#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d6t s LEU 2 N 0.00 -0.04 0.00 3.17 2.34 -1.26 -5.19 118.68 117.70 1d6t s LEU 2 Ca 0.00 -0.06 0.00 0.00 0.06 0.00 0.00 54.13 54.13 1d6t s LEU 2 Cb 0.00 1.22 0.00 0.00 -0.56 0.00 0.00 46.19 46.85 1d6t s LEU 2 CO 0.00 -0.17 0.00 -0.11 -1.06 0.00 0.00 176.35 175.01 1d6t n LEU 3 N -0.41 0.00 0.00 1.48 -0.00 -1.26 -4.91 117.00 111.91 1d6t n LEU 3 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.94 1d6t n LEU 3 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.04 1d6t n LEU 3 CO 0.11 0.00 0.00 1.21 -0.00 0.00 0.00 177.39 178.71 1d6t n GLU 4 N 0.00 0.00 0.00 1.96 2.13 -1.26 -2.21 120.64 121.26 1d6t n GLU 4 Ca 0.00 0.00 0.12 0.00 0.66 0.00 0.00 57.16 57.94 1d6t n GLU 4 Cb 0.00 0.00 0.68 0.00 0.27 0.00 0.00 31.44 32.39 1d6t n GLU 4 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 1d6t n LYS 5 N 0.00 0.51 0.00 5.31 2.85 -1.26 -3.21 118.16 122.36 1d6t n LYS 5 Ca 0.00 0.03 -0.13 0.00 -1.05 0.00 0.00 58.31 57.17 1d6t n LYS 5 Cb 0.00 -1.50 -0.09 0.00 -0.65 0.00 0.00 35.03 32.79 1d6t n LYS 5 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1d6t h ALA 6 N 3.33 -0.01 -0.98 0.58 0.00 -1.80 -3.24 119.26 117.13 1d6t h ALA 6 Ca 0.00 -0.19 -0.63 0.00 0.00 0.00 0.00 54.91 54.09 1d6t h ALA 6 Cb 0.16 0.01 -0.36 0.00 0.00 0.00 0.00 17.79 17.59 1d6t h ALA 6 CO 0.00 -0.32 0.02 2.48 0.00 0.00 0.00 179.25 181.43 1d6t n TYR 7 N -4.91 3.05 -1.62 0.00 4.11 -1.20 -5.03 117.16 111.56 1d6t n TYR 7 Ca -0.08 -2.65 -0.29 0.00 -0.00 0.00 0.00 57.90 54.88 1d6t n TYR 7 Cb 0.20 -0.80 0.15 0.00 -0.00 0.00 0.00 39.34 38.90 1d6t n TYR 7 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.86 175.88 1d6t s ARG 8 N -3.73 0.86 -0.59 -3.48 3.03 -1.21 -3.90 118.95 109.92 1d6t s ARG 8 Ca 0.55 0.07 0.06 0.00 2.03 0.00 0.00 55.73 58.44 1d6t s ARG 8 Cb 0.45 -1.83 0.25 0.00 -1.03 0.00 0.00 34.95 32.78 1d6t s ARG 8 CO -0.07 -2.34 0.68 -0.89 -1.13 0.00 0.00 175.30 171.55 1d6t n ILE 9 N -3.82 1.65 0.01 4.99 2.08 -1.26 -4.78 119.36 118.22 1d6t n ILE 9 Ca 0.09 -4.93 0.09 0.00 0.56 0.00 0.00 62.75 58.56 1d6t n ILE 9 Cb 0.60 -2.07 -0.14 0.00 -0.75 0.00 0.00 39.64 37.28 1d6t n ILE 9 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 1d6t n LYS 10 N 1.04 0.54 -2.99 0.38 5.02 -1.26 -4.88 118.16 116.00 1d6t n LYS 10 Ca 0.28 -0.16 -0.42 0.00 -2.02 0.00 0.00 58.31 55.99 1d6t n LYS 10 Cb 0.43 -1.41 -0.05 0.00 -0.02 0.00 0.00 35.03 33.98 1d6t n LYS 10 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1d6t s LYS 11 N -3.20 3.85 0.32 1.97 2.20 -1.26 -4.92 119.74 118.69 1d6t s LYS 11 Ca -0.06 0.39 0.07 0.00 -0.36 0.00 0.00 55.97 56.01 1d6t s LYS 11 Cb 0.11 -3.77 0.90 0.00 -1.51 0.00 0.00 37.83 33.57 1d6t s LYS 11 CO 0.73 -0.73 1.61 -0.97 -0.36 0.00 0.00 175.35 175.63 1d6t h ASN 12 N 8.29 -0.03 -0.83 1.43 -0.73 -2.00 1.64 115.58 123.35 1d6t h ASN 12 Ca -0.25 0.24 0.18 0.00 1.87 0.00 0.00 56.30 58.33 1d6t h ASN 12 Cb 1.10 0.32 -0.11 0.00 0.27 0.00 0.00 38.32 39.91 1d6t h ASN 12 CO 0.88 -0.28 0.35 0.00 -0.37 0.00 0.00 177.43 178.01 1d6t h ALA 13 N 1.90 1.25 -0.20 1.57 0.00 -1.96 1.65 119.26 123.47 1d6t h ALA 13 Ca 0.65 0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.76 1d6t h ALA 13 Cb 1.46 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.35 1d6t h ALA 13 CO -0.76 -0.25 0.19 -0.44 0.00 0.00 0.00 179.25 177.99 1d6t h ASP 14 N 0.45 0.00 0.13 0.00 5.19 0.20 1.59 116.42 123.98 1d6t h ASP 14 Ca 0.49 0.00 -0.36 0.00 -0.62 0.00 0.00 57.03 56.53 1d6t h ASP 14 Cb 0.82 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 40.28 1d6t h ASP 14 CO -0.46 0.00 -2.15 0.49 -3.12 0.00 0.00 179.24 174.00 1d6t n PHE 15 N -3.99 0.68 -0.04 4.55 3.72 0.46 -4.16 117.46 118.68 1d6t n PHE 15 Ca 0.02 0.17 -0.13 0.00 -0.05 0.00 0.00 57.45 57.46 1d6t n PHE 15 Cb 0.33 -1.10 -0.00 0.00 -0.94 0.00 0.00 39.48 37.76 1d6t n PHE 15 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 1d6t h GLN 16 N 0.03 0.73 -0.06 -1.08 4.20 0.27 -2.26 115.11 116.95 1d6t h GLN 16 Ca -0.47 -0.48 0.02 0.00 0.06 0.00 0.00 58.65 57.78 1d6t h GLN 16 Cb 2.02 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 29.86 1d6t h GLN 16 CO 0.03 1.10 0.12 -0.09 -0.67 0.00 0.00 178.83 179.32 1d6t h ARG 17 N 0.55 0.00 0.00 1.46 2.43 0.21 0.65 114.38 119.68 1d6t h ARG 17 Ca 0.00 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 1d6t h ARG 17 Cb 1.17 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.70 1d6t h ARG 17 CO 0.12 0.00 -0.67 0.82 -1.51 0.00 0.00 179.97 178.73 1d6t h ILE 18 N 0.00 0.66 0.00 1.20 1.08 -1.65 -3.34 117.51 115.46 1d6t h ILE 18 Ca 0.03 -1.70 0.00 0.00 -0.39 0.00 0.00 64.86 62.80 1d6t h ILE 18 Cb 0.27 1.45 0.00 0.00 -3.07 0.00 0.00 36.82 35.47 1d6t h ILE 18 CO -0.00 0.22 0.00 -1.22 -0.69 0.00 0.00 178.15 176.46 1d6t n TYR 19 N -4.56 0.45 0.00 1.37 4.02 -0.88 0.18 117.16 117.75 1d6t n TYR 19 Ca -0.17 0.21 0.00 0.00 -0.01 0.00 0.00 57.90 57.93 1d6t n TYR 19 Cb 0.43 -0.84 0.00 0.00 -0.02 0.00 0.00 39.34 38.92 1d6t n TYR 19 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 1d6t n LYS 20 N -1.94 0.00 -0.06 -0.72 3.00 0.22 -4.58 118.16 114.08 1d6t n LYS 20 Ca 0.01 0.01 0.02 0.00 -0.00 0.00 0.00 58.31 58.34 1d6t n LYS 20 Cb 0.10 -0.87 0.02 0.00 0.00 0.00 0.00 35.03 34.29 1d6t n LYS 20 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1d6t n LYS 21 N -0.37 1.62 -0.41 1.64 5.02 -1.24 -5.08 118.16 119.34 1d6t n LYS 21 Ca 0.00 -1.37 -0.29 0.00 -2.02 0.00 0.00 58.31 54.63 1d6t n LYS 21 Cb 0.00 -0.90 0.26 0.00 -0.02 0.00 0.00 35.03 34.37 1d6t n LYS 21 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1d6t n GLY 22 N -0.48 -2.81 3.10 0.72 0.00 0.13 -4.99 105.19 100.85 1d6t n GLY 22 Ca 0.03 -1.30 -0.33 0.00 0.00 0.00 0.00 46.02 44.41 1d6t n GLY 22 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1d6t s HIS 23 N -2.26 3.38 -0.03 1.61 2.46 0.20 -4.94 115.29 115.73 1d6t s HIS 23 Ca 0.65 -2.31 -0.13 0.00 0.47 0.00 0.00 55.06 53.74 1d6t s HIS 23 Cb -0.18 -2.28 -0.05 0.00 -0.13 0.00 0.00 32.58 29.93 1d6t s HIS 23 CO 0.61 -0.88 0.35 -1.54 -2.47 0.00 0.00 174.74 170.81 1d6t s SER 24 N 1.18 6.72 -0.07 9.88 1.04 -1.26 -2.06 113.70 129.12 1d6t s SER 24 Ca -0.03 0.85 0.01 0.00 0.48 0.00 0.00 55.95 57.27 1d6t s SER 24 Cb -0.20 -2.21 0.02 0.00 0.10 0.00 0.00 66.02 63.72 1d6t s SER 24 CO -0.04 0.34 -0.09 0.68 0.98 0.00 0.00 173.24 175.10 1d6t s VAL 25 N -1.02 0.96 -0.07 5.02 -7.23 0.66 -4.98 120.40 113.74 1d6t s VAL 25 Ca 0.22 -0.35 0.04 0.00 -1.81 0.00 0.00 61.98 60.08 1d6t s VAL 25 Cb -0.16 -0.92 -0.00 0.00 0.56 0.00 0.00 36.38 35.86 1d6t s VAL 25 CO 0.11 0.33 -0.22 0.00 -0.31 0.00 0.00 175.10 175.01 1d6t s ALA 26 N 0.93 1.94 0.00 1.32 0.00 -1.26 -0.42 121.76 124.28 1d6t s ALA 26 Ca -0.10 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 50.98 1d6t s ALA 26 Cb -0.15 -0.69 0.00 0.00 0.00 0.00 0.00 23.12 22.29 1d6t s ALA 26 CO 0.01 0.30 0.00 0.27 0.00 0.00 0.00 175.76 176.34 1d6t n ASN 27 N 3.32 0.00 0.02 0.00 6.94 -0.58 -4.97 115.26 119.99 1d6t n ASN 27 Ca -0.19 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.37 1d6t n ASN 27 Cb 0.52 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.94 1d6t n ASN 27 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1d6t n ARG 28 N -0.64 0.00 0.00 -3.83 5.12 -1.26 -4.89 116.66 111.15 1d6t n ARG 28 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1d6t n ARG 28 Cb 0.00 -0.44 0.00 0.00 -1.16 0.00 0.00 32.46 30.86 1d6t n ARG 28 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1d6t n GLN 29 N -3.16 0.60 -4.14 5.56 0.00 -1.26 -4.97 117.38 110.02 1d6t n GLN 29 Ca 0.00 -0.19 -0.32 0.00 0.00 0.00 0.00 57.00 56.48 1d6t n GLN 29 Cb 0.27 -0.63 -0.07 0.00 0.00 0.00 0.00 30.24 29.81 1d6t n GLN 29 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.06 177.18 1d6t s PHE 30 N -0.14 3.21 -0.23 2.61 5.36 -1.26 0.10 117.98 127.63 1d6t s PHE 30 Ca 0.00 0.15 -0.04 0.00 -0.96 0.00 0.00 56.93 56.08 1d6t s PHE 30 Cb 0.00 -1.70 