#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i2t n LYS 2 N 0.00 1.24 -1.65 0.54 5.02 -1.26 -4.83 118.16 117.22 2i2t n LYS 2 Ca 0.00 0.45 -0.45 0.00 -2.02 0.00 0.00 58.31 56.30 2i2t n LYS 2 Cb 0.00 -2.15 -0.02 0.00 -0.02 0.00 0.00 35.03 32.84 2i2t n LYS 2 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2i2t n ILE 3 N 4.69 1.48 -3.09 -0.18 5.41 -1.26 -4.94 119.36 121.47 2i2t n ILE 3 Ca 0.26 -0.37 -0.40 0.00 1.00 0.00 0.00 62.75 63.24 2i2t n ILE 3 Cb 0.14 -1.31 -0.05 0.00 -0.71 0.00 0.00 39.64 37.71 2i2t n ILE 3 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2i2t s LYS 4 N -1.08 4.25 0.43 0.38 1.02 -1.26 -5.00 119.74 118.49 2i2t s LYS 4 Ca 0.63 0.69 -0.23 0.00 0.02 0.00 0.00 55.97 57.08 2i2t s LYS 4 Cb -0.66 -3.56 -0.08 0.00 -0.52 0.00 0.00 37.83 33.01 2i2t s LYS 4 CO 0.56 -0.20 1.08 0.95 -0.92 0.00 0.00 175.35 176.82 2i2t s THR 5 N 1.77 3.53 -1.10 2.17 -4.23 -1.26 -4.89 115.64 111.63 2i2t s THR 5 Ca 0.31 1.12 -0.23 0.00 -1.18 0.00 0.00 61.69 61.71 2i2t s THR 5 Cb -0.16 -3.56 -0.08 0.00 1.34 0.00 0.00 72.50 70.04 2i2t s THR 5 CO 0.11 -0.04 1.95 -0.69 -0.54 0.00 0.00 174.62 175.42 2i2t s VAL 6 N -1.68 3.49 0.15 2.29 1.01 -0.38 -4.80 120.40 120.48 2i2t s VAL 6 Ca 0.61 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.87 2i2t s VAL 6 Cb -0.23 -4.37 0.21 0.00 0.00 0.00 0.00 36.38 32.00 2i2t s VAL 6 CO 0.28 -0.92 0.76 -1.14 0.00 0.00 0.00 175.10 174.09 2i2t n ARG 7 N 8.44 -0.04 0.20 2.72 3.00 -1.26 -1.20 116.66 128.52 2i2t n ARG 7 Ca 0.43 0.74 -0.11 0.00 -0.00 0.00 0.00 57.85 58.91 2i2t n ARG 7 Cb 0.47 -1.15 -0.06 0.00 0.00 0.00 0.00 32.46 31.72 2i2t n ARG 7 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 2i2t h GLY 8 N 0.00 -0.98 -0.21 5.14 0.00 -1.97 -2.82 103.07 102.23 2i2t h GLY 8 Ca 0.27 0.43 0.31 0.00 0.00 0.00 0.00 47.33 48.34 2i2t h GLY 8 CO -0.47 -0.32 0.76 0.00 0.00 0.00 0.00 176.54 176.51 2i2t h ALA 9 N -1.35 2.81 0.00 3.60 0.00 -1.53 0.38 119.26 123.16 2i2t h ALA 9 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2i2t h ALA 9 Cb 0.53 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2i2t h ALA 9 CO 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 179.25 178.10 2i2t n ALA 10 N -2.67 2.02 -0.03 0.00 0.00 -1.07 -1.49 120.51 117.27 2i2t n ALA 10 Ca 0.24 -0.07 0.02 0.00 0.00 0.00 0.00 53.44 53.63 2i2t n ALA 10 Cb 1.09 -1.19 0.05 0.00 0.00 0.00 0.00 19.45 19.39 2i2t n ALA 10 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2i2t n LYS 11 N -0.91 2.54 0.00 0.00 5.02 0.13 -4.63 118.16 120.32 2i2t n LYS 11 Ca 0.09 -1.57 0.00 0.00 -2.02 0.00 0.00 58.31 54.81 2i2t n LYS 11 Cb 0.04 -1.09 0.00 0.00 -0.02 0.00 0.00 35.03 33.96 2i2t n LYS 11 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2i2t n ARG 12 N -0.11 3.30 -4.42 1.97 