#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d6t h LEU 2 N 0.00 -1.03 -7.83 4.03 3.38 -2.09 -3.43 115.31 108.35 1d6t h LEU 2 Ca 0.00 0.04 -0.38 0.00 0.09 0.00 0.00 57.88 57.63 1d6t h LEU 2 Cb 0.00 0.27 -0.32 0.00 0.09 0.00 0.00 40.66 40.70 1d6t h LEU 2 CO 0.00 -0.72 -0.77 -0.22 0.09 0.00 0.00 178.44 176.82 1d6t s LEU 3 N -10.02 1.62 0.00 1.67 1.98 -1.26 -4.97 118.68 107.70 1d6t s LEU 3 Ca -0.19 -0.12 0.00 0.00 -2.89 0.00 0.00 54.13 50.93 1d6t s LEU 3 Cb 0.03 -0.39 0.00 0.00 0.66 0.00 0.00 46.19 46.49 1d6t s LEU 3 CO 0.61 0.00 0.00 1.21 -1.89 0.00 0.00 176.35 176.28 1d6t n GLU 4 N 3.54 3.84 0.12 1.98 2.13 -1.26 -4.94 120.64 126.06 1d6t n GLU 4 Ca -0.20 0.00 0.06 0.00 0.66 0.00 0.00 57.16 57.68 1d6t n GLU 4 Cb 0.54 0.00 0.34 0.00 0.27 0.00 0.00 31.44 32.59 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 0.08 -0.28 5.31 2.85 -1.26 -1.56 118.16 123.30 1d6t n LYS 5 Ca 0.00 0.54 0.34 0.00 -1.05 0.00 0.00 58.31 58.14 1d6t n LYS 5 Cb 0.00 -1.93 0.69 0.00 -0.65 0.00 0.00 35.03 33.14 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 1.54 3.03 -1.32 0.58 0.00 -1.94 0.25 119.26 121.40 1d6t h ALA 6 Ca 0.00 -0.04 0.42 0.00 0.00 0.00 0.00 54.91 55.29 1d6t h ALA 6 Cb 0.31 0.09 -0.10 0.00 0.00 0.00 0.00 17.79 18.09 1d6t h ALA 6 CO 0.00 -1.56 0.89 0.66 0.00 0.00 0.00 179.25 179.24 1d6t n TYR 7 N -3.80 0.38 -3.52 0.00 4.01 -0.60 -4.35 117.16 109.28 1d6t n TYR 7 Ca 0.25 0.39 0.00 0.00 -0.16 0.00 0.00 57.90 58.37 1d6t n TYR 7 Cb 1.34 -0.80 0.00 0.00 -0.31 0.00 0.00 39.34 39.57 1d6t n TYR 7 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1d6t n ARG 8 N -4.09 1.82 -3.70 -0.72 1.74 0.07 -2.00 116.66 109.78 1d6t n ARG 8 Ca 0.35 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 57.07 1d6t n ARG 8 Cb 1.43 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 32.78 1d6t n ARG 8 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1d6t s ILE 9 N -0.07 5.34 0.00 0.55 -1.09 -1.26 -4.40 121.20 120.27 1d6t s ILE 9 Ca 0.00 0.17 0.00 0.00 -2.23 0.00 0.00 60.65 58.59 1d6t s ILE 9 Cb 0.00 -3.47 0.00 0.00 -1.58 0.00 0.00 42.46 37.41 1d6t s ILE 9 CO 0.00 0.39 0.50 1.17 -1.23 0.00 0.00 174.94 175.77 1d6t n LYS 10 N 3.97 0.57 -3.58 2.79 4.81 -1.26 -5.01 118.16 120.46 1d6t n LYS 10 Ca -0.15 -0.62 -0.12 0.00 -0.87 0.00 0.00 58.31 56.54 1d6t n LYS 10 Cb 0.52 -0.69 -0.11 0.00 0.02 0.00 0.00 35.03 34.77 1d6t n LYS 10 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1d6t s LYS 11 N -0.24 0.24 0.23 1.64 1.02 -1.26 -5.03 119.74 116.35 1d6t s LYS 11 Ca 0.00 0.71 -0.06 0.00 0.02 0.00 0.00 55.97 56.64 1d6t s LYS 11 Cb 0.00 -0.19 0.41 0.00 -0.52 0.00 0.00 37.83 37.53 1d6t s LYS 11 CO 0.00 -0.40 1.71 -2.95 -0.92 0.00 0.00 175.35 172.79 1d6t h ASN 12 N 8.24 0.11 -0.81 2.83 7.08 -1.99 -0.78 115.58 130.27 1d6t h ASN 12 Ca -0.16 0.12 0.11 0.00 -3.08 0.00 0.00 56.30 53.29 1d6t h ASN 12 Cb 1.13 0.14 -0.13 0.00 -2.08 0.00 0.00 38.32 37.38 1d6t h ASN 12 CO 0.18 0.03 -0.44 0.00 -2.08 0.00 0.00 177.43 175.12 1d6t h ALA 13 N 1.54 -0.17 -1.01 4.14 0.00 -1.97 1.98 119.26 123.77 1d6t h ALA 13 Ca 0.38 0.18 0.24 0.00 0.00 0.00 0.00 54.91 55.71 1d6t h ALA 13 Cb 0.60 1.04 -0.10 0.00 0.00 0.00 0.00 17.79 19.34 1d6t h ALA 13 CO -0.43 -0.77 0.64 0.38 0.00 0.00 0.00 179.25 179.07 1d6t h ASP 14 N -0.10 0.52 -0.03 0.00 3.04 -1.57 0.82 116.42 119.11 1d6t h ASP 14 Ca 0.24 0.09 -0.18 0.00 -3.24 0.00 0.00 57.03 53.93 1d6t h ASP 14 Cb 0.55 -0.00 0.01 0.00 -1.04 0.00 0.00 39.33 38.85 1d6t h ASP 14 CO -0.84 0.13 -0.69 0.15 -2.04 0.00 0.00 179.24 175.95 1d6t h PHE 15 N 0.48 0.75 -0.81 4.15 3.57 0.28 -3.25 116.94 122.11 1d6t h PHE 15 Ca 0.58 -0.39 -0.04 0.00 3.53 0.00 0.00 57.97 61.65 1d6t h PHE 15 Cb 1.32 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.93 1d6t h PHE 15 CO -0.00 1.20 0.35 1.96 -2.23 0.00 0.00 178.31 179.59 1d6t h GLN 16 N 0.09 1.20 -0.85 1.11 4.20 0.41 -2.46 115.11 118.80 1d6t h