0.08 0.00 -0.34 0.00 0.00 43.02 41.06 1d6t s PHE 30 CO 0.00 0.52 0.11 0.54 -1.46 0.00 0.00 175.22 174.93 1d6t s VAL 31 N -1.20 -0.04 -0.17 3.12 0.11 0.54 -1.53 120.40 121.23 1d6t s VAL 31 Ca 0.23 -0.48 -0.08 0.00 -2.93 0.00 0.00 61.98 58.73 1d6t s VAL 31 Cb -0.12 -0.80 -0.04 0.00 -1.53 0.00 0.00 36.38 33.89 1d6t s VAL 31 CO 0.14 -0.49 0.09 0.68 -3.33 0.00 0.00 175.10 172.19 1d6t s VAL 32 N 2.10 5.03 0.07 2.04 -7.23 0.44 0.18 120.40 123.04 1d6t s VAL 32 Ca 0.05 0.05 0.03 0.00 -1.81 0.00 0.00 61.98 60.30 1d6t s VAL 32 Cb -0.16 -3.25 -0.04 0.00 0.56 0.00 0.00 36.38 33.49 1d6t s VAL 32 CO -0.22 0.49 0.08 -0.31 -0.31 0.00 0.00 175.10 174.83 1d6t s TYR 33 N 0.04 3.21 0.15 2.82 1.51 0.32 -0.25 117.35 125.16 1d6t s TYR 33 Ca 0.07 0.10 -0.11 0.00 -1.01 0.00 0.00 57.07 56.11 1d6t s TYR 33 Cb -0.12 -1.64 0.01 0.00 -0.11 0.00 0.00 41.96 40.10 1d6t s TYR 33 CO 0.00 0.53 0.33 0.95 -1.11 0.00 0.00 175.55 176.25 1d6t s THR 34 N -1.37 0.07 -0.27 -0.71 -4.23 -0.88 -0.66 115.64 107.60 1d6t s THR 34 Ca 0.29 -1.13 -0.32 0.00 -1.18 0.00 0.00 61.69 59.34 1d6t s THR 34 Cb -0.12 -1.62 0.17 0.00 1.34 0.00 0.00 72.50 72.27 1d6t s THR 34 CO 0.21 -0.33 1.32 0.00 -0.54 0.00 0.00 174.62 175.29 1d6t n ASN 36 N 0.33 0.00 0.00 0.00 6.94 -1.26 -2.58 115.26 118.68 1d6t n ASN 36 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.57 1d6t n ASN 36 Cb 0.58 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.00 1d6t n ASN 36 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 1d6t n ASN 37 N 0.00 0.00 0.00 0.53 5.15 -1.26 -5.06 115.26 114.62 1d6t n ASN 37 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1d6t n ASN 37 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1d6t n ASN 37 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1d6t n LYS 38 N 0.00 0.00 -3.64 1.20 0.00 -1.26 -5.14 118.16 109.32 1d6t n LYS 38 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 58.31 58.28 1d6t n LYS 38 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 35.03 34.96 1d6t n LYS 38 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 1d6t s GLU 39 N -0.12 0.44 0.32 1.64 2.12 -1.26 -5.18 118.70 116.67 1d6t s GLU 39 Ca 0.00 0.76 0.08 0.00 0.36 0.00 0.00 54.97 56.18 1d6t s GLU 39 Cb 0.00 0.09 -0.04 0.00 0.26 0.00 0.00 34.13 34.44 1d6t s GLU 39 CO 0.00 -0.09 0.11 -1.50 -0.54 0.00 0.00 175.26 173.24 1d6t s ILE 40 N 1.39 3.16 -0.58 -3.70 1.10 -1.26 -5.04 121.20 116.27 1d6t s ILE 40 Ca -0.09 -1.73 0.01 0.00 -0.51 0.00 0.00 60.65 58.33 1d6t s ILE 40 Cb -0.04 -2.97 0.43 0.00 0.15 0.00 0.00 42.46 40.03 1d6t s ILE 40 CO -0.16 -0.23 1.71 -0.90 -2.11 0.00 0.00 174.94 173.26 1d6t n ASP 41 N -1.10 6.63 0.00 4.50 5.75 -1.26 -4.94 116.55 126.13 1d6t n ASP 41 Ca -0.04 -3.78 0.00 0.00 -0.01 0.00 0.00 54.79 50.96 1d6t n ASP 41 Cb 0.61 -0.78 0.00 0.00 -1.03 0.00 0.00 41.12 39.92 1d6t n ASP 41 CO 0.00 0.00 0.00 1.57 -0.11 0.00 0.00 177.20 178.66 1d6t n HIS 42 N -0.74 0.00 -1.41 2.11 -0.00 -1.26 -4.66 115.22 109.26 1d6t n HIS 42 Ca 0.54 0.00 -0.14 0.00 0.46 0.00 0.00 57.72 58.57 1d6t n HIS 42 Cb 0.65 -0.31 -0.13 0.00 -0.12 0.00 0.00 29.99 30.08 1d6t n HIS 42 CO 0.00 0.00 0.00 1.97 0.46 0.00 0.00 176.34 178.77 1d6t n PHE 43 N -0.45 0.37 -2.35 1.57 -1.74 -1.24 -4.23 117.46 109.38 1d6t n PHE 43 Ca 0.00 -0.02 -0.36 0.00 -0.56 0.00 0.00 57.45 56.51 1d6t n PHE 43 Cb 0.00 -1.23 -0.04 0.00 1.52 0.00 0.00 39.48 39.73 1d6t n PHE 43 CO 0.00 0.00 0.00 -0.98 -0.56 0.00 0.00 176.76 175.22 1d6t s ARG 44 N 7.18 3.15 0.21 3.97 1.70 -1.26 -4.93 118.95 128.97 1d6t s ARG 44 Ca 0.88 -0.67 -0.30 0.00 -0.47 0.00 0.00 55.73 55.16 1d6t s ARG 44 Cb -0.40 -5.12 -0.08 0.00 -0.57 0.00 0.00 34.95 28.78 1d6t s ARG 44 CO 0.29 -2.65 1.00 -0.51 -1.08 0.00 0.00 175.30 172.35 1d6t s LEU 45 N 7.05 4.58 0.00 -1.89 1.43 -1.25 -3.69 118.68 124.91 1d6t s LEU 45 Ca 0.55 2.01 0.00 0.00 -1.03 0.00 0.00 54.13 55.65 1d6t s LEU 45 Cb -0.04 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.58 1d6t s LEU 45 CO -0.03 