#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pns n SER 17 N 0.00 -4.11 -2.72 3.54 2.88 -1.26 -4.97 113.62 106.98 1pns n SER 17 Ca 0.00 -0.35 -0.28 0.00 -1.33 0.00 0.00 58.87 56.91 1pns n SER 17 Cb 0.00 -3.34 -0.01 0.00 -0.75 0.00 0.00 64.21 60.10 1pns n SER 17 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1pns n ARG 18 N -3.23 3.39 -0.07 -1.46 5.12 -1.26 -4.76 116.66 114.39 1pns n ARG 18 Ca -0.04 -4.62 -0.22 0.00 -1.93 0.00 0.00 57.85 51.04 1pns n ARG 18 Cb 0.55 -2.25 -0.12 0.00 -1.16 0.00 0.00 32.46 29.48 1pns n ARG 18 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1pns n LYS 19 N -0.38 0.64 0.00 5.56 5.02 -1.26 -5.04 118.16 122.70 1pns n LYS 19 Ca 0.37 0.41 0.00 0.00 -2.02 0.00 0.00 58.31 57.07 1pns n LYS 19 Cb 0.52 -1.70 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 1pns n LYS 19 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1pns n ALA 20 N -3.34 0.00 -2.46 7.82 0.00 -1.26 -5.13 120.51 116.14 1pns n ALA 20 Ca -0.35 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.66 1pns n ALA 20 Cb 0.85 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.27 1pns n ALA 20 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1pns s LYS 21 N -0.24 4.33 0.50 0.00 3.01 -1.26 -4.90 119.74 121.18 1pns s LYS 21 Ca 0.00 1.66 0.27 0.00 -1.01 0.00 0.00 55.97 56.90 1pns s LYS 21 Cb 0.00 -3.60 1.36 0.00 -1.01 0.00 0.00 37.83 34.59 1pns s LYS 21 CO 0.00 -0.50 1.88 0.28 0.51 0.00 0.00 175.35 177.52 1pns h VAL 22 N 5.10 0.59 0.46 3.17 2.07 -1.50 -1.75 116.25 124.39 1pns h VAL 22 Ca -0.33 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 1pns h VAL 22 Cb 1.15 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1pns h VAL 22 CO 0.90 0.02 -0.22 0.50 0.02 0.00 0.00 177.57 178.79 1pns h LYS 23 N 0.12 -0.59 -0.43 1.57 3.64 -1.79 -3.23 116.57 115.86 1pns h LYS 23 Ca 0.44 0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.91 1pns h LYS 23 Cb 1.55 0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 33.46 1pns h LYS 23 CO -0.06 -0.30 0.18 0.00 -2.27 0.00 0.00 179.45 177.00 1pns h ALA 24 N -0.45 0.53 0.00 5.00 0.00 -1.67 -2.98 119.26 119.69 1pns h ALA 24 Ca -0.06 0.04 -0.51 0.00 0.00 0.00 0.00 54.91 54.38 1pns h ALA 24 Cb 0.57 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.36 1pns h ALA 24 CO 0.10 -0.19 2.96 2.41 0.00 0.00 0.00 179.25 184.54 1pns n THR 25 N -4.96 2.96 0.00 0.00 -1.04 -0.75 -4.75 114.28 105.74 1pns n THR 25 Ca 0.03 -1.88 0.00 0.00 -2.04 0.00 0.00 64.05 60.16 1pns n THR 25 Cb 0.14 -2.32 0.00 0.00 -1.82 0.00 0.00 70.33 66.33 1pns n THR 25 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1pns n LEU 26 N 4.48 0.00 0.00 -4.42 7.94 -1.13 -4.90 117.00 118.97 1pns n LEU 26 Ca 0.55 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.45 1pns n LEU 26 Cb 0.20 