#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fpt n LEU 9 N 0.00 4.65 0.00 0.64 4.77 -1.26 -4.53 117.00 121.27 3fpt n LEU 9 Ca 0.00 -2.16 -0.15 0.00 -0.03 0.00 0.00 56.01 53.66 3fpt n LEU 9 Cb 0.00 -0.92 0.07 0.00 -2.33 0.00 0.00 43.42 40.24 3fpt n LEU 9 CO 0.00 0.85 0.35 0.61 -1.33 0.00 0.00 177.39 177.88 3fpt n GLY 10 N 1.11 1.01 0.00 -0.72 0.00 -1.26 -5.16 105.19 100.17 3fpt n GLY 10 Ca 0.02 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.98 3fpt n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fpt n GLY 11 N -0.22 2.26 3.38 -0.02 0.00 -1.26 -5.00 105.19 104.34 3fpt n GLY 11 Ca 0.11 -2.10 -0.09 0.00 0.00 0.00 0.00 46.02 43.94 3fpt n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fpt s PRO 13 N -3.93 4.54 0.43 0.00 0.02 -1.26 -4.98 135.00 129.82 3fpt s PRO 13 Ca 0.14 1.69 -0.25 0.00 0.02 0.00 0.00 61.00 62.60 3fpt s PRO 13 Cb 0.02 -3.32 -0.10 0.00 0.02 0.00 0.00 34.50 31.12 3fpt s PRO 13 CO -0.02 -0.04 1.26 1.19 -0.33 0.00 0.00 177.00 179.06 3fpt n PHE 14 N 3.07 2.08 -1.75 6.54 3.72 -1.26 -4.99 117.46 124.88 3fpt n PHE 14 Ca 0.05 0.50 -0.36 0.00 -0.05 0.00 0.00 57.45 57.59 3fpt n PHE 14 Cb 0.47 -2.37 0.06 0.00 -0.94 0.00 0.00 39.48 36.70 3fpt n PHE 14 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3fpt s LEU 15 N -1.69 3.54 0.06 4.37 1.43 -1.26 -4.99 118.68 120.14 3fpt s LEU 15 Ca 0.61 2.49 -0.04 0.00 -1.03 0.00 0.00 54.13 56.16 3fpt s LEU 15 Cb -0.51 -4.61 -0.02 0.00 0.03 0.00 0.00 46.19 41.08 3fpt s LEU 15 CO 0.58 -1.95 0.06 0.68 0.23 0.00 0.00 176.35 175.94 3fpt s VAL 16 N -1.60 0.18 0.35 -1.59 -7.23 -1.26 -2.88 120.40 106.37 3fpt s VAL 16 Ca 0.79 -1.49 0.09 0.00 -1.81 0.00 0.00 61.98 59.56 3fpt s VAL 16 Cb -0.33 -1.35 -0.06 0.00 0.56 0.00 0.00 36.38 35.19 3fpt s VAL 16 CO 0.39 -0.82 -0.04 0.00 -0.31 0.00 0.00 175.10 174.31 3fpt s ALA 17 N -3.67 3.08 -0.07 1.32 0.00 0.61 -4.82 121.76 118.20 3fpt s ALA 17 Ca 0.04 -2.08 -0.03 0.00 0.00 0.00 0.00 51.96 49.90 3fpt s ALA 17 Cb 0.05 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 3fpt s ALA 17 CO -0.09 0.05 0.05 -1.21 0.00 0.00 0.00 175.76 174.56 3fpt s GLU 18 N -3.66 3.10 0.00 0.00 0.41 -0.12 -0.16 118.70 118.26 3fpt s GLU 18 Ca 0.34 -0.37 0.00 0.00 -0.41 0.00 0.00 54.97 54.53 3fpt s GLU 18 Cb 0.02 -2.90 0.00 0.00 -1.78 0.00 0.00 34.13 29.48 3fpt s GLU 18 CO 0.18 0.70 0.00 0.27 -0.49 0.00 0.00 175.26 175.92 3fpt n ASN 19 N 1.83 -0.16 0.01 -0.19 0.23 0.29 -2.64 115.26 114.64 3fpt n ASN 19 Ca -0.17 -0.13 -0.22 0.00 -0.53 0.00 0.00 54.58 53.53 3fpt n ASN 19 Cb 0.54 0.00 -0.14 0.00 -2.08 0.00 0.00 39.78 38.10 3fpt n ASN 19 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 3fpt h LYS 20 N 0.00 0.27 -1.40 -3.83 3.11 -1.89 -3.36 116.57 109.47 3fpt h LYS 20 Ca 0.00 -0.47 0.00 0.00 -2.81 0.00 0.00 60.65 57.37 3fpt h LYS 20 Cb 0.00 0.17 0.00 0.00 -1.00 0.00 0.00 32.23 31.40 3fpt h LYS 20 CO 0.00 1.22 0.00 0.25 -2.81 0.00 0.00 179.45 178.11 3fpt n THR 21 N -3.50 0.00 -0.02 1.00 -2.24 -1.26 -4.74 114.28 103.52 3fpt n THR 21 Ca -0.31 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 3fpt n THR 21 Cb 1.05 -0.18 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 3fpt n THR 21 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fpt n GLY 22 N 0.73 0.00 3.83 3.38 0.00 -1.26 -4.98 105.19 106.89 3fpt n GLY 22 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 3fpt n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3fpt s TYR 23 N -0.43 3.33 0.29 1.61 2.02 -1.26 -4.66 117.35 118.24 3fpt s TYR 23 Ca 0.00 1.48 -0.28 0.00 -0.37 0.00 0.00 57.07 57.90 3fpt s TYR 23 Cb 0.00 -2.75 -0.09 0.00 -0.40 0.00 0.00 41.96 38.72 3fpt s TYR 23 CO 0.00 -0.05 0.96 -2.14 -1.57 0.00 0.00 175.55 172.75 3fpt s PRO 24 N -3.13 4.69 0.03 -1.71 0.02 -1.26 -0.55 135.00 133.10 3fpt s PRO 24 Ca 0.59 1.44 0.03 0.00 0.02 0.00 0.00 61.00 63.08 3fpt s PRO 24 Cb -0.09 -3.02 -0.02 0.00 0.02 0.00 0.00 34.50 31.39 3fpt s PRO 24 CO 0.15 0.36 -0.09 0.99 -0.33 0.00 0.00 177.00 178.07 3fpt s THR 25 N -1.40 0.67 0.42 0.99 2.01 0.77 -4.90 115.64 114.20 3fpt s THR 25 Ca 0.46 -0.90 -0.15 0.00 0.31 0.00 0.00 61.69 61.41 3fpt s THR 25 Cb -0.23 -0.67 -0.08 0.00 0.01 0.00 0.00 72.50 71.53 3fpt s THR 25 CO 0.29 -0.19 0.84 0.27 -0.69 0.00 0.00 174.62 175.14 3fpt s ILE 26 N -1.01 4.64 -0.30 1.82 -4.36 -1.26 -0.29 121.20 120.45 3fpt s ILE 26 Ca -0.05 0.97 0.13 0.00 -0.26 0.00 0.00 60.65 61.45 3fpt s ILE 26 Cb -0.08 -3.68 -0.18 0.00 1.25 0.00 0.00 42.46 39.77 3fpt s ILE 26 CO 0.01 -0.46 0.42 0.55 0.24 0.00 0.00 174.94 175.70 3fpt n VAL 27 N -1.06 0.00 -4.14 8.37 3.14 -1.14 -0.69 118.33 122.81 3fpt n VAL 27 Ca 0.04 -0.25 -0.11 0.00 -2.96 0.00 0.00 64.34 61.06 3fpt n VAL 27 Cb 0.54 0.57 -0.10 0.00 -1.06 0.00 0.00 33.84 33.78 3fpt n VAL 27 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3fpt s