#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 1.75 -2.74 -1.40 7.35 -1.26 -5.02 117.46 116.13 1yto n PHE 1 Ca 0.00 -1.97 -0.43 0.00 -0.76 0.00 0.00 57.45 54.29 1yto n PHE 1 Cb 0.00 -0.28 -0.03 0.00 0.35 0.00 0.00 39.48 39.52 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 -3.49 7.02 0.11 -2.13 0.01 -1.26 -5.02 114.94 110.18 1yto s ASN 2 Ca 0.41 1.28 0.07 0.00 -0.71 0.00 0.00 52.86 53.91 1yto s ASN 2 Cb 0.38 -2.51 -0.04 0.00 0.41 0.00 0.00 41.25 39.49 1yto s ASN 2 CO -0.01 -0.59 -0.10 -0.76 -1.51 0.00 0.00 177.10 174.12 1yto s LEU 3 N 2.96 3.03 0.85 0.60 1.43 -1.26 -0.17 118.68 126.11 1yto s LEU 3 Ca 0.41 -0.40 -0.08 0.00 -1.03 0.00 0.00 54.13 53.03 1yto s LEU 3 Cb -0.15 -1.82 0.17 0.00 0.03 0.00 0.00 46.19 44.42 1yto s LEU 3 CO 0.08 0.17 1.17 -2.16 0.23 0.00 0.00 176.35 175.83 1yto s PRO 4 N -2.25 1.07 0.39 1.29 0.04 -1.26 -4.70 135.00 129.59 1yto s PRO 4 Ca 0.21 -0.84 0.09 0.00 0.04 0.00 0.00 61.00 60.51 1yto s PRO 4 Cb -0.11 -2.09 0.87 0.00 0.04 0.00 0.00 34.50 33.21 1yto s PRO 4 CO 0.14 -1.98 1.97 -1.00 0.04 0.00 0.00 177.00 176.16 1yto h PRO 5 N -1.11 0.58 -5.99 0.56 0.13 -1.99 -3.47 132.00 120.70 1yto h PRO 5 Ca -0.40 -0.03 -0.32 0.00 -0.87 0.00 0.00 66.00 64.38 1yto h PRO 5 Cb 1.24 -0.13 0.07 0.00 0.13 0.00 0.00 31.00 32.32 1yto h PRO 5 CO 0.37 0.38 -0.74 0.41 -0.23 0.00 0.00 178.00 178.19 1yto n GLY 6 N -1.48 -1.12 3.52 1.56 0.00 -1.26 -4.93 105.19 101.49 1yto n GLY 6 Ca 0.10 0.50 -0.43 0.00 0.00 0.00 0.00 46.02 46.19 1yto n GLY 6 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1yto s ASN 7 N -3.28 6.36 0.00 1.61 0.01 -1.26 -4.90 114.94 113.47 1yto s ASN 7 Ca 0.30 -0.27 0.21 0.00 -0.71 0.00 0.00 52.86 52.39 1yto s ASN 7 Cb -0.09 -2.35 0.13 0.00 0.41 0.00 0.00 41.25 39.35 1yto s ASN 7 CO 0.82 -0.85 1.13 -1.22 -1.51 0.00 0.00 177.10 175.47 1yto n TYR 8 N 6.49 0.00 0.07 2.20 4.01 -1.26 -4.57 117.16 124.09 1yto n TYR 8 Ca -0.00 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.63 1yto n TYR 8 Cb 0.48 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.46 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 3.74 -0.30 -6.16 -0.72 1.57 -1.90 -3.43 116.57 109.37 1yto h LYS 9 Ca 0.00 0.02 -0.55 0.00 -1.87 0.00 0.00 60.65 58.25 1yto h LYS 9 Cb 0.84 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.19 1yto h LYS 9 CO 0.00 -0.20 -0.37 0.15 -0.57 0.00 0.00 179.45 178.46 1yto s LYS 10 N -6.11 3.51 0.78 3.15 1.02 -1.26 -5.07 119.74 115.76 1yto s LYS 10 Ca -0.15 -0.37 -0.11 0.00 0.02 0.00 0.00 55.97 55.37 1yto s LYS 10 Cb 0.09 -2.88 0.06 0.00 -0.52 0.00 0.00 37.83 34.57 1yto s LYS 10 CO 0.66 0.45 1.08 -1.25 -0.92 0.00 0.00 175.35 175.37 1yto s PRO 11 N -3.16 2.22 0.34 -1.68 0.04 -1.26 -4.77 135.00 126.74 1yto s PRO 11 Ca 0.38 0.95 -0.07 0.00 0.04 0.00 0.00 61.00 62.30 1yto s PRO 11 Cb -0.11 -1.91 0.03 0.00 0.04 0.00 0.00 34.50 32.55 1yto s PRO 11 CO 0.28 -1.61 0.58 0.36 0.04 0.00 0.00 177.00 176.65 1yto n LYS 12 N -3.47 0.83 -4.22 4.56 0.00 0.71 -4.27 118.16 112.29 1yto n LYS 12 Ca 0.08 -2.32 -0.28 0.00 -0.00 0.00 0.00 58.31 55.79 1yto n LYS 12 Cb 0.54 2.50 -0.09 0.00 -0.00 0.00 0.00 35.03 37.98 1yto n LYS 12 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1yto s LEU 13 N 0.00 3.13 -0.30 -5.58 1.43 0.97 -0.27 118.68 118.06 1yto s LEU 13 Ca 0.21 -0.41 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 1yto s LEU 13 Cb -0.03 -1.86 0.07 0.00 0.03 0.00 0.00 46.19 44.40 1yto s LEU 13 CO 0.15 0.14 -0.02 -0.76 0.23 0.00 0.00 176.35 176.10 1yto s LEU 14 N -2.52 3.99 -0.33 1.79 1.43 -1.26 -0.61 118.68 121.16 1yto s LEU 14 Ca 0.24 -1.54 -0.13 0.00 -1.03 0.00 0.00 54.13 51.66 1yto s LEU 14 Cb -0.10 -1.64 -0.02 0.00 0.03 0.00 0.00 46.19 44.45 1yto s LEU 14 CO 0.16 -0.28 0.28 -0.47 0.23 0.00 0.00 176.35 176.27 1yto s TYR 15 N 1.12 3.22 0.32 0.29 5.04 -0.68 -1.23 117.35 125.43 1yto s TYR 15 Ca -0.03 -0.10 -0.27 0.00 -2.44 0.00 0.00 57.07 54.23 1yto s TYR 15 Cb -0.20 -2.53 -0.09 0.00 0.35 0.00 0.00 41.96 39.49 1yto s TYR 15 CO -0.04 -0.36 1.04 0.00 -1.34 0.00 0.00 175.55 174.85 1yto n SER 17 N 0.69 0.55 -0.17 0.00 7.64 0.07 -0.77 113.62 121.62 1yto n SER 17 Ca 0.01 0.73 0.11 0.00 1.01 0.00 0.00 58.87 60.73 1yto n SER 17 Cb 0.48 -0.81 0.59 0.00 -1.01 0.00 0.00 64.21 63.46 1yto n SER 17 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1yto n