#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d6t n LEU 2 N 0.00 0.00 -4.58 3.17 0.00 -1.26 -4.96 117.00 109.38 1d6t n LEU 2 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 56.01 55.71 1d6t n LEU 2 Cb 0.00 0.00 0.24 0.00 0.00 0.00 0.00 43.42 43.66 1d6t n LEU 2 CO 0.00 0.00 0.61 -0.22 0.00 0.00 0.00 177.39 177.78 1d6t s LEU 3 N 0.00 0.61 0.00 -1.96 2.96 -1.26 -5.06 118.68 113.98 1d6t s LEU 3 Ca 0.00 0.68 0.00 0.00 -0.22 0.00 0.00 54.13 54.59 1d6t s LEU 3 Cb 0.00 -2.41 0.00 0.00 0.50 0.00 0.00 46.19 44.28 1d6t s LEU 3 CO 0.00 -4.17 0.00 1.21 -1.32 0.00 0.00 176.35 172.07 1d6t n GLU 4 N -4.80 0.91 0.00 1.98 0.00 -1.26 -4.98 120.64 112.49 1d6t n GLU 4 Ca 0.13 0.00 0.09 0.00 0.00 0.00 0.00 57.16 57.37 1d6t n GLU 4 Cb 0.59 0.00 -0.02 0.00 0.00 0.00 0.00 31.44 32.02 1d6t n GLU 4 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.13 177.49 1d6t n LYS 5 N -0.08 1.53 0.29 5.31 2.85 -1.26 -4.26 118.16 122.54 1d6t n LYS 5 Ca 0.00 -0.75 0.20 0.00 -1.05 0.00 0.00 58.31 56.71 1d6t n LYS 5 Cb 0.00 -1.33 1.03 0.00 -0.65 0.00 0.00 35.03 34.09 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 3.00 1.00 0.00 0.58 0.00 -1.97 -0.37 119.26 121.50 1d6t h ALA 6 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1d6t h ALA 6 Cb 0.58 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 1d6t h ALA 6 CO 0.00 0.00 -0.45 0.66 0.00 0.00 0.00 179.25 179.46 1d6t n TYR 7 N -2.89 0.00 -4.18 0.00 4.02 -1.26 -4.61 117.16 108.24 1d6t n TYR 7 Ca -0.02 -1.16 -0.11 0.00 -0.01 0.00 0.00 57.90 56.59 1d6t n TYR 7 Cb 0.09 -0.20 -0.10 0.00 -0.02 0.00 0.00 39.34 39.11 1d6t n TYR 7 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1d6t s ARG 8 N -2.55 1.14 0.00 -0.72 0.52 -0.15 0.22 118.95 117.41 1d6t s ARG 8 Ca 0.34 -1.56 0.00 0.00 -0.52 0.00 0.00 55.73 53.99 1d6t s ARG 8 Cb 0.33 0.27 0.00 0.00 0.52 0.00 0.00 34.95 36.07 1d6t s ARG 8 CO -0.05 -0.36 0.00 -0.89 0.02 0.00 0.00 175.30 174.01 1d6t n ILE 9 N -0.23 0.00 0.00 1.52 2.08 -1.24 -4.79 119.36 116.71 1d6t n ILE 9 Ca -0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 1d6t n ILE 9 Cb 0.65 -1.01 0.00 0.00 -0.75 0.00 0.00 39.64 38.53 1d6t n ILE 9 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 1d6t n LYS 10 N -0.79 0.00 -3.40 0.38 3.00 -1.26 -5.05 118.16 111.04 1d6t n LYS 10 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 58.31 58.12 1d6t n LYS 10 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.02 1d6t n LYS 10 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1d6t s LYS 11 N 0.00 2.93 -0.13 1.64 2.20 -1.26 -5.05 119.74 120.08 1d6t s LYS 11 Ca 0.00 -1.16 -0.28 0.00 -0.36 0.00 0.00 55.97 54.16 1d6t s LYS 11 Cb 0.00 -2.72 -0.25 0.00 -1.51 0.00 0.00 37.83 33.35 1d6t s LYS 11 CO 0.00 -0.05 0.82 -0.91 -0.36 0.00 0.00 175.35 174.85 1d6t h ASN 12 N 0.89 -0.00 -0.85 1.43 2.35 -2.01 -3.27 115.58 114.12 1d6t h ASN 12 Ca -0.44 -0.93 0.09 0.00 -0.55 0.00 0.00 56.30 54.47 1d6t h ASN 12 Cb 1.26 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 39.51 1d6t h ASN 12 CO 0.52 0.94 -0.53 0.00 -1.65 0.00 0.00 177.43 176.71 1d6t h ALA 13 N 0.04 -0.44 -1.01 -0.83 0.00 -1.96 2.05 119.26 117.12 1d6t h ALA 13 Ca -0.00 0.13 0.30 0.00 0.00 0.00 0.00 54.91 55.34 1d6t h ALA 13 Cb 0.94 1.22 -0.14 0.00 0.00 0.00 0.00 17.79 19.81 1d6t h ALA 13 CO 0.00 -0.91 0.58 -0.44 0.00 0.00 0.00 179.25 178.49 1d6t h ASP 14 N -0.09 0.56 0.08 0.00 3.32 -2.00 1.81 116.42 120.10 1d6t h ASP 14 Ca 0.18 0.17 -0.26 0.00 0.02 0.00 0.00 57.03 57.14 1d6t h ASP 14 Cb 0.49 0.10 0.03 0.00 0.22 0.00 0.00 39.33 40.17 1d6t h ASP 14 CO -0.86 -0.06 -1.08 -0.26 -1.72 0.00 0.00 179.24 175.26 1d6t h PHE 15 N 0.40 0.94 -0.36 4.55 0.04 0.20 -3.26 116.94 119.45 1d6t h PHE 15 Ca 0.71 -0.57 -0.07 0.00 2.80 0.00 0.00 57.97 60.84 1d6t h PHE 15 Cb 1.55 -0.08 -0.02 0.00 2.20 0.00 0.00 35.95 39.60 1d6t h PHE 15 CO -0.01 1.41 -0.09 1.96 -0.60 0.00 0.00 178.31 180.98 1d6t h GLN 16 N 0.20 0.61 0.00 