#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 0.00 3.17 0.00 -1.26 -5.17 117.00 113.74 1d6t n LEU 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 1d6t n LEU 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.42 1d6t n LEU 2 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.39 177.28 1d6t n LEU 3 N 0.00 0.00 0.00 -1.96 -0.00 -1.26 -5.01 117.00 108.77 1d6t n LEU 3 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1d6t n LEU 3 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1d6t n LEU 3 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 177.39 178.60 1d6t n GLU 4 N 0.00 0.00 0.00 1.96 2.13 -1.26 -3.12 120.64 120.35 1d6t n GLU 4 Ca 0.00 0.00 0.04 0.00 0.66 0.00 0.00 57.16 57.86 1d6t n GLU 4 Cb 0.00 0.00 0.18 0.00 0.27 0.00 0.00 31.44 31.89 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 7.89 0.09 0.00 5.31 2.85 -1.26 -0.37 118.16 132.67 1d6t n LYS 5 Ca 0.00 0.24 0.14 0.00 -1.05 0.00 0.00 58.31 57.64 1d6t n LYS 5 Cb 0.00 -1.50 0.61 0.00 -0.65 0.00 0.00 35.03 33.49 1d6t n LYS 5 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1d6t n ALA 6 N -1.32 2.73 -2.03 0.58 0.00 -1.18 -3.76 120.51 115.54 1d6t n ALA 6 Ca 0.03 -0.24 -0.00 0.00 0.00 0.00 0.00 53.44 53.23 1d6t n ALA 6 Cb 0.06 -1.36 -0.00 0.00 0.00 0.00 0.00 19.45 18.16 1d6t n ALA 6 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1d6t n TYR 7 N -1.09 0.00 -3.02 0.00 4.02 0.50 -4.83 117.16 112.74 1d6t n TYR 7 Ca 0.13 -0.06 -0.22 0.00 -0.01 0.00 0.00 57.90 57.74 1d6t n TYR 7 Cb 0.28 0.09 0.01 0.00 -0.02 0.00 0.00 39.34 39.70 1d6t n TYR 7 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 176.86 174.87 1d6t s ARG 8 N 0.00 3.02 -0.27 -0.72 1.70 -0.43 -3.99 118.95 118.26 1d6t s ARG 8 Ca 0.02 -0.60 -0.02 0.00 -0.47 0.00 0.00 55.73 54.66 1d6t s ARG 8 Cb 0.02 -2.59 0.03 0.00 -0.57 0.00 0.00 34.95 31.85 1d6t s ARG 8 CO -0.01 -0.27 -0.03 0.42 -1.08 0.00 0.00 175.30 174.33 1d6t s ILE 9 N -2.52 2.94 0.59 4.99 -1.09 -1.26 -4.86 121.20 119.99 1d6t s ILE 9 Ca 0.49 -1.16 0.33 0.00 -2.23 0.00 0.00 60.65 58.08 1d6t s ILE 9 Cb -0.10 -2.57 0.48 0.00 -1.58 0.00 0.00 42.46 38.68 1d6t s ILE 9 CO 0.37 0.07 1.51 0.11 -1.23 0.00 0.00 174.94 175.77 1d6t h LYS 10 N 8.01 0.00 0.00 2.79 1.57 -1.96 -3.43 116.57 123.55 1d6t h LYS 10 Ca -0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1d6t h LYS 10 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1d6t h LYS 10 CO 0.56 0.00 0.00 0.36 -0.57 0.00 0.00 179.45 179.80 1d6t n LYS 11 N -3.55 0.00 0.00 3.15 2.85 -1.26 -4.80 118.16 114.55 1d6t n LYS 11 Ca 0.25 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.51 1d6t n LYS 11 Cb 1.45 -0.74 0.00 0.00 -0.65 0.00 0.00 35.03 35.09 1d6t n LYS 11 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1d6t n ASN 12 N 0.00 0.00 -0.14 -5.58 5.15 -1.26 -4.58 115.26 108.84 1d6t n ASN 12 Ca 0.00 0.00 -0.05 0.00 -0.60 0.00 0.00 54.58 53.93 1d6t n ASN 12 Cb 0.00 0.00 0.02 0.00 -0.53 0.00 0.00 39.78 39.27 1d6t n ASN 12 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1d6t h ALA 13 N 1.00 0.11 -0.01 5.20 0.00 -1.97 2.61 119.26 126.20 1d6t h ALA 13 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1d6t h ALA 13 Cb 0.00 0.54 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1d6t h ALA 13 CO 0.00 -0.57 0.18 -0.44 0.00 0.00 0.00 179.25 178.42 1d6t h ASP 14 N -0.12 0.00 0.09 0.00 3.32 -1.90 0.94 116.42 118.74 1d6t h ASP 14 Ca 0.22 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.91 1d6t h ASP 14 Cb 0.46 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.95 1d6t h ASP 14 CO -0.54 0.00 -2.27 0.49 -1.72 0.00 0.00 179.24 175.20 1d6t n PHE 15 N -3.01 0.19 0.08 4.55 3.01 0.52 -4.20 117.46 118.61 1d6t n PHE 15 Ca -0.02 0.07 -0.17 0.00 1.01 0.00 0.00 57.45 58.34 1d6t n PHE 15 Cb 0.24 -1.03 -0.09 0.00 -0.01 0.00 0.00 39.48 38.59 1d6t n PHE 15 CO 0.00 0.00 0.00 -0.56 1.01 0.00 0.00 176.76 