ASN 18 N -2.20 0.51 0.00 6.43 3.02 -1.26 -4.90 115.26 116.85 1yto n ASN 18 Ca -0.01 -1.41 0.00 0.00 -0.03 0.00 0.00 54.58 53.14 1yto n ASN 18 Cb 0.07 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 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 0.94 1.04 3.20 7.41 0.00 0.05 -4.52 105.19 113.30 1yto n GLY 20 Ca 0.17 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.99 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 1.34 0.01 1.61 3.76 -1.22 -4.51 115.29 114.28 1yto s HIS 21 Ca 0.00 -0.46 -0.19 0.00 -0.15 0.00 0.00 55.06 54.27 1yto s HIS 21 Cb 0.00 -0.75 -0.06 0.00 1.11 0.00 0.00 32.58 32.89 1yto s HIS 21 CO 0.00 0.09 0.53 -0.06 -0.85 0.00 0.00 174.74 174.45 1yto s PHE 22 N -1.29 3.71 0.19 1.40 0.08 0.86 0.02 117.98 122.96 1yto s PHE 22 Ca 0.00 1.14 -0.31 0.00 0.12 0.00 0.00 56.93 57.88 1yto s PHE 22 Cb -0.10 -2.50 -0.10 0.00 -0.57 0.00 0.00 43.02 39.76 1yto s PHE 22 CO 0.03 0.47 1.51 -1.17 -0.10 0.00 0.00 175.22 175.95 1yto s LEU 23 N -0.58 4.37 -0.04 -0.37 2.96 -0.36 -1.95 118.68 122.70 1yto s LEU 23 Ca 0.28 2.62 0.03 0.00 -0.22 0.00 0.00 54.13 56.84 1yto s LEU 23 Cb -0.18 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.91 1yto s LEU 23 CO 0.16 -0.77 -0.14 -0.60 -1.32 0.00 0.00 176.35 173.69 1yto s ARG 24 N 0.55 1.54 -0.28 1.98 3.52 0.49 -4.46 118.95 122.29 1yto s ARG 24 Ca 0.65 -0.48 -0.02 0.00 -0.13 0.00 0.00 55.73 55.76 1yto s ARG 24 Cb -0.43 -1.34 0.04 0.00 -1.56 0.00 0.00 34.95 31.67 1yto s ARG 24 CO 0.36 0.15 -0.01 0.42 -0.81 0.00 0.00 175.30 175.41 1yto s ILE 25 N 0.24 3.04 0.46 4.11 1.01 -0.96 -1.51 121.20 127.58 1yto s ILE 25 Ca -0.06 -1.21 -0.10 0.00 0.00 0.00 0.00 60.65 59.27 1yto s ILE 25 Cb -0.12 -2.67 -0.06 0.00 0.01 0.00 0.00 42.46 39.63 1yto s ILE 25 CO 0.02 0.00 0.84 -0.76 0.00 0.00 0.00 174.94 175.04 1yto s LEU 26 N 1.30 3.69 0.28 2.97 1.43 0.18 -4.82 118.68 123.70 1yto s LEU 26 Ca -0.03 1.19 0.02 0.00 -1.03 0.00 0.00 54.13 54.28 1yto s LEU 26 Cb -0.19 -4.11 0.62 0.00 0.03 0.00 0.00 46.19 42.55 1yto s LEU 26 CO -0.02 -0.52 1.75 -0.65 0.23 0.00 0.00 176.35 177.14 1yto h PRO 27 N 0.81 0.58 0.00 1.29 0.11 -1.99 -0.31 132.00 132.48 1yto h PRO 27 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1yto h PRO 27 Cb 1.19 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1yto h PRO 27 CO 0.63 0.38 0.00 -0.40 -0.21 0.00 0.00 178.00 178.40 1yto n ASP 28 N -4.89 0.00 0.00 -2.05 5.68 -1.26 -4.79 116.55 109.23 1yto n ASP 28 Ca 0.20 -0.76 0.00 0.00 -0.50 0.00 0.00 54.79 53.73 1yto n ASP 28 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 1yto n ASP 28 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1yto n GLY 29 N 0.16 0.76 3.81 6.12 0.00 -0.13 -4.96 105.19 110.95 1yto n GLY 29 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.26 4.47 -0.02 2.61 2.01 -1.23 -0.41 115.64 120.82 1yto s THR 30 Ca 0.00 1.40 0.07 0.00 0.31 0.00 0.00 61.69 63.47 1yto s THR 30 Cb 0.00 -3.84 -0.02 0.00 0.01 0.00 0.00 72.50 68.65 1yto s THR 30 CO 0.00 0.09 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.10 1yto s VAL 31 N -1.67 1.83 0.00 3.82 1.01 -1.26 0.48 120.40 124.61 1yto s VAL 31 Ca 0.48 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 61.47 1yto s VAL 31 Cb -0.16 -1.52 0.00 0.00 0.00 0.00 0.00 36.38 34.71 1yto s VAL 31 CO 0.20 0.52 0.00 -0.90 0.00 0.00 0.00 175.10 174.92 1yto n ASP 32 N 2.52 0.00 -4.24 3.32 5.75 -0.57 -4.57 116.55 118.77 1yto n ASP 32 Ca -0.16 -0.37 -0.20 0.00 -0.01 0.00 0.00 54.79 54.05 1yto n ASP 32 Cb 0.52 0.00 -0.12 0.00 -1.03 0.00 0.00 41.12 40.49 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 -0.87 1.07 0.03 6.12 0.00 0.97 -0.38 107.32 114.25 1yto s GLY 33 Ca 0.00 -1.19 -0.02 0.00 0.00 0.00 0.00 44.72 43.51 1yto s GLY 33 CO 0.00 -1.23 0.00 -1.08 0.00 0.00 0.00 173.10 170.80 1yto s THR 34 N -1.58 0.13 -0.90 0.90 -1.32 -0.83 -4.72 115.64 107.33 1yto s THR 34 Ca 0.05 -1.11 0.24 0.00 -1.21 0.00 0.00 61.69 59.66 1yto s THR 34 Cb -0.08 -0.64 -0.03 0.00 -1.51 0.00 0.00 72.50 70.23 1yto s THR 34 CO 0.03 -0.61 1.29 0.54 -2.21 0.00 0.00 174.62 173.66 1yto n ARG 35 N 1.14 0.08 -2.62 7.08 1.74 -1.26 -0.10 116.66 122.72 1yto n ARG 35 Ca -0.21 0.01 -0.42 0.00 -0.77 0.00 0.00 57.85 56.46 1yto n ARG 35 Cb 0.57 -1.54 -0.03 0.00 -1.02 0.00 0.00 32.46 30.44 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 -3.29 6.35 0.11 0.55 2.15 -1.26 -4.88 116.67 116.40 1yto s ASP 36 Ca 0.09 -0.14 0.12 0.00 0.43 0.00 0.00 52.55 53.05 1yto s ASP 36 Cb 0.16 -2.53 0.57 0.00 -0.30 0.00 0.00 42.92 40.82 1yto s ASP 36 CO 0.74 -1.53 1.37 -1.14 -0.17 0.00 0.00 175.17 174.43 1yto n ARG 37 N 8.51 0.06 0.00 4.34 0.63 -1.26 -1.91 116.66 127.03 1yto n ARG 37 Ca 0.06 0.46 0.12 0.00 -0.92 0.00 0.00 57.85 57.57 1yto n ARG 37 Cb 0.49 -1.66 0.19 0.00 0.45 0.00 0.00 32.46 31.92 1yto n ARG 37 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1yto n SER 38 N -1.79 0.78 -4.65 6.15 3.41 -1.26 -4.94 113.62 111.32 1yto n SER 38 Ca 0.01 -0.59 -0.47 0.00 -0.26 0.00 0.00 58.87 57.56 1yto n SER 38 Cb 0.08 0.38 -0.04 0.00 -0.26 0.00 0.00 64.21 64.38 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 -1.26 2.67 0.00 4.04 -0.08 -0.80 -4.85 116.55 116.27 1yto n ASP 39 Ca 0.07 1.11 0.15 0.00 -1.51 0.00 0.00 54.79 54.61 1yto n ASP 39 Cb 0.34 -1.38 0.91 0.00 2.34 0.00 0.00 41.12 43.34 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 2.80 0.95 -0.35 -0.67 10.64 -1.26 -3.37 117.38 126.12 1yto n GLN 40 Ca 0.16 0.00 0.07 0.00 -1.83 0.00 0.00 57.00 55.40 1yto n GLN 40 Cb 0.28 -1.50 0.23 0.00 -0.86 0.00 0.00 30.24 28.39 1yto n GLN 40 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 1yto n HIS 41 N -1.01 0.82 0.58 2.61 8.25 -1.26 -4.38 115.22 120.83 1yto n HIS 41 Ca 0.23 -0.65 0.07 0.00 -0.26 0.00 0.00 57.72 57.11 1yto n HIS 41 Cb 0.11 -0.16 0.06 0.00 1.12 0.00 0.00 29.99 31.12 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 0.29 0.03 -2.76 1.59 -5.35 -1.22 -2.27 119.36 109.67 1yto n ILE 42 Ca 0.18 -0.51 -0.43 0.00 -0.27 0.00 0.00 62.75 61.72 1yto n ILE 42 Cb 0.67 1.28 -0.03 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 -1.19 4.10 0.15 6.28 1.11 -1.26 -4.44 119.66 124.41 1yto s GLN 43 Ca 0.17 1.00 0.11 0.00 0.01 0.00 0.00 55.36 56.64 1yto s GLN 43 Cb 0.12 -3.70 -0.04 0.00 -1.01 0.00 0.00 33.01 28.38 1yto s GLN 43 CO 0.18 -0.73 -0.24 -0.51 0.01 0.00 0.00 175.29 174.00 1yto s LEU 44 N 3.25 2.45 -0.24 2.90 1.43 0.63 -2.00 118.68 127.09 1yto s LEU 44 Ca 0.40 -0.74 0.02 0.00 -1.03 0.00 0.00 54.13 52.79 1yto s LEU 44 Cb -0.14 -1.28 0.05 0.00 0.03 0.00 0.00 46.19 44.85 1yto s LEU 44 CO 0.11 0.16 -0.12 -1.58 0.23 0.00 0.00 176.35 175.16 1yto s GLN 45 N -2.27 2.28 0.08 1.70 2.00 0.14 -0.21 119.66 123.39 1yto s GLN 45 Ca 0.17 -1.21 -0.15 0.00 -2.00 0.00 0.00 55.36 52.16 1yto s GLN 45 Cb -0.09 -2.79 -0.06 0.00 0.80 0.00 0.00 33.01 30.86 1yto s GLN 45 CO 0.08 -0.51 0.51 -0.51 -0.50 0.00 0.00 175.29 174.36 1yto s LEU 46 N 1.17 4.43 0.01 3.68 1.02 -1.26 -1.46 118.68 126.27 1yto s LEU 46 Ca -0.06 1.08 0.00 0.00 0.02 0.00 0.00 54.13 55.17 1yto s LEU 46 Cb -0.19 -2.96 -0.01 0.00 0.02 0.00 0.00 46.19 43.05 1yto s LEU 46 CO -0.06 0.22 -0.03 -0.94 0.02 0.00 0.00 176.35 175.55 1yto s SER 47 N -1.39 0.25 0.02 2.29 1.04 -0.74 -4.75 113.70 110.43 1yto s SER 47 Ca 0.31 -0.27 -0.08 0.00 0.48 0.00 0.00 55.95 56.40 1yto s SER 47 Cb -0.17 0.04 -0.05 0.00 0.10 0.00 0.00 66.02 65.94 1yto s SER 47 CO 0.18 -0.13 0.30 0.00 0.98 0.00 0.00 173.24 174.56 1yto s ALA 48 N -0.73 3.82 0.00 5.32 0.00 -1.26 0.09 121.76 128.99 1yto s ALA 48 Ca -0.07 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.37 1yto s ALA 48 Cb -0.05 -2.12 0.00 0.00 0.00 0.00 0.00 23.12 20.95 1yto s ALA 48 CO -0.00 0.62 0.00 -1.91 0.00 0.00 0.00 175.76 174.47 1yto n GLU 49 N 1.17 0.00 -1.38 0.00 4.07 -0.85 -4.94 120.64 118.70 1yto n GLU 49 Ca -0.11 0.00 -0.29 0.00 -0.06 0.00 0.00 57.16 56.70 1yto n GLU 49 Cb 0.53 0.00 0.15 0.00 -0.06 0.00 0.00 31.44 32.06 1yto n GLU 49 CO 0.00 0.00 0.00 -1.12 -0.06 0.00 0.00 177.13 175.95 1yto s SER 50 N -0.78 3.23 0.22 4.31 0.01 -1.26 -4.86 113.70 114.57 1yto s SER 50 Ca 0.00 1.09 -0.32 0.00 1.31 0.00 0.00 55.95 58.04 1yto s SER 50 Cb 0.00 -1.72 -0.13 0.00 0.21 0.00 0.00 66.02 64.38 1yto s SER 50 CO 0.00 -2.74 1.59 0.52 0.41 0.00 0.00 173.24 173.02 1yto n VAL 51 N -3.91 0.46 -0.27 3.43 0.31 -1.26 -1.52 118.33 115.57 1yto n VAL 51 Ca 0.06 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1yto n VAL 51 Cb 0.58 -1.75 0.00 0.00 -0.91 0.00 0.00 33.84 31.76 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 2.98 1.71 3.70 2.92 0.00 -1.26 -5.03 105.19 110.21 1yto n GLY 52 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.27 