1.51 4.20 0.70 -3.10 115.11 119.24 1d6t h GLN 16 Ca -0.16 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.38 1d6t h GLN 16 Cb 1.77 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 29.48 1d6t h GLN 16 CO 0.21 0.70 0.00 -2.13 -0.67 0.00 0.00 178.83 176.94 1d6t n ARG 17 N -4.20 0.00 -0.16 1.46 3.00 0.57 0.23 116.66 117.56 1d6t n ARG 17 Ca 0.01 0.71 -0.09 0.00 -0.00 0.00 0.00 57.85 58.48 1d6t n ARG 17 Cb 0.32 -1.25 -0.04 0.00 0.00 0.00 0.00 32.46 31.49 1d6t n ARG 17 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.63 176.79 1d6t h ILE 18 N 0.00 0.10 0.00 5.15 -2.65 -1.70 1.61 117.51 120.03 1d6t h ILE 18 Ca 0.00 0.00 0.00 0.00 1.03 0.00 0.00 64.86 65.89 1d6t h ILE 18 Cb 0.00 0.10 0.00 0.00 -2.05 0.00 0.00 36.82 34.87 1d6t h ILE 18 CO 0.00 0.00 0.18 1.88 0.03 0.00 0.00 178.15 180.24 1d6t h TYR 19 N -0.28 0.00 0.00 0.16 -1.99 -1.25 2.27 116.97 115.88 1d6t h TYR 19 Ca 0.16 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.89 1d6t h TYR 19 Cb 0.57 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.30 1d6t h TYR 19 CO -0.66 0.00 0.00 1.17 -0.00 0.00 0.00 178.16 178.67 1d6t n LYS 20 N -2.30 0.00 0.00 4.88 3.00 0.64 -4.69 118.16 119.69 1d6t n LYS 20 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.30 1d6t n LYS 20 Cb 0.22 -0.67 0.00 0.00 0.00 0.00 0.00 35.03 34.57 1d6t n LYS 20 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1d6t n LYS 21 N -0.50 0.02 -0.67 1.64 3.00 -1.04 -5.06 118.16 115.55 1d6t n LYS 21 Ca 0.00 -0.73 -0.32 0.00 -0.00 0.00 0.00 58.31 57.27 1d6t n LYS 21 Cb 0.00 -0.98 0.17 0.00 0.00 0.00 0.00 35.03 34.22 1d6t n LYS 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1d6t n GLY 22 N -0.12 -2.54 3.20 3.14 0.00 0.76 -4.94 105.19 104.68 1d6t n GLY 22 Ca 0.00 -0.78 -0.40 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.21 3.45 0.15 1.61 2.46 0.25 -4.87 115.29 116.13 1d6t s HIS 23 Ca 0.54 -1.97 -0.15 0.00 0.47 0.00 0.00 55.06 53.95 1d6t s HIS 23 Cb -0.10 -3.34 -0.07 0.00 -0.13 0.00 0.00 32.58 28.94 1d6t s HIS 23 CO 0.64 -0.97 0.57 -1.54 -2.47 0.00 0.00 174.74 170.97 1d6t s SER 24 N 2.37 6.87 -0.00 9.88 1.04 -1.26 -2.35 113.70 130.25 1d6t s SER 24 Ca 0.06 1.14 0.01 0.00 0.48 0.00 0.00 55.95 57.63 1d6t s SER 24 Cb -0.25 -2.31 0.00 0.00 0.10 0.00 0.00 66.02 63.56 1d6t s SER 24 CO -0.01 0.11 -0.02 0.68 0.98 0.00 0.00 173.24 174.97 1d6t s VAL 25 N -1.44 0.18 -0.08 5.02 -7.23 0.34 -4.97 120.40 112.21 1d6t s VAL 25 Ca 0.38 -0.09 0.00 0.00 -1.81 0.00 0.00 61.98 60.46 1d6t s VAL 25 Cb -0.16 -0.17 0.02 0.00 0.56 0.00 0.00 36.38 36.64 1d6t s VAL 25 CO 0.19 0.06 -0.06 0.00 -0.31 0.00 0.00 175.10 174.98 1d6t s ALA 26 N 0.02 1.07 0.00 1.32 0.00 -1.26 0.66 121.76 123.58 1d6t s ALA 26 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 51.96 51.61 1d6t s ALA 26 Cb -0.02 -0.73 0.00 0.00 0.00 0.00 0.00 23.12 22.37 1d6t s ALA 26 CO -0.00 -0.26 0.00 0.27 0.00 0.00 0.00 175.76 175.77 1d6t n ASN 27 N 4.62 0.00 0.00 0.00 2.04 -0.09 -4.92 115.26 116.90 1d6t n ASN 27 Ca -0.15 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 53.99 1d6t n ASN 27 Cb 0.50 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.75 1d6t n ASN 27 CO 0.00 0.00 0.00 -2.11 -0.44 0.00 0.00 177.26 174.71 1d6t n ARG 28 N 0.00 0.90 -2.67 -3.83 1.85 -1.26 -4.87 116.66 106.77 1d6t n ARG 28 Ca 0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 57.85 56.76 1d6t n ARG 28 Cb 0.00 -0.92 0.05 0.00 -1.05 0.00 0.00 32.46 30.54 1d6t n ARG 28 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1d6t n GLN 29 N -2.18 1.15 0.00 2.89 6.02 -1.26 -4.97 117.38 119.03 1d6t n GLN 29 Ca 0.00 -2.96 0.00 0.00 -0.01 0.00 0.00 57.00 54.03 1d6t n GLN 29 Cb 0.42 -1.00 0.00 0.00 1.02 0.00 0.00 30.24 30.68 1d6t n GLN 29 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1d6t n PHE 30 N -0.16 0.00 -4.22 1.08 7.35 -1.26 -4.28 117.46 115.96 1d6t n PHE 30 Ca 0.07 0.00 -0.20 0.00 -0.76 0.00 0.00 57.45 56.56 1d6t n PHE 