177.21 1d6t h GLN 16 N 0.00 0.46 0.00 -1.08 -0.00 0.64 -2.80 115.11 112.33 1d6t h GLN 16 Ca -0.50 -0.57 0.00 0.00 -0.00 0.00 0.00 58.65 57.57 1d6t h GLN 16 Cb 2.19 0.18 0.00 0.00 -0.00 0.00 0.00 27.48 29.85 1d6t h GLN 16 CO 0.03 1.22 0.00 2.89 -0.00 0.00 0.00 178.83 182.97 1d6t n ARG 17 N -3.73 0.05 -0.09 0.06 1.85 0.30 -1.15 116.66 113.96 1d6t n ARG 17 Ca -0.09 0.41 -0.14 0.00 -1.00 0.00 0.00 57.85 57.03 1d6t n ARG 17 Cb 0.91 -1.63 -0.06 0.00 -1.05 0.00 0.00 32.46 30.63 1d6t n ARG 17 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 1d6t n ILE 18 N -1.73 1.48 0.24 8.89 2.08 -1.14 -4.13 119.36 125.03 1d6t n ILE 18 Ca 0.01 0.07 0.14 0.00 0.56 0.00 0.00 62.75 63.53 1d6t n ILE 18 Cb 0.11 -2.21 0.70 0.00 -0.75 0.00 0.00 39.64 37.49 1d6t n ILE 18 CO 0.00 0.00 0.00 1.88 0.56 0.00 0.00 176.55 178.99 1d6t h TYR 19 N -1.00 0.00 0.00 1.39 -1.99 -1.27 0.67 116.97 114.77 1d6t h TYR 19 Ca -0.19 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.54 1d6t h TYR 19 Cb 0.95 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.68 1d6t h TYR 19 CO -0.11 0.00 0.00 1.17 -0.00 0.00 0.00 178.16 179.22 1d6t n LYS 20 N -2.45 0.00 -0.15 4.88 0.00 -0.30 -4.37 118.16 115.77 1d6t n LYS 20 Ca -0.01 0.36 0.02 0.00 0.00 0.00 0.00 58.31 58.68 1d6t n LYS 20 Cb 0.08 -1.13 0.03 0.00 0.00 0.00 0.00 35.03 34.01 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 -1.18 0.94 -1.11 1.64 5.02 -1.21 -5.08 118.16 117.17 1d6t n LYS 21 Ca 0.00 -1.29 -0.28 0.00 -2.02 0.00 0.00 58.31 54.71 1d6t n LYS 21 Cb 0.00 -0.82 0.19 0.00 -0.02 0.00 0.00 35.03 34.38 1d6t n LYS 21 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1d6t s GLY 22 N -1.10 1.56 -0.30 0.72 0.00 0.23 -5.02 107.32 103.42 1d6t s GLY 22 Ca 0.07 -0.37 0.03 0.00 0.00 0.00 0.00 44.72 44.45 1d6t s GLY 22 CO 0.01 0.26 -0.03 -1.58 0.00 0.00 0.00 173.10 171.75 1d6t s HIS 23 N -2.93 3.50 0.44 1.90 2.46 -1.03 -4.87 115.29 114.76 1d6t s HIS 23 Ca 0.66 -2.63 -0.09 0.00 0.47 0.00 0.00 55.06 53.47 1d6t s HIS 23 Cb -0.19 -2.39 -0.05 0.00 -0.13 0.00 0.00 32.58 29.81 1d6t s HIS 23 CO 0.58 -0.91 0.79 -1.54 -2.47 0.00 0.00 174.74 171.19 1d6t s SER 24 N 1.02 6.43 -0.06 9.88 1.04 -1.26 -3.07 113.70 127.68 1d6t s SER 24 Ca 0.00 1.09 -0.02 0.00 0.48 0.00 0.00 55.95 57.50 1d6t s SER 24 Cb -0.20 -2.31 0.04 0.00 0.10 0.00 0.00 66.02 63.65 1d6t s SER 24 CO -0.06 -0.48 0.11 0.68 0.98 0.00 0.00 173.24 174.47 1d6t s VAL 25 N -2.53 -0.13 -0.04 5.02 -7.23 -1.12 -4.97 120.40 109.40 1d6t s VAL 25 Ca 0.50 0.29 0.07 0.00 -1.81 0.00 0.00 61.98 61.03 1d6t s VAL 25 Cb -0.10 -0.21 -0.01 0.00 0.56 0.00 0.00 36.38 36.61 1d6t s VAL 25 CO 0.37 0.12 -0.25 0.00 -0.31 0.00 0.00 175.10 175.03 1d6t s ALA 26 N 1.69 2.08 0.00 1.32 0.00 -1.26 0.14 121.76 125.73 1d6t s ALA 26 Ca -0.03 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 50.89 1d6t s ALA 26 Cb -0.12 -0.59 0.00 0.00 0.00 0.00 0.00 23.12 22.41 1d6t s ALA 26 CO -0.05 0.46 0.00 0.27 0.00 0.00 0.00 175.76 176.44 1d6t n ASN 27 N 2.69 0.00 0.00 0.00 6.94 0.33 -4.97 115.26 120.25 1d6t n ASN 27 Ca -0.17 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.39 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 -0.13 0.00 -2.26 -3.83 1.74 -1.26 -4.88 116.66 106.04 1d6t n ARG 28 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1d6t n ARG 28 Cb 0.00 -0.76 0.04 0.00 -1.02 0.00 0.00 32.46 30.73 1d6t n ARG 28 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1d6t n GLN 29 N -2.57 1.02 -3.63 5.56 -0.00 -1.26 -4.93 117.38 111.56 1d6t n GLN 29 Ca 0.00 -2.51 -0.12 0.00 -0.00 0.00 0.00 57.00 54.37 1d6t n GLN 29 Cb 0.44 -0.65 -0.07 0.00 -0.00 0.00 0.00 30.24 29.95 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 -1.79 -0.75 0.03 2.61 2.19 -1.26 -3.46 117.98 115.56 1d6t s PHE 30 Ca 0.24 1.79 0.06 0.00 0.33 0.00 0.00 56.93 59.34 1d6t s PHE 30 Cb 0.33 0.32 -0.02 0.00 -1.31 0.00 0.00 43.02 42.34 1d6t s PHE 30 