2.92 0.06 1.61 2.02 -0.58 -0.41 118.70 124.06 1yto s GLU 53 Ca 0.00 -0.49 -0.02 0.00 0.02 0.00 0.00 54.97 54.48 1yto s GLU 53 Cb 0.00 -2.76 -0.03 0.00 0.10 0.00 0.00 34.13 31.44 1yto s GLU 53 CO 0.00 0.67 0.01 0.14 0.02 0.00 0.00 175.26 176.10 1yto s VAL 54 N -1.00 0.20 0.03 2.63 -7.23 0.83 -2.01 120.40 113.85 1yto s VAL 54 Ca 0.17 -1.65 0.04 0.00 -1.81 0.00 0.00 61.98 58.73 1yto s VAL 54 Cb -0.11 -1.44 -0.03 0.00 0.56 0.00 0.00 36.38 35.35 1yto s VAL 54 CO 0.07 -0.91 -0.08 -0.31 -0.31 0.00 0.00 175.10 173.55 1yto s TYR 55 N -3.81 2.83 -0.23 2.82 2.02 0.11 -1.46 117.35 119.63 1yto s TYR 55 Ca 0.06 -0.08 0.02 0.00 -0.37 0.00 0.00 57.07 56.69 1yto s TYR 55 Cb 0.07 -1.56 0.05 0.00 -0.40 0.00 0.00 41.96 40.12 1yto s TYR 55 CO -0.10 0.37 -0.10 0.42 -1.57 0.00 0.00 175.55 174.57 1yto s ILE 56 N -1.03 1.85 0.03 2.71 1.01 -1.26 -1.79 121.20 122.72 1yto s ILE 56 Ca 0.18 -1.31 0.09 0.00 0.00 0.00 0.00 60.65 59.61 1yto s ILE 56 Cb -0.11 -1.97 -0.03 0.00 0.01 0.00 0.00 42.46 40.36 1yto s ILE 56 CO 0.09 0.05 -0.26 -0.75 0.00 0.00 0.00 174.94 174.07 1yto s LYS 57 N 1.27 1.84 -0.11 2.79 2.20 -0.53 -0.41 119.74 126.80 1yto s LYS 57 Ca -0.05 -1.05 -0.30 0.00 -0.36 0.00 0.00 55.97 54.21 1yto s LYS 57 Cb -0.18 -1.95 -0.03 0.00 -1.51 0.00 0.00 37.83 34.15 1yto s LYS 57 CO -0.07 0.51 1.39 0.45 -0.36 0.00 0.00 175.35 177.28 1yto s SER 58 N -1.07 6.86 0.36 1.43 0.15 0.99 0.28 113.70 122.70 1yto s SER 58 Ca 0.11 1.91 0.14 0.00 0.70 0.00 0.00 55.95 58.81 1yto s SER 58 Cb -0.10 -2.54 0.70 0.00 -1.71 0.00 0.00 66.02 62.37 1yto s SER 58 CO 0.01 -0.79 1.80 0.71 1.20 0.00 0.00 173.24 176.17 1yto h THR 59 N 5.42 1.22 0.01 6.45 1.35 -1.74 0.28 112.91 125.90 1yto h THR 59 Ca -0.32 -1.40 -0.00 0.00 -0.55 0.00 0.00 66.41 64.14 1yto h THR 59 Cb 1.14 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 69.32 1yto h THR 59 CO 0.95 0.39 -0.00 -0.08 -0.25 0.00 0.00 175.52 176.53 1yto h GLU 60 N 0.00 -0.01 0.00 4.72 4.57 -1.81 -3.38 114.58 118.68 1yto h GLU 60 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1yto h GLU 60 Cb 0.73 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.33 1yto h GLU 60 CO 0.05 0.77 -1.03 0.25 -1.18 0.00 0.00 179.01 177.87 1yto n THR 61 N -4.71 0.00 -0.92 0.32 -2.24 -1.24 -4.98 114.28 100.51 1yto n THR 61 Ca -0.09 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1yto n THR 61 Cb 0.38 0.90 0.00 0.00 -2.10 0.00 0.00 70.33 69.51 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 1.45 0.47 3.80 3.38 0.00 0.98 -5.00 105.19 110.28 1yto n GLY 62 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.55 4.37 -0.06 1.61 -0.21 -1.25 -4.71 119.66 118.87 1yto s GLN 63 Ca 0.00 1.20 -0.11 0.00 0.02 0.00 0.00 55.36 56.47 1yto s GLN 63 Cb 0.00 -2.43 -0.05 0.00 1.00 0.00 0.00 33.01 31.54 1yto s GLN 63 CO 0.00 0.09 0.28 0.71 -2.12 0.00 0.00 175.29 174.25 1yto s TYR 64 N -1.96 3.67 0.40 0.91 1.51 0.14 -0.01 117.35 122.01 1yto s TYR 64 Ca 0.57 0.77 -0.25 0.00 -1.01 0.00 0.00 57.07 57.16 1yto s TYR 64 Cb -0.13 -2.12 -0.09 0.00 -0.11 0.00 0.00 41.96 39.52 1yto s TYR 64 CO 0.17 0.69 1.12 -1.17 -1.11 0.00 0.00 175.55 175.25 1yto s LEU 65 N -1.06 4.17 0.21 -1.29 2.96 0.46 -0.26 118.68 123.87 1yto s LEU 65 Ca 0.20 2.22 -0.17 0.00 -0.22 0.00 0.00 54.13 56.15 1yto s LEU 65 Cb -0.14 -4.09 0.02 0.00 0.50 0.00 0.00 46.19 42.48 1yto s LEU 65 CO 0.09 -0.60 0.54 0.00 -1.32 0.00 0.00 176.35 175.06 1yto s ALA 66 N -1.51 -0.89 -0.05 5.97 0.00 -0.59 -4.34 121.76 120.35 1yto s ALA 66 Ca 0.57 -0.31 -0.00 0.00 0.00 0.00 0.00 51.96 52.23 1yto s ALA 66 Cb -0.27 0.88 0.03 0.00 0.00 0.00 0.00 23.12 23.75 1yto s ALA 66 CO 0.34 -0.84 -0.02 1.41 0.00 0.00 0.00 175.76 176.65 1yto s MET 67 N -3.90 0.66 0.90 0.00 1.75 -0.88 -1.33 119.30 116.50 1yto s MET 67 Ca 0.11 0.01 -0.14 0.00 -1.25 0.00 0.00 55.69 54.43 1yto s MET 67 Cb -0.02 -0.85 0.16 0.00 2.84 0.00 0.00 34.83 36.96 1yto s MET 67 CO -0.00 -0.19 1.25 0.16 -0.65 0.00 0.00 175.02 175.59 1yto s ASP 68 N 1.41 3.61 0.60 1.11 1.47 -0.20 -4.80 116.67 119.87 1yto s ASP 68 Ca -0.04 0.37 0.29 0.00 1.18 0.00 0.00 52.55 54.35 1yto s ASP 68 Cb -0.13 -0.57 1.56 0.00 -0.34 0.00 0.00 42.92 43.43 1yto s ASP 68 CO -0.03 -2.42 1.96 0.00 0.68 0.00 0.00 175.17 175.36 1yto h THR 69 N -1.39 0.33 -0.36 2.11 1.03 -2.01 0.32 112.91 112.93 1yto h THR 69 Ca -0.44 