0.00 0.00 0.61 0.23 0.00 0.00 176.35 177.16 1d6t n GLY 46 N 1.65 4.95 3.50 -3.19 0.00 -1.26 -4.48 105.19 106.36 1d6t n GLY 46 Ca -0.00 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.38 1d6t n GLY 46 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1d6t s ILE 47 N 3.77 -0.48 -0.02 -0.61 1.09 -1.26 -4.64 121.20 119.06 1d6t s ILE 47 Ca 0.00 0.00 -0.01 0.00 -1.10 0.00 0.00 60.65 59.54 1d6t s ILE 47 Cb 0.00 -1.00 0.01 0.00 -1.06 0.00 0.00 42.46 40.41 1d6t s ILE 47 CO 0.00 0.00 0.04 -0.44 -0.10 0.00 0.00 174.94 174.44 1d6t s SER 48 N 2.29 -0.02 0.24 3.58 0.01 -0.92 -5.00 113.70 113.88 1d6t s SER 48 Ca -0.05 0.07 -0.14 0.00 1.31 0.00 0.00 55.95 57.15 1d6t s SER 48 Cb -0.07 0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.21 1d6t s SER 48 CO -0.17 -0.03 0.48 -0.69 0.41 0.00 0.00 173.24 173.24 1d6t s VAL 49 N 0.22 0.01 0.44 3.43 1.01 -1.26 -1.73 120.40 122.52 1d6t s VAL 49 Ca -0.02 -1.29 -0.03 0.00 0.00 0.00 0.00 61.98 60.64 1d6t s VAL 49 Cb -0.03 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 1d6t s VAL 49 CO -0.01 -0.04 0.70 -0.55 0.00 0.00 0.00 175.10 175.20 1d6t s SER 50 N -2.99 6.19 0.00 3.32 0.15 -1.26 -4.89 113.70 114.22 1d6t s SER 50 Ca 0.19 0.69 0.21 0.00 0.70 0.00 0.00 55.95 57.73 1d6t s SER 50 Cb -0.01 -2.07 -0.10 0.00 -1.71 0.00 0.00 66.02 62.13 1d6t s SER 50 CO 0.06 -0.52 0.96 2.29 1.20 0.00 0.00 173.24 177.23 1d6t n LYS 51 N -2.10 0.90 0.03 5.44 2.85 -1.26 -4.03 118.16 119.99 1d6t n LYS 51 Ca -0.01 -0.53 0.11 0.00 -1.05 0.00 0.00 58.31 56.83 1d6t n LYS 51 Cb 0.56 -1.44 0.04 0.00 -0.65 0.00 0.00 35.03 33.53 1d6t n LYS 51 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 1d6t n LYS 52 N -0.68 0.26 0.00 -1.58 3.00 -1.26 -4.54 118.16 113.37 1d6t n LYS 52 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.38 1d6t n LYS 52 Cb 0.39 -1.59 0.00 0.00 0.00 0.00 0.00 35.03 33.82 1d6t n LYS 52 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1d6t n LEU 53 N -1.93 0.00 0.00 3.14 0.00 -1.26 -4.99 117.00 111.96 1d6t n LEU 53 Ca 0.02 0.46 0.00 0.00 0.00 0.00 0.00 56.01 56.49 1d6t n LEU 53 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.85 1d6t n LEU 53 CO 0.40 0.00 0.00 0.61 0.00 0.00 0.00 177.39 178.40 1d6t n GLY 54 N -0.78 0.53 3.98 -3.96 0.00 -1.26 -4.91 105.19 98.78 1d6t n GLY 54 Ca 0.00 0.47 -0.22 0.00 0.00 0.00 0.00 46.02 46.26 1d6t n GLY 54 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1d6t n ASN 55 N 0.00 1.66 0.27 1.61 5.15 -1.26 -4.95 115.26 117.74 1d6t n ASN 55 Ca 0.00 -2.31 0.15 0.00 -0.60 0.00 0.00 54.58 51.82 1d6t n ASN 55 Cb 0.00 -0.58 0.71 0.00 -0.53 0.00 0.00 39.78 39.38 1d6t n ASN 55 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1d6t h ALA 56 N -0.35 1.09 0.00 5.20 0.00 -1.99 -1.45 119.26 121.76 1d6t h ALA 56 Ca -0.32 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.43 1d6t h ALA 56 Cb 1.26 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1d6t h ALA 56 CO 0.37 0.12 -0.39 -0.24 0.00 0.00 0.00 179.25 179.11 1d6t h VAL 57 N 0.00 1.17 -0.09 0.00 3.04 -1.97 0.26 116.25 118.67 1d6t h VAL 57 Ca -0.00 -1.38 -0.05 0.00 -1.01 0.00 0.00 66.70 64.26 1d6t h VAL 57 Cb 0.45 1.76 -0.00 0.00 -2.01 0.00 0.00 31.29 31.49 1d6t h VAL 57 CO 0.01 0.38 -0.15 -0.07 -1.01 0.00 0.00 177.57 176.74 1d6t h LEU 58 N 0.00 0.29 0.00 3.16 3.38 -1.63 -0.38 115.31 120.12 1d6t h LEU 58 Ca -0.00 -0.54 0.00 0.00 0.09 0.00 0.00 57.88 57.43 1d6t h LEU 58 Cb 0.73 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1d6t h LEU 58 CO 0.05 0.77 0.00 -2.11 0.09 0.00 0.00 178.44 177.24 1d6t n ARG 59 N -4.60 0.96 -0.10 1.13 -4.01 -1.10 -1.99 116.66 106.95 1d6t n ARG 59 Ca -0.07 0.00 -0.11 0.00 -1.04 0.00 0.00 57.85 56.63 1d6t n ARG 59 Cb 0.37 -1.50 -0.15 0.00 -3.04 0.00 0.00 32.46 28.14 1d6t n ARG 59 CO 0.00 0.00 0.00 0.09 -3.04 0.00 0.00 177.63 174.68 1d6t n ASN 60 N -1.00 0.29 0.09 2.89 3.02 0.06 -3.39 115.26 117.22 1d6t n ASN 60 Ca 0.23 -0.01 0.12 0.00 -0.03 0.00 0.00 54.58 54.89 1d6t n