ALA 28 N -2.61 0.84 -0.85 1.55 0.00 -1.26 0.36 121.76 119.79 3fpt s ALA 28 Ca -0.00 -1.21 0.27 0.00 0.00 0.00 0.00 51.96 51.02 3fpt s ALA 28 Cb 0.09 0.14 1.00 0.00 0.00 0.00 0.00 23.12 24.36 3fpt s ALA 28 CO 0.55 -0.20 1.82 0.00 0.00 0.00 0.00 175.76 177.93 3fpt s LYS 30 N -3.06 1.67 -0.04 0.00 1.02 -1.26 -0.91 119.74 117.16 3fpt s LYS 30 Ca 0.11 -0.70 0.02 0.00 0.02 0.00 0.00 55.97 55.43 3fpt s LYS 30 Cb 0.15 -1.58 0.01 0.00 -0.52 0.00 0.00 37.83 35.89 3fpt s LYS 30 CO 0.53 0.39 -0.08 -1.14 -0.92 0.00 0.00 175.35 174.13 3fpt s GLN 31 N -0.37 1.09 0.13 1.68 2.00 -0.27 -4.96 119.66 118.96 3fpt s GLN 31 Ca 0.05 -0.27 -0.19 0.00 -2.00 0.00 0.00 55.36 52.94 3fpt s GLN 31 Cb -0.09 -0.99 -0.07 0.00 0.80 0.00 0.00 33.01 32.66 3fpt s GLN 31 CO -0.00 0.04 0.63 0.34 -0.50 0.00 0.00 175.29 175.80 3fpt s ASP 32 N 0.50 7.07 -0.49 6.67 -1.08 -1.26 -1.16 116.67 126.92 3fpt s ASP 32 Ca -0.08 1.32 0.03 0.00 -0.52 0.00 0.00 52.55 53.30 3fpt s ASP 32 Cb -0.12 -2.38 0.13 0.00 -1.46 0.00 0.00 42.92 39.09 3fpt s ASP 32 CO 0.01 0.19 0.26 0.00 0.52 0.00 0.00 175.17 176.15 3fpt n ASN 34 N 3.25 -2.41 0.00 0.00 4.13 -1.26 -1.97 115.26 117.00 3fpt n ASN 34 Ca 0.07 -1.16 0.00 0.00 1.68 0.00 0.00 54.58 55.17 3fpt n ASN 34 Cb 0.33 -1.40 0.00 0.00 -1.54 0.00 0.00 39.78 37.17 3fpt n ASN 34 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3fpt n GLY 35 N -2.10 3.10 3.74 7.41 0.00 -1.26 -4.88 105.19 111.20 3fpt n GLY 35 Ca -0.15 -0.92 -0.41 0.00 0.00 0.00 0.00 46.02 44.54 3fpt n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fpt s THR 36 N -0.79 3.84 -0.18 2.61 2.01 -0.83 -5.04 115.64 117.26 3fpt s THR 36 Ca 0.00 1.59 -0.01 0.00 0.31 0.00 0.00 61.69 63.58 3fpt s THR 36 Cb 0.00 -4.02 -0.00 0.00 0.01 0.00 0.00 72.50 68.49 3fpt s THR 36 CO 0.00 0.27 -0.11 -0.89 -0.69 0.00 0.00 174.62 173.20 3fpt s THR 37 N -0.24 2.96 -0.09 -0.82 2.01 -1.26 -0.68 115.64 117.52 3fpt s THR 37 Ca 0.50 -0.66 -0.04 0.00 0.31 0.00 0.00 61.69 61.79 3fpt s THR 37 Cb -0.30 -2.29 -0.04 0.00 0.01 0.00 0.00 72.50 69.89 3fpt s THR 37 CO 0.35 0.49 0.08 -1.61 -0.69 0.00 0.00 174.62 173.24 3fpt s GLU 38 N 1.00 3.24 -0.01 4.92 2.02 -0.31 -4.96 118.70 124.60 3fpt s GLU 38 Ca -0.01 -0.27 0.04 0.00 0.02 0.00 0.00 54.97 54.75 3fpt s GLU 38 Cb -0.15 -3.01 -0.01 0.00 0.10 0.00 0.00 34.13 31.06 3fpt s GLU 38 CO -0.02 0.74 -0.14 0.99 0.02 0.00 0.00 175.26 176.86 3fpt s THR 39 N -1.00 