GLN 16 Ca -0.08 -0.20 0.18 0.00 0.06 0.00 0.00 58.65 58.61 1d6t h GLN 16 Cb 1.37 -0.20 -0.11 0.00 0.30 0.00 0.00 27.48 28.84 1d6t h GLN 16 CO 0.14 0.95 0.39 0.00 -0.67 0.00 0.00 178.83 179.64 1d6t h ARG 17 N 1.17 0.48 0.48 1.46 3.08 0.46 0.36 114.38 121.87 1d6t h ARG 17 Ca 0.27 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.27 1d6t h ARG 17 Cb 0.18 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.13 1d6t h ARG 17 CO -0.03 0.32 -0.23 0.82 -1.07 0.00 0.00 179.97 179.78 1d6t h ILE 18 N 0.50 0.00 0.00 2.04 2.04 -1.48 -1.83 117.51 118.78 1d6t h ILE 18 Ca 0.49 -0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.35 1d6t h ILE 18 Cb 0.82 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1d6t h ILE 18 CO -0.44 0.00 0.26 1.88 0.00 0.00 0.00 178.15 179.85 1d6t h TYR 19 N -0.65 0.00 0.00 1.37 -1.99 -1.27 1.42 116.97 115.86 1d6t h TYR 19 Ca -0.07 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.66 1d6t h TYR 19 Cb 0.50 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.23 1d6t h TYR 19 CO 0.12 0.00 0.00 1.63 -0.00 0.00 0.00 178.16 179.91 1d6t n LYS 20 N -2.34 0.00 -0.00 4.88 4.01 0.12 -4.69 118.16 120.13 1d6t n LYS 20 Ca -0.01 0.00 0.09 0.00 -0.51 0.00 0.00 58.31 57.88 1d6t n LYS 20 Cb 0.29 -0.28 -0.15 0.00 -0.51 0.00 0.00 35.03 34.38 1d6t n LYS 20 CO 0.00 0.00 0.00 0.36 -1.11 0.00 0.00 177.40 176.65 1d6t n LYS 21 N -0.13 0.66 -0.88 1.97 2.85 -0.88 -5.00 118.16 116.75 1d6t n LYS 21 Ca 0.00 -0.15 -0.30 0.00 -1.05 0.00 0.00 58.31 56.81 1d6t n LYS 21 Cb 0.00 -1.56 0.03 0.00 -0.65 0.00 0.00 35.03 32.85 1d6t n LYS 21 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1d6t n GLY 22 N 1.29 -3.57 3.08 2.58 0.00 0.49 -4.94 105.19 104.12 1d6t n GLY 22 Ca -0.06 -0.53 -0.32 0.00 0.00 0.00 0.00 46.02 45.11 1d6t n GLY 22 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1d6t s HIS 23 N -1.65 2.68 0.21 1.61 -3.43 0.62 -4.82 115.29 110.50 1d6t s HIS 23 Ca 0.37 -1.63 0.01 0.00 -0.80 0.00 0.00 55.06 53.00 1d6t s HIS 23 Cb -0.21 -1.83 -0.04 0.00 -1.43 0.00 0.00 32.58 29.06 1d6t s HIS 23 CO 0.65 -0.78 0.38 -1.54 -2.00 0.00 0.00 174.74 171.44 1d6t s SER 24 N 1.32 6.36 0.00 7.38 1.04 -1.26 -1.65 113.70 126.88 1d6t s SER 24 Ca 0.03 0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.76 1d6t s SER 24 Cb -0.14 -1.97 0.00 0.00 0.10 0.00 0.00 66.02 64.01 1d6t s SER 24 CO -0.11 -0.05 0.00 1.33 0.98 0.00 0.00 173.24 175.39 1d6t n VAL 25 N -0.85 0.00 0.00 5.02 0.24 -0.72 -4.97 118.33 117.05 1d6t n VAL 25 Ca -0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.24 1d6t n VAL 25 Cb 0.54 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.91 1d6t n VAL 25 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1d6t n ALA 26 N -3.00 0.00 -1.45 2.33 0.00 -1.26 -4.23 120.51 112.90 1d6t n ALA 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1d6t n ALA 26 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1d6t n ALA 26 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1d6t n ASN 27 N 0.00 0.00 0.00 0.00 0.23 0.61 -4.90 115.26 111.20 1d6t n ASN 27 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1d6t n ASN 27 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1d6t n ASN 27 CO 0.00 0.00 0.00 -2.11 -0.93 0.00 0.00 177.26 174.22 1d6t n ARG 28 N 0.00 0.00 -0.89 -3.83 1.85 -1.26 -4.84 116.66 107.69 1d6t n ARG 28 Ca 0.00 0.00 0.01 0.00 -1.00 0.00 0.00 57.85 56.86 1d6t n ARG 28 Cb 0.00 -0.95 0.01 0.00 -1.05 0.00 0.00 32.46 30.47 1d6t n ARG 28 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1d6t n GLN 29 N -2.45 0.00 -3.83 2.89 -0.00 -1.26 -5.01 117.38 107.71 1d6t n GLN 29 Ca 0.00 -1.36 -0.10 0.00 -0.00 0.00 0.00 57.00 55.54 1d6t n GLN 29 Cb 0.47 -0.28 -0.08 0.00 -0.00 0.00 0.00 30.24 30.35 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 0.00 0.06 -0.10 2.61 2.19 -1.26 -3.13 117.98 118.35 1d6t s PHE 30 Ca 0.13 -0.36 -0.07 0.00 0.33 0.00 0.00 56.93 