CO -0.09 -0.36 -0.16 0.14 1.83 0.00 0.00 175.22 176.58 1d6t s VAL 31 N 0.46 1.30 -0.26 3.12 -7.23 0.13 -0.52 120.40 117.41 1d6t s VAL 31 Ca -0.00 -0.98 -0.01 0.00 -1.81 0.00 0.00 61.98 59.18 1d6t s VAL 31 Cb -0.05 -1.14 0.08 0.00 0.56 0.00 0.00 36.38 35.83 1d6t s VAL 31 CO -0.02 0.15 0.05 0.68 -0.31 0.00 0.00 175.10 175.65 1d6t s VAL 32 N -0.72 0.87 -0.13 1.32 -7.23 0.12 0.16 120.40 114.79 1d6t s VAL 32 Ca 0.04 -1.09 -0.29 0.00 -1.81 0.00 0.00 61.98 58.84 1d6t s VAL 32 Cb -0.08 -1.48 -0.01 0.00 0.56 0.00 0.00 36.38 35.38 1d6t s VAL 32 CO 0.01 -0.42 0.98 -0.31 -0.31 0.00 0.00 175.10 175.05 1d6t s TYR 33 N 1.66 3.47 0.01 2.82 1.51 0.60 -2.80 117.35 124.62 1d6t s TYR 33 Ca 0.04 1.52 -0.03 0.00 -1.01 0.00 0.00 57.07 57.58 1d6t s TYR 33 Cb -0.17 -3.17 -0.01 0.00 -0.11 0.00 0.00 41.96 38.50 1d6t s TYR 33 CO -0.16 -0.26 0.04 0.95 -1.11 0.00 0.00 175.55 175.01 1d6t s THR 34 N 2.20 0.10 -3.92 -0.71 -4.23 -1.17 0.74 115.64 108.65 1d6t s THR 34 Ca 0.46 -0.82 0.00 0.00 -1.18 0.00 0.00 61.69 60.14 1d6t s THR 34 Cb -0.17 -0.34 0.00 0.00 1.34 0.00 0.00 72.50 73.33 1d6t s THR 34 CO 0.15 -0.45 0.00 0.00 -0.54 0.00 0.00 174.62 173.78 1d6t n ASN 36 N 2.35 -0.53 -0.28 0.00 4.13 -1.26 -3.32 115.26 116.35 1d6t n ASN 36 Ca 0.00 -2.31 0.00 0.00 1.68 0.00 0.00 54.58 53.95 1d6t n ASN 36 Cb 0.00 1.16 0.00 0.00 -1.54 0.00 0.00 39.78 39.40 1d6t n ASN 36 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1d6t n ASN 37 N -2.10 0.00 0.00 6.41 2.85 -1.26 -4.92 115.26 116.23 1d6t n ASN 37 Ca 0.04 -1.45 0.00 0.00 -0.11 0.00 0.00 54.58 53.06 1d6t n ASN 37 Cb 0.37 -0.09 0.00 0.00 1.24 0.00 0.00 39.78 41.30 1d6t n ASN 37 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 1d6t n LYS 38 N 0.00 0.00 -3.15 1.20 5.02 -1.26 -5.09 118.16 114.88 1d6t n LYS 38 Ca 0.00 0.00 0.06 0.00 -2.02 0.00 0.00 58.31 56.35 1d6t n LYS 38 Cb 0.59 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.58 1d6t n LYS 38 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1d6t s GLU 39 N 0.00 0.04 0.00 1.97 -1.05 -1.26 -5.18 118.70 113.22 1d6t s GLU 39 Ca 0.00 0.06 0.00 0.00 -0.15 0.00 0.00 54.97 54.88 1d6t s GLU 39 Cb 0.00 0.03 0.00 0.00 -0.44 0.00 0.00 34.13 33.72 1d6t s GLU 39 CO 0.00 -0.04 0.00 1.51 0.95 0.00 0.00 175.26 177.68 1d6t n ILE 40 N 5.40 0.00 -1.72 1.83 0.13 -1.26 -5.06 119.36 118.68 1d6t n ILE 40 Ca -0.05 0.00 -0.03 0.00 -1.10 0.00 0.00 62.75 61.57 1d6t n ILE 40 Cb 0.56 -1.43 -0.03 0.00 -0.84 0.00 0.00 39.64 37.90 1d6t n ILE 40 CO 0.00 0.00 0.00 -0.67 2.80 0.00 0.00 176.55 178.68 1d6t n ASP 41 N -0.52 -0.37 -3.44 9.51 -0.08 -1.26 -4.99 116.55 115.40 1d6t n ASP 41 Ca 0.00 -0.97 -0.12 0.00 -1.51 0.00 0.00 54.79 52.18 1d6t n ASP 41 Cb 0.00 0.11 -0.03 0.00 2.34 0.00 0.00 41.12 43.55 1d6t n ASP 41 CO 0.00 0.00 0.00 -1.00 0.12 0.00 0.00 177.20 176.32 1d6t s HIS 42 N 0.00 -0.54 -0.26 -0.67 0.09 -1.26 -4.80 115.29 107.86 1d6t s HIS 42 Ca 0.00 0.43 -0.06 0.00 -0.00 0.00 0.00 55.06 55.44 1d6t s HIS 42 Cb 0.00 0.54 -0.01 0.00 -0.00 0.00 0.00 32.58 33.11 1d6t s HIS 42 CO 0.00 -0.78 0.03 -0.59 -0.00 0.00 0.00 174.74 173.40 1d6t s PHE 43 N -3.31 3.07 -0.90 1.40 -0.71 -1.26 -1.18 117.98 115.09 1d6t s PHE 43 Ca -0.00 -0.83 -0.01 0.00 -1.04 0.00 0.00 56.93 55.05 1d6t s PHE 43 Cb -0.01 -2.19 0.23 0.00 -1.21 0.00 0.00 43.02 39.84 1d6t s PHE 43 CO -0.09 -0.51 0.83 0.54 -1.34 0.00 0.00 175.22 174.65 1d6t n ARG 44 N 4.85 2.76 -2.82 1.99 1.74 -1.26 -4.71 116.66 119.21 1d6t n ARG 44 Ca -0.16 -4.50 -0.42 0.00 -0.77 0.00 0.00 57.85 52.00 1d6t n ARG 44 Cb 0.50 -2.41 -0.04 0.00 -1.02 0.00 0.00 32.46 29.49 1d6t n ARG 44 CO 0.00 0.00 0.00 -0.48 -1.52 0.00 0.00 177.63 175.63 1d6t s LEU 45 N -1.56 4.08 0.00 0.55 -0.00 -1.25 -3.34 118.68 117.16 1d6t s LEU 45 Ca 0.29 1.13 0.04 0.00 -0.00 0.00 0.00 54.13 55.59 1d6t s LEU 45 Cb -0.05 -3.30 0.04 0.00 -0.00 0.00 0.00 46.19 42.88 1d6t s LEU 45 CO -0.11 -0.57 0.31 0.61 -0.00 