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 65.96 1yto h THR 69 Cb 1.26 0.69 0.00 0.00 -1.07 0.00 0.00 68.15 69.03 1yto h THR 69 CO 0.46 0.00 0.00 0.47 -0.01 0.00 0.00 175.52 176.44 1yto n ASP 70 N -3.59 2.79 0.00 0.00 8.00 -1.26 -4.94 116.55 117.55 1yto n ASP 70 Ca 0.05 -1.91 0.00 0.00 0.71 0.00 0.00 54.79 53.64 1yto n ASP 70 Cb 0.52 -0.24 0.00 0.00 -0.02 0.00 0.00 41.12 41.39 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 1.36 0.46 3.81 0.44 0.00 0.11 -4.59 105.19 106.78 1yto n GLY 71 Ca 0.18 -0.81 -0.36 0.00 0.00 0.00 0.00 46.02 45.03 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 4.31 0.18 0.99 1.43 -1.26 0.05 118.68 124.39 1yto s LEU 72 Ca 0.00 0.38 -0.28 0.00 -1.03 0.00 0.00 54.13 53.20 1yto s LEU 72 Cb 0.00 -2.10 -0.08 0.00 0.03 0.00 0.00 46.19 44.04 1yto s LEU 72 CO 0.00 0.30 0.87 -0.76 0.23 0.00 0.00 176.35 177.00 1yto s LEU 73 N -0.42 4.60 0.26 1.79 1.43 -1.26 -1.04 118.68 124.05 1yto s LEU 73 Ca 0.12 1.79 -0.13 0.00 -1.03 0.00 0.00 54.13 54.88 1yto s LEU 73 Cb -0.12 -3.47 0.00 0.00 0.03 0.00 0.00 46.19 42.63 1yto s LEU 73 CO 0.02 0.13 0.51 -0.72 0.23 0.00 0.00 176.35 176.52 1yto s TYR 74 N -0.92 0.37 -0.20 0.29 1.13 -0.44 -4.42 117.35 113.15 1yto s TYR 74 Ca 0.40 -0.74 -0.09 0.00 -1.41 0.00 0.00 57.07 55.22 1yto s TYR 74 Cb -0.24 0.24 -0.05 0.00 -1.10 0.00 0.00 41.96 40.81 1yto s TYR 74 CO 0.29 -1.05 0.11 0.20 -2.51 0.00 0.00 175.55 172.59 1yto s GLY 75 N -3.03 1.98 -0.05 5.49 0.00 0.45 -1.54 107.32 110.62 1yto s GLY 75 Ca 0.22 -0.76 0.03 0.00 0.00 0.00 0.00 44.72 44.22 1yto s GLY 75 CO 0.10 0.17 -0.13 -0.45 0.00 0.00 0.00 173.10 172.79 1yto s SER 76 N 0.52 4.14 0.22 1.64 0.15 0.64 -4.76 113.70 116.25 1yto s SER 76 Ca 0.06 -0.18 0.07 0.00 0.70 0.00 0.00 55.95 56.61 1yto s SER 76 Cb -0.12 -0.90 0.18 0.00 -1.71 0.00 0.00 66.02 63.47 1yto s SER 76 CO 0.00 0.34 1.50 1.56 1.20 0.00 0.00 173.24 177.85 1yto h GLN 77 N 5.25 0.09 -6.45 5.44 1.08 -1.89 0.39 115.11 119.03 1yto h GLN 77 Ca -0.47 -0.08 -0.68 0.00 -1.45 0.00 0.00 58.65 55.97 1yto h GLN 77 Cb 1.16 0.02 -0.19 0.00 -0.05 0.00 0.00 27.48 28.42 1yto h GLN 77 CO 0.51 0.77 -0.75 0.95 -0.95 0.00 0.00 178.83 179.36 1yto s THR 78 N -3.43 3.25 -1.57 -0.54 -4.23 -1.26 -4.78 115.64 103.09 1yto s THR 78 Ca -0.02 -1.02 -0.11 0.00 -1.18 0.00 0.00 61.69 59.36 1yto s THR 78 Cb 0.12 -2.41 -0.04 0.00 1.34 0.00 0.00 72.50 71.50 1yto s THR 78 CO 0.79 0.33 2.73 -0.81 -0.54 0.00 0.00 174.62 177.12 1yto n PRO 79 N 1.42 3.52 -0.91 3.99 -0.04 -1.26 -4.87 135.00 136.84 1yto n PRO 79 Ca -0.15 -2.38 -0.22 0.00 -0.04 0.00 0.00 63.50 60.70 1yto n PRO 79 Cb 0.52 -2.92 0.18 0.00 -0.04 0.00 0.00 33.50 31.24 1yto n PRO 79 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1yto n ASN 80 N 4.17 -1.46 0.33 3.54 0.23 -1.26 -4.82 115.26 115.99 1yto n ASN 80 Ca 0.71 -1.07 0.21 0.00 -0.53 0.00 0.00 54.58 53.89 1yto n ASN 80 Cb 0.28 -0.76 1.15 0.00 -2.08 0.00 0.00 39.78 38.36 1yto n ASN 80 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1yto h GLU 81 N 0.00 0.00 -0.00 -3.83 4.11 -1.99 -0.82 114.58 112.05 1yto h GLU 81 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.12 1yto h GLU 81 Cb 0.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1yto h GLU 81 CO 0.21 0.00 -0.10 0.39 0.07 0.00 0.00 179.01 179.58 1yto n GLU 82 N -3.22 0.39 0.00 1.06 1.02 -1.26 -3.58 120.64 115.05 1yto n GLU 82 Ca -0.03 -0.10 0.11 0.00 -0.02 0.00 0.00 57.16 57.13 1yto n GLU 82 Cb 0.09 -1.50 0.09 0.00 -0.02 0.00 0.00 31.44 30.10 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 -2.91 4.32 0.05 0.00 1.43 -1.23 -4.47 118.68 115.86 1yto s LEU 84 Ca 0.12 1.39 0.07 0.00 -1.03 0.00 0.00 54.13 54.67 1yto s LEU 84 Cb 0.17 -3.31 -0.02 0.00 0.03 0.00 0.00 46.19 43.05 1yto s LEU 84 CO 0.74 -0.22 -0.20 -0.36 0.23 0.00 0.00 176.35 176.54 1yto s PHE 85 N 1.10 1.73 -0.37 0.29 0.08 -0.54 -1.54 117.98 118.73 1yto s PHE 85 Ca 0.44 -0.37 -0.19 0.00 0.12 0.00 0.00 56.93 56.92 1yto s PHE 85 Cb -0.19 -1.03 0.01 0.00 -0.57 0.00 0.00 43.02 41.24 1yto s PHE 85 CO 0.21 0.09 0.58 -0.51 -0.10 0.00 0.00 175.22 175.49 1yto s LEU 86 N -1.20 4.37 -0.25 -0.37 1.43 0.70 -0.12 118.68 123.24 1yto s LEU 86 Ca 0.07 -0.05 -0.18 0.00 -1.03 0.00 0.00 54.13 52.93 1yto s LEU 86 Cb -0.09 -2.68 -0.03 0.00 0.03 0.00 0.00 46.19 43.43 1yto s LEU 86 CO 0.02 -0.58 0.52 -0.70 