56.97 1d6t s PHE 30 Cb 0.15 -0.02 0.04 0.00 -1.31 0.00 0.00 43.02 41.88 1d6t s PHE 30 CO -0.07 -0.49 0.25 0.14 1.83 0.00 0.00 175.22 176.88 1d6t s VAL 31 N -3.10 -0.02 -0.14 3.12 -7.23 -0.88 -0.28 120.40 111.87 1d6t s VAL 31 Ca -0.01 0.09 0.02 0.00 -1.81 0.00 0.00 61.98 60.27 1d6t s VAL 31 Cb 0.01 -0.37 0.01 0.00 0.56 0.00 0.00 36.38 36.59 1d6t s VAL 31 CO -0.07 0.04 -0.21 0.68 -0.31 0.00 0.00 175.10 175.23 1d6t s VAL 32 N 0.83 1.98 -0.24 1.32 -7.23 -1.26 -0.23 120.40 115.58 1d6t s VAL 32 Ca -0.06 -0.93 -0.15 0.00 -1.81 0.00 0.00 61.98 59.03 1d6t s VAL 32 Cb -0.07 -1.76 -0.04 0.00 0.56 0.00 0.00 36.38 35.07 1d6t s VAL 32 CO -0.05 0.53 0.37 -0.31 -0.31 0.00 0.00 175.10 175.34 1d6t s TYR 33 N 0.84 3.30 0.03 2.82 1.51 0.13 -1.76 117.35 124.22 1d6t s TYR 33 Ca -0.07 0.48 -0.01 0.00 -1.01 0.00 0.00 57.07 56.47 1d6t s TYR 33 Cb -0.15 -2.54 -0.03 0.00 -0.11 0.00 0.00 41.96 39.13 1d6t s TYR 33 CO -0.02 -0.13 -0.03 0.95 -1.11 0.00 0.00 175.55 175.21 1d6t s THR 34 N 1.72 0.16 -0.05 -0.71 -4.23 -0.66 -0.19 115.64 111.69 1d6t s THR 34 Ca 0.16 -1.35 -0.00 0.00 -1.18 0.00 0.00 61.69 59.32 1d6t s THR 34 Cb -0.15 -0.88 -0.03 0.00 1.34 0.00 0.00 72.50 72.77 1d6t s THR 34 CO 0.09 -0.75 -0.05 0.00 -0.54 0.00 0.00 174.62 173.37 1d6t n ASN 36 N -2.75 -5.77 -4.64 0.00 4.13 -1.26 -4.74 115.26 100.22 1d6t n ASN 36 Ca -0.09 -0.06 -0.24 0.00 1.68 0.00 0.00 54.58 55.87 1d6t n ASN 36 Cb 0.59 -1.98 -0.07 0.00 -1.54 0.00 0.00 39.78 36.78 1d6t n ASN 36 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1d6t s ASN 37 N -1.54 4.58 -1.08 6.41 2.20 -1.26 -5.00 114.94 119.25 1d6t s ASN 37 Ca 0.35 -0.58 -0.07 0.00 -0.94 0.00 0.00 52.86 51.63 1d6t s ASN 37 Cb -0.04 -0.88 -0.06 0.00 -2.00 0.00 0.00 41.25 38.27 1d6t s ASN 37 CO 0.82 0.03 2.30 0.29 -2.94 0.00 0.00 177.10 177.61 1d6t n LYS 38 N -0.65 2.46 0.00 3.55 4.01 -1.26 -2.88 118.16 123.38 1d6t n LYS 38 Ca -0.08 -1.64 0.00 0.00 -0.51 0.00 0.00 58.31 56.08 1d6t n LYS 38 Cb 0.58 -2.55 0.00 0.00 -0.51 0.00 0.00 35.03 32.55 1d6t n LYS 38 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 1d6t n GLU 39 N 4.13 0.00 -3.70 1.97 1.02 -1.26 -5.16 120.64 117.64 1d6t n GLU 39 Ca 0.53 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 57.39 1d6t n GLU 39 Cb 0.16 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.55 1d6t n GLU 39 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1d6t s ILE 40 N 0.00 5.21 0.00 -3.67 -1.09 -1.14 -4.99 121.20 115.51 1d6t s ILE 40 Ca 0.00 -0.38 0.00 0.00 -2.23 0.00 0.00 60.65 58.04 1d6t s ILE 40 Cb 0.00 -3.74 0.00 0.00 -1.58 0.00 0.00 42.46 37.14 1d6t s ILE 40 CO 0.00 -0.18 0.53 0.47 -1.23 0.00 0.00 174.94 174.53 1d6t n ASP 41 N -0.67 0.68 0.00 3.58 9.92 -1.26 -4.96 116.55 123.83 1d6t n ASP 41 Ca -0.05 -1.26 0.00 0.00 -0.53 0.00 0.00 54.79 52.95 1d6t n ASP 41 Cb 0.54 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.02 1d6t n ASP 41 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1d6t n HIS 42 N -0.13 0.00 -3.71 1.24 1.44 -1.26 -4.82 115.22 107.98 1d6t n HIS 42 Ca 0.00 0.00 -0.35 0.00 -2.01 0.00 0.00 57.72 55.36 1d6t n HIS 42 Cb 0.31 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.33 1d6t n HIS 42 CO 0.00 0.00 0.00 -0.59 -2.81 0.00 0.00 176.34 172.94 1d6t s PHE 43 N -2.00 3.63 -0.17 -1.40 -0.71 -1.26 0.14 117.98 116.21 1d6t s PHE 43 Ca 0.00 -2.94 -0.32 0.00 -1.04 0.00 0.00 56.93 52.63 1d6t s PHE 43 Cb 0.00 -3.16 -0.15 0.00 -1.21 0.00 0.00 43.02 38.51 1d6t s PHE 43 CO 0.00 -0.76 0.97 0.54 -1.34 0.00 0.00 175.22 174.64 1d6t n ARG 44 N 2.79 0.00 -3.87 1.99 1.74 -1.24 -4.54 116.66 113.53 1d6t n ARG 44 Ca 0.15 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.93 1d6t n ARG 44 Cb 0.37 -1.11 -0.14 0.00 -1.02 0.00 0.00 32.46 30.56 1d6t n ARG 44 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1d6t s LEU 45 N 1.02 3.80 0.41 0.55 1.43 -0.84 -1.75 118.68 123.30 1d6t s LEU 45 Ca 0.72 -2.95 