0.00 0.00 176.35 176.59 1d6t n GLY 46 N 3.63 2.20 2.73 -3.48 0.00 -1.23 -4.72 105.19 104.32 1d6t n GLY 46 Ca 0.08 -2.19 -0.26 0.00 0.00 0.00 0.00 46.02 43.65 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 -0.73 0.37 0.15 -0.61 1.01 -1.26 -3.49 121.20 116.63 1d6t s ILE 47 Ca 0.23 -0.24 0.03 0.00 0.00 0.00 0.00 60.65 60.67 1d6t s ILE 47 Cb -0.02 -0.77 -0.04 0.00 0.01 0.00 0.00 42.46 41.63 1d6t s ILE 47 CO 0.15 -0.05 -0.07 -0.44 0.00 0.00 0.00 174.94 174.53 1d6t s SER 48 N 1.94 1.56 0.00 3.58 0.01 -0.47 -5.03 113.70 115.29 1d6t s SER 48 Ca 0.02 -1.05 0.00 0.00 1.31 0.00 0.00 55.95 56.22 1d6t s SER 48 Cb -0.15 0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.11 1d6t s SER 48 CO -0.07 -0.41 0.00 0.52 0.41 0.00 0.00 173.24 173.69 1d6t n VAL 49 N -0.19 0.00 -3.60 3.43 0.31 -1.26 -1.20 118.33 115.82 1d6t n VAL 49 Ca -0.10 0.00 -0.23 0.00 -0.01 0.00 0.00 64.34 64.01 1d6t n VAL 49 Cb 0.61 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.54 1d6t n VAL 49 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1d6t s SER 50 N 1.00 4.90 0.00 4.52 0.15 -1.05 -3.93 113.70 119.29 1d6t s SER 50 Ca 0.00 -0.95 0.30 0.00 0.70 0.00 0.00 55.95 56.00 1d6t s SER 50 Cb 0.00 -0.06 1.45 0.00 -1.71 0.00 0.00 66.02 65.70 1d6t s SER 50 CO 0.00 -0.93 1.98 1.17 1.20 0.00 0.00 173.24 176.65 1d6t n LYS 51 N -1.74 1.06 -0.01 5.44 0.00 -1.26 -3.13 118.16 118.53 1d6t n LYS 51 Ca 0.04 -0.33 0.05 0.00 0.00 0.00 0.00 58.31 58.06 1d6t n LYS 51 Cb 0.63 -1.49 -0.08 0.00 0.00 0.00 0.00 35.03 34.09 1d6t n LYS 51 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1d6t n LYS 52 N -0.68 0.41 0.00 1.64 5.02 -1.26 -4.90 118.16 118.40 1d6t n LYS 52 Ca 0.19 -0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 1d6t n LYS 52 Cb 0.23 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 34.00 1d6t n LYS 52 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1d6t n LEU 53 N -1.88 0.00 -2.86 -0.35 4.77 -1.18 -5.01 117.00 110.49 1d6t n LEU 53 Ca -0.03 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.93 1d6t n LEU 53 Cb 0.29 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.36 1d6t n LEU 53 CO 0.21 0.00 -0.37 0.61 -1.33 0.00 0.00 177.39 176.51 1d6t n GLY 54 N 4.41 -2.58 3.49 -0.72 0.00 -1.25 -4.99 105.19 103.55 1d6t n GLY 54 Ca 0.00 0.81 -0.01 0.00 0.00 0.00 0.00 46.02 46.82 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 1.94 -1.42 -0.02 1.61 5.15 -1.26 -5.01 115.26 116.24 1d6t n ASN 55 Ca -0.18 -1.64 0.07 0.00 -0.60 0.00 0.00 54.58 52.22 1d6t n ASN 55 Cb 0.32 2.28 -0.15 0.00 -0.53 0.00 0.00 39.78 41.70 1d6t n ASN 55 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1d6t n ALA 56 N -1.04 2.52 0.03 5.20 0.00 -1.26 -2.86 120.51 123.10 1d6t n ALA 56 Ca -0.12 -0.61 -0.12 0.00 0.00 0.00 0.00 53.44 52.59 1d6t n ALA 56 Cb 0.52 -0.59 -0.14 0.00 0.00 0.00 0.00 19.45 19.25 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 1.15 0.12 0.00 3.04 -1.97 -3.10 116.25 115.49 1d6t h VAL 57 Ca -0.09 -2.88 -0.23 0.00 -1.01 0.00 0.00 66.70 62.48 1d6t h VAL 57 Cb 1.14 2.66 0.00 0.00 -2.01 0.00 0.00 31.29 33.08 1d6t h VAL 57 CO 0.01 0.75 -1.15 0.17 -1.01 0.00 0.00 177.57 176.34 1d6t h LEU 58 N 0.03 0.38 0.00 3.16 8.10 -1.81 -3.20 115.31 121.97 1d6t h LEU 58 Ca -0.21 -0.88 0.00 0.00 0.11 0.00 0.00 57.88 56.90 1d6t h LEU 58 Cb 1.96 -0.13 0.00 0.00 -0.44 0.00 0.00 40.66 42.06 1d6t h LEU 58 CO 0.12 1.51 0.00 -2.11 -4.11 0.00 0.00 178.44 173.86 1d6t n ARG 59 N -4.04 0.25 -0.00 0.17 -4.01 -1.14 0.14 116.66 108.03 1d6t n ARG 59 Ca -0.21 0.11 0.10 0.00 -1.04 0.00 0.00 57.85 56.81 1d6t n ARG 59 Cb 0.85 -1.50 -0.14 0.00 -3.04 0.00 0.00 32.46 28.63 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 -1.17 0.60 -0.01 2.89 3.02 -1.17 -2.85 115.26 116.56 1d6t n ASN 60 Ca 0.07 -0.50 0.01 0.00 -0.03 0.00 0.00 54.58 54.13 1d6t n ASN 60 Cb 0.07 1.47 -0.00 0.00 -0.61 0.00 0.00 39.78 40.71 1d6t n