1.74 -0.56 -5.08 116.66 113.51 2i2t n ARG 12 Ca 0.04 0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.85 2i2t n ARG 12 Cb 0.28 -0.54 -0.13 0.00 -1.02 0.00 0.00 32.46 31.06 2i2t n ARG 12 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2i2t s PHE 13 N -0.69 2.08 -0.27 -1.55 0.08 -0.90 -4.03 117.98 112.71 2i2t s PHE 13 Ca 0.00 -0.40 -0.03 0.00 0.12 0.00 0.00 56.93 56.62 2i2t s PHE 13 Cb 0.00 -1.15 0.10 0.00 -0.57 0.00 0.00 43.02 41.40 2i2t s PHE 13 CO 0.00 0.25 0.18 0.21 -0.10 0.00 0.00 175.22 175.76 2i2t s LYS 14 N -1.86 0.21 -0.00 0.44 2.36 0.42 -4.82 119.74 116.50 2i2t s LYS 14 Ca 0.11 -0.31 -0.38 0.00 -2.55 0.00 0.00 55.97 52.83 2i2t s LYS 14 Cb -0.10 -1.11 -0.18 0.00 -1.05 0.00 0.00 37.83 35.40 2i2t s LYS 14 CO 0.05 -0.95 1.34 1.17 1.55 0.00 0.00 175.35 178.50 2i2t n LYS 15 N 5.28 0.83 0.00 4.03 4.81 -1.21 -3.57 118.16 128.33 2i2t n LYS 15 Ca -0.05 0.30 0.00 0.00 -0.87 0.00 0.00 58.31 57.69 2i2t n LYS 15 Cb 0.45 -1.91 0.00 0.00 0.02 0.00 0.00 35.03 33.59 2i2t n LYS 15 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2i2t n THR 16 N 2.59 0.00 -0.01 3.15 -2.24 0.32 -4.94 114.28 113.16 2i2t n THR 16 Ca 0.20 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 62.01 2i2t n THR 16 Cb 0.15 -0.72 0.37 0.00 -2.10 0.00 0.00 70.33 68.03 2i2t n THR 16 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2i2t h GLY 17 N 0.00 0.59 0.00 3.38 0.00 -1.93 -3.45 103.07 101.66 2i2t h GLY 17 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2i2t h GLY 17 CO 0.00 0.25 0.00 0.58 0.00 0.00 0.00 176.54 177.37 2i2t n LYS 18 N -4.40 2.50 0.07 4.80 -0.00 -1.26 -5.03 118.16 114.83 2i2t n LYS 18 Ca 0.03 0.00 -0.14 0.00 -0.00 0.00 0.00 58.31 58.19 2i2t n LYS 18 Cb 0.12 0.00 -0.08 0.00 -0.00 0.00 0.00 35.03 35.07 2i2t n LYS 18 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 2i2t h GLY 19 N 0.00 -0.92 0.00 2.58 0.00 -2.00 -3.45 103.07 99.28 2i2t h GLY 19 Ca 0.00 0.57 0.00 0.00 0.00 0.00 0.00 47.33 47.90 2i2t h GLY 19 CO 0.00 -0.25 0.00 0.61 0.00 0.00 0.00 176.54 176.90 2i2t n GLY 20 N -1.46 0.00 0.00 4.60 0.00 -1.26 -4.29 105.19 102.78 2i2t n GLY 20 Ca -0.07 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.02 2i2t n GLY 20 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2i2t n PHE 21 N 0.00 0.00 -2.06 1.61 3.01 -1.26 0.12 117.46 118.88 2i2t n PHE 21 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2i2t n PHE 21 Cb 0.00 -0.18 0.00 0.00 -0.01 0.00 0.00 39.48 39.29 2i2t n PHE 21 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 2i2t n LYS 22 N -1.69 -3.87 -4.21 -1.08 3.00 -1.23 0.16 118.16 109.24 2i2t n LYS 22 Ca -0.00 2.76 -0.12 0.00 -0.00 0.00 0.00 58.31 60.94 2i2t n LYS 22 Cb 0.29 -3.31 -0.10 0.00 0.00 0.00 0.00 35.03 31.91 2i2t n LYS 22 