1.07 0.41 3.63 2.01 -1.26 -1.11 115.64 119.39 3fpt s THR 39 Ca 0.15 -0.57 -0.12 0.00 0.31 0.00 0.00 61.69 61.46 3fpt s THR 39 Cb -0.12 -0.90 -0.07 0.00 0.01 0.00 0.00 72.50 71.42 3fpt s THR 39 CO 0.05 0.31 0.80 0.00 -0.69 0.00 0.00 174.62 175.08 3fpt s ALA 40 N -0.27 3.30 0.27 7.40 0.00 -0.09 -5.01 121.76 127.37 3fpt s ALA 40 Ca 0.04 -0.10 -0.29 0.00 0.00 0.00 0.00 51.96 51.61 3fpt s ALA 40 Cb -0.06 -2.78 -0.09 0.00 0.00 0.00 0.00 23.12 20.19 3fpt s ALA 40 CO -0.00 0.01 1.22 -1.25 0.00 0.00 0.00 175.76 175.74 3fpt s PRO 41 N -3.74 4.48 0.14 0.00 0.05 -1.26 -4.52 135.00 130.15 3fpt s PRO 41 Ca 0.53 2.00 -0.19 0.00 0.05 0.00 0.00 61.00 63.40 3fpt s PRO 41 Cb -0.10 -3.16 -0.11 0.00 0.05 0.00 0.00 34.50 31.18 3fpt s PRO 41 CO 0.29 -0.05 0.34 0.09 0.05 0.00 0.00 177.00 177.72 3fpt n ASN 42 N 1.49 -0.90 -0.28 6.66 3.02 -1.26 -2.22 115.26 121.78 3fpt n ASN 42 Ca 0.01 0.75 -0.04 0.00 -0.03 0.00 0.00 54.58 55.28 3fpt n ASN 42 Cb 0.43 -0.64 -0.02 0.00 -0.61 0.00 0.00 39.78 38.95 3fpt n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3fpt n GLY 43 N 1.36 0.55 3.76 7.41 0.00 0.26 -4.94 105.19 113.59 3fpt n GLY 43 Ca 0.12 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 3fpt n GLY 43 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fpt s THR 44 N -1.75 3.08 0.27 2.61 2.01 -0.94 -4.66 115.64 116.26 3fpt s THR 44 Ca 0.00 1.02 -0.29 0.00 0.31 0.00 0.00 61.69 62.73 3fpt s THR 44 Cb 0.00 -3.65 -0.09 0.00 0.01 0.00 0.00 72.50 68.76 3fpt s THR 44 CO 0.00 0.22 1.14 -0.60 -0.69 0.00 0.00 174.62 174.68 3fpt s ARG 45 N -1.19 4.59 0.09 4.92 3.52 -1.26 -0.75 118.95 128.86 3fpt s ARG 45 Ca 0.50 1.86 -0.15 0.00 -0.13 0.00 0.00 55.73 57.81 3fpt s ARG 45 Cb -0.37 -3.18 0.03 0.00 -1.56 0.00 0.00 34.95 29.87 3fpt s ARG 45 CO 0.45 0.13 0.37 0.00 -0.81 0.00 0.00 175.30 175.44 3fpt s PHE 47 N -3.28 3.82 -1.22 0.00 0.08 0.13 0.15 117.98 117.66 3fpt s PHE 47 Ca -0.00 1.36 -0.08 0.00 0.12 0.00 0.00 56.93 58.33 3fpt s PHE 47 Cb 0.01 -2.59 0.21 0.00 -0.57 0.00 0.00 43.02 40.08 3fpt s PHE 47 CO -0.08 0.54 1.73 -1.13 -0.10 0.00 0.00 175.22 176.17 3fpt n SER 48 N 1.82 5.46 -0.01 1.36 3.41 -0.40 -4.30 113.62 120.96 3fpt n SER 48 Ca -0.09 -3.18 -0.02 0.00 -0.26 0.00 0.00 58.87 55.32 3fpt n SER 48 Cb 0.50 -1.43 -0.02 0.00 -0.26 0.00 0.00 64.21 63.01 3fpt n SER 48 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3fpt n ILE 49 N 2.87 0.17 0.00 -1.33 5.41 -1.22 -4.90 119.36 120.35 3fpt n ILE 49 Ca 0.36 -0.08 0.00 0.00 1.00 0.00 0.00 62.75 64.03 3fpt n ILE 49 Cb 0.36 -0.71 0.00 0.00 -0.71 0.00 0.00 39.64 38.58 3fpt n ILE 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3fpt n GLY 50 N 3.20 -1.30 0.27 7.39 0.00 0.16 -3.83 105.19 111.07 3fpt n GLY 50 Ca -0.05 -1.59 -0.02 0.00 0.00 0.00 0.00 46.02 44.36 3fpt n GLY 50 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3fpt h ASP 51 N 0.00 0.58 0.02 1.61 3.32 -1.97 0.10 116.42 120.09 3fpt h ASP 51 Ca 0.00 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 3fpt h ASP 51 Cb 0.00 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.40 3fpt h ASP 51 CO 0.00 0.66 -0.01 -0.08 -1.72 0.00 0.00 179.24 178.08 3fpt h GLU 52 N 0.58 -0.03 -0.67 3.56 4.22 -1.97 -0.36 114.58 119.91 3fpt h GLU 52 Ca 0.12 0.00 0.11 0.00 0.08 0.00 0.00 59.36 59.67 3fpt h GLU 52 Cb 0.38 0.01 -0.11 0.00 0.50 0.00 0.00 28.75 29.53 3fpt h GLU 52 CO 0.01 0.67 -0.24 0.41 -2.18 0.00 0.00 179.01 177.69 3fpt n GLY 53 N 1.37 -1.32 0.28 1.92 0.00 -1.17 -0.16 105.19 106.10 3fpt n GLY 53 Ca -0.08 0.74 -0.10 0.00 0.00 0.00 0.00 46.02 46.59 3fpt n GLY 53 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3fpt h LEU 54 N 0.00 0.95 0.20 0.99 5.85 -0.28 -2.88 115.31 120.14 3fpt h LEU 54 Ca 0.25 -0.35 0.01 0.00 0.84 0.00 0.00 57.88 58.64 3fpt h LEU 54 Cb 0.42 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 3fpt h LEU 54 CO -0.67 1.12 -0.29 0.03 -0.34 0.00 0.00 178.44 178.28 3fpt h ARG 55 N 0.81 -0.54 -0.49 1.25 3.08 0.12 -2.95 114.38 115.66 3fpt h ARG 55 Ca 0.11 0.04 0.14 0.00 0.07 0.00 0.00 59.98 60.34 3fpt h ARG 55 Cb 0.76 0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.91 3fpt h ARG 55 CO 0.06 -0.36 0.50 0.00 -1.07 0.00 0.00 179.97 179.10 3fpt h ARG 56 N -0.56 0.00 -6.71 0.04 2.47 -1.00 -3.42 114.38 105.20 3fpt h ARG 56 Ca 0.01 0.00 -0.53 0.00 -1.26 0.00 0.00 59.98 58.20 3fpt h ARG 56 Cb 0.55 0.00 0.06 0.00 -1.65 0.00 0.00 29.97 28.93 3fpt h ARG 56 CO -0.12 0.00 0.85 -1.64 0.56 0.00 0.00 179.97 179.62 3fpt s MET 57 N -4.64 4.21 0.42 0.04 -1.94 -1.12 -4.95 119.30 111.33 3fpt s MET 57 Ca -0.04 2.41 -0.25 0.00 -1.71 0.00 0.00 55.69 56.09 3fpt s MET 57 Cb 0.16 -3.10 -0.08 0.00 2.01 0.00 0.00 34.83 33.82 3fpt s MET 57 CO 0.56 -0.55 1.25 0.99 -0.01 0.00 0.00 175.02 177.26 3fpt s THR 58 N 0.44 2.80 0.12 2.05 2.01 -1.26 -4.93 115.64 116.87 3fpt