#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vqe s ARG 3 N 0.00 1.39 0.04 0.54 0.52 -1.26 -5.12 118.95 115.06 2vqe s ARG 3 Ca 0.00 -0.54 -0.28 0.00 -0.52 0.00 0.00 55.73 54.39 2vqe s ARG 3 Cb 0.00 -2.07 0.09 0.00 0.52 0.00 0.00 34.95 33.49 2vqe s ARG 3 CO 0.00 -1.81 0.95 -1.54 0.02 0.00 0.00 175.30 172.92 2vqe s SER 4 N -4.74 -0.28 0.00 0.23 1.04 -1.26 -5.05 113.70 103.64 2vqe s SER 4 Ca 0.68 -0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.97 2vqe s SER 4 Cb -0.06 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.45 2vqe s SER 4 CO 0.48 -0.68 0.00 0.18 0.98 0.00 0.00 173.24 174.20 2vqe n LEU 5 N -0.32 0.00 0.00 2.42 4.77 -1.26 -5.17 117.00 117.44 2vqe n LEU 5 Ca -0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 2vqe n LEU 5 Cb 0.61 0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.97 2vqe n LEU 5 CO 0.12 -0.33 0.00 1.17 -1.33 0.00 0.00 177.39 177.02 2vqe n LYS 6 N -2.16 0.00 -3.27 3.23 4.81 -1.26 -4.88 118.16 114.63 2vqe n LYS 6 Ca 0.00 0.00 -0.25 0.00 -0.87 0.00 0.00 58.31 57.19 2vqe n LYS 6 Cb 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 35.03 34.97 2vqe n LYS 6 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 2vqe n LYS 7 N 0.00 0.84 0.00 1.64 -0.00 -1.26 -4.84 118.16 114.54 2vqe n LYS 7 Ca 0.00 -3.40 0.00 0.00 -0.00 0.00 0.00 58.31 54.91 2vqe n LYS 7 Cb 0.00 -1.43 0.00 0.00 -0.00 0.00 0.00 35.03 33.60 2vqe n LYS 7 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2vqe n GLY 8 N 1.60 0.00 0.00 2.58 0.00 -1.26 -5.13 105.19 102.98 2vqe n GLY 8 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 2vqe n GLY 8 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2vqe n VAL 9 N 0.00 0.00 -3.67 1.61 0.31 -1.26 -4.91 118.33 110.40 2vqe n VAL 9 Ca 0.00 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.00 2vqe n VAL 9 Cb 0.00 0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 32.88 2vqe n VAL 9 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 2vqe s PHE 10 N 0.00 3.52 -0.28 3.52 5.36 -1.26 -5.07 117.98 123.77 2vqe s PHE 10 Ca 0.00 0.60 -0.16 0.00 -0.96 0.00 0.00 56.93 56.41 2vqe s PHE 10 Cb 0.00 -2.03 0.10 0.00 -0.34 0.00 0.00 43.02 40.75 2vqe s PHE 10 CO 0.00 0.49 0.77 0.08 -1.46 0.00 0.00 175.22 175.10 2vqe s VAL 11 N -1.53 0.00 0.15 3.12 1.01 -1.26 -2.36 120.40 119.53 2vqe s VAL 11 Ca 0.37 0.00 -0.31 0.00 0.00 0.00 0.00 61.98 62.04 2vqe s VAL 11 Cb -0.13 -1.00 -0.08 0.00 0.00 0.00 0.00 36.38 35.17 2vqe s VAL 11 CO 0.22 0.00 1.37 -1.81 0.00 0.00 0.00 175.10 174.88 2vqe s ASP 12 N 1.54 6.83 0.00 3.32 -0.00 -1.26 -4.90 116.67 122.20 2vqe s ASP 12 Ca -0.10 2.38 0.15 0.00 -0.00 0.00 0.00 52.55 54.99 2vqe s ASP 12 Cb -0.05 -2.60 0.91 0.00 -0.00 0.00 0.00 42.92 41.19 2vqe s ASP 12 CO -0.18 -0.62 1.43 -0.90 -0.00 0.00 0.00 175.17 174.90 2vqe n ASP 13 N 3.41 0.00 -0.26 0.27 3.85 -1.26 -2.37 116.55 120.19 2vqe n ASP 13 Ca 0.09 -1.06 -0.05 0.00 -0.71 0.00 0.00 54.79 53.07 2vqe n ASP 13 Cb 0.42 0.00 0.10 0.00 -1.35 0.00 0.00 41.12 40.29 2vqe n ASP 13 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.20 176.64 2vqe h HIS 14 N 0.00 1.14 0.00 2.11 3.86 -2.01 -3.28 115.15 116.97 2vqe h HIS 14 Ca 0.00 -0.08 -0.12 0.00 -1.16 0.00 0.00 60.37 59.01 2vqe h HIS 14 Cb 0.00 -0.34 -0.02 0.00 1.06 0.00 0.00 27.41 28.10 2vqe h HIS 14 CO 0.00 0.87 -1.56 1.47 0.86 0.00 0.00 177.93 179.57 2vqe n LEU 15 N -4.28 0.00 -0.29 2.43 -0.00 -1.22 -3.86 117.00 109.77 2vqe n LEU 15 Ca 0.07 0.00 0.20 0.00 -0.00 0.00 0.00 56.01 56.28 2vqe n LEU 15 Cb 0.19 0.16 0.38 0.00 -0.00 0.00 0.00 43.42 44.15 2vqe n LEU 15 CO 0.40 0.16 0.80 -0.11 -0.00 0.00 0.00 177.39 178.64 2vqe n LEU 16 N -2.20 0.10 -0.10 1.47 7.94 -1.00 0.20 117.00 123.41 2vqe n LEU 16 Ca -0.11 1.44 -0.11 0.00 -1.11 0.00 0.00 56.01 56.12 2vqe n LEU 16 Cb 0.65 -0.61 -0.15 0.00 0.53 0.00 0.00 43.42 43.84 2vqe n LEU 16 CO 0.19 -1.54 -1.17 -1.84 -1.11 0.00 0.00 177.39 171.91 2vqe n GLU 17 N -5.10 0.74 -0.18 1.96 0.28 -1.25 -3.87 120.64 113.23 2vqe n GLU 17 Ca 0.26 0.01 -0.06 0.00 -0.16 0.00 0.00 57.16 57.22 2vqe n GLU 17 Cb 0.88 -1.51 0.04 0.00 1.43 0.00 0.00 31.44 32.28 2vqe n GLU 17 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 177.13 176.75 2vqe h LYS 18 N 0.00 0.61 -0.13 3.44 1.63 -0.42 -0.39 116.57 121.31 2vqe h LYS 18 Ca -0.54 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.21 2vqe h LYS 18 Cb 2.17 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 33.66 2vqe h LYS 18 CO 0.01 0.41 0.05 -0.24 -3.45 0.00 0.00 179.45 176.23 2vqe h VAL 19 N 0.63 1.16 0.00 2.00 3.04 0.22 -2.72 116.25 120.57 2vqe h VAL 19 Ca 0.21 -0.47 -0.02 0.00 -1.01 0.00 0.00 66.70 65.41 2vqe h VAL 19 Cb 0.01 1.22 -0.00 0.00 -2.01 0.00 0.00 31.29 30.51 2vqe h VAL 19 CO -0.09 0.14 -0.08 0.17 -1.01 0.00 0.00 177.57 176.70 2vqe h LEU 20 N 0.06 0.00 -0.57 3.16 8.10 -1.60 -1.50 115.31 122.95 2vqe h LEU 20 Ca 0.04 0.00 -0.16 0.00 0.11 0.00 0.00 57.88 57.88 2vqe h LEU 20 Cb 0.18 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.38 2vqe h LEU 20 CO -0.00 0.08 -0.69 -0.33 -4.11 0.00 0.00 178.44 173.39 2vqe h GLU 21 N 0.00 0.13 0.00 0.17 5.08 -0.77 -2.19 114.58 117.00 2vqe h GLU 21 Ca -0.00 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2vqe h GLU 21 Cb 0.25 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2vqe h GLU 21 CO 0.01 0.77 0.00 1.28 -1.00 0.00 0.00 179.01 180.07 2vqe n LEU 22 N -3.77 0.00 -0.08 1.33 