30 Cb 0.82 0.00 -0.16 0.00 0.35 0.00 0.00 39.48 40.49 1d6t n PHE 30 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 1d6t s VAL 31 N -1.31 0.59 -0.03 -2.13 -7.23 -0.81 -0.91 120.40 108.57 1d6t s VAL 31 Ca 0.00 -0.18 0.07 0.00 -1.81 0.00 0.00 61.98 60.07 1d6t s VAL 31 Cb 0.00 -0.60 -0.02 0.00 0.56 0.00 0.00 36.38 36.33 1d6t s VAL 31 CO 0.00 0.23 -0.25 0.68 -0.31 0.00 0.00 175.10 175.45 1d6t s VAL 32 N 0.76 2.02 -0.13 1.32 -7.23 0.21 -0.22 120.40 117.14 1d6t s VAL 32 Ca -0.11 -1.08 -0.02 0.00 -1.81 0.00 0.00 61.98 58.96 1d6t s VAL 32 Cb -0.14 -1.69 -0.03 0.00 0.56 0.00 0.00 36.38 35.09 1d6t s VAL 32 CO 0.01 0.57 -0.04 -0.31 -0.31 0.00 0.00 175.10 175.01 1d6t s TYR 33 N -0.45 3.01 0.05 2.82 1.51 0.36 -0.51 117.35 124.15 1d6t s TYR 33 Ca 0.05 -0.19 -0.07 0.00 -1.01 0.00 0.00 57.07 55.86 1d6t s TYR 33 Cb -0.11 -1.88 -0.01 0.00 -0.11 0.00 0.00 41.96 39.85 1d6t s TYR 33 CO 0.01 0.09 0.13 0.95 -1.11 0.00 0.00 175.55 175.62 1d6t s THR 34 N -0.02 0.14 0.01 -0.71 -4.23 -0.99 0.13 115.64 109.97 1d6t s THR 34 Ca 0.01 -1.15 -0.28 0.00 -1.18 0.00 0.00 61.69 59.09 1d6t s THR 34 Cb -0.13 -1.09 0.08 0.00 1.34 0.00 0.00 72.50 72.70 1d6t s THR 34 CO 0.03 -0.63 0.70 0.00 -0.54 0.00 0.00 174.62 174.18 1d6t s ASN 36 N -1.81 -0.41 0.00 0.00 2.47 -1.26 -3.50 114.94 110.43 1d6t s ASN 36 Ca -0.05 0.76 0.00 0.00 0.42 0.00 0.00 52.86 54.00 1d6t s ASN 36 Cb -0.00 0.74 0.00 0.00 -1.45 0.00 0.00 41.25 40.53 1d6t s ASN 36 CO -0.00 -0.15 0.00 -3.20 -3.72 0.00 0.00 177.10 170.03 1d6t n ASN 37 N 3.28 0.00 -3.54 -4.21 5.15 -1.26 -5.03 115.26 109.65 1d6t n ASN 37 Ca -0.16 0.00 -0.39 0.00 -0.60 0.00 0.00 54.58 53.43 1d6t n ASN 37 Cb 0.57 0.00 0.04 0.00 -0.53 0.00 0.00 39.78 39.85 1d6t n ASN 37 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1d6t n LYS 38 N 0.00 -1.90 0.03 1.20 4.01 -1.26 -4.87 118.16 115.37 1d6t n LYS 38 Ca 0.00 1.36 0.00 0.00 -0.51 0.00 0.00 58.31 59.16 1d6t n LYS 38 Cb 0.00 -2.03 0.00 0.00 -0.51 0.00 0.00 35.03 32.49 1d6t n LYS 38 CO 0.00 0.00 0.00 -1.91 -1.11 0.00 0.00 177.40 174.38 1d6t n GLU 39 N -0.40 0.00 -3.90 1.97 4.07 -1.26 -5.14 120.64 115.99 1d6t n GLU 39 Ca -0.11 0.00 -0.23 0.00 -0.06 0.00 0.00 57.16 56.76 1d6t n GLU 39 Cb 0.69 0.00 -0.05 0.00 -0.06 0.00 0.00 31.44 32.02 1d6t n GLU 39 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 1d6t s ILE 40 N -2.00 2.62 -0.00 6.31 1.10 -1.26 -5.04 121.20 122.94 1d6t s ILE 40 Ca 0.00 -1.55 0.00 0.00 -0.51 0.00 0.00 60.65 58.59 1d6t s ILE 40 Cb 0.00 -3.00 0.00 0.00 0.15 0.00 0.00 42.46 39.61 1d6t s ILE 40 CO 0.00 -0.04 0.62 0.47 -2.11 0.00 0.00 174.94 173.88 1d6t n ASP 41 N -1.35 0.40 -3.77 4.50 9.92 -1.26 -4.79 116.55 120.21 1d6t n ASP 41 Ca 0.00 -1.24 -0.10 0.00 -0.53 0.00 0.00 54.79 52.92 1d6t n ASP 41 Cb 0.63 -0.01 -0.05 0.00 -0.64 0.00 0.00 41.12 41.04 1d6t n ASP 41 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 1d6t s HIS 42 N -0.22 0.02 -0.49 1.24 3.76 -1.26 -4.50 115.29 113.83 1d6t s HIS 42 Ca 0.00 -0.37 -0.29 0.00 -0.15 0.00 0.00 55.06 54.25 1d6t s HIS 42 Cb 0.00 0.15 0.02 0.00 1.11 0.00 0.00 32.58 33.87 1d6t s HIS 42 CO 0.00 -0.71 1.25 -0.59 -0.85 0.00 0.00 174.74 173.84 1d6t s PHE 43 N -3.86 2.61 -0.37 1.40 -0.12 -1.20 -2.01 117.98 114.41 1d6t s PHE 43 Ca 0.08 0.62 -0.29 0.00 -0.05 0.00 0.00 56.93 57.28 1d6t s PHE 43 Cb 0.02 -4.42 0.02 0.00 -0.63 0.00 0.00 43.02 38.01 1d6t s PHE 43 CO -0.07 -1.59 1.11 1.03 -0.05 0.00 0.00 175.22 175.64 1d6t s ARG 44 N 4.80 3.94 -0.23 1.99 0.52 -1.24 -4.44 118.95 124.29 1d6t s ARG 44 Ca 0.51 0.91 -0.21 0.00 -0.52 0.00 0.00 55.73 56.42 1d6t s ARG 44 Cb -0.09 -3.80 -0.02 0.00 0.52 0.00 0.00 34.95 31.56 1d6t s ARG 44 CO 0.30 -1.08 0.64 -1.17 0.02 0.00 0.00 175.30 174.01 1d6t s LEU 45 N 3.97 4.10 -0.05 2.53 0.20 0.59 -1.45 118.68 128.57 1d6t s LEU 45 Ca 0.47 0.78 0.03 0.00 0.69 0.00 0.00 54.13 56.10 1d6t s LEU 45 Cb -0.11 -2.89 0.01 0.00 -0.43 0.00 0.00 46.19 42.77 1d6t s LEU 45 CO 0.21 -0.34 -0.12 -0.83 -0.29 0.00 0.00 176.35 174.99 1d6t s GLY 46 N 1.35 0.71 -0.14 7.98 0.00 -1.18 -3.67 107.32 112.36 1d6t s GLY 46 Ca 0.28 -0.42 -0.05 0.00 0.00 0.00 0.00 44.72 44.53 1d6t s GLY 46 CO 0.09 -0.02 0.04 -0.26 0.00 0.00 0.00 173.10 172.96 1d6t s ILE 47 N 0.41 4.64 -0.07 0.90 -0.00 -1.26 -1.53 121.20 124.29 1d6t s ILE 47 Ca -0.09 -0.10 -0.04 0.00 -0.00 0.00 0.00 60.65 60.42 1d6t s ILE 47 Cb -0.13 -3.04 0.03 0.00 -0.00 0.00 0.00 42.46 39.32 1d6t s ILE 47 CO 0.02 0.53 0.17 -0.44 -0.00 0.00 0.00 174.94 175.21 1d6t s SER 48 N -0.16 -0.16 0.08 4.36 0.01 -0.71 -4.98 113.70 112.15 1d6t s SER 48 Ca 0.06 0.34 -0.01 0.00 1.31 0.00 0.00 55.95 57.66 1d6t s SER 48 Cb -0.12 0.28 -0.04 0.00 0.21 0.00 0.00 66.02 66.35 1d6t s SER 48 CO 0.01 -0.11 0.00 -0.69 0.41 0.00 0.00 173.24 172.87 1d6t s VAL 49 N 0.67 0.18 0.41 3.43 1.01 -1.26 -1.72 120.40 123.14 1d6t s VAL 49 Ca -0.05 -1.85 0.01 0.00 0.00 0.00 0.00 61.98 60.09 1d6t s VAL 49 Cb -0.06 -1.71 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 1d6t s VAL 49 CO -0.03 -0.81 0.62 -0.55 0.00 0.00 0.00 175.10 174.33 1d6t s SER 50 N -2.97 5.97 0.00 3.32 0.15 -1.26 -4.93 113.70 113.98 1d6t s SER 50 Ca 0.13 0.29 0.21 0.00 0.70 0.00 0.00 55.95 57.28 1d6t s SER 50 Cb 0.08 -1.64 0.20 0.00 -1.71 0.00 0.00 66.02 62.94 1d6t s SER 50 CO -0.06 -0.57 1.18 1.17 1.20 0.00 0.00 173.24 176.16 1d6t n LYS 51 N -1.97 1.94 -0.01 5.44 0.00 -1.26 -4.09 118.16 118.22 1d6t n LYS 51 Ca -0.00 -1.80 0.09 0.00 0.00 0.00 0.00 58.31 56.60 1d6t n LYS 51 Cb 0.57 -1.40 -0.13 0.00 0.00 0.00 0.00 35.03 34.07 1d6t n LYS 51 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1d6t n LYS 52 N 1.18 0.72 -0.05 1.64 0.00 -1.26 -4.62 118.16 115.78 1d6t n LYS 52 Ca 0.13 -0.12 -0.01 0.00 0.00 0.00 0.00 58.31 58.30 1d6t n LYS 52 Cb 0.52 -1.39 -0.01 0.00 0.00 0.00 0.00 35.03 34.15 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 -1.95 -0.13 0.00 3.14 0.00 -1.26 -4.95 117.00 111.85 1d6t n LEU 53 Ca -0.02 1.06 0.00 0.00 0.00 0.00 0.00 56.01 57.06 1d6t n LEU 53 Cb 0.41 -0.45 0.00 0.00 0.00 0.00 0.00 43.42 43.38 1d6t n LEU 53 CO 0.37 -0.60 0.00 0.61 0.00 0.00 0.00 177.39 177.76 1d6t n GLY 54 N -1.03 -0.66 0.00 -3.96 0.00 -1.26 -4.83 105.19 93.44 1d6t n GLY 54 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.45 1d6t n GLY 54 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1d6t n ASN 55 N 0.00 0.00 0.04 1.61 3.02 -1.26 -5.02 115.26 113.65 1d6t n ASN 55 Ca 0.00 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.66 1d6t n ASN 55 Cb 0.00 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.07 1d6t n ASN 55 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1d6t n ALA 56 N -3.00 2.74 -0.14 5.41 0.00 -1.26 -3.60 120.51 120.67 1d6t n ALA 56 Ca 0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 53.44 53.00 1d6t n ALA 56 Cb 0.00 -0.90 0.18 0.00 0.00 0.00 0.00 19.45 18.73 1d6t n ALA 56 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1d6t h VAL 57 N 0.00 1.23 0.00 0.00 3.04 -1.98 0.92 116.25 119.46 1d6t h VAL 57 Ca 0.00 -0.83 -0.05 0.00 -1.01 0.00 0.00 66.70 64.81 1d6t h VAL 57 Cb 0.98 0.66 -0.01 0.00 -2.01 0.00 0.00 31.29 30.92 1d6t h VAL 57 CO 0.00 0.31 -0.48 0.17 -1.01 0.00 0.00 177.57 176.56 1d6t h LEU 58 N 0.82 0.00 0.00 3.16 8.10 -1.84 -2.92 115.31 122.63 1d6t h LEU 58 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.17 1d6t h LEU 58 Cb 0.30 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.52 1d6t h LEU 58 CO -0.00 0.23 -0.56 0.54 -4.11 0.00 0.00 178.44 174.54 1d6t n ARG 59 N -3.05 0.16 0.03 0.17 1.74 -0.64 -2.84 116.66 112.23 1d6t n ARG 59 Ca 0.01 0.04 -0.20 0.00 -0.77 0.00 0.00 57.85 56.93 1d6t n ARG 59 Cb 0.63 -1.60 -0.14 0.00 -1.02 0.00 0.00 32.46 30.33 1d6t n ARG 59 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 1d6t h ASN 60 N 0.00 0.45 -0.10 0.55 2.35 0.89 -2.97 115.58 116.75 1d6t h ASN 60 Ca 0.00 -0.82 -0.17 0.00 -0.55 0.00 0.00 56.30 