s THR 58 Ca 0.65 0.67 -0.30 0.00 0.31 0.00 0.00 61.69 63.02 3fpt s THR 58 Cb -0.44 -3.38 -0.06 0.00 0.01 0.00 0.00 72.50 68.62 3fpt s THR 58 CO 0.40 0.06 1.07 0.00 -0.69 0.00 0.00 174.62 175.46 3fpt s ALA 59 N -1.35 3.32 0.00 7.40 0.00 -1.26 -3.38 121.76 126.49 3fpt s ALA 59 Ca 0.59 0.73 0.00 0.00 0.00 0.00 0.00 51.96 53.28 3fpt s ALA 59 Cb -0.35 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.42 3fpt s ALA 59 CO 0.44 -0.20 0.00 0.09 0.00 0.00 0.00 175.76 176.08 3fpt n ASN 60 N 2.93 -2.13 -4.41 0.00 3.02 -0.71 -4.95 115.26 109.01 3fpt n ASN 60 Ca 0.04 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.27 3fpt n ASN 60 Cb 0.48 -0.35 -0.14 0.00 -0.61 0.00 0.00 39.78 39.15 3fpt n ASN 60 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3fpt s LEU 61 N 0.00 2.47 0.04 3.41 1.02 -1.22 -5.02 118.68 119.38 3fpt s LEU 61 Ca 0.00 -0.35 -0.30 0.00 0.02 0.00 0.00 54.13 53.50 3fpt s LEU 61 Cb 0.00 -1.47 -0.06 0.00 0.02 0.00 0.00 46.19 44.68 3fpt s LEU 61 CO 0.00 0.32 1.32 -2.84 0.02 0.00 0.00 176.35 175.16 3fpt s PRO 62 N -0.86 4.34 0.27 1.29 0.02 -1.26 -4.33 135.00 134.47 3fpt s PRO 62 Ca 0.12 1.90 0.12 0.00 0.02 0.00 0.00 61.00 63.16 3fpt s PRO 62 Cb -0.10 -3.43 -0.05 0.00 0.02 0.00 0.00 34.50 30.94 3fpt s PRO 62 CO 0.01 -0.44 -0.20 0.71 -0.33 0.00 0.00 177.00 176.76 3fpt s TYR 63 N 1.68 2.30 -0.96 6.54 2.02 -0.38 -5.01 117.35 123.54 3fpt s TYR 63 Ca 0.62 -0.33 -0.17 0.00 -0.37 0.00 0.00 57.07 56.82 3fpt s TYR 63 Cb -0.31 -1.01 0.16 0.00 -0.40 0.00 0.00 41.96 40.40 3fpt s TYR 63 CO 0.28 0.70 1.11 0.34 -1.57 0.00 0.00 175.55 176.41 3fpt s ASP 64 N -3.46 6.76 -0.13 2.29 2.15 -1.26 -2.40 116.67 120.62 3fpt s ASP 64 Ca 0.29 -2.40 -0.16 0.00 0.43 0.00 0.00 52.55 50.72 3fpt s ASP 64 Cb -0.05 -2.35 -0.05 0.00 -0.30 0.00 0.00 42.92 40.17 3fpt s ASP 64 CO 0.15 -0.88 0.38 0.00 -0.17 0.00 0.00 175.17 174.64 3fpt s PRO 66 N 0.35 4.54 0.39 0.00 0.04 -1.26 -0.08 135.00 138.98 3fpt s PRO 66 Ca 0.21 1.55 -0.10 0.00 0.04 0.00 0.00 61.00 62.70 3fpt s PRO 66 Cb -0.14 -3.40 -0.06 0.00 0.04 0.00 0.00 34.50 30.93 3fpt s PRO 66 CO 0.07 -0.07 0.75 -0.51 0.04 0.00 0.00 177.00 177.28 3fpt s LEU 67 N 0.80 3.86 0.00 -3.56 1.43 0.57 -1.27 118.68 120.51 3fpt s LEU 67 Ca 0.53 1.10 -0.07 0.00 -1.03 0.00 0.00 54.13 54.66 3fpt s LEU 67 Cb -0.24 -3.98 0.03 0.00 0.03 0.00 0.00 46.19 42.03 3fpt s LEU 67 CO 0.29 -0.38 0.49 0.61 0.23 0.00 0.00 176.35 