4.77 -0.57 -1.75 117.00 116.93 2vqe n LEU 22 Ca -0.02 0.40 -0.10 0.00 -0.03 0.00 0.00 56.01 56.26 2vqe n LEU 22 Cb 0.68 -0.40 -0.15 0.00 -2.33 0.00 0.00 43.42 41.21 2vqe n LEU 22 CO 0.44 -0.18 -0.98 0.59 -1.33 0.00 0.00 177.39 175.94 2vqe n ASN 23 N -1.40 0.33 0.27 -1.43 3.02 -0.87 -0.03 115.26 115.15 2vqe n ASN 23 Ca 0.06 0.12 0.11 0.00 -0.03 0.00 0.00 54.58 54.84 2vqe n ASN 23 Cb 0.16 0.64 0.76 0.00 -0.61 0.00 0.00 39.78 40.73 2vqe n ASN 23 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vqe h ALA 24 N 0.96 1.81 0.00 5.41 0.00 -0.88 -3.23 119.26 123.33 2vqe h ALA 24 Ca -0.47 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 2vqe h ALA 24 Cb 2.17 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.92 2vqe h ALA 24 CO 0.04 -0.02 -0.54 0.36 0.00 0.00 0.00 179.25 179.09 2vqe n LYS 25 N -4.23 0.06 0.00 0.00 -0.00 -1.22 -5.11 118.16 107.65 2vqe n LYS 25 Ca -0.03 -1.19 0.00 0.00 -0.00 0.00 0.00 58.31 57.09 2vqe n LYS 25 Cb 0.10 -0.49 0.00 0.00 -0.00 0.00 0.00 35.03 34.65 2vqe n LYS 25 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2vqe n GLY 26 N -0.00 -0.12 0.00 2.58 0.00 -1.12 -4.97 105.19 101.55 2vqe n GLY 26 Ca 0.01 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2vqe n GLY 26 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2vqe n GLU 27 N 0.00 0.00 0.00 1.61 0.00 0.95 -4.14 120.64 119.06 2vqe n GLU 27 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 2vqe n GLU 27 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 2vqe n GLU 27 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 2vqe n LYS 28 N -0.85 0.00 -3.79 3.44 4.81 -1.26 -4.84 118.16 115.67 2vqe n LYS 28 Ca 0.00 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.31 2vqe n LYS 28 Cb 0.00 0.00 -0.14 0.00 0.02 0.00 0.00 35.03 34.91 2vqe n LYS 28 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 2vqe s ARG 29 N 0.00 0.11 0.60 1.64 0.52 -1.26 -4.98 118.95 115.58 2vqe s ARG 29 Ca 0.00 0.28 0.00 0.00 -0.52 0.00 0.00 55.73 55.49 2vqe s ARG 29 Cb 0.00 -0.07 0.00 0.00 0.52 0.00 0.00 34.95 35.40 2vqe s ARG 29 CO 0.00 -0.10 0.00 1.28 0.02 0.00 0.00 175.30 176.50 2vqe n LEU 30 N 3.65 -1.10 -3.52 2.53 4.77 -1.24 -5.07 117.00 117.03 2vqe n LEU 30 Ca -0.20 2.41 -0.16 0.00 -0.03 0.00 0.00 56.01 58.03 2vqe n LEU 30 Cb 0.55 -3.05 -0.05 0.00 -2.33 0.00 0.00 43.42 38.54 2vqe n LEU 30 CO 0.20 -1.86 0.39 -0.63 -1.33 0.00 0.00 177.39 174.16 2vqe s ILE 31 N -4.56 0.01 -0.17 -0.08 -1.09 -1.15 -4.94 121.20 109.21 2vqe s ILE 31 Ca 0.00 -0.06 -0.00 0.00 -2.23 0.00 0.00 60.65 58.36 2vqe s ILE 31 Cb 0.00 -0.98 0.04 0.00 -1.58 0.00 0.00 42.46 39.94 2vqe s ILE 31 CO 0.00 -0.03 -0.07 -0.54 -1.23 0.00 0.00 174.94 173.07 2vqe s