179.01 180.66 1yto n LYS 105 N -3.12 2.00 -3.49 1.06 5.02 -0.60 -4.97 118.16 114.07 1yto n LYS 105 Ca -0.00 -1.49 -0.19 0.00 -2.02 0.00 0.00 58.31 54.61 1yto n LYS 105 Cb 0.25 -1.47 0.08 0.00 -0.02 0.00 0.00 35.03 33.87 1yto n LYS 105 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1yto n ASN 106 N 0.80 -2.52 -4.52 4.39 4.13 -0.84 -4.93 115.26 111.78 1yto n ASN 106 Ca 0.16 -0.64 -0.43 0.00 1.68 0.00 0.00 54.58 55.35 1yto n ASN 106 Cb 0.49 -4.96 -0.06 0.00 -1.54 0.00 0.00 39.78 33.72 1yto n ASN 106 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 1yto s TRP 107 N -3.39 2.98 0.28 3.10 0.52 -1.25 -4.60 118.94 116.58 1yto s TRP 107 Ca 0.09 -0.04 0.03 0.00 0.02 0.00 0.00 56.10 56.20 1yto s TRP 107 Cb -0.04 -3.65 -0.03 0.00 -1.15 0.00 0.00 33.47 28.60 1yto s TRP 107 CO 0.74 -1.04 0.45 -0.06 0.02 0.00 0.00 176.95 177.06 1yto s PHE 108 N 3.21 3.48 0.05 -1.98 0.40 -1.26 -1.19 117.98 120.69 1yto s PHE 108 Ca 0.26 0.17 -0.30 0.00 -0.60 0.00 0.00 56.93 56.46 1yto s PHE 108 Cb -0.14 -1.73 -0.05 0.00 0.51 0.00 0.00 43.02 41.61 1yto s PHE 108 CO 0.19 0.30 1.08 0.08 0.70 0.00 0.00 175.22 177.57 1yto s VAL 109 N -2.12 4.38 -0.07 -0.44 1.01 -0.29 -4.46 120.40 118.41 1yto s VAL 109 Ca 0.37 1.76 -0.30 0.00 0.00 0.00 0.00 61.98 63.81 1yto s VAL 109 Cb -0.09 -4.13 0.07 0.00 0.00 0.00 0.00 36.38 32.23 1yto s VAL 109 CO 0.32 0.16 0.68 -0.83 0.00 0.00 0.00 175.10 175.43 1yto s GLY 110 N 0.83 -0.57 -0.03 4.51 0.00 -1.26 -4.41 107.32 106.40 1yto s GLY 110 Ca 0.54 1.37 0.07 0.00 0.00 0.00 0.00 44.72 46.71 1yto s GLY 110 CO 0.29 1.02 -0.26 1.08 0.00 0.00 0.00 173.10 175.24 1yto s LEU 111 N -1.04 2.06 0.75 0.66 1.43 -0.91 -0.17 118.68 121.47 1yto s LEU 111 Ca -0.10 -0.48 -0.11 0.00 -1.03 0.00 0.00 54.13 52.41 1yto s LEU 111 Cb -0.01 -1.35 0.05 0.00 0.03 0.00 0.00 46.19 44.91 1yto s LEU 111 CO 0.09 0.30 1.13 -0.54 0.23 0.00 0.00 176.35 177.56 1yto s LYS 112 N -0.49 2.40 0.59 1.70 1.02 0.14 -4.43 119.74 120.67 1yto s LYS 112 Ca 0.06 0.25 0.39 0.00 0.02 0.00 0.00 55.97 56.69 1yto s LYS 112 Cb -0.11 -2.00 1.91 0.00 -0.52 0.00 0.00 37.83 37.11 1yto s LYS 112 CO 0.00 -1.30 2.16 0.87 -0.92 0.00 0.00 175.35 176.17 1yto h LYS 113 N -0.83 0.00 -0.37 1.68 1.57 -1.88 -1.44 116.57 115.30 1yto h LYS 113 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1yto h LYS 113 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1yto h LYS 113 CO 0.65 0.00 0.00 0.27 -0.57 0.00 0.00 179.45 179.80 1yto n ASN 114 N -3.01 2.04 -0.11 0.86 0.23 -1.26 -4.90 115.26 109.11 1yto n ASN 114 Ca -0.01 -1.98 -0.01 0.00 -0.53 0.00 0.00 54.58 52.05 1yto n ASN 114 Cb 0.16 -0.25 -0.01 0.00 -2.08 0.00 0.00 39.78 37.61 1yto n ASN 114 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1yto n GLY 115 N 1.12 0.50 3.57 4.83 0.00 -0.54 -4.99 105.19 109.67 