177.60 3fpt n GLY 68 N -1.23 1.64 3.06 -3.19 0.00 0.40 -2.04 105.19 103.83 3fpt n GLY 68 Ca 0.02 -1.31 -0.21 0.00 0.00 0.00 0.00 46.02 44.53 3fpt n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fpt s GLN 69 N -2.23 0.98 0.07 1.61 -0.21 0.65 -1.43 119.66 119.10 3fpt s GLN 69 Ca 0.15 -0.41 -0.31 0.00 0.02 0.00 0.00 55.36 54.81 3fpt s GLN 69 Cb -0.03 -0.94 -0.08 0.00 1.00 0.00 0.00 33.01 32.97 3fpt s GLN 69 CO 0.11 0.23 1.55 0.00 -2.12 0.00 0.00 175.29 175.06 3fpt s SER 71 N 1.96 1.26 -1.10 0.00 0.15 0.46 0.91 113.70 117.34 3fpt s SER 71 Ca 0.70 -0.00 -0.05 0.00 0.70 0.00 0.00 55.95 57.30 3fpt s SER 71 Cb -0.38 0.10 0.01 0.00 -1.71 0.00 0.00 66.02 64.03 3fpt s SER 71 CO 0.30 -0.28 0.94 -3.20 1.20 0.00 0.00 173.24 172.21 3fpt n ASN 72 N 5.31 -4.31 0.00 5.45 5.15 -1.26 -1.71 115.26 123.89 3fpt n ASN 72 Ca -0.05 -0.48 0.00 0.00 -0.60 0.00 0.00 54.58 53.45 3fpt n ASN 72 Cb 0.50 -4.37 0.00 0.00 -0.53 0.00 0.00 39.78 35.38 3fpt n ASN 72 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3fpt n GLY 73 N -1.53 0.06 3.46 8.20 0.00 -1.26 -5.02 105.19 109.10 3fpt n GLY 73 Ca -0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 3fpt n GLY 73 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3fpt s ASP 74 N -2.00 3.73 -0.32 1.61 1.01 -0.70 -4.08 116.67 115.93 3fpt s ASP 74 Ca 0.00 -0.58 -0.29 0.00 0.71 0.00 0.00 52.55 52.39 3fpt s ASP 74 Cb 0.00 -0.48 0.01 0.00 1.01 0.00 0.00 42.92 43.46 3fpt s ASP 74 CO 0.00 0.19 1.26 0.00 0.21 0.00 0.00 175.17 176.83 3fpt s ILE 76 N 4.31 5.00 0.30 0.00 -1.09 0.29 -4.82 121.20 125.19 3fpt s ILE 76 Ca 0.54 1.21 -0.29 0.00 -2.23 0.00 0.00 60.65 59.88 3fpt s ILE 76 Cb -0.15 -3.96 -0.09 0.00 -1.58 0.00 0.00 42.46 36.68 3fpt s ILE 76 CO 0.23 0.09 1.09 -2.84 -1.23 0.00 0.00 174.94 172.28 3fpt s PRO 77 N 2.03 4.56 -0.22 2.79 0.02 -1.26 -0.25 135.00 142.66 3fpt s PRO 77 Ca 0.29 1.77 0.11 0.00 0.02 0.00 0.00 61.00 63.19 3fpt s PRO 77 Cb -0.16 -3.09 0.43 0.00 0.02 0.00 0.00 34.50 31.71 3fpt s PRO 77 CO 0.10 0.15 1.28 0.36 -0.33 0.00 0.00 177.00 178.56 3fpt n LYS 78 N 0.99 1.65 -2.84 5.54 2.85 -0.87 -4.87 118.16 120.61 3fpt n LYS 78 Ca -0.00 -3.21 -0.18 0.00 -1.05 0.00 0.00 58.31 53.86 3fpt n LYS 78 Cb 0.45 -1.67 0.00 0.00 -0.65 0.00 0.00 35.03 33.17 3fpt n LYS 78 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 3fpt n GLU 79 N -1.13 -3.01 -4.52 -1.58 0.00 -1.26 -5.00 120.64 104.13 3fpt n