LYS 32 N -1.91 1.59 0.26 2.79 1.02 -1.26 -0.39 119.74 121.84 2vqe s LYS 32 Ca -0.08 -0.60 0.10 0.00 0.02 0.00 0.00 55.97 55.42 2vqe s LYS 32 Cb -0.01 -2.11 -0.05 0.00 -0.52 0.00 0.00 37.83 35.14 2vqe s LYS 32 CO 0.03 -0.43 -0.17 0.99 -0.92 0.00 0.00 175.35 174.85 2vqe s THR 33 N 1.57 2.23 -0.06 2.17 2.01 -1.08 -5.01 115.64 117.47 2vqe s THR 33 Ca 0.00 -2.33 0.10 0.00 0.31 0.00 0.00 61.69 59.77 2vqe s THR 33 Cb -0.15 -2.25 0.18 0.00 0.01 0.00 0.00 72.50 70.29 2vqe s THR 33 CO -0.08 -0.44 1.09 0.79 -0.69 0.00 0.00 174.62 175.29 2vqe n TRP 34 N -0.56 0.00 -3.41 4.92 8.01 -1.26 -2.99 117.44 122.15 2vqe n TRP 34 Ca -0.06 -0.51 -0.28 0.00 -1.31 0.00 0.00 57.50 55.35 2vqe n TRP 34 Cb 0.60 -0.11 -0.08 0.00 -2.01 0.00 0.00 31.31 29.72 2vqe n TRP 34 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13 2vqe n SER 35 N -0.51 3.86 0.00 -0.99 2.88 -1.26 -4.83 113.62 112.77 2vqe n SER 35 Ca 0.08 -3.45 0.07 0.00 -1.33 0.00 0.00 58.87 54.24 2vqe n SER 35 Cb 0.73 -0.69 0.38 0.00 -0.75 0.00 0.00 64.21 63.88 2vqe n SER 35 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 2vqe n ARG 36 N 0.87 0.35 0.00 -1.46 1.85 -1.26 -2.06 116.66 114.95 2vqe n ARG 36 Ca 0.30 0.05 0.13 0.00 -1.00 0.00 0.00 57.85 57.33 2vqe n ARG 36 Cb 0.41 -1.50 0.39 0.00 -1.05 0.00 0.00 32.46 30.71 2vqe n ARG 36 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 2vqe n ARG 37 N -1.09 1.47 -3.27 2.89 1.85 -1.26 -2.35 116.66 114.89 2vqe n ARG 37 Ca 0.09 -0.95 -0.38 0.00 -1.00 0.00 0.00 57.85 55.61 2vqe n ARG 37 Cb 0.06 -1.48 -0.06 0.00 -1.05 0.00 0.00 32.46 29.94 2vqe n ARG 37 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2vqe s SER 38 N -2.18 6.79 0.86 2.89 1.04 -0.87 -4.82 113.70 117.41 2vqe s SER 38 Ca 0.31 0.94 -0.11 0.00 0.48 0.00 0.00 55.95 57.58 2vqe s SER 38 Cb 0.20 -2.31 0.12 0.00 0.10 0.00 0.00 66.02 64.12 2vqe s SER 38 CO 0.40 0.03 1.14 -0.89 0.98 0.00 0.00 173.24 174.90 2vqe s THR 39 N 0.36 2.38 -0.17 2.02 2.01 -0.99 -3.13 115.64 118.12 2vqe s THR 39 Ca 0.28 0.13 -0.08 0.00 0.31 0.00 0.00 61.69 62.33 2vqe s THR 39 Cb -0.16 -2.31 -0.04 0.00 0.01 0.00 0.00 72.50 70.00 2vqe s THR 39 CO 0.13 -0.16 0.11 -0.63 -0.69 0.00 0.00 174.62 173.38 2vqe s ILE 40 N -2.65 5.24 0.24 1.82 1.01 -0.82 -4.84 121.20 121.20 2vqe s ILE 40 Ca 0.66 0.12 0.11 0.00 0.00 0.00 0.00 60.65 61.54 2vqe s ILE 40 Cb -0.22 -3.35 -0.05 0.00 0.01 0.00 0.00 42.46 38.85 2vqe s ILE 40 CO 0.56 0.49 -0.20 0.68 0.00 0.00 0.00 174.94 176.48 2vqe s VAL 41 N -0.01 2.28 0.08 2.92 -7.23 -1.26 -1.57 120.40 115.62 2vqe s VAL 41 Ca 0.09 -2.25 -0.16 0.00 -1.81 0.00 0.00 61.98 57.84 2vqe s VAL 41 Cb -0.12 -2.18 -0.04 0.00 0.56 0.00 0.00 36.38 34.61 2vqe s VAL 41 CO -0.00 -0.36 0.95 -2.65 -0.31 0.00 0.00 175.10 172.73 2vqe n PRO 42 N -0.31 -0.23 0.00 4.82 -0.02 -1.26 -0.88 135.00 137.13 2vqe n PRO 42 Ca -0.08 0.94 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 2vqe n PRO 42 Cb 0.59 -1.38 0.00 0.00 -0.02 0.00 0.00 33.50 32.69 2vqe n PRO 42 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2vqe n GLU 43 N -4.32 0.00 -0.05 -0.52 0.00 -1.26 -0.93 120.64 113.56 2vqe n GLU 43 Ca 0.01 0.11 -0.11 0.00 0.00 0.00 0.00 57.16 57.17 2vqe n GLU 43 Cb 0.13 -1.61 -0.14 0.00 0.00 0.00 0.00 31.44 29.82 2vqe n GLU 43 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 2vqe n MET 44 N -0.98 0.67 -1.33 3.44 2.81 -0.06 -4.80 117.12 116.87 2vqe n MET 44 Ca 0.00 0.19 -0.39 0.00 -1.81 0.00 0.00 57.70 55.69 2vqe n MET 44 Cb 0.11 -1.69 0.02 0.00 -0.71 0.00 0.00 33.22 30.96 2vqe n MET 44 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2vqe n VAL 45 N -3.03 0.79 0.00 2.03 0.31 -0.11 -0.91 118.33 117.42 2vqe n VAL 45 Ca -0.25 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.58 2vqe n VAL 45 Cb 1.08 -0.23 0.00 0.00 -0.91 0.00 0.00 33.84 33.78 2vqe n VAL 45 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2vqe n GLY 46 N 2.25 1.69 3.36 2.92 0.00 -0.94 -4.97 105.19 109.48 2vqe n GLY 46 Ca 0.09 -0.20 -0.29 0.00 0.00 0.00 0.00 46.02 45.62 2vqe n GLY 46 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2vqe s HIS 47 N -0.12 0.25 -0.25 1.61 4.02 -0.09 -4.77 115.29 115.94 2vqe s HIS 47 Ca 0.00 0.88 -0.04 0.00 1.02 0.00 0.00 55.06 56.92 2vqe s HIS 47 Cb 0.00 -2.95 0.09 0.00 -1.02 0.00 0.00 32.58 28.70 2vqe s HIS 47 CO 0.00 -4.60 0.11 0.99 1.02 0.00 0.00 174.74 172.26 2vqe s THR 48 N -2.29 0.02 -0.13 1.30 2.01 -1.26 -2.88 115.64 112.41 2vqe s THR 48 Ca 0.69 -0.63 -0.05 0.00 0.31 0.00 0.00 61.69 62.00 2vqe s THR 48 Cb -0.20 -0.92 -0.04 0.00 0.01 0.00 0.00 72.50 71.36 2vqe s THR 48 CO 0.62 -0.58 0.06 -0.63 -0.69 0.00 0.00 174.62 173.40 2vqe s ILE 49 N 2.07 4.79 -0.57 1.82 1.01 -0.90 -2.96 121.20 126.46 2vqe s ILE 49 Ca 0.07 -0.05 -0.17 0.00 0.00 0.00 0.00 60.65 60.49 2vqe s ILE 49 Cb -0.16 -3.08 0.12 0.00 0.01 0.00 0.00 42.46 39.35 2vqe s ILE 49 CO -0.27 0.56 0.60 0.00 0.00 0.00 0.00 174.94 175.83 2vqe s ALA 50 N -0.53 3.57 0.31 9.38 0.00 0.47 0.40 121.76 135.37 2vqe s ALA 50 Ca 0.10 -2.45 -0.22 0.00 0.00 0.00 0.00 51.96 49.40 2vqe s ALA 50 Cb -0.12 -3.39 -0.09 0.00 0.00 0.00 0.00 23.12 19.52 2vqe s ALA 50 CO 0.02 -2.17 0.85 0.08 0.00 0.00 0.00 175.76 174.54 2vqe s VAL 51 N 2.00 4.42 -0.07 0.00 1.01 -0.24 -2.65 120.40 124.87 2vqe s VAL 51 Ca 0.07 1.48 -0.25 0.00 0.00 0.00 0.00 61.98 63.28 2vqe s VAL 51 Cb -0.27 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 2vqe s