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.40 174.02 2i2t s HIS 23 N -0.39 1.18 0.27 5.64 -3.43 -1.26 -1.89 115.29 115.40 2i2t s HIS 23 Ca 0.00 -1.34 -0.16 0.00 -0.80 0.00 0.00 55.06 52.76 2i2t s HIS 23 Cb 0.00 -0.59 -0.08 0.00 -1.43 0.00 0.00 32.58 30.47 2i2t s HIS 23 CO 0.00 -0.59 0.71 0.21 -2.00 0.00 0.00 174.74 173.07 2i2t s LYS 24 N -4.13 4.08 0.22 -0.38 2.36 -1.26 0.18 119.74 120.81 2i2t s LYS 24 Ca 0.37 0.71 -0.21 0.00 -2.55 0.00 0.00 55.97 54.29 2i2t s LYS 24 Cb 0.07 -2.65 -0.08 0.00 -1.05 0.00 0.00 37.83 34.12 2i2t s LYS 24 CO 0.11 0.28 0.74 -1.01 1.55 0.00 0.00 175.35 177.03 2i2t s HIS 25 N -1.76 3.69 0.50 4.03 3.76 -1.26 -4.88 115.29 119.36 2i2t s HIS 25 Ca 0.48 1.45 -0.09 0.00 -0.15 0.00 0.00 55.06 56.76 2i2t s HIS 25 Cb -0.13 -2.66 -0.05 0.00 1.11 0.00 0.00 32.58 30.85 2i2t s HIS 25 CO 0.19 0.36 0.85 0.00 -0.85 0.00 0.00 174.74 175.29 2i2t s ALA 26 N -1.47 3.30 -0.36 -1.40 0.00 -1.26 -4.55 121.76 116.02 2i2t s ALA 26 Ca 0.42 -0.29 -0.02 0.00 0.00 0.00 0.00 51.96 52.07 2i2t s ALA 26 Cb -0.18 -2.76 -0.02 0.00 0.00 0.00 0.00 23.12 20.16 2i2t s ALA 26 CO 0.22 -0.34 0.32 0.09 0.00 0.00 0.00 175.76 176.05 2i2t n ASN 27 N -2.09 -3.90 -1.45 0.00 5.03 -1.26 -5.00 115.26 106.59 2i2t n ASN 27 Ca 0.03 -0.19 -0.04 0.00 0.87 0.00 0.00 54.58 55.24 2i2t n ASN 27 Cb 0.54 -2.40 0.00 0.00 -1.02 0.00 0.00 39.78 36.91 2i2t n ASN 27 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 2i2t n LEU 28 N -1.88 -0.92 0.00 3.41 7.94 -1.26 -4.92 117.00 119.38 2i2t n LEU 28 Ca -0.02 -2.00 0.00 0.00 -1.11 0.00 0.00 56.01 52.89 2i2t n LEU 28 Cb 0.53 0.11 0.00 0.00 0.53 0.00 0.00 43.42 44.59 2i2t n LEU 28 CO 0.22 1.39 0.04 -2.11 -1.11 0.00 0.00 177.39 175.81 2i2t n ARG 29 N -0.45 0.00 -3.65 1.96 1.85 -1.26 -5.11 116.66 110.00 2i2t n ARG 29 Ca -0.19 -0.08 -0.15 0.00 -1.00 0.00 0.00 57.85 56.43 2i2t n ARG 29 Cb 0.67 -0.08 -0.08 0.00 -1.05 0.00 0.00 32.46 31.92 2i2t n ARG 29 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 2i2t s HIS 30 N 0.00 -0.49 -0.21 2.89 2.46 -1.26 -5.02 115.29 113.66 2i2t s HIS 30 Ca 0.00 0.98 -0.18 0.00 0.47 0.00 0.00 55.06 56.33 2i2t s HIS 30 Cb 0.00 0.24 0.03 0.00 -0.13 0.00 0.00 32.58 32.72 2i2t s HIS 30 CO 0.00 -0.43 0.31 1.51 -2.47 0.00 0.00 174.74 173.66 2i2t n ILE 31 N 1.69 -2.27 -0.01 0.89 3.06 -1.26 -4.91 119.36 116.56 2i2t n ILE 31 Ca -0.18 0.16 0.01 0.00 -2.50 0.00 0.00 62.75 60.25 2i2t n ILE 31 Cb 0.56 -2.37 -0.05 0.00 0.54 0.00 0.00 39.64 38.32 2i2t n ILE 31 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 2i2t n LEU 32 N 0.30 0.00 -0.34 9.51 4.77 -1.26 -4.63 117.00 125.36 2i2t n LEU 32 Ca -0.04 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.10 2i2t n LEU 32 Cb 0.44 0.04 0.36 0.00 -2.33 0.00 0.00 43.42 41.94 2i2t n LEU 32 CO 0.26 0.04 