54.76 1d6t h ASN 60 Cb 0.63 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.85 1d6t h ASN 60 CO 0.00 1.72 -0.55 0.50 -1.65 0.00 0.00 177.43 177.44 1d6t h LYS 61 N 0.08 0.69 0.00 0.81 1.63 -1.62 1.50 116.57 119.65 1d6t h LYS 61 Ca -0.36 -0.44 -0.07 0.00 -0.85 0.00 0.00 60.65 58.93 1d6t h LYS 61 Cb 2.05 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 33.73 1d6t h LYS 61 CO 0.13 1.06 -0.32 0.82 -3.45 0.00 0.00 179.45 177.69 1d6t h ILE 62 N 0.53 0.89 0.00 2.00 2.04 -1.66 -2.24 117.51 119.06 1d6t h ILE 62 Ca 0.01 -1.25 0.00 0.00 1.00 0.00 0.00 64.86 64.62 1d6t h ILE 62 Cb 1.12 1.75 0.00 0.00 -0.74 0.00 0.00 36.82 38.95 1d6t h ILE 62 CO 0.11 0.31 -0.33 1.17 0.00 0.00 0.00 178.15 179.41 1d6t n LYS 63 N -3.67 0.29 -0.31 2.37 4.81 -1.03 -3.34 118.16 117.28 1d6t n LYS 63 Ca -0.01 0.43 0.19 0.00 -0.87 0.00 0.00 58.31 58.05 1d6t n LYS 63 Cb 0.43 -1.36 0.36 0.00 0.02 0.00 0.00 35.03 34.48 1d6t n LYS 63 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 1d6t n ARG 64 N -3.79 -0.07 -0.05 1.64 1.85 0.51 0.22 116.66 116.98 1d6t n ARG 64 Ca -0.05 1.33 -0.11 0.00 -1.00 0.00 0.00 57.85 58.03 1d6t n ARG 64 Cb 0.17 -2.20 -0.05 0.00 -1.05 0.00 0.00 32.46 29.33 1d6t n ARG 64 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1d6t h ALA 65 N 1.83 0.23 -0.64 2.89 0.00 -1.57 -0.54 119.26 121.45 1d6t h ALA 65 Ca 0.63 -0.11 0.13 0.00 0.00 0.00 0.00 54.91 55.56 1d6t h ALA 65 Cb 1.45 -0.07 -0.10 0.00 0.00 0.00 0.00 17.79 19.07 1d6t h ALA 65 CO -0.81 -0.17 0.08 0.82 0.00 0.00 0.00 179.25 179.18 1d6t h ILE 66 N 0.13 0.54 -0.19 0.00 2.04 0.27 1.30 117.51 121.59 1d6t h ILE 66 Ca 0.06 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1d6t h ILE 66 Cb 0.19 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 1d6t h ILE 66 CO -0.00 0.04 0.00 -2.11 0.00 0.00 0.00 178.15 176.07 1d6t n ARG 67 N -5.21 1.66 -0.07 2.37 1.85 -0.12 -2.31 116.66 114.84 1d6t n ARG 67 Ca 0.10 -0.79 -0.06 0.00 -1.00 0.00 0.00 57.85 56.11 1d6t n ARG 67 Cb 0.37 -1.33 -0.13 0.00 -1.05 0.00 0.00 32.46 30.32 1d6t n ARG 67 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 1d6t n GLU 68 N 0.13 1.25 -0.11 2.89 2.13 0.43 -4.55 120.64 122.81 1d6t n GLU 68 Ca 0.07 -0.03 -0.19 0.00 0.66 0.00 0.00 57.16 57.67 1d6t n GLU 68 Cb 0.28 -1.41 -0.06 0.00 0.27 0.00 0.00 31.44 30.51 1d6t n GLU 68 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1d6t n ASN 69 N -2.53 1.94 -0.19 4.31 5.03 -0.42 -4.43 115.26 118.97 1d6t n ASN 69 Ca -0.23 0.35 0.19 0.00 0.87 0.00 0.00 54.58 55.75 1d6t n ASN 69 Cb 0.95 -0.79 0.34 0.00 -1.02 0.00 0.00 39.78 39.26 1d6t n ASN 69 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1d6t n PHE 70 N -4.37 0.62 0.14 3.10 3.72 -0.98 0.11 117.46 119.81 1d6t n PHE 70 Ca -0.33 0.62 -0.07 0.00 -0.05 0.00 0.00 57.45 57.63 1d6t n PHE 70 Cb 0.69 -1.06 -0.03 0.00 -0.94 0.00 0.00 39.48 38.14 1d6t n PHE 70 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1d6t h LYS 71 N 0.00 -0.39 -0.88 -1.08 1.63 -1.80 1.58 116.57 115.62 1d6t h LYS 71 Ca 0.48 0.03 0.12 0.00 -0.85 0.00 0.00 60.65 60.43 1d6t h LYS 71 Cb 1.32 0.09 -0.07 0.00 -0.60 0.00 0.00 32.23 32.97 1d6t h LYS 71 CO -0.41 -0.26 0.57 -0.39 -3.45 0.00 0.00 179.45 175.51 1d6t h VAL 72 N -0.41 0.89 0.00 2.00 -1.51 0.53 0.80 116.25 118.56 1d6t h VAL 72 Ca -0.03 -0.26 0.00 0.00 -1.23 0.00 0.00 66.70 65.17 1d6t h VAL 72 Cb 0.33 0.05 0.00 0.00 -2.13 0.00 0.00 31.29 29.54 1d6t h VAL 72 CO 0.03 0.14 0.00 0.45 -1.23 0.00 0.00 177.57 176.96 1d6t h HIS 73 N 0.77 0.00 0.00 5.19 3.86 -0.13 -2.07 115.15 122.77 1d6t h HIS 73 Ca 0.43 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.64 1d6t h HIS 73 Cb 0.58 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.05 1d6t h HIS 73 CO -0.00 0.00 0.00 -0.22 0.86 0.00 0.00 177.93 178.57 1d6t h LYS 74 N 0.00 0.00 -1.27 2.45 3.11 0.93 0.76 116.57 122.55 1d6t h LYS 74 Ca 0.00 0.00 -0.35 0.00 -2.81 0.00 0.00 60.65 57.49 1d6t h LYS 74 Cb 0.55 0.00 -0.17 0.00 -1.00 0.00 0.00 32.23 31.61 1d6t h LYS 74 CO 0.00 0.00 0.45 0.43 -2.81 0.00 0.00 179.45 177.52 1d6t n SER 75 N -2.78 5.44 0.00 4.20 7.64 -0.78 -4.05 113.62 123.30 1d6t n SER 75 Ca -0.00 -3.08 0.00 0.00 1.01 0.00 0.00 58.87 56.79 1d6t n SER 75 Cb 0.19 -0.91 0.00 0.00 -1.01 0.00 0.00 64.21 62.48 1d6t n SER 75 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1d6t n HIS 76 N -0.08 0.00 -1.48 1.43 1.44 -0.85 -5.12 115.22 110.55 1d6t n HIS 76 Ca 0.35 0.00 -0.45 0.00 -2.01 0.00 0.00 57.72 55.61 1d6t n HIS 76 Cb 0.81 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.90 1d6t n HIS 76 CO 0.00 0.00 0.00 1.51 -2.81 0.00 0.00 176.34 175.04 1d6t n ILE 77 N -0.45 1.91 -4.35 0.61 0.13 0.26 -3.85 119.36 113.62 1d6t n ILE 77 Ca 0.00 -0.50 -0.30 0.00 -1.10 0.00 0.00 62.75 60.85 1d6t n ILE 77 Cb 0.00 -0.48 -0.04 0.00 -0.84 0.00 0.00 39.64 38.28 1d6t n ILE 77 CO 0.00 0.00 0.00 -1.48 2.80 0.00 0.00 176.55 177.87 1d6t s LEU 78 N 1.85 2.49 0.14 9.51 -0.00 -1.12 -4.91 118.68 126.64 1d6t s LEU 78 Ca 0.62 -1.46 -0.31 0.00 -0.00 0.00 0.00 54.13 52.97 1d6t s LEU 78 Cb -0.78 -0.95 -0.09 0.00 -0.00 0.00 0.00 46.19 44.37 1d6t s LEU 78 CO 0.58 -0.97 1.46 0.00 -0.00 0.00 0.00 176.35 177.43 1d6t s ALA 79 N -2.83 3.67 0.00 1.48 0.00 -1.26 -3.28 121.76 119.55 1d6t s ALA 79 Ca 0.19 1.23 0.00 0.00 0.00 0.00 0.00 51.96 53.38 1d6t s ALA 79 Cb -0.00 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.55 1d6t s ALA 79 CO 0.12 -0.69 0.00 1.63 0.00 0.00 0.00 175.76 176.82 1d6t n LYS 80 N 3.85 0.00 -1.70 0.00 5.02 -0.85 -4.78 118.16 119.69 1d6t n LYS 80 Ca 0.12 0.00 -0.57 0.00 -2.02 0.00 0.00 58.31 55.84 1d6t n LYS 80 Cb 0.41 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 35.34 1d6t n LYS 80 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1d6t n ASP 81 N 0.00 2.28 -4.29 4.39 -0.08 -1.23 -3.65 116.55 113.98 1d6t n ASP 81 Ca 0.00 1.08 -0.19 0.00 -1.51 0.00 0.00 54.79 54.18 1d6t n ASP 81 Cb 0.00 -1.14 -0.11 0.00 2.34 0.00 0.00 41.12 42.21 1d6t n ASP 81 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 1d6t s ILE 82 N 3.24 1.52 -0.23 5.18 -1.16 -0.53 -2.58 121.20 126.65 1d6t s ILE 82 Ca 0.97 -1.90 -0.11 0.00 -0.51 0.00 0.00 60.65 59.11 1d6t s ILE 82 Cb -1.07 -1.74 0.08 0.00 0.61 0.00 0.00 42.46 40.34 1d6t s ILE 82 CO 0.64 -0.46 0.53 -0.63 -2.81 0.00 0.00 174.94 172.22 1d6t s ILE 83 N -2.39 -0.32 -0.20 2.00 1.01 0.12 -3.12 121.20 118.29 1d6t s ILE 83 Ca 0.14 0.07 -0.06 0.00 0.00 0.00 0.00 60.65 60.80 1d6t s ILE 83 Cb -0.04 -0.80 -0.03 0.00 0.01 0.00 0.00 42.46 41.61 1d6t s ILE 83 CO 0.04 0.03 0.03 0.68 0.00 0.00 0.00 174.94 175.72 1d6t s VAL 84 N 1.99 4.21 0.07 2.92 -7.23 -0.59 0.13 120.40 121.91 1d6t s VAL 84 Ca -0.07 -0.23 0.08 0.00 -1.81 0.00 0.00 61.98 59.96 1d6t s VAL 84 Cb -0.09 -2.91 -0.03 0.00 0.56 0.00 0.00 36.38 33.91 1d6t s VAL 84 CO -0.16 0.42 -0.23 -0.63 -0.31 0.00 0.00 175.10 174.19 1d6t s ILE 85 N 0.96 1.87 -0.40 -0.62 1.09 0.69 -1.73 121.20 123.06 1d6t s ILE 85 Ca 0.02 -1.40 -0.28 0.00 -1.10 0.00 0.00 60.65 57.90 1d6t s ILE 85 Cb -0.14 -1.64 0.02 0.00 -1.06 0.00 0.00 42.46 39.64 1d6t s ILE 85 CO 0.02 0.17 1.04 0.00 -0.10 0.00 0.00 174.94 176.07 1d6t s ALA 86 N -0.91 3.33 0.00 9.38 0.00 -0.70 -1.92 121.76 130.94 1d6t s ALA 86 Ca 0.09 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 51.67 1d6t s ALA 86 Cb -0.09 -3.70 0.00 0.00 0.00 0.00 0.00 23.12 19.32 1d6t s ALA 86 CO 0.03 -1.83 0.00 0.54 0.00 0.00 0.00 175.76 174.50 1d6t n ARG 87 N 7.19 0.00 0.05 0.00 5.12 -1.26 -4.42 116.66 123.33 1d6t n ARG 87 Ca 0.10 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.02 1d6t n ARG 87 Cb 0.48 -0.32 0.00 0.00 -1.16 0.00 0.00 32.46 31.47 1d6t n ARG 87 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1d6t n GLN 88 N 0.00 0.00 0.00 5.56 6.02 -1.26 -4.86 117.38 122.83 1d6t n GLN 88 Ca 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 57.00 57.05 1d6t n GLN 88 Cb 0.00 0.00 0.38 