0.08 0.00 -1.03 0.00 0.00 54.13 50.95 1d6t s LEU 45 Cb -1.02 -1.44 -0.03 0.00 0.03 0.00 0.00 46.19 43.73 1d6t s LEU 45 CO 0.51 -0.23 0.29 -0.83 0.23 0.00 0.00 176.35 176.31 1d6t s GLY 46 N -0.16 2.19 -0.19 -3.19 0.00 -1.25 -4.05 107.32 100.67 1d6t s GLY 46 Ca 0.18 -1.96 0.01 0.00 0.00 0.00 0.00 44.72 42.94 1d6t s GLY 46 CO -0.01 -1.78 -0.18 -0.42 0.00 0.00 0.00 173.10 170.71 1d6t s ILE 47 N -2.51 2.19 -0.09 0.90 1.09 -1.26 -3.70 121.20 117.81 1d6t s ILE 47 Ca 0.45 -0.91 0.03 0.00 -1.10 0.00 0.00 60.65 59.12 1d6t s ILE 47 Cb -0.01 -1.93 0.00 0.00 -1.06 0.00 0.00 42.46 39.47 1d6t s ILE 47 CO 0.26 0.52 -0.20 -0.44 -0.10 0.00 0.00 174.94 174.97 1d6t s SER 48 N 1.31 2.67 0.13 3.58 0.01 -1.09 -5.05 113.70 115.25 1d6t s SER 48 Ca 0.05 -0.48 0.04 0.00 1.31 0.00 0.00 55.95 56.87 1d6t s SER 48 Cb -0.13 -1.23 -0.04 0.00 0.21 0.00 0.00 66.02 64.83 1d6t s SER 48 CO -0.12 0.12 -0.10 -0.69 0.41 0.00 0.00 173.24 172.85 1d6t s VAL 49 N 0.47 1.09 0.45 3.43 1.01 -1.26 -1.87 120.40 123.71 1d6t s VAL 49 Ca -0.17 -1.90 0.01 0.00 0.00 0.00 0.00 61.98 59.93 1d6t s VAL 49 Cb -0.17 -1.66 0.00 0.00 0.00 0.00 0.00 36.38 34.54 1d6t s VAL 49 CO 0.07 -0.67 0.65 -0.55 0.00 0.00 0.00 175.10 174.60 1d6t s SER 50 N -2.88 5.78 0.00 3.32 0.15 -1.25 -4.94 113.70 113.88 1d6t s SER 50 Ca 0.12 0.17 0.23 0.00 0.70 0.00 0.00 55.95 57.17 1d6t s SER 50 Cb 0.00 -1.39 0.26 0.00 -1.71 0.00 0.00 66.02 63.18 1d6t s SER 50 CO 0.00 -0.72 1.28 0.29 1.20 0.00 0.00 173.24 175.29 1d6t n LYS 51 N -2.05 2.29 -0.00 5.44 5.02 -1.26 -4.00 118.16 123.60 1d6t n LYS 51 Ca 0.02 -2.00 0.07 0.00 -2.02 0.00 0.00 58.31 54.38 1d6t n LYS 51 Cb 0.58 -1.46 -0.09 0.00 -0.02 0.00 0.00 35.03 34.03 1d6t n LYS 51 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1d6t n LYS 52 N 1.35 1.39 0.00 1.97 5.02 -1.26 -4.70 118.16 121.93 1d6t n LYS 52 Ca 0.15 -0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 1d6t n LYS 52 Cb 0.58 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 34.35 1d6t n LYS 52 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1d6t n LEU 53 N -1.68 0.00 0.00 -0.35 0.00 -1.26 -4.97 117.00 108.75 1d6t n LEU 53 Ca -0.00 0.72 0.00 0.00 0.00 0.00 0.00 56.01 56.73 1d6t n LEU 53 Cb 0.30 -0.22 0.00 0.00 0.00 0.00 0.00 43.42 43.49 1d6t n LEU 53 CO 0.29 -0.22 0.00 0.61 0.00 0.00 0.00 177.39 178.07 1d6t n GLY 54 N -1.00 -0.86 3.76 -3.96 0.00 -1.26 -4.71 105.19 97.17 1d6t n GLY 54 Ca 0.00 0.55 -0.20 0.00 0.00 0.00 0.00 46.02 46.37 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 2.17 0.22 1.61 3.02 -1.26 -5.00 115.26 116.02 1d6t n ASN 55 Ca 0.00 -2.56 0.10 0.00 -0.03 0.00 0.00 54.58 52.09 1d6t n ASN 55 Cb 0.00 -0.34 0.42 0.00 -0.61 0.00 0.00 39.78 39.25 1d6t n ASN 55 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1d6t h ALA 56 N 0.24 0.98 0.00 5.41 0.00 -2.01 -2.36 119.26 121.52 1d6t h ALA 56 Ca -0.28 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1d6t h ALA 56 Cb 1.21 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1d6t h ALA 56 CO 0.41 0.27 -0.06 -0.24 0.00 0.00 0.00 179.25 179.63 1d6t h VAL 57 N 0.00 0.24 0.20 0.00 3.04 -1.98 0.21 116.25 117.95 1d6t h VAL 57 Ca -0.00 -0.44 -0.35 0.00 -1.01 0.00 0.00 66.70 64.90 1d6t h VAL 57 Cb 0.80 1.35 0.01 0.00 -2.01 0.00 0.00 31.29 31.45 1d6t h VAL 57 CO 0.03 0.06 -1.70 -0.07 -1.01 0.00 0.00 177.57 174.88 1d6t h LEU 58 N 0.00 0.65 0.00 3.16 3.38 -1.78 -2.76 115.31 117.95 1d6t h LEU 58 Ca -0.00 -0.91 0.00 0.00 0.09 0.00 0.00 57.88 57.06 1d6t h LEU 58 Cb 0.35 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1d6t h LEU 58 CO 0.01 1.76 0.00 -2.11 0.09 0.00 0.00 178.44 178.19 1d6t n ARG 59 N -3.61 0.08 -0.04 1.13 -4.01 -0.85 -1.35 116.66 108.02 1d6t n ARG 59 Ca -0.23 0.11 -0.21 0.00 -1.04 0.00 0.00 57.85 56.48 1d6t n ARG 59 Cb 1.08 -1.50 -0.13 0.00 -3.04 0.00 0.00 32.46 28.87 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 -1.45 2.06 0.08 2.89 