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.15 1pns n LEU 26 CO 0.79 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.68 1pns n GLY 27 N -0.26 1.47 3.47 -3.96 0.00 -1.26 -5.03 105.19 99.62 1pns n GLY 27 Ca 0.00 -1.99 -0.43 0.00 0.00 0.00 0.00 46.02 43.60 1pns n GLY 27 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pns s GLU 28 N 1.66 3.14 0.26 1.61 8.01 -1.26 -5.02 118.70 127.10 1pns s GLU 28 Ca 0.00 -0.73 0.09 0.00 0.01 0.00 0.00 54.97 54.34 1pns s GLU 28 Cb 0.00 -4.20 -0.04 0.00 -4.31 0.00 0.00 34.13 25.57 1pns s GLU 28 CO 0.00 -1.80 0.03 -0.59 0.01 0.00 0.00 175.26 172.91 1pns s PHE 29 N 4.14 2.77 -0.82 1.61 -0.12 -1.26 -5.07 117.98 119.24 1pns s PHE 29 Ca 0.24 -0.20 -0.20 0.00 -0.05 0.00 0.00 56.93 56.72 1pns s PHE 29 Cb -0.16 -1.24 0.12 0.00 -0.63 0.00 0.00 43.02 41.11 1pns s PHE 29 CO 0.11 0.60 1.02 0.34 -0.05 0.00 0.00 175.22 177.25 1pns s ASP 30 N -3.63 6.47 0.42 1.98 2.15 -1.26 -4.88 116.67 117.91 1pns s ASP 30 Ca 0.31 -1.73 0.12 0.00 0.43 0.00 0.00 52.55 51.69 1pns s ASP 30 Cb -0.07 -2.39 0.68 0.00 -0.30 0.00 0.00 42.92 40.85 1pns s ASP 30 CO 0.20 -1.15 1.28 -0.07 -0.17 0.00 0.00 175.17 175.27 1pns h LEU 31 N 10.50 0.00 0.00 -1.34 3.38 -1.97 0.21 115.31 126.09 1pns h LEU 31 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1pns h LEU 31 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1pns h LEU 31 CO 1.11 0.00 -0.70 -0.09 0.09 0.00 0.00 178.44 178.86 1pns h ARG 32 N 0.00 0.00 -6.35 1.13 2.43 -1.89 -3.41 114.38 106.29 1pns h ARG 32 Ca 0.00 0.00 -0.57 0.00 -0.81 0.00 0.00 59.98 58.60 1pns h ARG 32 Cb 0.92 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.43 1pns h ARG 32 CO 0.00 0.00 1.19 0.34 -1.51 0.00 0.00 179.97 179.99 1pns s ASP 33 N -5.53 6.10 -0.09 -3.80 2.15 0.74 -4.90 116.67 111.33 1pns s ASP 33 Ca 0.02 1.22 0.08 0.00 0.43 0.00 0.00 52.55 54.29 1pns s ASP 33 Cb 0.08 -2.53 0.39 0.00 -0.30 0.00 0.00 42.92 40.57 1pns s ASP 33 CO 0.75 -1.56 1.15 0.00 -0.17 0.00 0.00 175.17 175.34 1pns n TYR 34 N 9.57 0.93 -0.08 -5.34 0.18 -1.26 -3.95 117.16 117.20 1pns n TYR 34 Ca 0.20 -0.34 0.00 0.00 1.88 0.00 0.00 57.90 59.65 1pns n TYR 34 Cb 0.47 -0.24 0.00 0.00 -0.38 0.00 0.00 39.34 39.18 1pns n TYR 34 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 1pns n ARG 35 N 0.36 3.25 -1.23 -3.48 1.74 -1.26 -4.23 116.66 111.81 1pns n ARG 35 Ca 0.13 -0.14 -0.36 0.00 -0.77 0.00 0.00 57.85 56.72 1pns n ARG 35 Cb 0.64 -0.56 -0.02 0.00 -1.02 0.00 0.00 32.46 31.49 1pns n ARG 35 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1pns n ASN 36 N -0.50 6.27 -0.38 0.55 4.05 -1.25 -4.63 115.26 119.37 1pns n ASN 36 Ca 0.00 -2.57 0.32 0.00 0.45 0.00 0.00 54.58 52.77 1pns n ASN 36 Cb 0.02 -1.42 0.62 0.00 1.23 0.00 0.00 39.78 40.23 1pns n ASN 36 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 177.26 174.79 1pns