1.15 0.00 -1.33 0.00 0.00 177.39 177.51 2i2t h THR 33 N 0.00 0.56 -2.22 -5.08 1.03 -2.03 -1.59 112.91 103.58 2i2t h THR 33 Ca -0.05 -0.20 -0.75 0.00 -0.01 0.00 0.00 66.41 65.40 2i2t h THR 33 Cb 0.60 -0.08 -0.31 0.00 -1.07 0.00 0.00 68.15 67.29 2i2t h THR 33 CO 0.00 0.11 0.62 2.29 -0.01 0.00 0.00 175.52 178.53 2i2t n LYS 34 N -4.89 4.68 -3.83 0.00 2.85 -1.26 -4.96 118.16 110.75 2i2t n LYS 34 Ca 0.25 -4.61 -0.12 0.00 -1.05 0.00 0.00 58.31 52.78 2i2t n LYS 34 Cb 0.70 -2.40 -0.11 0.00 -0.65 0.00 0.00 35.03 32.57 2i2t n LYS 34 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2i2t s LYS 35 N -4.11 0.38 0.11 -1.58 1.02 -0.60 -5.12 119.74 109.84 2i2t s LYS 35 Ca 0.43 -0.06 -0.31 0.00 0.02 0.00 0.00 55.97 56.05 2i2t s LYS 35 Cb 0.24 0.17 -0.10 0.00 -0.52 0.00 0.00 37.83 37.62 2i2t s LYS 35 CO -0.16 -0.08 1.86 0.00 -0.92 0.00 0.00 175.35 176.05 2i2t s ALA 36 N -0.68 3.73 0.02 5.17 0.00 -1.26 -4.83 121.76 123.92 2i2t s ALA 36 Ca -0.08 1.43 0.29 0.00 0.00 0.00 0.00 51.96 53.60 2i2t s ALA 36 Cb -0.04 -3.78 1.51 0.00 0.00 0.00 0.00 23.12 20.80 2i2t s ALA 36 CO 0.01 -1.30 1.88 1.79 0.00 0.00 0.00 175.76 178.15 2i2t h THR 37 N 4.87 0.00 0.02 0.00 1.35 -1.98 0.26 112.91 117.43 2i2t h THR 37 Ca -0.47 -0.06 -0.27 0.00 -0.55 0.00 0.00 66.41 65.06 2i2t h THR 37 Cb 1.22 0.75 -0.04 0.00 -1.73 0.00 0.00 68.15 68.36 2i2t h THR 37 CO 0.95 0.00 -1.46 0.50 -0.25 0.00 0.00 175.52 175.25 2i2t h LYS 38 N 0.00 0.04 -0.08 4.72 3.64 -1.98 -2.66 116.57 120.24 2i2t h LYS 38 Ca 0.00 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 2i2t h LYS 38 Cb 0.08 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2i2t h LYS 38 CO 0.00 0.76 -0.01 -0.09 -2.27 0.00 0.00 179.45 177.84 2i2t h ARG 39 N 0.01 0.15 -0.34 1.90 2.43 -0.89 -1.28 114.38 116.36 2i2t h ARG 39 Ca -0.19 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 58.87 2i2t h ARG 39 Cb 1.93 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 31.46 2i2t h ARG 39 CO 0.11 0.44 0.01 0.87 -1.51 0.00 0.00 179.97 179.88 2i2t h LYS 40 N -0.16 0.60 -0.74 0.20 1.57 -1.45 -2.45 116.57 114.13 2i2t h LYS 40 Ca 0.02 -0.19 0.08 0.00 -1.87 0.00 0.00 60.65 58.70 2i2t h LYS 40 Cb 0.38 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.59 2i2t h LYS 40 CO 0.01 0.71 0.49 -0.09 -0.57 0.00 0.00 179.45 180.00 2i2t h ARG 41 N 0.40 0.67 -1.17 3.15 2.43 -1.46 0.48 114.38 118.89 2i2t h ARG 41 Ca 0.10 -0.04 -0.38 0.00 -0.81 0.00 0.00 59.98 58.84 2i2t h ARG 41 Cb 0.44 -0.15 -0.19 0.00 -0.42 0.00 0.00 29.97 29.65 2i2t h ARG 41 CO 0.02 0.45 0.49 0.72 -1.51 0.00 0.00 179.97 180.13 2i2t n HIS 42 N -4.49 2.03 0.00 2.20 8.25 -0.49 -3.74 115.22 118.98 2i2t n HIS 42 Ca 0.12 -1.81 0.00 0.00 -0.26 0.00 0.00 57.72 55.77 2i2t n HIS 42 Cb 0.30 -0.90 0.00 0.00 1.12 0.00 0.00 29.99 