3.02 0.00 -2.66 115.26 119.21 1d6t n ASN 60 Ca 0.07 0.17 -0.05 0.00 -0.03 0.00 0.00 54.58 54.73 1d6t n ASN 60 Cb 0.24 -0.78 0.11 0.00 -0.61 0.00 0.00 39.78 38.74 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 -0.10 0.24 -0.10 3.52 3.64 -1.37 1.44 116.57 123.84 1d6t h LYS 61 Ca -0.46 -0.17 -0.20 0.00 -1.27 0.00 0.00 60.65 58.55 1d6t h LYS 61 Cb 1.91 0.03 0.01 0.00 -0.41 0.00 0.00 32.23 33.77 1d6t h LYS 61 CO -0.00 0.78 -0.74 0.82 -2.27 0.00 0.00 179.45 178.04 1d6t h ILE 62 N 0.18 1.31 0.00 2.00 2.04 -1.38 -2.81 117.51 118.86 1d6t h ILE 62 Ca -0.01 -1.99 0.00 0.00 1.00 0.00 0.00 64.86 63.86 1d6t h ILE 62 Cb 1.13 2.17 0.00 0.00 -0.74 0.00 0.00 36.82 39.38 1d6t h ILE 62 CO 0.10 0.62 -0.31 0.07 0.00 0.00 0.00 178.15 178.62 1d6t h LYS 63 N 0.34 0.00 -0.08 2.37 5.09 -1.42 -3.02 116.57 119.86 1d6t h LYS 63 Ca -0.06 0.00 -0.02 0.00 0.09 0.00 0.00 60.65 60.65 1d6t h LYS 63 Cb 1.38 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 33.71 1d6t h LYS 63 CO 0.15 0.00 -0.04 -0.09 -2.09 0.00 0.00 179.45 177.38 1d6t h ARG 64 N 0.00 0.17 0.00 0.07 2.43 0.21 0.51 114.38 117.76 1d6t h ARG 64 Ca 0.00 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1d6t h ARG 64 Cb 0.81 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 1d6t h ARG 64 CO 0.00 0.55 0.00 0.00 -1.51 0.00 0.00 179.97 179.01 1d6t n ALA 65 N -2.35 2.31 -0.01 2.80 0.00 -1.07 -2.62 120.51 119.58 1d6t n ALA 65 Ca -0.07 -0.10 -0.01 0.00 0.00 0.00 0.00 53.44 53.26 1d6t n ALA 65 Cb 0.27 -1.46 -0.11 0.00 0.00 0.00 0.00 19.45 18.14 1d6t n ALA 65 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1d6t n ILE 66 N -1.49 1.09 1.01 0.00 -0.00 -1.06 -2.80 119.36 116.12 1d6t n ILE 66 Ca 0.07 -0.71 0.13 0.00 -0.00 0.00 0.00 62.75 62.24 1d6t n ILE 66 Cb 0.33 -0.59 0.39 0.00 -0.00 0.00 0.00 39.64 39.77 1d6t n ILE 66 CO 0.00 0.00 0.00 -2.11 -0.00 0.00 0.00 176.55 174.44 1d6t n ARG 67 N -2.78 0.03 0.00 0.38 -4.01 0.18 -2.99 116.66 107.46 1d6t n ARG 67 Ca -0.14 -0.01 0.05 0.00 -1.04 0.00 0.00 57.85 56.71 1d6t n ARG 67 Cb 0.88 -1.50 -0.06 0.00 -3.04 0.00 0.00 32.46 28.74 1d6t n ARG 67 CO 0.00 0.00 0.00 -0.85 -3.04 0.00 0.00 177.63 173.74 1d6t n GLU 68 N -1.48 3.13 0.00 2.89 0.28 -1.08 -4.21 120.64 120.18 1d6t n GLU 68 Ca 0.06 -0.03 -0.17 0.00 -0.16 0.00 0.00 57.16 56.86 1d6t n GLU 68 Cb 0.34 -1.05 -0.14 0.00 1.43 0.00 0.00 31.44 32.02 1d6t n GLU 68 CO 0.00 0.00 0.00 -0.97 -0.16 0.00 0.00 177.13 176.00 1d6t h ASN 69 N 0.06 0.28 -0.19 -1.84 -0.00 -1.54 -3.10 115.58 109.26 1d6t h ASN 69 Ca 0.00 -0.62 -0.04 0.00 -0.00 0.00 0.00 56.30 55.65 1d6t h ASN 69 Cb 0.28 -0.09 -0.01 0.00 -0.00 0.00 0.00 38.32 38.50 1d6t h ASN 69 CO 0.00 1.55 -0.02 -0.26 -0.00 0.00 0.00 177.43 178.70 1d6t h PHE 70 N 0.05 0.38 0.23 0.67 0.04 -1.75 0.77 116.94 117.33 1d6t h PHE 70 Ca -0.37 -0.07 -0.01 0.00 2.80 0.00 0.00 57.97 60.32 1d6t h PHE 70 Cb 2.03 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 40.08 1d6t h PHE 70 CO 0.05 0.58 -0.11 -0.22 -0.60 0.00 0.00 178.31 178.01 1d6t h LYS 71 N 0.08 -0.30 0.23 1.51 1.63 -1.73 1.74 116.57 119.74 1d6t h LYS 71 Ca 0.05 0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.86 1d6t h LYS 71 Cb 0.44 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.14 1d6t h LYS 71 CO 0.01 -0.10 -0.11 -0.24 -3.45 0.00 0.00 179.45 175.56 1d6t h VAL 72 N -0.44 0.77 -0.14 2.00 3.04 -1.54 -1.00 116.25 118.94 1d6t h VAL 72 Ca -0.03 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 65.64 1d6t h VAL 72 Cb 0.34 0.79 0.00 0.00 -2.01 0.00 0.00 31.29 30.41 1d6t h VAL 72 CO 0.05 0.01 0.00 1.41 -1.01 0.00 0.00 177.57 178.03 1d6t n HIS 73 N -5.22 0.40 -0.08 3.17 8.25 0.27 -4.02 115.22 117.99 1d6t n HIS 73 Ca -0.09 -0.15 -0.09 0.00 -0.26 0.00 0.00 57.72 57.13 1d6t n HIS 73 Cb 0.15 -0.14 -0.02 0.00 1.12 0.00 0.00 29.99 31.10 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 0.92 0.36 -0.00 -0.41 3.64 0.41 0.98 116.57 