h VAL 37 N 3.44 0.35 0.10 3.44 2.07 -1.92 0.16 116.25 123.89 1pns h VAL 37 Ca 0.68 -0.07 0.02 0.00 0.82 0.00 0.00 66.70 68.16 1pns h VAL 37 Cb 0.36 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 1pns h VAL 37 CO 1.74 0.03 -0.35 -0.33 0.02 0.00 0.00 177.57 178.69 1pns h GLU 38 N 0.19 -0.54 0.04 1.57 4.39 -2.00 -2.29 114.58 115.94 1pns h GLU 38 Ca 0.67 0.04 -0.13 0.00 0.34 0.00 0.00 59.36 60.28 1pns h GLU 38 Cb 2.12 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 30.89 1pns h GLU 38 CO -0.25 -0.36 -0.67 -0.24 -1.16 0.00 0.00 179.01 176.33 1pns h VAL 39 N -0.56 1.40 -0.60 3.13 3.04 -1.20 -3.38 116.25 118.07 1pns h VAL 39 Ca 0.04 -2.33 0.12 0.00 -1.01 0.00 0.00 66.70 63.51 1pns h VAL 39 Cb 0.60 2.94 -0.12 0.00 -2.01 0.00 0.00 31.29 32.70 1pns h VAL 39 CO -0.22 0.56 -0.22 -0.07 -1.01 0.00 0.00 177.57 176.61 1pns h LEU 40 N -0.81 -0.77 -1.11 3.16 3.38 -0.95 0.27 115.31 118.47 1pns h LEU 40 Ca -0.16 0.20 0.06 0.00 0.09 0.00 0.00 57.88 58.07 1pns h LEU 40 Cb 1.28 0.45 -0.01 0.00 0.09 0.00 0.00 40.66 42.47 1pns h LEU 40 CO -0.03 -0.25 0.74 0.50 0.09 0.00 0.00 178.44 179.49 1pns h LYS 41 N -0.07 0.00 -0.04 1.13 3.64 -1.58 0.16 116.57 119.81 1pns h LYS 41 Ca 0.28 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.57 1pns h LYS 41 Cb 0.50 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 1pns h LYS 41 CO -0.65 0.00 -0.36 0.00 -2.27 0.00 0.00 179.45 176.17 1pns h ARG 42 N 0.00 0.08 -0.56 1.90 2.47 -0.65 -3.07 114.38 114.55 1pns h ARG 42 Ca 0.11 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.79 1pns h ARG 42 Cb 1.58 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.89 1pns h ARG 42 CO -0.00 0.44 0.00 1.19 0.56 0.00 0.00 179.97 182.16 1pns n PHE 43 N -4.09 0.79 -4.15 3.04 3.01 0.54 -4.90 117.46 111.71 1pns n PHE 43 Ca -0.02 -0.32 -0.35 0.00 1.01 0.00 0.00 57.45 57.78 1pns n PHE 43 Cb 0.42 -0.14 -0.08 0.00 -0.01 0.00 0.00 39.48 39.67 1pns n PHE 43 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1pns s LEU 44 N -1.21 3.90 0.00 4.37 1.43 -1.16 -1.33 118.68 124.68 1pns s LEU 44 Ca 0.28 0.22 -0.08 0.00 -1.03 0.00 0.00 54.13 53.52 1pns s LEU 44 Cb 0.18 -2.07 0.12 0.00 0.03 0.00 0.00 46.19 44.45 1pns s LEU 44 CO 0.14 0.34 0.33 -1.54 0.23 0.00 0.00 176.35 175.84 1pns n SER 45 N 1.69 -2.30 -0.19 2.29 3.41 0.28 -4.72 113.62 114.09 1pns n SER 45 Ca -0.16 -0.45 0.00 0.00 -0.26 0.00 0.00 58.87 58.00 1pns n SER 45 Cb 0.54 -0.34 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 1pns n SER 45 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1pns n GLU 46 N -3.10 0.64 -4.20 4.33 4.71 -1.26 -4.54 120.64 117.22 1pns n GLU 46 Ca 0.05 0.00 -0.13 0.00 -0.01 0.00 0.00 57.16 57.07 1pns n GLU 46 Cb 0.21 -1.12 -0.09 0.00 -1.01 0.00 0.00 31.44 29.42 1pns n GLU 46 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 