1yto n GLY 115 Ca 0.13 -0.93 -0.30 0.00 0.00 0.00 0.00 46.02 44.92 1yto n GLY 115 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1yto s SER 116 N -2.90 4.38 0.19 1.61 1.04 -1.26 -0.71 113.70 116.06 1yto s SER 116 Ca 0.00 -0.37 -0.33 0.00 0.48 0.00 0.00 55.95 55.74 1yto s SER 116 Cb 0.00 -0.85 -0.13 0.00 0.10 0.00 0.00 66.02 65.14 1yto s SER 116 CO 0.00 0.19 1.55 0.00 0.98 0.00 0.00 173.24 175.96 1yto s LYS 118 N 0.49 4.02 0.22 0.00 2.20 0.76 -4.74 119.74 122.69 1yto s LYS 118 Ca 0.75 0.24 -0.32 0.00 -0.36 0.00 0.00 55.97 56.27 1yto s LYS 118 Cb -0.64 -3.67 -0.13 0.00 -1.51 0.00 0.00 37.83 31.88 1yto s LYS 118 CO 0.41 -0.37 1.54 0.54 -0.36 0.00 0.00 175.35 177.11 1yto n ARG 119 N 5.54 2.29 -0.37 4.03 1.74 -1.26 -4.33 116.66 124.29 1yto n ARG 119 Ca -0.05 0.82 -0.01 0.00 -0.77 0.00 0.00 57.85 57.84 1yto n ARG 119 Cb 0.50 -2.56 0.04 0.00 -1.02 0.00 0.00 32.46 29.42 1yto n ARG 119 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yto n GLY 120 N 2.79 -1.96 0.38 -0.13 0.00 0.64 0.34 105.19 107.25 1yto n GLY 120 Ca 0.13 1.07 0.20 0.00 0.00 0.00 0.00 46.02 47.42 1yto n GLY 120 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1yto h PRO 121 N 0.00 0.00 0.00 1.61 0.11 -1.84 -0.49 132.00 131.39 1yto h PRO 121 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 1yto h PRO 121 Cb 0.57 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.68 1yto h PRO 121 CO -0.95 0.00 -0.46 0.00 -0.21 0.00 0.00 178.00 176.38 1yto h ARG 122 N 0.00 0.00 -7.14 1.05 2.47 -0.46 -3.47 114.38 106.83 1yto h ARG 122 Ca 0.21 0.00 -0.49 0.00 -1.26 0.00 0.00 59.98 58.44 1yto h ARG 122 Cb 0.96 0.00 0.05 0.00 -1.65 0.00 0.00 29.97 29.33 1yto h ARG 122 CO -0.00 0.00 0.23 0.95 0.56 0.00 0.00 179.97 181.71 1yto s THR 123 N -3.16 4.40 -0.25 2.04 -4.23 -0.19 -5.00 115.64 109.25 1yto s THR 123 Ca 0.07 0.34 -0.37 0.00 -1.18 0.00 0.00 61.69 60.55 1yto s THR 123 Cb 0.13 -3.72 0.15 0.00 1.34 0.00 0.00 72.50 70.40 1yto s THR 123 CO 0.69 -0.80 1.34 -1.38 -0.54 0.00 0.00 174.62 173.93 1yto s HIS 124 N -2.97 -0.04 0.48 3.99 -3.43 -1.26 -4.83 115.29 107.22 1yto s HIS 124 Ca 0.52 0.02 -0.23 0.00 -0.80 0.00 0.00 55.06 54.57 1yto s HIS 124 Cb -0.11 0.51 -0.09 0.00 -1.43 0.00 0.00 32.58 31.46 1yto s HIS 124 CO 0.48 -0.07 1.00 0.66 -2.00 0.00 0.00 174.74 174.81 1yto n TYR 125 N -0.08 1.10 -0.07 0.38 4.01 -1.26 -2.95 117.16 118.29 1yto n TYR 125 Ca 0.03 0.51 0.00 0.00 -0.16 0.00 0.00 57.90 58.28 1yto n TYR 125 Cb 0.57 -2.21 0.00 0.00 -0.31 0.00 0.00 39.34 37.40 1yto n TYR 125 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1yto n GLY 126 N 1.20 0.48 3.91 2.72 0.00 -1.26 -5.07 105.19 107.16 1yto n GLY 126 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1yto n GLY 126 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1yto s GLN 