122.47 1d6t h LYS 74 Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1d6t h LYS 74 Cb 0.66 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1d6t h LYS 74 CO 0.08 0.26 -0.15 0.43 -2.27 0.00 0.00 179.45 177.80 1d6t n SER 75 N -4.89 0.16 0.01 4.20 7.64 -1.26 -3.20 113.62 116.29 1d6t n SER 75 Ca -0.02 0.24 -0.02 0.00 1.01 0.00 0.00 58.87 60.08 1d6t n SER 75 Cb 0.03 -0.26 -0.10 0.00 -1.01 0.00 0.00 64.21 62.87 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 -1.48 0.93 -2.96 1.43 8.25 -0.52 -4.88 115.22 115.98 1d6t n HIS 76 Ca 0.07 0.32 -0.36 0.00 -0.26 0.00 0.00 57.72 57.49 1d6t n HIS 76 Cb 0.34 -1.10 -0.06 0.00 1.12 0.00 0.00 29.99 30.28 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 -2.84 4.43 0.19 1.59 1.09 0.33 -3.47 121.20 122.52 1d6t s ILE 77 Ca -0.04 1.47 0.11 0.00 -1.10 0.00 0.00 60.65 61.09 1d6t s ILE 77 Cb 0.08 -3.86 -0.04 0.00 -1.06 0.00 0.00 42.46 37.58 1d6t s ILE 77 CO 0.82 0.09 -0.23 -1.48 -0.10 0.00 0.00 174.94 174.04 1d6t s LEU 78 N -2.22 2.44 -0.19 2.97 -0.00 -1.24 -4.92 118.68 115.51 1d6t s LEU 78 Ca 0.49 -0.87 -0.41 0.00 -0.00 0.00 0.00 54.13 53.34 1d6t s LEU 78 Cb -0.16 -1.11 -0.19 0.00 -0.00 0.00 0.00 46.19 44.73 1d6t s LEU 78 CO 0.21 0.10 1.23 0.00 -0.00 0.00 0.00 176.35 177.88 1d6t n ALA 79 N 0.26 -2.65 0.00 1.48 0.00 -1.26 -4.38 120.51 113.96 1d6t n ALA 79 Ca -0.13 0.54 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1d6t n ALA 79 Cb 0.56 -1.75 0.00 0.00 0.00 0.00 0.00 19.45 18.27 1d6t n ALA 79 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1d6t n LYS 80 N 2.38 0.00 -1.65 0.00 5.02 0.38 -4.74 118.16 119.54 1d6t n LYS 80 Ca 0.23 0.00 -0.58 0.00 -2.02 0.00 0.00 58.31 55.95 1d6t n LYS 80 Cb 0.02 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 34.96 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 1.68 -4.03 4.39 5.68 -1.20 -3.64 116.55 119.42 1d6t n ASP 81 Ca 0.00 1.12 -0.08 0.00 -0.50 0.00 0.00 54.79 55.33 1d6t n ASP 81 Cb 0.00 -1.09 -0.09 0.00 -1.14 0.00 0.00 41.12 38.80 1d6t n ASP 81 CO 0.00 0.00 0.00 -0.51 -1.33 0.00 0.00 177.20 175.36 1d6t s ILE 82 N 2.06 0.20 -0.27 2.12 -1.16 -0.72 -2.87 121.20 120.57 1d6t s ILE 82 Ca 0.94 -1.62 -0.05 0.00 -0.51 0.00 0.00 60.65 59.40 1d6t s ILE 82 Cb -1.12 -1.41 0.14 0.00 0.61 0.00 0.00 42.46 40.68 1d6t s ILE 82 CO 0.61 -0.90 0.54 -0.63 -2.81 0.00 0.00 174.94 171.76 1d6t s ILE 83 N -3.76 -0.87 -0.36 2.00 1.01 0.73 -3.84 121.20 116.11 1d6t s ILE 83 Ca 0.05 0.02 -0.21 0.00 0.00 0.00 0.00 60.65 60.52 1d6t s ILE 83 Cb 0.06 -0.90 0.00 0.00 0.01 0.00 0.00 42.46 41.64 1d6t s ILE 83 CO -0.10 -0.01 0.66 0.68 0.00 0.00 0.00 174.94 176.18 1d6t s VAL 84 N 2.77 4.86 0.01 2.92 -7.23 -1.24 0.18 120.40 122.67 1d6t s VAL 84 Ca 0.07 0.60 0.05 0.00 -1.81 0.00 0.00 61.98 60.89 1d6t s VAL 84 Cb -0.14 -4.10 -0.03 0.00 0.56 0.00 0.00 36.38 32.67 1d6t s VAL 84 CO -0.18 -0.35 -0.15 -0.63 -0.31 0.00 0.00 175.10 173.48 1d6t s ILE 85 N 2.77 3.03 -0.27 -0.62 1.09 0.68 -2.68 121.20 125.21 1d6t s ILE 85 Ca 0.25 -0.98 -0.16 0.00 -1.10 0.00 0.00 60.65 58.67 1d6t s ILE 85 Cb -0.14 -2.26 -0.03 0.00 -1.06 0.00 0.00 42.46 38.97 1d6t s ILE 85 CO 0.15 0.42 0.41 0.00 -0.10 0.00 0.00 174.94 175.82 1d6t s ALA 86 N -0.88 3.56 0.64 9.38 0.00 -0.78 -2.07 121.76 131.61 1d6t s ALA 86 Ca 0.14 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.31 1d6t s ALA 86 Cb -0.11 -2.76 0.00 0.00 0.00 0.00 0.00 23.12 20.25 1d6t s ALA 86 CO 0.04 -0.71 0.00 0.54 0.00 0.00 0.00 175.76 175.64 1d6t n ARG 87 N 5.39 -0.02 -0.07 0.00 5.12 -1.18 -3.87 116.66 122.04 1d6t n ARG 87 Ca -0.07 0.00 -0.05 0.00 -1.93 0.00 0.00 57.85 55.79 1d6t n ARG 87 Cb 0.50 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.78 1d6t n ARG 87 CO 0.00 0.00 0.00 1.96 -1.93 0.00 0.00 177.63 177.66 1d6t h GLN 88 N 0.00 0.00 0.00 5.56 4.20 -1.96 -3.34 115.11 119.57 1d6t h GLN 88 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1d6t h GLN 