1pns s THR 47 N -1.63 0.00 -1.69 2.62 2.01 -1.26 -4.75 115.64 110.94 1pns s THR 47 Ca 0.00 -1.95 0.04 0.00 0.31 0.00 0.00 61.69 60.09 1pns s THR 47 Cb 0.00 -2.48 0.10 0.00 0.01 0.00 0.00 72.50 70.13 1pns s THR 47 CO 0.00 0.00 0.87 0.61 -0.69 0.00 0.00 174.62 175.41 1pns n GLY 48 N -0.34 -0.30 3.77 4.40 0.00 -1.26 -4.73 105.19 106.73 1pns n GLY 48 Ca 0.03 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1pns n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pns s LYS 49 N -2.31 4.06 -0.03 1.61 1.02 -1.26 -4.71 119.74 118.12 1pns s LYS 49 Ca 0.05 2.41 -0.29 0.00 0.02 0.00 0.00 55.97 58.17 1pns s LYS 49 Cb 0.03 -2.90 -0.03 0.00 -0.52 0.00 0.00 37.83 34.41 1pns s LYS 49 CO 0.06 -0.51 0.93 0.42 -0.92 0.00 0.00 175.35 175.33 1pns s ILE 50 N -1.16 4.89 0.55 2.17 1.01 -1.26 0.10 121.20 127.50 1pns s ILE 50 Ca 0.54 1.95 -0.19 0.00 0.00 0.00 0.00 60.65 62.95 1pns s ILE 50 Cb -0.43 -4.27 -0.05 0.00 0.01 0.00 0.00 42.46 37.71 1pns s ILE 50 CO 0.58 0.15 1.11 -0.76 0.00 0.00 0.00 174.94 176.02 1pns s LEU 51 N 1.11 3.70 0.78 2.97 1.43 -0.44 -4.83 118.68 123.40 1pns s LEU 51 Ca 0.49 2.09 -0.11 0.00 -1.03 0.00 0.00 54.13 55.57 1pns s LEU 51 Cb -0.20 -4.57 0.06 0.00 0.03 0.00 0.00 46.19 41.51 1pns s LEU 51 CO 0.25 -1.19 1.08 -2.84 0.23 0.00 0.00 176.35 173.88 1pns s PRO 52 N -3.44 2.24 0.53 1.29 0.02 -1.26 -4.69 135.00 129.70 1pns s PRO 52 Ca 0.70 0.90 0.19 0.00 0.02 0.00 0.00 61.00 62.81 1pns s PRO 52 Cb -0.22 -1.92 1.39 0.00 0.02 0.00 0.00 34.50 33.77 1pns s PRO 52 CO 0.28 -1.58 2.16 0.00 -0.33 0.00 0.00 177.00 177.54 1pns h ARG 53 N -1.07 0.00 -1.00 5.54 3.08 -1.95 0.11 114.38 119.09 1pns h ARG 53 Ca -0.46 0.00 0.23 0.00 0.07 0.00 0.00 59.98 59.82 1pns h ARG 53 Cb 1.24 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 31.20 1pns h ARG 53 CO 0.56 0.01 0.63 0.00 -1.07 0.00 0.00 179.97 180.10 1pns h ARG 54 N 0.00 0.53 0.00 0.04 3.08 -1.91 0.77 114.38 116.89 1pns h ARG 54 Ca -0.00 -0.03 -0.13 0.00 0.07 0.00 0.00 59.98 59.89 1pns h ARG 54 Cb 0.02 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 1pns h ARG 54 CO 0.00 0.35 -1.87 0.54 -1.07 0.00 0.00 179.97 177.92 1pns n ARG 55 N -4.69 1.00 0.03 0.04 5.12 -0.36 -4.40 116.66 113.41 1pns n ARG 55 Ca 0.24 -0.08 0.13 0.00 -1.93 0.00 0.00 57.85 56.21 1pns n ARG 55 Cb 0.73 -1.38 0.44 0.00 -1.16 0.00 0.00 32.46 31.09 1pns n ARG 55 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1pns n THR 56 N -2.29 0.19 -0.84 0.55 -2.24 0.24 -1.76 114.28 108.14 1pns n THR 56 Ca -0.13 -0.11 -0.00 0.00 -2.27 0.00 0.00 64.05 61.54 1pns n THR 56 Cb 0.69 -0.34 -0.00 0.00 -2.10 0.00 0.00 70.33 68.58 1pns n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pns n GLY 57 N 1.43 0.01 3.94 3.38 0.00 0.23 -2.87 105.19 111.32 1pns n GLY 57 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 