0.23 0.00 0.00 176.35 175.83 1yto s GLU 87 N 2.58 4.09 0.06 1.70 2.12 0.45 -1.80 118.70 127.90 1yto s GLU 87 Ca 0.21 0.34 0.04 0.00 0.36 0.00 0.00 54.97 55.92 1yto s GLU 87 Cb -0.15 -3.64 -0.03 0.00 0.26 0.00 0.00 34.13 30.57 1yto s GLU 87 CO 0.15 -0.33 -0.12 1.03 -0.54 0.00 0.00 175.26 175.45 1yto s ARG 88 N 2.22 0.73 0.52 4.30 1.81 -0.38 -4.76 118.95 123.39 1yto s ARG 88 Ca 0.22 -0.89 -0.19 0.00 -1.72 0.00 0.00 55.73 53.14 1yto s ARG 88 Cb -0.16 -0.66 -0.07 0.00 -0.45 0.00 0.00 34.95 33.62 1yto s ARG 88 CO 0.09 0.14 1.08 -1.17 -0.68 0.00 0.00 175.30 174.76 1yto s LEU 89 N -1.69 3.76 -0.04 2.53 2.96 0.76 -0.59 118.68 126.36 1yto s LEU 89 Ca -0.05 2.01 -0.03 0.00 -0.22 0.00 0.00 54.13 55.85 1yto s LEU 89 Cb -0.10 -4.56 0.02 0.00 0.50 0.00 0.00 46.19 42.04 1yto s LEU 89 CO 0.02 -1.01 0.10 -0.70 -1.32 0.00 0.00 176.35 173.44 1yto s GLU 90 N -3.36 0.09 -1.23 1.98 2.56 0.28 -4.81 118.70 114.21 1yto s GLU 90 Ca 0.69 0.20 -0.05 0.00 0.00 0.00 0.00 54.97 55.81 1yto s GLU 90 Cb -0.19 -0.03 0.04 0.00 2.00 0.00 0.00 34.13 35.94 1yto s GLU 90 CO 0.25 -0.07 0.32 0.39 -0.56 0.00 0.00 175.26 175.59 1yto n GLU 91 N 3.43 -3.17 -0.50 4.30 1.02 -1.26 -1.31 120.64 123.15 1yto n GLU 91 Ca -0.17 0.58 0.00 0.00 -0.02 0.00 0.00 57.16 57.55 1yto n GLU 91 Cb 0.57 -5.27 0.00 0.00 -0.02 0.00 0.00 31.44 26.71 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 -2.14 0.00 0.00 1.62 4.13 -1.26 -4.56 115.26 113.05 1yto n ASN 92 Ca -0.08 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.18 1yto n ASN 92 Cb 0.58 -2.23 0.00 0.00 -1.54 0.00 0.00 39.78 36.59 1yto n ASN 92 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 1yto n HIS 93 N -2.00 0.00 -3.35 3.10 8.25 -0.88 -5.12 115.22 115.22 1yto n HIS 93 Ca 0.00 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.28 1yto n HIS 93 Cb 0.00 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.11 1yto n HIS 93 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1yto s TYR 94 N -0.91 3.04 -0.11 4.41 1.51 -0.43 -4.91 117.35 119.95 1yto s TYR 94 Ca 0.00 -0.27 -0.02 0.00 -1.01 0.00 0.00 57.07 55.77 1yto s TYR 94 Cb 0.00 -2.09 -0.03 0.00 -0.11 0.00 0.00 41.96 39.73 1yto s TYR 94 CO 0.00 -0.11 -0.04 -0.80 -1.11 0.00 0.00 175.55 173.49 1yto s ASN 95 N -4.22 4.85 0.17 2.29 -0.87 0.28 -0.56 114.94 116.89 1yto s ASN 95 Ca 0.48 -0.04 0.08 0.00 -1.57 0.00 0.00 52.86 51.81 1yto s ASN 95 Cb -0.10 -1.53 -0.04 0.00 -0.02 0.00 0.00 41.25 39.56 1yto s ASN 95 CO 0.32 0.27 -0.17 0.42 -2.57 0.00 0.00 177.10 175.37 1yto s THR 96 N -0.26 1.73 -0.17 1.60 -4.23 0.24 -0.91 115.64 113.65 1yto s THR 96 Ca 0.05 -1.94 -0.01 0.00 -1.18 0.00 0.00 61.69 58.61 1yto s THR 96 Cb -0.13 -1.83 0.04 0.00 1.34 0.00 0.00 72.50 71.93 1yto s THR 96 CO 0.02 -0.38 -0.03 -0.31 -0.54 0.00 0.00 174.62 173.39 1yto s TYR 97 N -2.22 1.50 -0.13 3.99 2.02 -1.26 -1.25 117.35 119.99 1yto s TYR 97 Ca 0.16 -0.99 -0.05 0.00 -0.37 0.00 0.00 57.07 55.82 1yto s TYR 97 Cb -0.05 -1.22 -0.04 0.00 -0.40 0.00 0.00 41.96 40.25 1yto s TYR 97 CO 0.06 -0.60 0.06 0.42 -1.57 0.00 0.00 175.55 173.92 1yto s ILE 98 N 1.70 4.78 -0.03 2.71 1.01 -0.74 -1.19 121.20 129.44 1yto s ILE 98 Ca 0.00 -0.05 -0.31 0.00 0.00 0.00 0.00 60.65 60.29 1yto s ILE 98 Cb -0.16 -3.09 -0.10 0.00 0.01 0.00 0.00 42.46 39.13 1yto s ILE 98 CO -0.07 0.55 1.97 -0.24 0.00 0.00 0.00 174.94 177.14 1yto n SER 99 N 2.69 3.85 -0.08 3.58 2.88 -0.02 -0.22 113.62 126.31 1yto n SER 99 Ca -0.18 0.87 -0.11 0.00 -1.33 0.00 0.00 58.87 58.12 1yto n SER 99 Cb 0.53 -1.47 -0.04 0.00 -0.75 0.00 0.00 64.21 62.48 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 10.51 0.39 -0.98 -1.46 3.64 -1.61 0.20 116.57 127.26 1yto h LYS 100 Ca -0.49 -0.09 0.20 0.00 -1.27 0.00 0.00 60.65 59.00 1yto h LYS 100 Cb 1.25 -0.05 -0.09 0.00 -0.41 0.00 0.00 32.23 32.92 1yto h LYS 100 CO 0.95 0.48 0.62 -0.22 -2.27 0.00 0.00 179.45 179.00 1yto h LYS 101 N 0.22 0.63 -0.19 1.90 3.64 -1.76 -1.46 116.57 119.55 1yto h LYS 101 Ca 0.08 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.32 1yto h LYS 101 Cb 0.26 -0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 31.88 1yto h LYS 101 CO -0.00 0.42 -0.27 0.72 -2.27 0.00 0.00 179.45 178.05 1yto n HIS 102 N -4.68 0.60 -0.10 1.91 8.25 -1.07 -4.76 115.22 115.37 1yto n HIS 102 Ca 0.22 -1.55 0.08 0.00 -0.26 0.00 0.00 57.72 56.21 1yto n HIS 