VAL 51 CO 0.04 0.02 0.78 -0.47 0.00 0.00 0.00 175.10 175.47 2vqe s TYR 52 N -1.75 3.57 -0.41 5.22 5.04 -1.16 0.11 117.35 127.96 2vqe s TYR 52 Ca 0.51 1.35 0.03 0.00 -2.44 0.00 0.00 57.07 56.52 2vqe s TYR 52 Cb -0.15 -2.91 0.58 0.00 0.35 0.00 0.00 41.96 39.83 2vqe s TYR 52 CO 0.20 0.01 1.83 0.27 -1.34 0.00 0.00 175.55 176.52 2vqe n ASN 53 N 4.04 3.95 0.00 4.32 6.94 0.57 -4.82 115.26 130.27 2vqe n ASN 53 Ca 0.01 -3.44 0.00 0.00 -0.02 0.00 0.00 54.58 51.14 2vqe n ASN 53 Cb 0.51 -0.81 0.00 0.00 -2.36 0.00 0.00 39.78 37.11 2vqe n ASN 53 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2vqe n GLY 54 N -0.93 2.82 0.00 4.83 0.00 -1.26 -4.60 105.19 106.06 2vqe n GLY 54 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.55 2vqe n GLY 54 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2vqe n LYS 55 N -2.00 0.57 -4.15 1.61 4.81 -1.26 -5.14 118.16 112.60 2vqe n LYS 55 Ca 0.00 0.00 -0.17 0.00 -0.87 0.00 0.00 58.31 57.27 2vqe n LYS 55 Cb 0.00 -0.76 -0.05 0.00 0.02 0.00 0.00 35.03 34.24 2vqe n LYS 55 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 2vqe s GLN 56 N -1.52 1.93 -0.36 1.64 -0.21 -1.26 -5.13 119.66 114.75 2vqe s GLN 56 Ca 0.00 -1.89 -0.09 0.00 0.02 0.00 0.00 55.36 53.40 2vqe s GLN 56 Cb 0.00 0.41 0.03 0.00 1.00 0.00 0.00 33.01 34.46 2vqe s GLN 56 CO 0.00 -0.78 0.15 -1.01 -2.12 0.00 0.00 175.29 171.53 2vqe s HIS 57 N -3.04 3.25 -0.12 0.91 3.76 -1.26 -0.31 115.29 118.47 2vqe s HIS 57 Ca 0.34 -1.19 -0.18 0.00 -0.15 0.00 0.00 55.06 53.87 2vqe s HIS 57 Cb 0.00 -2.36 -0.04 0.00 1.11 0.00 0.00 32.58 31.29 2vqe s HIS 57 CO 0.24 -0.69 0.49 0.14 -0.85 0.00 0.00 174.74 174.07 2vqe s VAL 58 N 1.48 5.18 -0.67 -0.90 -7.23 0.30 -4.78 120.40 113.77 2vqe s VAL 58 Ca 0.00 0.97 -0.26 0.00 -1.81 0.00 0.00 61.98 60.88 2vqe s VAL 58 Cb -0.19 -3.83 -0.05 0.00 0.56 0.00 0.00 36.38 32.88 2vqe s VAL 58 CO 0.05 0.31 2.03 -2.16 -0.31 0.00 0.00 175.10 175.02 2vqe s PRO 59 N 0.72 2.42 -0.52 4.82 0.04 -1.26 -1.07 135.00 140.15 2vqe s PRO 59 Ca 0.26 0.54 -0.15 0.00 0.04 0.00 0.00 61.00 61.69 2vqe s PRO 59 Cb -0.15 -4.61 0.12 0.00 0.04 0.00 0.00 34.50 29.89 2vqe s PRO 59 CO 0.10 -3.13 0.47 0.08 0.04 0.00 0.00 177.00 174.56 2vqe s VAL 60 N 10.38 5.14 0.37 -0.36 1.01 0.16 -4.96 120.40 132.15 2vqe s VAL 60 Ca 0.76 -1.44 -0.26 0.00 0.00 0.00 0.00 61.98 61.03 2vqe s VAL 60 Cb -0.12 -4.26 -0.09 0.00 0.00 0.00 0.00 36.38 31.91 2vqe s VAL 60 CO 0.16 -0.81 1.19 -0.47 0.00 0.00 0.00 175.10 175.17 2vqe s TYR 61 N 1.59 3.12 -0.11 5.22 5.04 -1.26 -2.11 117.35 128.84 2vqe s TYR 61 Ca 0.03 1.54 0.01 0.00 -2.44 0.00 0.00 57.07 56.22 2vqe s TYR 61 Cb -0.29 -3.44 -0.01 0.00 0.35 0.00 0.00 41.96 38.57 2vqe s TYR 61 CO 0.03 -1.34 -0.16 -1.50 -1.34 0.00 0.00 175.55 171.24 2vqe s ILE 62 N -1.33 2.80 0.38 3.14 2.07 -1.14 -4.96 121.20 122.16 2vqe s ILE 62 Ca 0.54 -0.76 0.08 0.00 -1.41 0.00 0.00 60.65 59.10 2vqe s ILE 62 Cb -0.33 -2.14 -0.07 0.00 0.13 0.00 0.00 42.46 40.06 2vqe s ILE 62 CO 0.42 0.54 0.00 0.42 -1.91 0.00 0.00 174.94 174.41 2vqe s THR 63 N 0.20 2.20 0.17 4.00 -4.23 -1.26 -2.22 115.64 114.50 2vqe s THR 63 Ca -0.10 -2.02 -0.14 0.00 -1.18 0.00 0.00 61.69 58.25 2vqe s THR 63 Cb -0.16 -2.87 0.08 0.00 1.34 0.00 0.00 72.50 70.89 2vqe s THR 63 CO 0.06 -0.09 1.72 -0.08 -0.54 0.00 0.00 174.62 175.69 2vqe h GLU 64 N 1.80 0.20 -0.81 3.99 4.57 -1.98 -1.52 114.58 120.83 2vqe h GLU 64 Ca -0.43 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.74 2vqe h GLU 64 Cb 1.25 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.79 2vqe h GLU 64 CO 0.74 0.13 0.00 0.27 -1.18 0.00 0.00 179.01 178.98 2vqe n ASN 65 N -5.12 0.94 0.00 1.04 0.23 -1.26 -2.61 115.26 108.48 2vqe n ASN 65 Ca 0.04 -1.26 0.00 0.00 -0.53 0.00 0.00 54.58 52.83 2vqe n ASN 65 Cb 0.21 -0.31 0.00 0.00 -2.08 0.00 0.00 39.78 37.59 2vqe n ASN 65 CO 0.00 0.00 0.00 0.23 -0.93 0.00 0.00 177.26 176.56 2vqe n MET 66 N 0.31 5.08 -1.84 -3.83 2.81 -0.57 -5.04 117.12 114.03 2vqe n MET 66 Ca 0.00 -0.09 -0.38 0.00 -1.81 0.00 0.00 57.70 55.42 2vqe n MET 66 Cb 0.20 -0.56 0.04 0.00 -0.71 0.00 0.00 33.22 32.18 2vqe n MET 66 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2vqe s VAL 67 N -0.75 2.22 0.00 2.03 1.01 -1.07 -2.65 120.40 121.18 2vqe s VAL 67 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.14 2vqe s VAL 67 Cb 0.00 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.30 2vqe s VAL 67 CO 0.00 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.70 2vqe n GLY 68 N 0.71 2.88 3.82 4.51 0.00 -0.60 -4.96 105.19 111.54 2vqe n GLY 68 Ca 0.11 -0.41 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 2vqe n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2vqe s HIS 69 N -1.67 3.16 0.47 1.61 4.02 -1.09 -4.48 115.29 117.31 2vqe s HIS 69 Ca 0.00 1.51 -0.13 0.00 1.02 0.00 0.00 55.06 57.45 2vqe s HIS 69 Cb 0.00 -2.93 -0.07 0.00 -1.02 0.00 0.00 32.58 28.56 2vqe s HIS 69 CO 0.00 -0.78 0.88 0.15 1.02 0.00 0.00 174.74 176.01 2vqe s LYS 70 N -3.93 3.85 0.28 1.40 3.01 -1.26 -1.94 119.74 121.15 2vqe s LYS 70 Ca 0.62 0.71 -0.03 0.00 -1.01 0.00 0.00 55.97 56.27 2vqe s LYS 70 Cb -0.14 -2.26 0.37 0.00 -1.01 0.00 0.00 37.83 34.80 2vqe s LYS 70 CO 0.32 -0.17 1.88 -0.07 0.51 0.00 0.00 175.35 177.82 2vqe h LEU 71 N 1.03 0.91 -1.62 3.17 3.38 -1.60 -2.78 115.31 117.80 2vqe h LEU 71 Ca -0.47 -0.10 0.16 0.00 0.09 0.00 0.00 57.88 57.57 2vqe h LEU 71 Cb 1.19 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.65 