1pns n GLY 57 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pns s LEU 58 N -0.03 2.77 0.43 0.99 1.43 -1.26 -4.82 118.68 118.18 1pns s LEU 58 Ca 0.00 0.18 0.08 0.00 -1.03 0.00 0.00 54.13 53.36 1pns s LEU 58 Cb 0.00 -2.41 -0.01 0.00 0.03 0.00 0.00 46.19 43.80 1pns s LEU 58 CO 0.00 -2.33 0.43 -0.94 0.23 0.00 0.00 176.35 173.75 1pns s SER 59 N -4.79 5.17 0.20 2.29 1.04 -1.26 -4.82 113.70 111.52 1pns s SER 59 Ca 0.70 -0.70 -0.14 0.00 0.48 0.00 0.00 55.95 56.29 1pns s SER 59 Cb -0.06 -0.53 0.21 0.00 0.10 0.00 0.00 66.02 65.75 1pns s SER 59 CO 0.50 -0.72 1.65 1.23 0.98 0.00 0.00 173.24 176.88 1pns h GLY 60 N 0.91 0.45 0.55 7.32 0.00 -1.98 0.49 103.07 110.81 1pns h GLY 60 Ca -0.41 0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 1pns h GLY 60 CO 0.54 -0.20 -0.04 1.70 0.00 0.00 0.00 176.54 178.54 1pns h LYS 61 N 0.03 -0.10 0.31 4.80 3.64 -1.99 -1.93 116.57 121.33 1pns h LYS 61 Ca 0.27 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 1pns h LYS 61 Cb 0.42 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.24 1pns h LYS 61 CO -0.55 0.32 -0.42 0.93 -2.27 0.00 0.00 179.45 177.46 1pns h GLU 62 N -0.55 -0.75 -0.68 1.90 5.08 -1.85 -1.90 114.58 115.83 1pns h GLU 62 Ca -0.01 0.05 0.20 0.00 -1.00 0.00 0.00 59.36 58.60 1pns h GLU 62 Cb 0.47 0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.86 1pns h GLU 62 CO 0.02 -0.50 0.54 0.37 -1.00 0.00 0.00 179.01 178.43 1pns h GLN 63 N -0.78 0.00 0.00 2.33 5.75 -0.08 0.19 115.11 122.51 1pns h GLN 63 Ca -0.02 0.00 -0.13 0.00 -0.15 0.00 0.00 58.65 58.35 1pns h GLN 63 Cb 0.73 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.26 1pns h GLN 63 CO -0.13 0.00 -0.64 -0.09 -2.65 0.00 0.00 178.83 175.32 1pns h ARG 64 N 0.00 0.00 0.05 1.69 2.43 -0.55 -3.08 114.38 114.92 1pns h ARG 64 Ca 0.32 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 59.24 1pns h ARG 64 Cb 1.39 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.92 1pns h ARG 64 CO -0.00 0.64 -1.28 0.82 -1.51 0.00 0.00 179.97 178.64 1pns h ILE 65 N 0.00 1.41 0.34 1.20 2.04 -0.25 -3.33 117.51 118.92 1pns h ILE 65 Ca -0.01 -3.11 -0.01 0.00 1.00 0.00 0.00 64.86 62.74 1pns h ILE 65 Cb 1.36 2.78 -0.01 0.00 -0.74 0.00 0.00 36.82 40.21 1pns h ILE 65 CO 0.08 0.85 -0.23 0.25 0.00 0.00 0.00 178.15 179.10 1pns h LEU 66 N 0.03 -0.59 -0.81 1.44 5.85 -1.25 -2.70 115.31 117.28 1pns h LEU 66 Ca -0.13 0.04 0.15 0.00 0.84 0.00 0.00 57.88 58.78 1pns h LEU 66 Cb 1.90 0.18 -0.15 0.00 0.37 0.00 0.00 40.66 42.97 1pns h LEU 66 CO 0.14 -0.36 -0.29 0.00 -0.34 0.00 0.00 178.44 177.58 1pns h ALA 67 N 0.05 0.28 -0.93 1.25 0.00 -1.64 0.53 119.26 118.79 1pns h ALA 67 Ca -0.03 0.27 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1pns h ALA 67 Cb 0.48 0.78 -0.05 0.00 0.00 0.00 0.00 17.79 19.00 1pns h ALA 67 CO 0.02 -0.54 0.62 0.87 0.00 