0.00 1.02 0.00 0.00 30.24 31.64 1d6t n GLN 88 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1d6t n PRO 89 N -2.90 0.75 -0.36 -1.09 -0.04 -1.26 -3.04 135.00 127.06 1d6t n PRO 89 Ca 0.00 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.47 1d6t n PRO 89 Cb 0.00 -1.27 0.14 0.00 -0.04 0.00 0.00 33.50 32.34 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 -0.77 3.11 0.32 0.55 0.00 -1.26 -3.77 120.51 118.70 1d6t n ALA 90 Ca 0.10 -0.77 0.13 0.00 0.00 0.00 0.00 53.44 52.90 1d6t n ALA 90 Cb 0.04 -1.06 0.33 0.00 0.00 0.00 0.00 19.45 18.76 1d6t n ALA 90 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1d6t h LYS 91 N 1.36 0.00 -0.29 0.00 5.09 -1.86 -2.92 116.57 117.95 1d6t h LYS 91 Ca 0.03 0.00 -0.07 0.00 0.09 0.00 0.00 60.65 60.70 1d6t h LYS 91 Cb 1.15 0.00 -0.04 0.00 0.10 0.00 0.00 32.23 33.44 1d6t h LYS 91 CO 0.22 0.00 -0.01 -3.47 -2.09 0.00 0.00 179.45 174.10 1d6t n ASP 92 N -2.89 3.37 -2.33 7.07 -0.08 -1.25 -4.70 116.55 115.75 1d6t n ASP 92 Ca 0.04 -3.27 0.00 0.00 -1.51 0.00 0.00 54.79 50.04 1d6t n ASP 92 Cb 0.45 -0.58 0.00 0.00 2.34 0.00 0.00 41.12 43.34 1d6t n ASP 92 CO 0.00 0.00 0.00 0.80 0.12 0.00 0.00 177.20 178.12 1d6t n MET 93 N -0.77 0.51 -3.66 -0.67 1.56 -1.10 -5.12 117.12 107.86 1d6t n MET 93 Ca 0.26 0.00 -0.15 0.00 -0.27 0.00 0.00 57.70 57.54 1d6t n MET 93 Cb 0.95 0.00 -0.08 0.00 2.15 0.00 0.00 33.22 36.24 1d6t n MET 93 CO 0.00 0.00 0.00 0.95 -0.73 0.00 0.00 175.97 176.19 1d6t s THR 94 N -0.45 0.01 0.61 1.12 -4.23 -1.26 -5.00 115.64 106.44 1d6t s THR 94 Ca 0.00 -0.12 0.25 0.00 -1.18 0.00 0.00 61.69 60.64 1d6t s THR 94 Cb 0.00 -0.78 0.35 0.00 1.34 0.00 0.00 72.50 73.41 1d6t s THR 94 CO 0.00 -0.07 1.45 0.74 -0.54 0.00 0.00 174.62 176.20 1d6t h THR 95 N 3.83 0.09 -0.01 3.99 2.02 -1.99 1.35 112.91 122.18 1d6t h THR 95 Ca -0.28 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 66.88 1d6t h THR 95 Cb 1.16 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 1d6t h THR 95 CO 0.29 0.00 -0.07 0.25 0.37 0.00 0.00 175.52 176.36 1d6t h LEU 96 N 0.00 0.08 -0.76 2.58 5.85 -1.95 -2.76 115.31 118.34 1d6t h LEU 96 Ca 0.37 -0.68 -0.09 0.00 0.84 0.00 0.00 57.88 58.31 1d6t h LEU 96 Cb 2.34 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 43.32 1d6t h LEU 96 CO -0.00 0.75 -0.08 1.56 -0.34 0.00 0.00 178.44 180.33 1d6t h GLN 97 N -0.59 0.86 -0.83 1.25 1.08 0.12 -2.57 115.11 114.44 1d6t h GLN 97 Ca -0.01 -0.28 0.08 0.00 -1.45 0.00 0.00 58.65 57.00 1d6t h GLN 97 Cb 0.75 -0.07 -0.07 0.00 -0.05 0.00 0.00 27.48 28.04 1d6t h GLN 97 CO 0.01 0.91 0.49 0.82 -0.95 0.00 0.00 178.83 180.11 1d6t h ILE 98 N 0.78 0.95 -0.12 2.54 2.04 -0.67 0.51 117.51 123.54 1d6t h ILE 98 Ca 0.13 -0.29 -0.07 0.00 1.00 0.00 0.00 64.86 65.64 1d6t h ILE 98 Cb 0.58 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 1d6t h ILE 98 CO 0.04 0.15 -0.23 1.56 0.00 0.00 0.00 178.15 179.67 1d6t h GLN 99 N 0.84 0.21 -0.01 2.37 1.08 -1.16 0.53 115.11 118.96 1d6t h GLN 99 Ca 0.39 -0.06 -0.20 0.00 -1.45 0.00 0.00 58.65 57.32 1d6t h GLN 99 Cb 0.29 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 1d6t h GLN 99 CO -0.22 0.43 -0.86 -0.91 -0.95 0.00 0.00 178.83 176.32 1d6t h ASN 100 N 0.19 0.38 0.04 1.46 2.35 -0.41 -2.32 115.58 117.28 1d6t h ASN 100 Ca 0.03 -0.30 -0.00 0.00 -0.55 0.00 0.00 56.30 55.48 1d6t h ASN 100 Cb 0.51 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.76 1d6t h ASN 100 CO 0.03 1.08 -0.02 0.28 -1.65 0.00 0.00 177.43 177.16 1d6t h SER 101 N 0.18 -0.05 -0.77 5.81 0.02 0.49 -3.21 113.55 116.02 1d6t h SER 101 Ca -0.05 -0.63 0.16 0.00 -0.84 0.00 0.00 61.79 60.43 1d6t h SER 101 Cb 1.48 0.01 -0.05 0.00 0.14 0.00 0.00 62.40 63.98 1d6t h SER 101 CO 0.14 0.66 0.51 -0.07 -1.14 0.00 0.00 176.83 176.94 1d6t h LEU 102 N -0.82 0.38 0.00 5.07 3.38 -0.04 1.29 115.31 124.57 1d6t h LEU 102 Ca -0.01 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1d6t h LEU 102 Cb 0.67 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1d6t