ASN 60 Cb 0.11 0.85 0.15 0.00 -0.61 0.00 0.00 39.78 40.28 1d6t n ASN 60 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1d6t h LYS 61 N 0.00 0.00 0.05 3.52 3.64 -0.91 -0.16 116.57 122.71 1d6t h LYS 61 Ca -0.54 0.00 -0.30 0.00 -1.27 0.00 0.00 60.65 58.54 1d6t h LYS 61 Cb 2.19 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.98 1d6t h LYS 61 CO 0.02 0.00 -1.65 0.82 -2.27 0.00 0.00 179.45 176.36 1d6t h ILE 62 N 0.00 0.95 0.00 2.00 2.04 -1.57 -2.96 117.51 117.96 1d6t h ILE 62 Ca 0.00 -2.73 0.00 0.00 1.00 0.00 0.00 64.86 63.13 1d6t h ILE 62 Cb 0.84 2.55 0.00 0.00 -0.74 0.00 0.00 36.82 39.46 1d6t h ILE 62 CO 0.00 0.68 -1.07 2.29 0.00 0.00 0.00 178.15 180.04 1d6t n LYS 63 N -3.24 0.39 -0.03 2.37 0.00 -1.22 -4.02 118.16 112.41 1d6t n LYS 63 Ca -0.18 0.01 -0.01 0.00 -0.00 0.00 0.00 58.31 58.14 1d6t n LYS 63 Cb 1.04 -1.64 -0.00 0.00 -0.00 0.00 0.00 35.03 34.42 1d6t n LYS 63 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.40 177.31 1d6t h ARG 64 N 0.00 -0.04 -0.95 -1.58 2.43 -1.13 -3.02 114.38 110.09 1d6t h ARG 64 Ca 0.00 0.00 0.17 0.00 -0.81 0.00 0.00 59.98 59.34 1d6t h ARG 64 Cb 0.81 0.01 -0.17 0.00 -0.42 0.00 0.00 29.97 30.20 1d6t h ARG 64 CO 0.00 -0.02 -0.32 0.00 -1.51 0.00 0.00 179.97 178.12 1d6t h ALA 65 N -1.10 0.35 -0.70 2.80 0.00 -1.72 1.59 119.26 120.48 1d6t h ALA 65 Ca -0.00 0.31 0.11 0.00 0.00 0.00 0.00 54.91 55.33 1d6t h ALA 65 Cb 0.03 0.87 -0.08 0.00 0.00 0.00 0.00 17.79 18.61 1d6t h ALA 65 CO 0.01 -0.52 0.31 0.97 0.00 0.00 0.00 179.25 180.01 1d6t h ILE 66 N -0.01 0.77 0.00 0.00 -0.00 -1.70 1.14 117.51 117.71 1d6t h ILE 66 Ca 0.39 -0.18 0.00 0.00 -0.00 0.00 0.00 64.86 65.07 1d6t h ILE 66 Cb 0.64 0.22 0.00 0.00 -0.00 0.00 0.00 36.82 37.68 1d6t h ILE 66 CO -0.97 0.09 0.00 0.54 -0.00 0.00 0.00 178.15 177.82 1d6t n ARG 67 N -4.93 0.11 -0.00 2.19 1.74 0.52 -0.48 116.66 115.81 1d6t n ARG 67 Ca 0.12 0.21 0.05 0.00 -0.77 0.00 0.00 57.85 57.46 1d6t n ARG 67 Cb 0.32 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.19 1d6t n ARG 67 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1d6t n GLU 68 N -1.37 2.42 -0.10 5.56 -0.58 0.33 -4.27 120.64 122.64 1d6t n GLU 68 Ca 0.05 -0.03 -0.16 0.00 -0.42 0.00 0.00 57.16 56.60 1d6t n GLU 68 Cb 0.12 -1.09 -0.06 0.00 -0.57 0.00 0.00 31.44 29.84 1d6t n GLU 68 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1d6t n ASN 69 N -1.46 1.90 0.06 1.62 2.85 0.21 -4.22 115.26 116.22 1d6t n ASN 69 Ca 0.01 0.42 0.04 0.00 -0.11 0.00 0.00 54.58 54.94 1d6t n ASN 69 Cb 0.21 -0.83 0.22 0.00 1.24 0.00 0.00 39.78 40.62 1d6t n ASN 69 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 1d6t n PHE 70 N -4.43 0.27 -0.07 1.20 3.01 0.37 -1.74 117.46 116.07 1d6t n PHE 70 Ca -0.27 0.14 -0.10 0.00 1.01 0.00 0.00 57.45 58.23 1d6t n PHE 70 Cb 0.59 -0.73 -0.03 0.00 -0.01 0.00 0.00 39.48 39.31 1d6t n PHE 70 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1d6t h LYS 71 N 0.00 0.33 -0.05 -1.08 1.63 -1.74 1.36 116.57 117.03 1d6t h LYS 71 Ca 0.00 -0.03 -0.18 0.00 -0.85 0.00 0.00 60.65 59.59 1d6t h LYS 71 Cb 0.01 -0.07 0.01 0.00 -0.60 0.00 0.00 32.23 31.58 1d6t h LYS 71 CO 0.00 0.27 -0.68 -0.39 -3.45 0.00 0.00 179.45 175.20 1d6t h VAL 72 N 0.30 1.36 0.00 2.00 -1.51 -1.57 -2.88 116.25 113.95 1d6t h VAL 72 Ca 0.09 -2.03 0.00 0.00 -1.23 0.00 0.00 66.70 63.53 1d6t h VAL 72 Cb 0.03 2.37 0.00 0.00 -2.13 0.00 0.00 31.29 31.56 1d6t h VAL 72 CO -0.02 0.61 0.00 1.41 -1.23 0.00 0.00 177.57 178.34 1d6t n HIS 73 N -4.12 0.00 -0.27 5.19 8.25 -1.11 -3.64 115.22 119.52 1d6t n HIS 73 Ca -0.10 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.38 1d6t n HIS 73 Cb 0.70 0.00 0.14 0.00 1.12 0.00 0.00 29.99 31.96 1d6t n HIS 73 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 1d6t h LYS 74 N 0.00 0.70 -0.01 -0.41 3.11 0.21 1.04 116.57 121.21 1d6t h LYS 74 Ca 0.00 -0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.80 1d6t h LYS 74 Cb 0.00 -0.16 0.00 0.00 -1.00 0.00 0.00 32.23 31.07 1d6t h LYS 74 CO 