0.00 0.00 179.25 180.21 1pns h LYS 68 N -0.05 1.22 0.09 0.00 1.57 -1.65 0.94 116.57 118.69 1pns h LYS 68 Ca 0.34 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 59.04 1pns h LYS 68 Cb 0.59 -0.28 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1pns h LYS 68 CO -0.85 0.81 -0.04 1.15 -0.57 0.00 0.00 179.45 179.95 1pns h THR 69 N 1.26 1.08 0.00 -0.16 2.02 -0.23 0.81 112.91 117.69 1pns h THR 69 Ca 0.34 -0.62 -0.01 0.00 0.77 0.00 0.00 66.41 66.89 1pns h THR 69 Cb -0.15 1.48 -0.00 0.00 -1.74 0.00 0.00 68.15 67.75 1pns h THR 69 CO -0.07 0.15 -0.04 0.40 0.37 0.00 0.00 175.52 176.32 1pns h ILE 70 N -0.40 0.98 0.07 3.11 2.04 0.13 -0.05 117.51 123.39 1pns h ILE 70 Ca -0.01 -0.15 -0.21 0.00 1.00 0.00 0.00 64.86 65.49 1pns h ILE 70 Cb 0.34 1.08 0.02 0.00 -0.74 0.00 0.00 36.82 37.53 1pns h ILE 70 CO 0.02 0.04 -0.85 0.11 0.00 0.00 0.00 178.15 177.47 1pns h LYS 71 N 0.00 0.45 -0.55 2.37 1.57 -0.61 -2.69 116.57 117.10 1pns h LYS 71 Ca -0.00 -0.58 0.04 0.00 -1.87 0.00 0.00 60.65 58.24 1pns h LYS 71 Cb 0.08 0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 1pns h LYS 71 CO 0.01 1.23 0.30 0.00 -0.57 0.00 0.00 179.45 180.41 1pns h ARG 72 N -0.06 0.56 0.00 3.15 3.08 -0.27 -0.78 114.38 120.06 1pns h ARG 72 Ca -0.13 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.87 1pns h ARG 72 Cb 1.58 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 31.50 1pns h ARG 72 CO 0.16 0.37 -0.10 0.00 -1.07 0.00 0.00 179.97 179.34 1pns h ALA 73 N 1.28 1.51 -0.10 0.04 0.00 -1.06 -2.51 119.26 118.43 1pns h ALA 73 Ca 0.24 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 1pns h ALA 73 Cb 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1pns h ALA 73 CO -0.15 0.12 -0.17 0.00 0.00 0.00 0.00 179.25 179.05 1pns h ARG 74 N 0.00 0.29 -0.03 0.00 3.08 -0.80 -1.63 114.38 115.29 1pns h ARG 74 Ca -0.00 -0.18 0.03 0.00 0.07 0.00 0.00 59.98 59.90 1pns h ARG 74 Cb 0.22 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 1pns h ARG 74 CO 0.01 0.76 -0.13 0.82 -1.07 0.00 0.00 179.97 180.36 1pns h ILE 75 N -0.16 0.67 0.00 2.04 2.04 -1.03 -0.97 117.51 120.11 1pns h ILE 75 Ca 0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.87 1pns h ILE 75 Cb 0.74 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 1pns h ILE 75 CO 0.04 0.00 0.11 0.18 0.00 0.00 0.00 178.15 178.48 1pns n LEU 76 N -5.26 0.45 0.00 1.44 4.77 -1.02 -4.80 117.00 112.58 1pns n LEU 76 Ca -0.05 0.67 0.00 0.00 -0.03 0.00 0.00 56.01 56.60 1pns n LEU 76 Cb 0.18 -0.69 0.00 0.00 -2.33 0.00 0.00 43.42 40.58 1pns n LEU 76 CO 0.26 -0.82 0.00 0.61 -1.33 0.00 0.00 177.39 176.11 1pns n GLY 77 N -1.30 0.72 0.20 -0.72 0.00 -0.37 -4.94 105.19 98.78 1pns n GLY 77 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 1pns n GLY 77 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1pns h LEU 78 