ASN 60 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1d6t n LYS 61 N -1.84 5.22 -0.04 3.52 3.00 0.17 -3.66 118.16 124.53 1d6t n LYS 61 Ca 0.00 -0.11 -0.01 0.00 -0.00 0.00 0.00 58.31 58.20 1d6t n LYS 61 Cb 0.43 -0.64 -0.10 0.00 0.00 0.00 0.00 35.03 34.71 1d6t n LYS 61 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1d6t n ILE 62 N -0.82 0.50 -0.09 3.15 5.41 0.38 -4.27 119.36 123.62 1d6t n ILE 62 Ca 0.00 -0.44 -0.10 0.00 1.00 0.00 0.00 62.75 63.21 1d6t n ILE 62 Cb 0.02 -0.29 -0.14 0.00 -0.71 0.00 0.00 39.64 38.52 1d6t n ILE 62 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1d6t n LYS 63 N -2.26 1.01 0.00 0.38 5.02 -1.13 -3.84 118.16 117.33 1d6t n LYS 63 Ca -0.13 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.17 1d6t n LYS 63 Cb 0.68 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 34.22 1d6t n LYS 63 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1d6t n ARG 64 N -2.72 0.00 -0.08 1.97 0.63 -1.24 0.61 116.66 115.83 1d6t n ARG 64 Ca -0.31 0.48 0.17 0.00 -0.92 0.00 0.00 57.85 57.27 1d6t n ARG 64 Cb 1.07 -1.42 0.59 0.00 0.45 0.00 0.00 32.46 33.15 1d6t n ARG 64 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1d6t h ALA 65 N -2.00 2.29 -0.55 5.13 0.00 -1.80 0.30 119.26 122.64 1d6t h ALA 65 Ca 0.00 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1d6t h ALA 65 Cb 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1d6t h ALA 65 CO 0.00 -0.46 -0.01 0.82 0.00 0.00 0.00 179.25 179.60 1d6t h ILE 66 N 0.21 1.26 -0.02 0.00 5.03 -1.63 0.36 117.51 122.73 1d6t h ILE 66 Ca 0.30 -1.13 0.00 0.00 -0.12 0.00 0.00 64.86 63.92 1d6t h ILE 66 Cb 0.89 0.90 0.00 0.00 -3.03 0.00 0.00 36.82 35.58 1d6t h ILE 66 CO -0.06 0.40 0.00 -1.14 -0.68 0.00 0.00 178.15 176.67 1d6t n ARG 67 N -4.25 1.15 0.00 2.37 0.63 0.20 -2.83 116.66 113.93 1d6t n ARG 67 Ca 0.02 -0.23 0.00 0.00 -0.92 0.00 0.00 57.85 56.72 1d6t n ARG 67 Cb 0.34 -1.42 0.00 0.00 0.45 0.00 0.00 32.46 31.83 1d6t n ARG 67 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 1d6t n GLU 68 N -0.66 -0.30 -0.08 -0.14 2.13 0.03 -4.32 120.64 117.31 1d6t n GLU 68 Ca 0.19 -0.47 -0.08 0.00 0.66 0.00 0.00 57.16 57.47 1d6t n GLU 68 Cb 0.15 -0.96 -0.03 0.00 0.27 0.00 0.00 31.44 30.87 1d6t n GLU 68 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1d6t n ASN 69 N -0.08 1.80 0.17 4.31 2.85 0.12 -4.20 115.26 120.23 1d6t n ASN 69 Ca 0.00 0.37 0.13 0.00 -0.11 0.00 0.00 54.58 54.97 1d6t n ASN 69 Cb 0.00 -0.75 0.57 0.00 1.24 0.00 0.00 39.78 40.85 1d6t n ASN 69 CO 0.00 0.00 0.00 -0.26 -2.11 0.00 0.00 177.26 174.89 1d6t h PHE 70 N -0.94 0.00 -0.28 1.20 -1.00 -1.79 -1.58 116.94 112.55 1d6t h PHE 70 Ca 0.00 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.71 1d6t h PHE 70 Cb 0.85 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.41 1d6t h PHE 70 CO -0.37 0.00 -0.11 -0.22 -1.61 0.00 0.00 178.31 176.00 1d6t h LYS 71 N 0.00 0.56 0.10 1.51 1.63 -1.77 0.54 116.57 119.14 1d6t h LYS 71 Ca 0.00 -0.24 -0.24 0.00 -0.85 0.00 0.00 60.65 59.32 1d6t h LYS 71 Cb 0.34 -0.02 0.02 0.00 -0.60 0.00 0.00 32.23 31.97 1d6t h LYS 71 CO 0.00 0.80 -1.00 -0.39 -3.45 0.00 0.00 179.45 175.40 1d6t h VAL 72 N 0.31 1.37 -0.00 2.00 -1.51 -1.64 -3.05 116.25 113.72 1d6t h VAL 72 Ca 0.06 -2.39 0.00 0.00 -1.23 0.00 0.00 66.70 63.14 1d6t h VAL 72 Cb 0.62 2.80 0.00 0.00 -2.13 0.00 0.00 31.29 32.57 1d6t h VAL 72 CO 0.04 0.71 0.00 1.41 -1.23 0.00 0.00 177.57 178.50 1d6t n HIS 73 N -3.97 0.00 -0.25 5.19 8.25 -0.63 -3.85 115.22 119.97 1d6t n HIS 73 Ca -0.13 -0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.38 1d6t n HIS 73 Cb 0.88 0.00 0.18 0.00 1.12 0.00 0.00 29.99 32.17 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 0.33 -0.08 -0.41 3.64 0.20 1.78 116.57 122.04 1d6t h LYS 74 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1d6t h LYS 74 Cb 0.00 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1d6t h LYS 74 