0.00 0.46 -0.01 0.45 -2.81 0.00 0.00 179.45 177.55 1d6t n SER 75 N -4.78 0.83 -0.04 4.20 2.88 -1.24 -3.26 113.62 112.20 1d6t n SER 75 Ca 0.12 -1.25 0.02 0.00 -1.33 0.00 0.00 58.87 56.43 1d6t n SER 75 Cb 0.25 -0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.56 1d6t n SER 75 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1d6t n HIS 76 N -0.37 0.00 -2.91 0.66 8.25 0.16 -4.94 115.22 116.07 1d6t n HIS 76 Ca 0.21 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.29 1d6t n HIS 76 Cb 0.25 -0.64 -0.06 0.00 1.12 0.00 0.00 29.99 30.66 1d6t n HIS 76 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1d6t s ILE 77 N -2.96 4.31 0.40 1.59 1.09 0.31 -3.59 121.20 122.35 1d6t s ILE 77 Ca -0.08 1.72 0.08 0.00 -1.10 0.00 0.00 60.65 61.26 1d6t s ILE 77 Cb 0.09 -4.08 -0.03 0.00 -1.06 0.00 0.00 42.46 37.38 1d6t s ILE 77 CO 0.78 0.36 0.28 -1.48 -0.10 0.00 0.00 174.94 174.78 1d6t s LEU 78 N -1.56 3.30 0.19 2.97 -0.00 -1.23 -4.89 118.68 117.46 1d6t s LEU 78 Ca 0.42 -0.85 -0.32 0.00 -0.00 0.00 0.00 54.13 53.38 1d6t s LEU 78 Cb -0.21 -1.82 -0.11 0.00 -0.00 0.00 0.00 46.19 44.05 1d6t s LEU 78 CO 0.26 -0.57 1.69 0.00 -0.00 0.00 0.00 176.35 177.72 1d6t s ALA 79 N -2.51 3.89 0.00 1.48 0.00 -1.26 -3.64 121.76 119.73 1d6t s ALA 79 Ca 0.44 1.52 0.00 0.00 0.00 0.00 0.00 51.96 53.93 1d6t s ALA 79 Cb -0.01 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.43 1d6t s ALA 79 CO 0.25 -0.90 0.00 1.63 0.00 0.00 0.00 175.76 176.74 1d6t n LYS 80 N 4.08 0.00 -1.50 0.00 5.02 -1.26 -4.74 118.16 119.76 1d6t n LYS 80 Ca 0.15 0.00 -0.51 0.00 -2.02 0.00 0.00 58.31 55.93 1d6t n LYS 80 Cb 0.36 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 35.30 1d6t n LYS 80 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1d6t n ASP 81 N 0.00 2.31 -1.48 4.39 5.75 -1.07 -4.12 116.55 122.34 1d6t n ASP 81 Ca 0.00 0.53 0.00 0.00 -0.01 0.00 0.00 54.79 55.31 1d6t n ASP 81 Cb 0.00 -1.27 0.00 0.00 -1.03 0.00 0.00 41.12 38.82 1d6t n ASP 81 CO 0.00 0.00 0.00 2.30 -0.11 0.00 0.00 177.20 179.39 1d6t n ILE 82 N 6.73 0.00 0.00 2.12 -6.64 -1.24 -0.74 119.36 119.58 1d6t n ILE 82 Ca 0.38 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 61.36 1d6t n ILE 82 Cb 0.23 0.00 0.00 0.00 -1.44 0.00 0.00 39.64 38.43 1d6t n ILE 82 CO 0.00 0.00 0.00 -0.38 -1.77 0.00 0.00 176.55 174.40 1d6t n ILE 83 N 0.00 0.00 -3.37 7.28 5.41 0.17 -4.40 119.36 124.45 1d6t n ILE 83 Ca 0.00 0.00 -0.43 0.00 1.00 0.00 0.00 62.75 63.32 1d6t n ILE 83 Cb 0.00 0.00 -0.09 0.00 -0.71 0.00 0.00 39.64 38.84 1d6t n ILE 83 CO 0.00 0.00 0.00 0.68 0.00 0.00 0.00 176.55 177.23 1d6t s VAL 84 N -0.08 5.17 0.06 1.39 -7.23 -1.26 0.12 120.40 118.56 1d6t s VAL 84 Ca 0.00 -0.66 0.05 0.00 -1.81 0.00 0.00 61.98 59.56 1d6t s VAL 84 Cb 0.00 -4.05 -0.04 0.00 0.56 0.00 0.00 36.38 32.86 1d6t s VAL 84 CO 0.00 -0.46 -0.06 -0.63 -0.31 0.00 0.00 175.10 173.64 1d6t s ILE 85 N 1.89 3.64 -0.24 -0.62 1.09 0.48 -2.16 121.20 125.28 1d6t s ILE 85 Ca 0.08 -0.98 -0.13 0.00 -1.10 0.00 0.00 60.65 58.52 1d6t s ILE 85 Cb -0.20 -2.66 -0.05 0.00 -1.06 0.00 0.00 42.46 38.50 1d6t s ILE 85 CO 0.10 0.24 0.26 0.00 -0.10 0.00 0.00 174.94 175.44 1d6t s ALA 86 N -1.14 3.58 0.46 9.38 0.00 -0.71 0.20 121.76 133.54 1d6t s ALA 86 Ca 0.20 -0.79 -0.02 0.00 0.00 0.00 0.00 51.96 51.36 1d6t s ALA 86 Cb -0.11 -2.47 0.03 0.00 0.00 0.00 0.00 23.12 20.56 1d6t s ALA 86 CO 0.12 -0.31 0.06 0.54 0.00 0.00 0.00 175.76 176.17 1d6t n ARG 87 N 4.52 0.32 -0.00 0.00 5.12 0.28 -4.16 116.66 122.74 1d6t n ARG 87 Ca -0.12 -0.10 -0.10 0.00 -1.93 0.00 0.00 57.85 55.60 1d6t n ARG 87 Cb 0.52 -0.24 -0.04 0.00 -1.16 0.00 0.00 32.46 31.54 1d6t n ARG 87 CO 0.00 0.00 0.00 0.37 -1.93 0.00 0.00 177.63 176.07 1d6t h GLN 88 N 0.00 -0.09 0.00 5.56 5.75 -1.95 -3.39 115.11 120.99 1d6t h GLN 88 Ca -0.03 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.48 1d6t h GLN 88 Cb 0.09 0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.66 1d6t h GLN 88 CO 0.02 -0.06 0.00 -0.35 -2.65 0.00 