N 0.00 0.87 -9.14 0.99 3.38 -1.53 -3.45 115.31 106.42 1pns h LEU 78 Ca 0.00 -0.63 -0.67 0.00 0.09 0.00 0.00 57.88 56.66 1pns h LEU 78 Cb 0.00 -0.26 -0.18 0.00 0.09 0.00 0.00 40.66 40.31 1pns h LEU 78 CO 0.00 1.43 -0.76 -0.76 0.09 0.00 0.00 178.44 178.44 1pns s LEU 79 N -8.19 2.90 0.81 1.67 1.43 -0.72 -4.99 118.68 111.59 1pns s LEU 79 Ca -0.09 -0.37 -0.12 0.00 -1.03 0.00 0.00 54.13 52.53 1pns s LEU 79 Cb 0.08 -1.70 0.08 0.00 0.03 0.00 0.00 46.19 44.67 1pns s LEU 79 CO 0.91 0.22 1.10 -2.16 0.23 0.00 0.00 176.35 176.65 1pns s PRO 80 N -1.80 1.97 -0.22 1.29 0.04 -1.26 -4.11 135.00 130.91 1pns s PRO 80 Ca 0.18 0.60 0.10 0.00 0.04 0.00 0.00 61.00 61.92 1pns s PRO 80 Cb -0.11 -1.91 -0.20 0.00 0.04 0.00 0.00 34.50 32.32 1pns s PRO 80 CO 0.09 -1.69 -0.08 1.19 0.04 0.00 0.00 177.00 176.56 1pns n PHE 81 N -3.47 0.00 -3.63 0.56 3.01 -1.26 -4.78 117.46 107.89 1pns n PHE 81 Ca 0.07 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.42 1pns n PHE 81 Cb 0.57 -0.97 -0.07 0.00 -0.01 0.00 0.00 39.48 39.00 1pns n PHE 81 CO 0.00 0.00 0.00 -0.08 1.01 0.00 0.00 176.76 177.69 1pns s THR 82 N -2.49 0.00 0.24 4.37 -1.32 -1.26 -4.16 115.64 111.02 1pns s THR 82 Ca -0.22 0.00 0.12 0.00 -1.21 0.00 0.00 61.69 60.38 1pns s THR 82 Cb 0.07 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 70.01 1pns s THR 82 CO 0.69 0.00 -0.22 -1.61 -2.21 0.00 0.00 174.62 171.27 1pns s GLU 83 N 0.23 1.61 0.44 7.08 0.41 -1.26 -4.60 118.70 122.61 1pns s GLU 83 Ca 0.02 -1.66 -0.21 0.00 -0.41 0.00 0.00 54.97 52.70 1pns s GLU 83 Cb -0.05 -1.80 -0.10 0.00 -1.78 0.00 0.00 34.13 30.40 1pns s GLU 83 CO -0.03 0.36 0.98 0.15 -0.49 0.00 0.00 175.26 176.23 1pns s LYS 84 N -3.14 4.12 -0.06 1.61 1.02 -1.26 -4.65 119.74 117.37 1pns s LYS 84 Ca 0.26 1.23 -0.17 0.00 0.02 0.00 0.00 55.97 57.31 1pns s LYS 84 Cb -0.06 -2.21 -0.05 0.00 -0.52 0.00 0.00 37.83 34.99 1pns s LYS 84 CO 0.13 -0.14 0.45 -1.17 -0.92 0.00 0.00 175.35 173.70 1pns s LEU 85 N -3.18 4.36 -0.15 3.17 2.96 -1.26 -4.91 118.68 119.68 1pns s LEU 85 Ca 0.63 0.88 -0.03 0.00 -0.22 0.00 0.00 54.13 55.39 1pns s LEU 85 Cb -0.12 -2.65 -0.03 0.00 0.50 0.00 0.00 46.19 43.88 1pns s LEU 85 CO 0.16 0.14 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.61 1pns s VAL 86 N -0.12 3.93 0.00 1.68 1.01 -1.26 -4.88 120.40 120.76 1pns s VAL 86 Ca 0.25 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 61.88 1pns s VAL 86 Cb -0.16 -2.71 0.00 0.00 0.00 0.00 0.00 36.38 33.51 1pns s VAL 86 CO 0.12 0.51 0.00 0.54 0.00 0.00 0.00 175.10 176.26 1pns n ARG 87 N 3.37 0.00 -0.56 2.72 5.12 -1.26 -5.26 116.66 120.79 1pns n ARG 87 Ca -0.17 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.75 1pns n ARG 87 Cb 0.53 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.83 1pns n ARG 87 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87