102 Cb 0.62 -0.38 0.42 0.00 1.12 0.00 0.00 29.99 31.77 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 0.99 1.81 0.00 -1.41 0.00 0.53 -0.18 119.26 121.00 1yto h ALA 103 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1yto h ALA 103 Cb 1.36 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1yto h ALA 103 CO 0.21 0.10 0.00 1.05 0.00 0.00 0.00 179.25 180.61 1yto h GLU 104 N 0.59 0.00 -0.03 0.00 9.09 -1.85 -1.50 114.58 120.87 1yto h GLU 104 Ca 0.26 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.67 1yto h GLU 104 Cb 0.27 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.37 1yto h GLU 104 CO -0.08 0.00 -0.09 1.63 0.05 0.00 0.00 179.01 180.52 1yto n LYS 105 N -2.61 2.07 -3.52 1.06 5.02 -0.09 -5.00 118.16 115.09 1yto n LYS 105 Ca -0.00 -1.73 -0.20 0.00 -2.02 0.00 0.00 58.31 54.36 1yto n LYS 105 Cb 0.17 -1.46 0.06 0.00 -0.02 0.00 0.00 35.03 33.79 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 1.07 -2.94 -4.52 4.39 4.13 -0.57 -4.95 115.26 111.86 1yto n ASN 106 Ca 0.13 -0.75 -0.41 0.00 1.68 0.00 0.00 54.58 55.22 1yto n ASN 106 Cb 0.57 -4.57 -0.09 0.00 -1.54 0.00 0.00 39.78 34.14 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 -3.49 3.21 0.36 3.10 0.52 -1.24 -4.63 118.94 116.76 1yto s TRP 107 Ca 0.14 -0.17 0.07 0.00 0.02 0.00 0.00 56.10 56.16 1yto s TRP 107 Cb -0.03 -2.68 -0.01 0.00 -1.15 0.00 0.00 33.47 29.60 1yto s TRP 107 CO 0.78 -0.49 0.45 -0.06 0.02 0.00 0.00 176.95 177.64 1yto s PHE 108 N 1.97 2.96 -0.06 -1.98 0.40 -1.26 -0.84 117.98 119.18 1yto s PHE 108 Ca 0.10 -0.30 -0.25 0.00 -0.60 0.00 0.00 56.93 55.88 1yto s PHE 108 Cb -0.17 -2.06 -0.03 0.00 0.51 0.00 0.00 43.02 41.27 1yto s PHE 108 CO 0.12 -0.08 0.78 0.08 0.70 0.00 0.00 175.22 176.82 1yto s VAL 109 N -2.27 4.99 -0.10 -0.44 1.01 -0.33 -4.63 120.40 118.63 1yto s VAL 109 Ca 0.47 1.61 -0.21 0.00 0.00 0.00 0.00 61.98 63.85 1yto s VAL 109 Cb -0.08 -4.12 0.05 0.00 0.00 0.00 0.00 36.38 32.23 1yto s VAL 109 CO 0.30 0.21 0.50 -0.83 0.00 0.00 0.00 175.10 175.28 1yto s GLY 110 N 0.88 -0.37 -0.01 4.51 0.00 -1.26 -4.43 107.32 106.64 1yto s GLY 110 Ca 0.41 1.08 0.08 0.00 0.00 0.00 0.00 44.72 46.28 1yto s GLY 110 CO 0.20 0.83 -0.25 1.08 0.00 0.00 0.00 173.10 174.96 1yto s LEU 111 N -0.64 2.06 0.63 0.66 1.43 -0.81 -0.75 118.68 121.26 1yto s LEU 111 Ca -0.07 -0.45 -0.07 0.00 -1.03 0.00 0.00 54.13 52.51 1yto s LEU 111 Cb -0.03 -1.26 0.02 0.00 0.03 0.00 0.00 46.19 44.96 1yto s LEU 111 CO 0.04 0.30 0.95 -0.54 0.23 0.00 0.00 176.35 177.33 1yto s LYS 112 N -0.63 2.72 0.58 1.70 1.02 0.07 -4.39 119.74 120.80 1yto s LYS 112 Ca 0.10 -0.03 0.34 0.00 0.02 0.00 0.00 55.97 56.39 1yto s LYS 112 Cb -0.09 -2.22 1.82 0.00 -0.52 0.00 0.00 37.83 36.81 1yto s LYS 112 CO -0.01 -0.88 2.19 0.87 -0.92 0.00 0.00 175.35 176.61 1yto h LYS 113 N -0.33 0.00 -0.50 1.68 1.57 -1.88 -1.57 116.57 115.54 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 1.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.58 1yto h LYS 113 CO 0.61 0.04 0.00 0.27 -0.57 0.00 0.00 179.45 179.80 1yto n ASN 114 N -3.46 2.35 0.00 0.86 0.23 -1.26 -4.91 115.26 109.07 1yto n ASN 114 Ca -0.02 -2.14 0.00 0.00 -0.53 0.00 0.00 54.58 51.89 1yto n ASN 114 Cb 0.16 -0.35 0.00 0.00 -2.08 0.00 0.00 39.78 37.51 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 0.84 1.70 3.89 4.83 0.00 -0.59 -5.00 105.19 110.86 1yto n GLY 115 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.35 6.51 0.42 1.61 1.04 -1.26 -0.02 113.70 118.65 1yto s SER 116 Ca 0.00 0.90 -0.24 0.00 0.48 0.00 0.00 55.95 57.09 1yto s SER 116 Cb 0.00 -2.22 -0.09 0.00 0.10 0.00 0.00 66.02 63.82 1yto s SER 116 CO 0.00 -0.23 1.08 0.00 0.98 0.00 0.00 173.24 175.07 1yto s LYS 118 N -2.59 3.84 0.26 0.00 1.02 0.07 -4.83 119.74 117.51 1yto s LYS 118 Ca 0.60 0.35 -0.17 0.00 0.02 0.00 0.00 55.97 56.77 1yto s LYS 118 Cb -0.23 -2.59 -0.08 0.00 -0.52 0.00 0.00 37.83 34.40 1yto s LYS 118 CO 0.29 0.27 0.71 0.50 -0.92 0.00 0.00 175.35 176.20 1yto s ARG 119 N -2.90 4.09 0.21 1.68 3.52 -1.26 -4.65 118.95 119.64 1yto s ARG 119 Ca 0.49 0.72 -0.19 0.00 -0.13 0.00 0.00 55.73 56.62 1yto s ARG 119 Cb -0.11 -2.67 0.18 0.00 -1.56 0.00 0.00 34.95 30.79 1yto s ARG 119 CO 0.21 0.29 1.48 0.41 -0.81 0.00 0.00 175.30 176.88 1yto n GLY 120 N 0.19 -2.05 0.28 8.12 0.00 0.11 -0.54 105.19 111.30 1yto n GLY 120 Ca 0.00 1.08 