88 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1d6t h GLN 88 CO 0.00 0.18 0.00 -0.35 -0.67 0.00 0.00 178.83 177.99 1d6t n PRO 89 N -4.66 0.75 -0.04 1.46 -0.04 -1.26 -2.91 135.00 128.29 1d6t n PRO 89 Ca -0.07 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.44 1d6t n PRO 89 Cb 0.22 -1.11 0.23 0.00 -0.04 0.00 0.00 33.50 32.79 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 -0.61 2.52 0.72 0.55 0.00 -1.25 -3.04 120.51 119.39 1d6t n ALA 90 Ca 0.04 -0.21 0.13 0.00 0.00 0.00 0.00 53.44 53.39 1d6t n ALA 90 Cb 0.02 -1.09 0.36 0.00 0.00 0.00 0.00 19.45 18.74 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 -0.28 0.20 0.00 0.00 0.00 -1.15 -2.90 118.16 114.03 1d6t n LYS 91 Ca 0.08 0.12 0.13 0.00 -0.00 0.00 0.00 58.31 58.63 1d6t n LYS 91 Cb 0.11 -1.68 0.33 0.00 -0.00 0.00 0.00 35.03 33.79 1d6t n LYS 91 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1d6t n ASP 92 N -2.00 0.97 -3.18 -5.58 5.68 -1.17 -4.91 116.55 106.36 1d6t n ASP 92 Ca 0.05 -0.80 -0.19 0.00 -0.50 0.00 0.00 54.79 53.35 1d6t n ASP 92 Cb 0.41 0.19 0.15 0.00 -1.14 0.00 0.00 41.12 40.73 1d6t n ASP 92 CO 0.00 0.00 0.00 0.23 -1.33 0.00 0.00 177.20 176.10 1d6t n MET 93 N -0.79 -2.02 -3.61 0.11 2.81 -1.14 -5.10 117.12 107.37 1d6t n MET 93 Ca 0.11 -1.15 -0.11 0.00 -1.81 0.00 0.00 57.70 54.74 1d6t n MET 93 Cb 0.35 -1.00 -0.04 0.00 -0.71 0.00 0.00 33.22 31.82 1d6t n MET 93 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1d6t s THR 94 N -2.39 0.06 0.64 2.03 -4.23 -1.26 -4.95 115.64 105.54 1d6t s THR 94 Ca 0.46 -0.51 0.18 0.00 -1.18 0.00 0.00 61.69 60.63 1d6t s THR 94 Cb -0.04 -1.15 0.23 0.00 1.34 0.00 0.00 72.50 72.88 1d6t s THR 94 CO 0.34 -0.28 1.41 0.74 -0.54 0.00 0.00 174.62 176.29 1d6t h THR 95 N 2.32 0.05 0.03 3.99 2.02 -1.97 2.00 112.91 121.35 1d6t h THR 95 Ca -0.34 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 66.71 1d6t h THR 95 Cb 1.26 0.23 0.01 0.00 -1.74 0.00 0.00 68.15 67.92 1d6t h THR 95 CO 0.46 0.00 -0.53 0.25 0.37 0.00 0.00 175.52 176.07 1d6t h LEU 96 N 0.00 0.42 0.15 2.58 7.12 -1.94 -3.02 115.31 120.62 1d6t h LEU 96 Ca 0.17 -0.81 -0.25 0.00 0.13 0.00 0.00 57.88 57.12 1d6t h LEU 96 Cb 1.86 -0.13 0.02 0.00 -0.53 0.00 0.00 40.66 41.87 1d6t h LEU 96 CO -0.00 1.18 -1.16 1.56 -0.13 0.00 0.00 178.44 179.89 1d6t h GLN 97 N -0.30 0.32 -1.03 1.25 4.20 0.19 -3.00 115.11 116.75 1d6t h GLN 97 Ca -0.07 -0.55 0.26 0.00 0.06 0.00 0.00 58.65 58.34 1d6t h GLN 97 Cb 1.29 0.21 -0.10 0.00 0.30 0.00 0.00 27.48 29.18 1d6t h GLN 97 CO 0.10 1.27 0.65 0.82 -0.67 0.00 0.00 178.83 181.00 1d6t h ILE 98 N -0.25 0.54 -0.06 2.54 2.04 0.22 1.58 117.51 124.13 1d6t h ILE 98 Ca -0.22 -0.15 -0.24 0.00 1.00 0.00 0.00 64.86 65.25 1d6t h ILE 98 Cb 1.79 0.05 0.01 0.00 -0.74 0.00 0.00 36.82 37.93 1d6t h ILE 98 CO 0.14 0.08 -0.91 1.56 0.00 0.00 0.00 178.15 179.02 1d6t h GLN 99 N 0.44 0.65 0.00 2.37 4.20 -1.60 -2.92 115.11 118.25 1d6t h GLN 99 Ca 0.60 -0.62 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1d6t h GLN 99 Cb 1.43 0.16 0.00 0.00 0.30 0.00 0.00 27.48 29.36 1d6t h GLN 99 CO -0.33 1.23 0.00 0.09 -0.67 0.00 0.00 178.83 179.15 1d6t n ASN 100 N -3.86 0.61 -0.03 1.46 3.02 0.18 -3.18 115.26 113.46 1d6t n ASN 100 Ca -0.08 0.59 -0.14 0.00 -0.03 0.00 0.00 54.58 54.93 1d6t n ASN 100 Cb 0.81 -0.75 -0.11 0.00 -0.61 0.00 0.00 39.78 39.13 1d6t n ASN 100 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1d6t h SER 101 N 0.00 0.05 0.23 6.41 0.02 0.22 -2.96 113.55 117.52 1d6t h SER 101 Ca 0.00 -0.66 0.00 0.00 -0.84 0.00 0.00 61.79 60.29 1d6t h SER 101 Cb 0.54 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.07 1d6t h SER 101 CO 0.00 0.70 0.00 -0.07 -1.14 0.00 0.00 176.83 176.32 1d6t h LEU 102 N -0.60 0.00 0.00 5.07 4.07 -1.49 0.70 115.31 123.06 1d6t h LEU 102 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1d6t h LEU 102 Cb 0.70 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.44 