30.51 2i2t n HIS 42 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2i2t n LEU 43 N -0.33 0.00 0.23 2.41 4.77 0.16 -4.92 117.00 119.31 2i2t n LEU 43 Ca 0.40 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 56.22 2i2t n LEU 43 Cb 0.95 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.97 2i2t n LEU 43 CO 0.45 0.00 0.71 0.03 -1.33 0.00 0.00 177.39 177.25 2i2t h ARG 44 N 0.00 -0.56 -6.20 3.23 3.08 -1.32 -3.40 114.38 109.22 2i2t h ARG 44 Ca 0.00 0.04 -0.58 0.00 0.07 0.00 0.00 59.98 59.51 2i2t h ARG 44 Cb 0.00 0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 2i2t h ARG 44 CO 0.00 -0.38 1.33 -1.25 -1.07 0.00 0.00 179.97 178.60 2i2t s PRO 45 N -6.09 3.31 0.41 0.04 0.04 -1.26 -4.81 135.00 126.64 2i2t s PRO 45 Ca -0.16 1.62 -0.26 0.00 0.04 0.00 0.00 61.00 62.25 2i2t s PRO 45 Cb 0.05 -4.24 -0.08 0.00 0.04 0.00 0.00 34.50 30.27 2i2t s PRO 45 CO 0.64 -1.89 1.28 -1.59 0.04 0.00 0.00 177.00 175.48 2i2t s LYS 46 N 5.79 3.95 -0.29 4.56 -2.85 -1.26 -4.83 119.74 124.81 2i2t s LYS 46 Ca 0.85 2.11 0.03 0.00 -1.00 0.00 0.00 55.97 57.97 2i2t s LYS 46 Cb -0.26 -2.72 0.20 0.00 -2.06 0.00 0.00 37.83 32.99 2i2t s LYS 46 CO 0.34 -0.49 0.67 0.00 0.10 0.00 0.00 175.35 175.97 2i2t s ALA 47 N -1.29 -2.69 0.00 0.59 0.00 0.13 -4.73 121.76 113.77 2i2t s ALA 47 Ca 0.57 1.11 0.00 0.00 0.00 0.00 0.00 51.96 53.65 2i2t s ALA 47 Cb -0.37 -2.59 0.00 0.00 0.00 0.00 0.00 23.12 20.16 2i2t s ALA 47 CO 0.47 -1.88 0.00 0.00 0.00 0.00 0.00 175.76 174.35 2i2t n MET 48 N 5.36 0.00 -1.84 0.00 0.00 -1.26 -4.53 117.12 114.86 2i2t n MET 48 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 57.70 57.46 2i2t n MET 48 Cb 0.55 0.00 0.05 0.00 0.00 0.00 0.00 33.22 33.82 2i2t n MET 48 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 175.97 176.11 2i2t s VAL 49 N 0.00 3.34 -0.39 3.17 -7.23 -1.26 -4.71 120.40 113.32 2i2t s VAL 49 Ca 0.00 0.44 0.02 0.00 -1.81 0.00 0.00 61.98 60.63 2i2t s VAL 49 Cb 0.00 -3.40 0.48 0.00 0.56 0.00 0.00 36.38 34.02 2i2t s VAL 49 CO 0.00 -0.57 1.79 -1.54 -0.31 0.00 0.00 175.10 174.47 2i2t n SER 50 N -3.08 4.43 0.00 4.85 3.41 -1.26 -4.88 113.62 117.08 2i2t n SER 50 Ca 0.07 -3.30 0.00 0.00 -0.26 0.00 0.00 58.87 55.38 2i2t n SER 50 Cb 0.57 -0.82 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 2i2t n SER 50 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2i2t n LYS 51 N -0.69 0.00 -0.01 4.33 4.01 -1.26 -4.38 118.16 120.17 2i2t n LYS 51 Ca 0.47 0.00 0.09 0.00 -0.51 0.00 0.00 58.31 58.37 2i2t n LYS 51 Cb 1.23 -3.41 -0.14 0.00 -0.51 0.00 0.00 35.03 32.21 2i2t n LYS 51 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2i2t n GLY 52 N -1.45 -0.85 0.01 0.72 0.00 -1.26 -4.20 105.19 98.16 2i2t n GLY 52 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.54 2i2t n GLY 