GLU 79 Ca 0.22 0.62 -0.26 0.00 0.00 0.00 0.00 57.16 57.75 3fpt n GLU 79 Cb 0.78 -5.30 -0.10 0.00 0.00 0.00 0.00 31.44 26.81 3fpt n GLU 79 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 3fpt s THR 80 N -2.83 2.28 0.15 3.84 -4.23 -1.26 -5.03 115.64 108.56 3fpt s THR 80 Ca 0.18 -2.19 -0.01 0.00 -1.18 0.00 0.00 61.69 58.49 3fpt s THR 80 Cb -0.09 -2.65 -0.04 0.00 1.34 0.00 0.00 72.50 71.05 3fpt s THR 80 CO 0.23 -0.21 0.09 -0.31 -0.54 0.00 0.00 174.62 173.88 3fpt s TYR 81 N -2.60 0.94 0.30 3.99 2.02 -1.25 -0.31 117.35 120.43 3fpt s TYR 81 Ca 0.33 -1.26 -0.20 0.00 -0.37 0.00 0.00 57.07 55.56 3fpt s TYR 81 Cb 0.02 -0.49 0.04 0.00 -0.40 0.00 0.00 41.96 41.13 3fpt s TYR 81 CO 0.17 -0.56 0.78 -1.83 -1.57 0.00 0.00 175.55 172.54 3fpt s GLU 82 N -4.08 1.85 -0.27 -0.62 -1.05 0.88 -4.85 118.70 110.57 3fpt s GLU 82 Ca 0.28 -1.09 -0.24 0.00 -0.15 0.00 0.00 54.97 53.77 3fpt s GLU 82 Cb 0.07 0.58 -0.00 0.00 -0.44 0.00 0.00 34.13 34.34 3fpt s GLU 82 CO 0.05 -0.86 0.82 0.08 0.95 0.00 0.00 175.26 176.31 3fpt s VAL 83 N -3.25 4.81 0.38 1.83 1.01 -1.25 -0.10 120.40 123.83 3fpt s VAL 83 Ca 0.13 1.45 0.08 0.00 0.00 0.00 0.00 61.98 63.64 3fpt s VAL 83 Cb -0.05 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 3fpt s VAL 83 CO 0.08 -0.14 0.26 0.00 0.00 0.00 0.00 175.10 175.30 3fpt s TYR 85 N -2.44 1.77 -0.22 0.00 1.13 -1.08 -1.24 117.35 115.27 3fpt s TYR 85 Ca 0.42 -1.29 -0.09 0.00 -1.41 0.00 0.00 57.07 54.70 3fpt s TYR 85 Cb -0.02 -1.10 -0.04 0.00 -1.10 0.00 0.00 41.96 39.69 3fpt s TYR 85 CO 0.25 -0.34 0.11 0.50 -2.51 0.00 0.00 175.55 173.56 3fpt s ARG 86 N -3.72 3.99 0.54 -3.49 3.52 -1.26 -0.95 118.95 117.58 3fpt s ARG 86 Ca 0.27 -0.32 -0.20 0.00 -0.13 0.00 0.00 55.73 55.35 3fpt s ARG 86 Cb 0.03 -3.38 -0.05 0.00 -1.56 0.00 0.00 34.95 29.99 3fpt s ARG 86 CO 0.16 0.13 1.18 1.03 -0.81 0.00 0.00 175.30 176.98 3fpt s ARG 87 N 0.82 3.30 -0.07 5.12 0.52 -1.26 -1.74 118.95 125.63 3fpt s ARG 87 Ca 0.06 1.76 -0.30 0.00 -0.52 0.00 0.00 55.73 56.73 3fpt s ARG 87 Cb -0.13 -2.08 -0.05 0.00 0.52 0.00 0.00 34.95 33.21 3fpt s ARG 87 CO 0.02 -0.92 1.54 0.54 0.02 0.00 0.00 175.30 176.50 3fpt s ASN 88 N -1.57 6.74 0.00 0.23 6.03 -1.26 -4.89 114.94 120.22 3fpt s ASN 88 Ca 0.72 2.11 0.27 0.00 -1.03 0.00 0.00 52.86 54.94 3fpt s ASN 88 Cb -0.28 -2.54 0.78 0.00 -3.03 0.00 0.00 41.25 36.18 3fpt s ASN 88 CO 0.32 -0.87 1.59 0.79 -2.03 0.00 0.00 177.10 176.90