1d6t h LEU 102 CO 0.01 0.00 0.00 -0.62 -1.08 0.00 0.00 178.44 176.75 1d6t n GLU 103 N -2.51 0.41 0.00 1.13 1.02 -1.12 -2.46 120.64 117.12 1d6t n GLU 103 Ca -0.01 0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 1d6t n GLU 103 Cb 0.10 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 1d6t n GLU 103 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 1d6t n HIS 104 N -1.16 0.00 -0.34 -0.32 -0.00 0.15 -4.50 115.22 109.05 1d6t n HIS 104 Ca 0.11 0.00 0.03 0.00 0.46 0.00 0.00 57.72 58.32 1d6t n HIS 104 Cb 0.11 0.14 0.10 0.00 -0.12 0.00 0.00 29.99 30.22 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 0.05 -0.46 3.57 3.04 -1.49 1.27 116.25 122.23 1d6t h VAL 105 Ca 0.00 0.00 -0.12 0.00 -1.01 0.00 0.00 66.70 65.57 1d6t h VAL 105 Cb 0.00 0.05 -0.01 0.00 -2.01 0.00 0.00 31.29 29.32 1d6t h VAL 105 CO 0.00 0.00 -0.20 0.25 -1.01 0.00 0.00 177.57 176.61 1d6t h LEU 106 N -0.01 0.96 -2.66 3.16 5.85 -1.68 -0.36 115.31 120.58 1d6t h LEU 106 Ca 0.42 -0.39 0.01 0.00 0.84 0.00 0.00 57.88 58.75 1d6t h LEU 106 Cb 0.66 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 1d6t h LEU 106 CO -0.96 1.14 0.08 0.50 -0.34 0.00 0.00 178.44 178.87 1d6t h LYS 107 N 0.78 0.00 0.10 1.25 3.11 0.16 -0.06 116.57 121.90 1d6t h LYS 107 Ca 0.10 0.00 -0.36 0.00 -2.81 0.00 0.00 60.65 57.59 1d6t h LYS 107 Cb 0.77 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.97 1d6t h LYS 107 CO 0.06 0.00 -1.98 -0.89 -2.81 0.00 0.00 179.45 173.83 1d6t n ILE 108 N -3.23 1.74 -0.50 2.00 5.41 0.23 -3.99 119.36 121.02 1d6t n ILE 108 Ca -0.02 -0.67 0.41 0.00 1.00 0.00 0.00 62.75 63.46 1d6t n ILE 108 Cb 0.16 -1.61 0.70 0.00 -0.71 0.00 0.00 39.64 38.18 1d6t n ILE 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1d6t h ALA 109 N 0.21 3.06 0.00 -1.39 0.00 0.70 -3.43 119.26 118.40 1d6t h ALA 109 Ca -0.41 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1d6t h ALA 109 Cb 2.03 0.18 0.00 0.00 0.00 0.00 0.00 17.79 20.00 1d6t h ALA 109 CO 0.08 -1.65 0.00 1.17 0.00 0.00 0.00 179.25 178.85 1d6t n LYS 110 N -4.45 0.00 -0.72 0.00 3.00 -1.16 -4.88 118.16 109.94 1d6t n LYS 110 Ca 0.38 0.20 -0.11 0.00 -0.00 0.00 0.00 58.31 58.78 1d6t n LYS 110 Cb 1.56 -2.12 0.14 0.00 0.00 0.00 0.00 35.03 34.61 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 -2.57 2.24 -3.92 3.15 0.24 -1.26 -4.79 118.33 111.41 1d6t n VAL 111 Ca 0.00 -1.12 -0.23 0.00 -2.04 0.00 0.00 64.34 60.95 1d6t n VAL 111 Cb 0.00 -0.61 -0.17 0.00 -1.47 0.00 0.00 33.84 31.59 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 -2.06 0.86 0.34 6.34 0.08 -1.26 -3.66 117.98 118.62 1d6t s PHE 112 Ca 0.35 -0.29 0.21 0.00 0.12 0.00 0.00 56.93 57.31 1d6t s PHE 112 Cb 0.29 -0.85 1.20 0.00 -0.57 0.00 0.00 43.02 43.09 1d6t s PHE 112 CO 0.07 -0.32 1.37 0.09 -0.10 0.00 0.00 175.22 176.33 1d6t n ASN 113 N 4.77 0.28 0.00 1.36 3.02 -1.23 -4.59 115.26 118.87 1d6t n ASN 113 Ca -0.13 1.40 0.00 0.00 -0.03 0.00 0.00 54.58 55.81 1d6t n ASN 113 Cb 0.50 -0.68 0.00 0.00 -0.61 0.00 0.00 39.78 38.99 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 -4.86 0.00 0.00 3.52 5.02 -1.26 -5.11 118.16 115.47 1d6t n LYS 114 Ca 0.34 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.63 1d6t n LYS 114 Cb 1.18 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 36.19 1d6t n LYS 114 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1d6t n LYS 115 N -0.35 0.00 -0.85 1.97 2.85 -1.26 -5.05 118.16 115.48 1d6t n LYS 115 Ca 0.00 0.00 -0.33 0.00 -1.05 0.00 0.00 58.31 56.93 1d6t n LYS 115 Cb 0.00 0.00 0.12 0.00 -0.65 0.00 0.00 35.03 34.50 1d6t n LYS 115 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 1d6t n ILE 116 N 0.00 0.31 0.00 0.58 2.08 -1.26 -5.24 119.36 115.83 1d6t n ILE 116 Ca 0.00 -0.19 0.00 0.00 0.56 0.00 0.00 62.75 63.12 1d6t n ILE 116 Cb 0.00 -0.71 0.00 0.00 -0.75 0.00 0.00 39.64 38.18 1d6t n ILE 116 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28