0.00 178.83 175.79 1d6t n PRO 89 N -5.22 0.00 -0.76 -2.39 -0.04 -1.26 -4.49 135.00 120.83 1d6t n PRO 89 Ca -0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 1d6t n PRO 89 Cb 0.15 -0.03 0.00 0.00 -0.04 0.00 0.00 33.50 33.57 1d6t n PRO 89 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1d6t n ALA 90 N -3.00 0.00 -0.07 0.55 0.00 -1.26 -4.67 120.51 112.05 1d6t n ALA 90 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 1d6t n ALA 90 Cb 0.00 -1.25 -0.14 0.00 0.00 0.00 0.00 19.45 18.06 1d6t n ALA 90 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1d6t n LYS 91 N -0.45 0.68 0.00 0.00 -0.00 -1.26 -4.00 118.16 113.13 1d6t n LYS 91 Ca 0.00 0.16 0.16 0.00 -0.00 0.00 0.00 58.31 58.63 1d6t n LYS 91 Cb 0.26 -1.61 0.91 0.00 -0.00 0.00 0.00 35.03 34.59 1d6t n LYS 91 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1d6t n ASP 92 N -3.17 0.10 -4.85 -5.58 -0.08 -1.26 -4.77 116.55 96.95 1d6t n ASP 92 Ca -0.35 -0.97 -0.36 0.00 -1.51 0.00 0.00 54.79 51.59 1d6t n ASP 92 Cb 1.05 -0.02 -0.07 0.00 2.34 0.00 0.00 41.12 44.43 1d6t n ASP 92 CO 0.00 0.00 0.00 -0.32 0.12 0.00 0.00 177.20 177.00 1d6t s MET 93 N -2.04 3.36 0.12 -0.67 1.75 -1.26 -5.10 119.30 115.45 1d6t s MET 93 Ca 0.46 -0.19 0.05 0.00 -1.25 0.00 0.00 55.69 54.76 1d6t s MET 93 Cb 0.22 -3.12 -0.04 0.00 2.84 0.00 0.00 34.83 34.73 1d6t s MET 93 CO 0.37 0.76 0.06 0.95 -0.65 0.00 0.00 175.02 176.52 1d6t s THR 94 N -1.02 4.26 0.62 10.11 -4.23 -1.26 -4.97 115.64 119.15 1d6t s THR 94 Ca 0.15 -1.00 0.25 0.00 -1.18 0.00 0.00 61.69 59.92 1d6t s THR 94 Cb -0.12 -3.09 0.33 0.00 1.34 0.00 0.00 72.50 70.96 1d6t s THR 94 CO 0.04 0.04 1.63 0.74 -0.54 0.00 0.00 174.62 176.53 1d6t h THR 95 N 2.52 0.15 -0.57 3.99 2.02 -1.98 1.32 112.91 120.37 1d6t h THR 95 Ca -0.47 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 66.62 1d6t h THR 95 Cb 1.18 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 1d6t h THR 95 CO 0.62 0.00 0.02 0.25 0.37 0.00 0.00 175.52 176.78 1d6t h LEU 96 N 0.00 0.94 0.00 2.58 7.12 -1.96 -1.88 115.31 122.10 1d6t h LEU 96 Ca 0.23 -0.24 0.00 0.00 0.13 0.00 0.00 57.88 58.00 1d6t h LEU 96 Cb 1.68 -0.25 0.00 0.00 -0.53 0.00 0.00 40.66 41.56 1d6t h LEU 96 CO -0.00 0.98 -0.34 1.56 -0.13 0.00 0.00 178.44 180.51 1d6t h GLN 97 N 0.90 0.00 0.43 1.25 4.20 0.13 -3.27 115.11 118.75 1d6t h GLN 97 Ca 0.17 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.86 1d6t h GLN 97 Cb 0.50 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.28 1d6t h GLN 97 CO 0.02 0.00 -0.21 0.82 -0.67 0.00 0.00 178.83 178.80 1d6t h ILE 98 N 0.00 0.27 0.00 2.54 2.04 -0.63 0.69 117.51 122.42 1d6t h ILE 98 Ca 0.00 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.26 1d6t h ILE 98 Cb 0.87 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 1d6t h ILE 98 CO 0.00 0.06 0.07 1.56 0.00 0.00 0.00 178.15 179.84 1d6t h GLN 99 N -1.05 0.00 0.00 2.37 4.20 -1.49 1.23 115.11 120.37 1d6t h GLN 99 Ca -0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1d6t h GLN 99 Cb 0.53 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.31 1d6t h GLN 99 CO 0.10 0.00 -1.79 0.09 -0.67 0.00 0.00 178.83 176.56 1d6t n ASN 100 N -2.43 0.25 -0.03 1.46 3.02 -1.10 -4.29 115.26 112.15 1d6t n ASN 100 Ca -0.02 -0.20 -0.21 0.00 -0.03 0.00 0.00 54.58 54.13 1d6t n ASN 100 Cb 0.11 1.79 -0.13 0.00 -0.61 0.00 0.00 39.78 40.94 1d6t n ASN 100 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1d6t n SER 101 N -2.10 2.08 0.17 6.41 7.64 0.24 -3.95 113.62 124.11 1d6t n SER 101 Ca -0.02 0.18 0.19 0.00 1.01 0.00 0.00 58.87 60.23 1d6t n SER 101 Cb 0.52 -0.81 0.76 0.00 -1.01 0.00 0.00 64.21 63.66 1d6t n SER 101 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1d6t h LEU 102 N -0.06 0.00 0.00 -3.43 4.07 0.96 1.42 115.31 118.27 1d6t h LEU 102 Ca -0.45 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.51 1d6t h LEU 102 Cb 1.94 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.68 1d6t h LEU 102 CO 0.02 0.00 0.00 -0.62 -1.08 