52 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2i2t n ASP 53 N -1.97 0.38 -0.06 1.61 8.00 -1.26 -4.67 116.55 118.57 2i2t n ASP 53 Ca -0.02 -0.69 -0.10 0.00 0.71 0.00 0.00 54.79 54.69 2i2t n ASP 53 Cb 0.45 0.64 -0.03 0.00 -0.02 0.00 0.00 41.12 42.15 2i2t n ASP 53 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2i2t h LEU 54 N 0.03 0.28 0.00 0.64 5.85 -1.86 -0.90 115.31 119.34 2i2t h LEU 54 Ca 0.00 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.66 2i2t h LEU 54 Cb 0.01 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 40.97 2i2t h LEU 54 CO 0.00 0.26 0.00 0.61 -0.34 0.00 0.00 178.44 178.97 2i2t n GLY 55 N -1.00 -0.42 0.48 3.75 0.00 -1.26 -1.19 105.19 105.55 2i2t n GLY 55 Ca -0.03 -0.05 0.04 0.00 0.00 0.00 0.00 46.02 45.99 2i2t n GLY 55 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2i2t n LEU 56 N -0.77 2.65 0.00 0.99 7.94 -0.35 -4.44 117.00 123.02 2i2t n LEU 56 Ca 0.05 -1.95 0.00 0.00 -1.11 0.00 0.00 56.01 53.00 2i2t n LEU 56 Cb 0.02 -0.17 0.00 0.00 0.53 0.00 0.00 43.42 43.81 2i2t n LEU 56 CO 0.04 0.66 -0.35 0.52 -1.11 0.00 0.00 177.39 177.15 2i2t n VAL 57 N 0.28 0.00 1.11 1.96 0.31 -0.33 -4.33 118.33 117.32 2i2t n VAL 57 Ca 0.09 0.00 0.06 0.00 -0.01 0.00 0.00 64.34 64.47 2i2t n VAL 57 Cb 0.37 -0.29 0.18 0.00 -0.91 0.00 0.00 33.84 33.19 2i2t n VAL 57 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2i2t n ILE 58 N -1.36 0.36 0.00 2.52 5.41 -1.06 -0.07 119.36 125.16 2i2t n ILE 58 Ca 0.00 -0.38 0.00 0.00 1.00 0.00 0.00 62.75 63.37 2i2t n ILE 58 Cb 0.21 0.21 0.00 0.00 -0.71 0.00 0.00 39.64 39.35 2i2t n ILE 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2i2t n ALA 59 N 0.33 1.95 -0.11 -1.39 0.00 -1.26 -4.53 120.51 115.50 2i2t n ALA 59 Ca 0.11 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.42 2i2t n ALA 59 Cb 0.26 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.56 2i2t n ALA 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2i2t n LEU 61 N -2.95 3.71 -0.18 0.00 4.77 0.90 -1.24 117.00 122.00 2i2t n LEU 61 Ca -0.37 -5.26 -0.05 0.00 -0.03 0.00 0.00 56.01 50.31 2i2t n LEU 61 Cb 1.09 -0.85 0.05 0.00 -2.33 0.00 0.00 43.42 41.38 2i2t n LEU 61 CO 0.37 1.78 1.05 -0.65 -1.33 0.00 0.00 177.39 178.61 2i2t h PRO 62 N 5.23 0.55 -2.26 3.23 0.11 -1.83 -3.18 132.00 133.85 2i2t h PRO 62 Ca 0.17 -0.03 -0.79 0.00 0.11 0.00 0.00 66.00 65.45 2i2t h PRO 62 Cb 0.73 -0.13 -0.25 0.00 0.11 0.00 0.00 31.00 31.47 2i2t h PRO 62 CO 0.82 0.37 1.19 0.66 -0.21 0.00 0.00 178.00 180.83 2i2t n TYR 63 N -4.83 2.75 0.31 0.65 4.01 -1.26 -5.07 117.16 113.72 2i2t n TYR 63 Ca 0.04 -2.55 0.04 0.00 -0.16 0.00 0.00 57.90 55.27 2i2t n TYR 63 Cb 0.11 -1.28 0.03 0.00 -0.31 0.00 0.00 39.34 37.90 2i2t n TYR 63 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40