h LEU 102 CO 0.01 0.19 0.00 -0.62 0.09 0.00 0.00 178.44 178.11 1d6t n GLU 103 N -4.48 0.42 0.00 1.13 -0.58 -0.87 -1.82 120.64 114.44 1d6t n GLU 103 Ca 0.15 0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.93 1d6t n GLU 103 Cb 0.56 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.93 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 -1.07 0.00 -0.19 -0.32 -0.00 0.40 -4.24 115.22 109.79 1d6t n HIS 104 Ca 0.11 0.00 -0.03 0.00 0.46 0.00 0.00 57.72 58.25 1d6t n HIS 104 Cb 0.07 0.05 0.03 0.00 -0.12 0.00 0.00 29.99 30.02 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 0.28 -0.40 3.57 3.04 -0.40 1.22 116.25 123.54 1d6t h VAL 105 Ca 0.00 0.00 -0.13 0.00 -1.01 0.00 0.00 66.70 65.56 1d6t h VAL 105 Cb 0.00 0.28 -0.01 0.00 -2.01 0.00 0.00 31.29 29.55 1d6t h VAL 105 CO 0.00 0.00 -0.26 0.25 -1.01 0.00 0.00 177.57 176.55 1d6t h LEU 106 N -0.10 0.93 -0.74 3.16 5.85 -1.50 -1.28 115.31 121.64 1d6t h LEU 106 Ca 0.26 -0.43 0.09 0.00 0.84 0.00 0.00 57.88 58.65 1d6t h LEU 106 Cb 0.51 -0.26 -0.07 0.00 0.37 0.00 0.00 40.66 41.21 1d6t h LEU 106 CO -0.65 1.16 0.38 0.50 -0.34 0.00 0.00 178.44 179.50 1d6t h LYS 107 N 0.71 0.63 -0.29 1.25 3.11 -0.17 0.39 116.57 122.19 1d6t h LYS 107 Ca 0.08 -0.04 -0.12 0.00 -2.81 0.00 0.00 60.65 57.76 1d6t h LYS 107 Cb 0.84 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 31.92 1d6t h LYS 107 CO 0.07 0.42 -0.33 0.82 -2.81 0.00 0.00 179.45 177.62 1d6t h ILE 108 N 0.65 1.28 -1.22 2.00 2.04 0.15 -2.81 117.51 119.61 1d6t h ILE 108 Ca 0.36 -1.46 0.42 0.00 1.00 0.00 0.00 64.86 65.19 1d6t h ILE 108 Cb 0.37 1.42 -0.14 0.00 -0.74 0.00 0.00 36.82 37.72 1d6t h ILE 108 CO -0.26 0.47 0.76 0.00 0.00 0.00 0.00 178.15 179.11 1d6t h ALA 109 N 1.11 2.53 -0.03 1.87 0.00 0.30 -3.44 119.26 121.60 1d6t h ALA 109 Ca 0.06 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1d6t h ALA 109 Cb 0.82 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1d6t h ALA 109 CO 0.07 -1.20 0.00 1.17 0.00 0.00 0.00 179.25 179.29 1d6t n LYS 110 N -4.86 0.00 -0.05 0.00 3.00 -1.06 -4.93 118.16 110.26 1d6t n LYS 110 Ca 0.37 0.00 0.07 0.00 -0.00 0.00 0.00 58.31 58.75 1d6t n LYS 110 Cb 1.36 -2.75 0.31 0.00 0.00 0.00 0.00 35.03 33.96 1d6t n LYS 110 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 1d6t n VAL 111 N -3.33 0.14 -3.98 3.15 0.24 -1.26 -4.75 118.33 108.54 1d6t n VAL 111 Ca 0.00 -0.18 -0.35 0.00 -2.04 0.00 0.00 64.34 61.77 1d6t n VAL 111 Cb 0.40 0.04 -0.12 0.00 -1.47 0.00 0.00 33.84 32.69 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 -1.86 3.10 0.35 6.34 0.40 -1.26 -2.81 117.98 122.25 1d6t s PHE 112 Ca 0.22 -0.29 0.26 0.00 -0.60 0.00 0.00 56.93 56.52 1d6t s PHE 112 Cb 0.11 -2.12 1.20 0.00 0.51 0.00 0.00 43.02 42.71 1d6t s PHE 112 CO 0.17 -0.16 1.26 0.09 0.70 0.00 0.00 175.22 177.28 1d6t n ASN 113 N 4.24 0.17 0.00 1.36 3.02 -1.25 -4.20 115.26 118.60 1d6t n ASN 113 Ca -0.17 1.12 0.00 0.00 -0.03 0.00 0.00 54.58 55.51 1d6t n ASN 113 Cb 0.52 -0.55 0.00 0.00 -0.61 0.00 0.00 39.78 39.14 1d6t n ASN 113 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1d6t n LYS 114 N -4.32 0.00 -2.72 3.52 4.01 -1.26 -5.11 118.16 112.27 1d6t n LYS 114 Ca 0.32 0.00 0.02 0.00 -0.51 0.00 0.00 58.31 58.14 1d6t n LYS 114 Cb 1.26 0.00 0.01 0.00 -0.51 0.00 0.00 35.03 35.78 1d6t n LYS 114 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 1d6t s LYS 115 N 0.00 0.11 1.00 1.97 2.20 -1.26 -5.01 119.74 118.74 1d6t s LYS 115 Ca 0.00 -0.04 -0.17 0.00 -0.36 0.00 0.00 55.97 55.40 1d6t s LYS 115 Cb 0.00 0.01 -0.13 0.00 -1.51 0.00 0.00 37.83 36.20 1d6t s LYS 115 CO 0.00 -0.16 -0.74 -0.89 -0.36 0.00 0.00 175.35 173.20 1d6t n ILE 116 N 3.58 0.00 1.08 5.43 2.08 -1.26 -5.15 119.36 125.11 1d6t n ILE 116 Ca 0.05 -0.43 0.12 0.00 0.56 0.00 0.00 62.75 63.06 1d6t n ILE 116 Cb 0.64 -0.07 0.17 0.00 -0.75 0.00 0.00 39.64 39.63 1d6t n ILE 116 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28