0.00 0.00 178.44 176.76 1d6t n GLU 103 N -3.44 0.73 0.00 1.13 -0.58 -1.25 -2.60 120.64 114.63 1d6t n GLU 103 Ca 0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 1d6t n GLU 103 Cb 0.55 -1.43 0.00 0.00 -0.57 0.00 0.00 31.44 29.99 1d6t n GLU 103 CO 0.00 0.00 0.00 1.58 -0.48 0.00 0.00 177.13 178.23 1d6t n HIS 104 N -0.93 0.00 -0.32 -0.32 -0.00 0.48 -4.36 115.22 109.78 1d6t n HIS 104 Ca 0.15 0.00 -0.00 0.00 0.46 0.00 0.00 57.72 58.33 1d6t n HIS 104 Cb 0.07 0.07 0.06 0.00 -0.12 0.00 0.00 29.99 30.07 1d6t n HIS 104 CO 0.00 0.00 0.00 -0.24 0.46 0.00 0.00 176.34 176.56 1d6t h VAL 105 N 0.00 0.08 -0.55 3.57 3.04 -1.48 1.11 116.25 122.01 1d6t h VAL 105 Ca 0.00 0.00 -0.11 0.00 -1.01 0.00 0.00 66.70 65.58 1d6t h VAL 105 Cb 0.00 0.08 -0.02 0.00 -2.01 0.00 0.00 31.29 29.34 1d6t h VAL 105 CO 0.00 0.00 -0.10 0.25 -1.01 0.00 0.00 177.57 176.71 1d6t h LEU 106 N -0.04 1.03 -1.49 3.16 5.85 -1.69 -0.86 115.31 121.28 1d6t h LEU 106 Ca 0.35 -0.33 0.10 0.00 0.84 0.00 0.00 57.88 58.83 1d6t h LEU 106 Cb 0.61 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.31 1d6t h LEU 106 CO -0.89 1.13 0.47 0.07 -0.34 0.00 0.00 178.44 178.88 1d6t h LYS 107 N 0.92 0.56 0.00 1.25 2.10 0.88 0.28 116.57 122.55 1d6t h LYS 107 Ca 0.14 -0.03 -0.14 0.00 -2.00 0.00 0.00 60.65 58.62 1d6t h LYS 107 Cb 0.66 -0.13 -0.02 0.00 -0.90 0.00 0.00 32.23 31.85 1d6t h LYS 107 CO 0.05 0.37 -0.67 0.82 -2.00 0.00 0.00 179.45 178.02 1d6t h ILE 108 N 0.58 1.15 -1.01 0.07 2.04 0.12 -3.20 117.51 117.27 1d6t h ILE 108 Ca 0.33 -2.61 0.26 0.00 1.00 0.00 0.00 64.86 63.83 1d6t h ILE 108 Cb 0.50 2.56 -0.07 0.00 -0.74 0.00 0.00 36.82 39.07 1d6t h ILE 108 CO -0.11 0.65 0.67 0.00 0.00 0.00 0.00 178.15 179.37 1d6t h ALA 109 N 1.33 2.40 0.00 1.87 0.00 0.99 -3.45 119.26 122.40 1d6t h ALA 109 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1d6t h ALA 109 Cb 1.51 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.32 1d6t h ALA 109 CO 0.09 -0.75 0.00 1.17 0.00 0.00 0.00 179.25 179.76 1d6t n LYS 110 N -4.50 0.00 -0.61 0.00 4.81 -1.17 -4.81 118.16 111.89 1d6t n LYS 110 Ca 0.23 0.28 -0.07 0.00 -0.87 0.00 0.00 58.31 57.88 1d6t n LYS 110 Cb 0.88 -2.37 0.14 0.00 0.02 0.00 0.00 35.03 33.71 1d6t n LYS 110 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 1d6t n VAL 111 N -2.60 1.95 -4.36 3.15 0.24 -1.26 -4.80 118.33 110.66 1d6t n VAL 111 Ca 0.00 -0.94 -0.27 0.00 -2.04 0.00 0.00 64.34 61.09 1d6t n VAL 111 Cb 0.01 -0.59 -0.17 0.00 -1.47 0.00 0.00 33.84 31.62 1d6t n VAL 111 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1d6t s PHE 112 N -1.85 1.72 0.53 6.34 0.08 -1.26 -3.56 117.98 119.97 1d6t s PHE 112 Ca 0.31 -0.78 0.27 0.00 0.12 0.00 0.00 56.93 56.84 1d6t s PHE 112 Cb 0.25 -1.28 1.41 0.00 -0.57 0.00 0.00 43.02 42.82 1d6t s PHE 112 CO 0.07 -0.43 1.96 -0.91 -0.10 0.00 0.00 175.22 175.81 1d6t h ASN 113 N 7.48 0.02 0.00 1.36 2.35 -1.87 -3.39 115.58 121.53 1d6t h ASN 113 Ca -0.31 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.44 1d6t h ASN 113 Cb 1.17 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.53 1d6t h ASN 113 CO 0.47 0.01 0.00 1.17 -1.65 0.00 0.00 177.43 177.43 1d6t n LYS 114 N -4.35 0.00 -0.32 0.81 0.00 -1.26 -5.11 118.16 107.93 1d6t n LYS 114 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.44 1d6t n LYS 114 Cb 0.71 -0.07 0.00 0.00 0.00 0.00 0.00 35.03 35.67 1d6t n LYS 114 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1d6t n LYS 115 N -1.86 0.00 -1.73 1.64 4.81 -1.26 -5.04 118.16 114.71 1d6t n LYS 115 Ca 0.00 0.11 -0.38 0.00 -0.87 0.00 0.00 58.31 57.16 1d6t n LYS 115 Cb 0.00 -0.24 0.05 0.00 0.02 0.00 0.00 35.03 34.85 1d6t n LYS 115 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1d6t n ILE 116 N -0.03 3.89 1.32 3.15 5.41 -1.26 -5.18 119.36 126.67 1d6t n ILE 116 Ca 0.00 -0.50 0.13 0.00 1.00 0.00 0.00 62.75 63.38 1d6t n ILE 116 Cb 0.00 -1.62 0.37 0.00 -0.71 0.00 0.00 39.64 37.69 1d6t n ILE 116 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72