127 N -0.90 3.45 0.32 1.61 -0.21 -1.15 -4.99 119.66 117.80 1yto s GLN 127 Ca 0.00 -0.33 0.16 0.00 0.02 0.00 0.00 55.36 55.21 1yto s GLN 127 Cb 0.00 -3.09 0.48 0.00 1.00 0.00 0.00 33.01 31.41 1yto s GLN 127 CO 0.00 0.66 1.65 0.87 -2.12 0.00 0.00 175.29 176.35 1yto h LYS 128 N 3.69 0.00 -0.33 2.91 1.79 -1.96 -3.23 116.57 119.44 1yto h LYS 128 Ca -0.48 0.00 0.10 0.00 -2.18 0.00 0.00 60.65 58.08 1yto h LYS 128 Cb 1.18 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.82 1yto h LYS 128 CO 0.70 0.49 0.24 0.00 -1.08 0.00 0.00 179.45 179.80 1yto h ALA 129 N 1.51 2.29 -0.01 3.86 0.00 -1.94 -2.01 119.26 122.96 1yto h ALA 129 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1yto h ALA 129 Cb 1.05 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1yto h ALA 129 CO 0.06 -0.41 -0.37 0.44 0.00 0.00 0.00 179.25 178.96 1yto n ILE 130 N -4.39 0.00 -3.03 0.00 -5.35 -1.22 -2.13 119.36 103.24 1yto n ILE 130 Ca 0.05 -0.12 -0.41 0.00 -0.27 0.00 0.00 62.75 62.00 1yto n ILE 130 Cb 0.42 0.55 -0.05 0.00 -1.74 0.00 0.00 39.64 38.82 1yto n ILE 130 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1yto s LEU 131 N -2.60 4.15 0.09 7.28 1.43 -0.75 -4.39 118.68 123.87 1yto s LEU 131 Ca 0.20 0.96 0.06 0.00 -1.03 0.00 0.00 54.13 54.33 1yto s LEU 131 Cb 0.19 -3.02 -0.03 0.00 0.03 0.00 0.00 46.19 43.35 1yto s LEU 131 CO 0.58 -0.33 -0.17 -0.36 0.23 0.00 0.00 176.35 176.30 1yto s PHE 132 N 2.03 1.43 -0.09 0.29 0.40 0.02 -0.64 117.98 121.42 1yto s PHE 132 Ca 0.32 -0.45 0.04 0.00 -0.60 0.00 0.00 56.93 56.24 1yto s PHE 132 Cb -0.16 -0.79 -0.00 0.00 0.51 0.00 0.00 43.02 42.57 1yto s PHE 132 CO 0.11 0.12 -0.23 -0.51 0.70 0.00 0.00 175.22 175.40 1yto s LEU 133 N -1.84 2.15 -0.36 -0.37 1.02 -0.07 -0.72 118.68 118.48 1yto s LEU 133 Ca 0.02 -0.53 -0.21 0.00 0.02 0.00 0.00 54.13 53.43 1yto s LEU 133 Cb -0.10 -1.42 0.01 0.00 0.02 0.00 0.00 46.19 44.70 1yto s LEU 133 CO 0.03 0.18 0.68 -2.16 0.02 0.00 0.00 176.35 175.10 1yto s PRO 134 N 0.23 3.67 0.22 1.29 0.04 -1.26 -1.26 135.00 137.92 1yto s PRO 134 Ca -0.15 0.09 0.08 0.00 0.04 0.00 0.00 61.00 61.06 1yto s PRO 134 Cb -0.17 -3.82 -0.04 0.00 0.04 0.00 0.00 34.50 30.51 1yto s PRO 134 CO 0.08 -0.79 0.02 -0.51 0.04 0.00 0.00 177.00 175.83 1yto s LEU 135 N 2.83 3.31 0.66 -3.56 1.43 -0.04 -4.88 118.68 118.43 1yto s LEU 135 Ca 0.26 -0.48 -0.17 0.00 -1.03 0.00 0.00 54.13 52.71 1yto s LEU 135 Cb -0.14 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.18 1yto s LEU 135 CO 0.16 0.04 1.19 -2.84 0.23 0.00 0.00 176.35 175.13 1yto s PRO 136 N -3.32 2.59 0.00 1.29 0.02 -1.26 -0.02 135.00 134.30 1yto s PRO 136 Ca 0.29 1.73 0.30 0.00 0.02 0.00 0.00 61.00 63.34 1yto s PRO 136 Cb -0.08 -1.89 1.82 0.00 0.02 0.00 0.00 34.50 34.36 1yto s PRO 136 CO 0.20 -1.48 2.14 1.33 -0.33 0.00 0.00 177.00 178.86