CO 0.00 0.22 0.00 0.43 -2.27 0.00 0.00 179.45 177.83 1d6t n SER 75 N -5.09 0.48 -0.06 4.20 7.64 -1.25 -3.22 113.62 116.32 1d6t n SER 75 Ca 0.14 -1.91 -0.08 0.00 1.01 0.00 0.00 58.87 58.03 1d6t n SER 75 Cb 0.43 -0.05 -0.07 0.00 -1.01 0.00 0.00 64.21 63.51 1d6t n SER 75 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1d6t n HIS 76 N -0.28 0.00 -2.38 1.43 8.25 0.55 -5.00 115.22 117.79 1d6t n HIS 76 Ca 0.05 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.13 1d6t n HIS 76 Cb 0.09 -0.50 -0.03 0.00 1.12 0.00 0.00 29.99 30.67 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 -2.26 3.35 0.44 1.59 1.09 0.21 -3.59 121.20 122.03 1d6t s ILE 77 Ca -0.13 1.14 0.07 0.00 -1.10 0.00 0.00 60.65 60.63 1d6t s ILE 77 Cb 0.04 -3.64 -0.02 0.00 -1.06 0.00 0.00 42.46 37.78 1d6t s ILE 77 CO 0.34 0.11 0.35 -1.48 -0.10 0.00 0.00 174.94 174.16 1d6t s LEU 78 N -2.37 3.24 -0.10 2.97 -0.00 -1.25 -4.94 118.68 116.23 1d6t s LEU 78 Ca 0.55 -0.88 -0.30 0.00 -0.00 0.00 0.00 54.13 53.51 1d6t s LEU 78 Cb -0.29 -1.81 -0.07 0.00 -0.00 0.00 0.00 46.19 44.02 1d6t s LEU 78 CO 0.36 -0.70 2.09 0.00 -0.00 0.00 0.00 176.35 178.10 1d6t n ALA 79 N -1.53 1.62 0.00 1.48 0.00 -1.26 -4.31 120.51 116.51 1d6t n ALA 79 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1d6t n ALA 79 Cb 0.63 -2.78 0.00 0.00 0.00 0.00 0.00 19.45 17.30 1d6t n ALA 79 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1d6t n LYS 80 N 8.07 0.00 -1.47 0.00 4.81 -0.32 -4.70 118.16 124.54 1d6t n LYS 80 Ca 0.26 0.00 -0.44 0.00 -0.87 0.00 0.00 58.31 57.26 1d6t n LYS 80 Cb 0.41 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 35.36 1d6t n LYS 80 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1d6t n ASP 81 N 0.00 1.22 -4.70 3.14 9.92 -1.21 -4.23 116.55 120.69 1d6t n ASP 81 Ca 0.00 0.10 -0.23 0.00 -0.53 0.00 0.00 54.79 54.13 1d6t n ASP 81 Cb 0.00 -1.15 -0.06 0.00 -0.64 0.00 0.00 41.12 39.26 1d6t n ASP 81 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1d6t s ILE 82 N 9.17 3.76 -0.30 0.53 -1.16 -1.21 -2.76 121.20 129.23 1d6t s ILE 82 Ca 1.19 -1.71 -0.04 0.00 -0.51 0.00 0.00 60.65 59.58 1d6t s ILE 82 Cb -0.93 -3.00 0.18 0.00 0.61 0.00 0.00 42.46 39.31 1d6t s ILE 82 CO 0.45 -0.34 0.64 -0.63 -2.81 0.00 0.00 174.94 172.25 1d6t s ILE 83 N -2.20 -0.96 -0.29 2.00 1.01 0.23 -3.54 121.20 117.44 1d6t s ILE 83 Ca 0.31 0.00 -0.17 0.00 0.00 0.00 0.00 60.65 60.80 1d6t s ILE 83 Cb -0.07 -1.00 -0.02 0.00 0.01 0.00 0.00 42.46 41.37 1d6t s ILE 83 CO 0.21 0.00 0.45 0.68 0.00 0.00 0.00 174.94 176.28 1d6t s VAL 84 N 2.87 5.10 0.14 2.92 -7.23 -1.23 0.22 120.40 123.19 1d6t s VAL 84 Ca 0.14 0.60 0.11 0.00 -1.81 0.00 0.00 61.98 61.01 1d6t s VAL 84 Cb -0.14 -3.81 -0.04 0.00 0.56 0.00 0.00 36.38 32.95 1d6t s VAL 84 CO -0.20 0.04 -0.25 -0.63 -0.31 0.00 0.00 175.10 173.75 1d6t s ILE 85 N 2.22 2.38 -0.09 -0.62 1.09 0.41 -1.37 121.20 125.23 1d6t s ILE 85 Ca 0.18 -1.76 -0.22 0.00 -1.10 0.00 0.00 60.65 57.75 1d6t s ILE 85 Cb -0.16 -2.08 -0.04 0.00 -1.06 0.00 0.00 42.46 39.13 1d6t s ILE 85 CO 0.10 0.06 0.64 0.00 -0.10 0.00 0.00 174.94 175.64 1d6t s ALA 86 N -1.17 3.39 0.01 9.38 0.00 -0.34 0.20 121.76 133.21 1d6t s ALA 86 Ca 0.16 0.02 -0.03 0.00 0.00 0.00 0.00 51.96 52.11 1d6t s ALA 86 Cb -0.10 -2.87 -0.01 0.00 0.00 0.00 0.00 23.12 20.13 1d6t s ALA 86 CO 0.07 -0.10 1.05 0.00 0.00 0.00 0.00 175.76 176.78 1d6t h ARG 87 N 6.79 -0.08 0.00 0.00 2.47 -1.87 -2.78 114.38 118.91 1d6t h ARG 87 Ca -0.40 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.32 1d6t h ARG 87 Cb 1.19 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.53 1d6t h ARG 87 CO 0.76 -0.05 0.00 0.94 0.56 0.00 0.00 179.97 182.17 1d6t n GLN 88 N -2.60 0.00 0.00 0.04 0.00 -1.26 -4.50 117.38 109.06 1d6t n GLN 88 Ca -0.01 0.00 0.09 0.00 -0.00 0.00 0.00 57.00 57.09 1d6t n GLN 88 Cb 0.04 0.00 0.56 0.00 0.00 0.00 0.00 30.24 30.84 1d6t n GLN 88 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 