0.12 0.00 0.00 0.00 0.00 46.02 47.23 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 -1.87 -2.12 132.00 129.73 1yto h PRO 121 Ca 0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.41 1yto h PRO 121 Cb 0.54 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.65 1yto h PRO 121 CO -0.94 0.01 -0.01 0.54 -0.21 0.00 0.00 178.00 177.38 1yto n ARG 122 N -4.10 0.23 -3.73 1.05 5.12 0.30 -4.83 116.66 110.69 1yto n ARG 122 Ca -0.03 -0.01 -0.23 0.00 -1.93 0.00 0.00 57.85 55.66 1yto n ARG 122 Cb 0.09 -1.50 -0.02 0.00 -1.16 0.00 0.00 32.46 29.87 1yto n ARG 122 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1yto s THR 123 N -2.78 5.20 -0.13 0.55 -4.23 -0.80 -4.95 115.64 108.51 1yto s THR 123 Ca 0.21 -0.74 -0.32 0.00 -1.18 0.00 0.00 61.69 59.66 1yto s THR 123 Cb 0.20 -3.85 0.13 0.00 1.34 0.00 0.00 72.50 70.32 1yto s THR 123 CO 0.50 -0.39 1.09 -1.38 -0.54 0.00 0.00 174.62 173.89 1yto s HIS 124 N -2.09 -0.22 0.47 3.99 -3.43 -1.26 -4.83 115.29 107.93 1yto s HIS 124 Ca 0.37 0.17 -0.22 0.00 -0.80 0.00 0.00 55.06 54.58 1yto s HIS 124 Cb -0.09 0.52 -0.10 0.00 -1.43 0.00 0.00 32.58 31.48 1yto s HIS 124 CO 0.32 -0.33 0.86 0.66 -2.00 0.00 0.00 174.74 174.25 1yto n TYR 125 N -0.05 0.58 0.00 0.38 4.01 -1.26 -2.66 117.16 118.15 1yto n TYR 125 Ca -0.04 0.53 0.00 0.00 -0.16 0.00 0.00 57.90 58.23 1yto n TYR 125 Cb 0.59 -2.13 0.00 0.00 -0.31 0.00 0.00 39.34 37.49 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 1.39 2.39 3.88 2.72 0.00 -1.26 -5.06 105.19 109.24 1yto n GLY 126 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.95 3.79 0.26 1.61 -0.21 -1.09 -4.97 119.66 118.11 1yto s GLN 127 Ca 0.00 0.32 0.13 0.00 0.02 0.00 0.00 55.36 55.84 1yto s GLN 127 Cb 0.00 -2.56 0.16 0.00 1.00 0.00 0.00 33.01 31.62 1yto s GLN 127 CO 0.00 0.19 1.48 0.87 -2.12 0.00 0.00 175.29 175.72 1yto h LYS 128 N 2.04 0.00 -0.53 2.91 1.57 -1.96 -3.27 116.57 117.33 1yto h LYS 128 Ca -0.47 0.00 0.15 0.00 -1.87 0.00 0.00 60.65 58.46 1yto h LYS 128 Cb 1.18 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.47 1yto h LYS 128 CO 0.67 0.62 0.44 0.00 -0.57 0.00 0.00 179.45 180.60 1yto h ALA 129 N 1.38 2.37 -0.01 3.86 0.00 -1.94 -0.16 119.26 124.77 1yto h ALA 129 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1yto h ALA 129 Cb 1.35 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1yto h ALA 129 CO 0.08 -0.71 -0.43 0.44 0.00 0.00 0.00 179.25 178.63 1yto n ILE 130 N -4.06 0.00 -2.83 0.00 -5.35 -1.23 -1.92 119.36 103.96 1yto n ILE 130 Ca 0.10 -0.12 -0.42 0.00 -0.27 0.00 0.00 62.75 62.04 1yto n ILE 130 Cb 0.66 0.62 -0.04 0.00 -1.74 0.00 0.00 39.64 39.14 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 -2.64 4.17 0.11 7.28 1.43 -0.07 -4.43 118.68 124.54 1yto s LEU 131 Ca 0.19 1.25 0.09 0.00 -1.03 0.00 0.00 54.13 54.62 1yto s LEU 131 Cb 0.18 -3.31 -0.04 0.00 0.03 0.00 0.00 46.19 43.05 1yto s LEU 131 CO 0.60 -0.44 -0.22 -0.36 0.23 0.00 0.00 176.35 176.17 1yto s PHE 132 N 2.26 1.88 -0.15 0.29 0.40 -0.08 -0.76 117.98 121.83 1yto s PHE 132 Ca 0.40 -0.41 0.02 0.00 -0.60 0.00 0.00 56.93 56.34 1yto s PHE 132 Cb -0.17 -1.02 0.02 0.00 0.51 0.00 0.00 43.02 42.36 1yto s PHE 132 CO 0.12 0.24 -0.20 -1.17 0.70 0.00 0.00 175.22 174.91 1yto s LEU 133 N -2.00 2.07 -0.29 -0.37 2.96 -0.22 -0.55 118.68 120.27 1yto s LEU 133 Ca 0.09 -0.61 -0.29 0.00 -0.22 0.00 0.00 54.13 53.10 1yto s LEU 133 Cb -0.10 -1.42 0.01 0.00 0.50 0.00 0.00 46.19 45.18 1yto s LEU 133 CO 0.05 0.04 1.16 -2.16 -1.32 0.00 0.00 176.35 174.11 1yto s PRO 134 N 1.06 4.06 0.20 0.98 0.04 -1.26 -1.69 135.00 138.37 1yto s PRO 134 Ca -0.01 1.21 0.10 0.00 0.04 0.00 0.00 61.00 62.34 1yto s PRO 134 Cb -0.14 -3.77 -0.04 0.00 0.04 0.00 0.00 34.50 30.58 1yto s PRO 134 CO -0.07 -0.92 -0.16 -0.51 0.04 0.00 0.00 177.00 175.38 1yto s LEU 135 N 3.80 2.73 0.36 -3.56 1.43 0.22 -4.94 118.68 118.72 1yto s LEU 135 Ca 0.49 -0.73 -0.27 0.00 -1.03 0.00 0.00 54.13 52.59 1yto s LEU 135 Cb -0.15 -1.41 -0.09 0.00 0.03 0.00 0.00 46.19 44.57 1yto s LEU 135 CO 0.17 0.10 1.17 -2.84 0.23 0.00 0.00 176.35 175.18 1yto s PRO 136 N -2.84 4.24 0.00 1.29 0.02 -1.26 -0.02 135.00 136.43 1yto s PRO 136 Ca 0.24 1.88 0.13 0.00 0.02 0.00 0.00 61.00 63.26 1yto s PRO 136 Cb -0.08 -2.85 0.77 0.00 0.02 0.00 0.00 34.50 32.37 1yto s PRO 136 CO 0.13 -0.17 1.20 1.33 -0.33 0.00 0.00 177.00 179.16