1d6t n PRO 89 N 0.00 0.75 -1.09 3.69 -0.04 -1.26 -3.62 135.00 133.43 1d6t n PRO 89 Ca 0.00 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.26 1d6t n PRO 89 Cb 0.00 -1.40 0.00 0.00 -0.04 0.00 0.00 33.50 32.06 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 -0.90 5.59 -0.07 0.55 0.00 -1.26 -4.18 120.51 120.24 1d6t n ALA 90 Ca 0.14 -2.11 -0.22 0.00 0.00 0.00 0.00 53.44 51.25 1d6t n ALA 90 Cb 0.07 -1.65 -0.12 0.00 0.00 0.00 0.00 19.45 17.74 1d6t n ALA 90 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1d6t n LYS 91 N 0.58 0.63 -1.01 0.00 4.81 -1.24 -4.11 118.16 117.82 1d6t n LYS 91 Ca 0.37 0.46 -0.19 0.00 -0.87 0.00 0.00 58.31 58.08 1d6t n LYS 91 Cb 0.58 -1.72 0.16 0.00 0.02 0.00 0.00 35.03 34.07 1d6t n LYS 91 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1d6t n ASP 92 N -4.12 3.69 -3.84 3.14 8.00 -1.26 -4.59 116.55 117.57 1d6t n ASP 92 Ca -0.34 -3.31 0.00 0.00 0.71 0.00 0.00 54.79 51.85 1d6t n ASP 92 Cb 0.81 -0.78 0.00 0.00 -0.02 0.00 0.00 41.12 41.13 1d6t n ASP 92 CO 0.00 0.00 0.00 1.15 -0.39 0.00 0.00 177.20 177.96 1d6t n MET 93 N -0.80 1.21 -3.61 -1.24 0.00 -1.26 -5.09 117.12 106.33 1d6t n MET 93 Ca 0.49 0.00 -0.16 0.00 0.00 0.00 0.00 57.70 58.03 1d6t n MET 93 Cb 1.46 0.00 -0.07 0.00 0.00 0.00 0.00 33.22 34.61 1d6t n MET 93 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 1d6t s THR 94 N 0.00 0.01 0.66 3.17 -4.23 -1.26 -4.98 115.64 109.01 1d6t s THR 94 Ca 0.00 -0.10 0.13 0.00 -1.18 0.00 0.00 61.69 60.54 1d6t s THR 94 Cb 0.00 -0.87 0.14 0.00 1.34 0.00 0.00 72.50 73.11 1d6t s THR 94 CO 0.00 -0.06 1.39 0.74 -0.54 0.00 0.00 174.62 176.15 1d6t h THR 95 N 3.52 0.01 0.03 3.99 2.02 -1.98 0.96 112.91 121.46 1d6t h THR 95 Ca -0.28 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 66.78 1d6t h THR 95 Cb 1.16 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 1d6t h THR 95 CO 0.32 0.00 -0.61 0.25 0.37 0.00 0.00 175.52 175.85 1d6t h LEU 96 N 0.00 0.09 -1.28 2.58 5.85 -1.95 -3.32 115.31 117.29 1d6t h LEU 96 Ca 0.02 -0.84 0.33 0.00 0.84 0.00 0.00 57.88 58.23 1d6t h LEU 96 Cb 1.48 -0.03 -0.12 0.00 0.37 0.00 0.00 40.66 42.36 1d6t h LEU 96 CO -0.00 1.25 0.70 1.56 -0.34 0.00 0.00 178.44 181.61 1d6t h GLN 97 N -0.85 0.29 0.02 1.25 1.08 0.58 0.62 115.11 118.10 1d6t h GLN 97 Ca -0.15 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.03 1d6t h GLN 97 Cb 1.24 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 28.61 1d6t h GLN 97 CO -0.04 0.19 -0.02 0.82 -0.95 0.00 0.00 178.83 178.84 1d6t h ILE 98 N 0.30 0.00 0.00 2.54 5.03 -1.55 0.49 117.51 124.32 1d6t h ILE 98 Ca 0.69 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 65.43 1d6t h ILE 98 Cb 1.83 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 35.62 1d6t h ILE 98 CO -0.41 0.00 0.04 0.06 -0.68 0.00 0.00 178.15 177.16 1d6t h GLN 99 N -0.04 0.00 0.03 2.37 3.07 -1.36 0.57 115.11 119.76 1d6t h GLN 99 Ca -0.00 0.00 -0.23 0.00 0.09 0.00 0.00 58.65 58.51 1d6t h GLN 99 Cb 0.03 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.57 1d6t h GLN 99 CO 0.00 0.00 -1.08 -0.97 0.09 0.00 0.00 178.83 176.87 1d6t h ASN 100 N 0.00 0.09 0.00 0.06 -0.73 0.97 -2.98 115.58 112.99 1d6t h ASN 100 Ca 0.00 -0.10 -0.14 0.00 1.87 0.00 0.00 56.30 57.93 1d6t h ASN 100 Cb 0.08 -0.03 -0.02 0.00 0.27 0.00 0.00 38.32 38.62 1d6t h ASN 100 CO 0.00 1.08 -1.01 -1.54 -0.37 0.00 0.00 177.43 175.59 1d6t n SER 101 N -3.38 1.85 -0.36 1.15 3.41 0.16 -4.15 113.62 112.31 1d6t n SER 101 Ca -0.03 0.51 0.30 0.00 -0.26 0.00 0.00 58.87 59.39 1d6t n SER 101 Cb 0.96 -0.91 0.62 0.00 -0.26 0.00 0.00 64.21 64.63 1d6t n SER 101 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1d6t h LEU 102 N -1.00 0.26 0.00 1.04 3.38 -0.25 2.63 115.31 121.36 1d6t h LEU 102 Ca -0.21 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1d6t h LEU 102 Cb 0.97 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1d6t h LEU 102 CO -0.12 0.01 0.00 -0.62 0.09 0.00 0.00 178.44 177.79 1d6t n GLU 103 N -4.48 0.19 0.00 1.13 -0.58 -1.13 -2.03 120.64 113.74 1d6t n GLU 103 Ca 0.28 0.07 0.00 0.00 -0.42 0.00 0.00 57.16 57.09 1d6t n GLU 103 Cb 1.13 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 30.50 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 -1.09 0.00 -0.33 -0.32 -0.00 0.84 -4.51 115.22 109.82 1d6t n HIS 104 Ca 0.05 0.00 0.26 0.00 0.46 0.00 0.00 57.72 58.48 1d6t n HIS 104 Cb 0.03 0.24 0.49 0.00 -0.12 0.00 0.00 29.99 30.63 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 0.13 0.01 3.57 3.04 -0.36 1.44 116.25 124.07 1d6t h VAL 105 Ca 0.00 -0.04 -0.24 0.00 -1.01 0.00 0.00 66.70 65.41 1d6t h VAL 105 Cb 0.00 -0.01 0.02 0.00 -2.01 0.00 0.00 31.29 29.29 1d6t h VAL 105 CO 0.00 0.02 -0.95 0.25 -1.01 0.00 0.00 177.57 175.88 1d6t h LEU 106 N 0.12 0.82 -1.85 3.16 5.85 -1.51 -2.05 115.31 119.85 1d6t h LEU 106 Ca 0.76 -0.75 0.21 0.00 0.84 0.00 0.00 57.88 58.94 1d6t h LEU 106 Cb 1.84 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 42.57 1d6t h LEU 106 CO -0.73 1.47 0.56 0.50 -0.34 0.00 0.00 178.44 179.90 1d6t h LYS 107 N 0.26 0.13 0.17 1.25 3.11 0.21 0.12 116.57 121.82 1d6t h LYS 107 Ca -0.12 -0.01 -0.26 0.00 -2.81 0.00 0.00 60.65 57.45 1d6t h LYS 107 Cb 1.62 -0.03 0.02 0.00 -1.00 0.00 0.00 32.23 32.84 1d6t h LYS 107 CO 0.19 0.08 -1.24 0.82 -2.81 0.00 0.00 179.45 176.49 1d6t h ILE 108 N 0.13 1.27 -1.61 2.00 2.04 -0.54 -3.28 117.51 117.53 1d6t h ILE 108 Ca 0.39 -2.54 0.49 0.00 1.00 0.00 0.00 64.86 64.20 1d6t h ILE 108 Cb 1.35 2.99 -0.09 0.00 -0.74 0.00 0.00 36.82 40.34 1d6t h ILE 108 CO -0.06 0.75 1.13 0.00 0.00 0.00 0.00 178.15 179.97 1d6t n ALA 109 N -2.78 1.55 -0.66 1.87 0.00 0.41 -4.66 120.51 116.25 1d6t n ALA 109 Ca -0.19 0.65 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1d6t n ALA 109 Cb 0.94 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.39 1d6t n ALA 109 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1d6t n LYS 110 N -3.96 0.00 -0.70 0.00 4.81 -1.11 -4.75 118.16 112.45 1d6t n LYS 110 Ca 0.39 0.17 -0.12 0.00 -0.87 0.00 0.00 58.31 57.88 1d6t n LYS 110 Cb 1.68 -2.33 0.12 0.00 0.02 0.00 0.00 35.03 34.52 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 -2.66 2.24 -3.82 3.15 0.24 -1.25 -4.78 118.33 111.44 1d6t n VAL 111 Ca 0.00 -1.10 -0.21 0.00 -2.04 0.00 0.00 64.34 60.99 1d6t n VAL 111 Cb 0.00 -0.66 -0.17 0.00 -1.47 0.00 0.00 33.84 31.54 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 -1.94 0.47 -0.12 6.34 0.08 -1.26 -3.82 117.98 117.72 1d6t s PHE 112 Ca 0.33 -0.04 -0.27 0.00 0.12 0.00 0.00 56.93 57.07 1d6t s PHE 112 Cb 0.28 -0.63 -0.27 0.00 -0.57 0.00 0.00 43.02 41.82 1d6t s PHE 112 CO 0.07 -0.24 0.78 -2.95 -0.10 0.00 0.00 175.22 172.77 1d6t h ASN 113 N 8.01 0.12 -0.01 1.36 7.08 -1.86 -3.36 115.58 126.91 1d6t h ASN 113 Ca -0.25 -0.97 0.00 0.00 -3.08 0.00 0.00 56.30 52.00 1d6t h ASN 113 Cb 1.13 -0.04 0.00 0.00 -2.08 0.00 0.00 38.32 37.33 1d6t h ASN 113 CO 0.30 1.12 -0.24 0.29 -2.08 0.00 0.00 177.43 176.82 1d6t n LYS 114 N -4.48 1.92 -4.10 4.14 4.76 -1.26 -4.98 118.16 114.16 1d6t n LYS 114 Ca -0.12 -0.68 -0.30 0.00 -2.87 0.00 0.00 58.31 54.34 1d6t n LYS 114 Cb 0.57 -1.14 -0.08 0.00 -1.84 0.00 0.00 35.03 32.54 1d6t n LYS 114 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1d6t n LYS 115 N -0.19 -0.88 -1.04 1.97 -0.00 -1.26 -4.78 118.16 111.98 1d6t n LYS 115 Ca 0.05 0.09 -0.35 0.00 -0.00 0.00 0.00 58.31 58.11 1d6t n LYS 115 Cb 0.25 -3.43 0.09 0.00 -0.00 0.00 0.00 35.03 31.94 1d6t n LYS 115 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1d6t n ILE 116 N -3.93 0.97 0.00 0.58 5.41 -1.26 -5.11 119.36 116.02 1d6t n ILE 116 Ca -0.15 -0.30 0.00 0.00 1.00 0.00 0.00 62.75 63.30 1d6t n ILE 116 Cb 0.53 -0.69 0.00 0.00 -0.71 0.00 0.00 39.64 38.77 1d6t n ILE 116 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72