2vqe h LEU 71 CO 0.63 0.77 0.52 1.23 0.09 0.00 0.00 178.44 181.67 2vqe h GLY 72 N 1.06 0.64 1.70 0.83 0.00 -1.79 -0.73 103.07 104.79 2vqe h GLY 72 Ca 0.25 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.42 2vqe h GLY 72 CO -0.03 0.04 0.02 1.18 0.00 0.00 0.00 176.54 177.75 2vqe n GLU 73 N -4.47 0.00 0.00 4.80 1.02 -1.05 -0.77 120.64 120.17 2vqe n GLU 73 Ca 0.15 0.38 0.01 0.00 -0.02 0.00 0.00 57.16 57.67 2vqe n GLU 73 Cb 0.59 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.49 2vqe n GLU 73 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2vqe n PHE 74 N -1.37 0.00 -3.87 -0.32 3.01 -0.28 -4.82 117.46 109.81 2vqe n PHE 74 Ca 0.00 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.17 2vqe n PHE 74 Cb 0.02 0.00 -0.13 0.00 -0.01 0.00 0.00 39.48 39.37 2vqe n PHE 74 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2vqe s ALA 75 N -0.12 3.36 0.10 4.37 0.00 0.05 -4.98 121.76 124.54 2vqe s ALA 75 Ca 0.01 -3.46 -0.31 0.00 0.00 0.00 0.00 51.96 48.20 2vqe s ALA 75 Cb 0.01 -2.11 -0.10 0.00 0.00 0.00 0.00 23.12 20.92 2vqe s ALA 75 CO 0.01 -2.06 1.79 -1.25 0.00 0.00 0.00 175.76 174.25 2vqe s PRO 76 N -0.81 4.15 0.10 0.00 0.04 -1.26 -4.75 135.00 132.47 2vqe s PRO 76 Ca 0.22 2.53 -0.08 0.00 0.04 0.00 0.00 61.00 63.71 2vqe s PRO 76 Cb -0.13 -3.63 -0.18 0.00 0.04 0.00 0.00 34.50 30.60 2vqe s PRO 76 CO -0.10 -0.82 1.23 1.79 0.04 0.00 0.00 177.00 179.14 2vqe h THR 77 N 4.78 1.38 -2.85 1.26 1.35 -1.90 -3.46 112.91 113.46 2vqe h THR 77 Ca -0.45 -2.51 -0.64 0.00 -0.55 0.00 0.00 66.41 62.25 2vqe h THR 77 Cb 1.21 2.55 -0.07 0.00 -1.73 0.00 0.00 68.15 70.11 2vqe h THR 77 CO 0.94 0.75 -0.38 -0.13 -0.25 0.00 0.00 175.52 176.46 2vqe s ARG 78 N -3.13 3.71 -0.30 4.72 0.52 -1.26 -4.97 118.95 118.24 2vqe s ARG 78 Ca -0.07 0.06 -0.14 0.00 -0.52 0.00 0.00 55.73 55.06 2vqe s ARG 78 Cb 0.08 -3.23 -0.03 0.00 0.52 0.00 0.00 34.95 32.28 2vqe s ARG 78 CO 0.89 0.67 0.32 0.99 0.02 0.00 0.00 175.30 178.19 2vqe s THR 79 N -0.83 5.21 -0.02 0.02 2.01 -1.26 -5.08 115.64 115.69 2vqe s THR 79 Ca 0.18 0.24 0.04 0.00 0.31 0.00 0.00 61.69 62.46 2vqe s THR 79 Cb -0.14 -3.70 -0.01 0.00 0.01 0.00 0.00 72.50 68.66 2vqe s THR 79 CO 0.07 0.08 -0.15 -0.47 -0.69 0.00 0.00 174.62 173.46 2vqe s TYR 80 N 1.96 1.40 -0.09 4.92 5.04 -1.26 -4.89 117.35 124.43 2vqe s TYR 80 Ca 0.11 -0.31 -0.00 0.00 -2.44 0.00 0.00 57.07 54.43 2vqe s TYR 80 Cb -0.16 -0.92 0.00 0.00 0.35 0.00 0.00 41.96 41.23 2vqe s TYR 80 CO 0.11 -0.07 0.01 0.54 -1.34 0.00 0.00 175.55 174.80 2vqe n ARG 81 N 2.88 -0.99 0.00 4.97 3.00 -1.26 -5.31 116.66 119.94 2vqe n ARG 81 Ca -0.16 0.01 0.00 0.00 -0.01 0.00 0.00 57.85 57.69 2vqe n ARG 81 Cb 0.54 -0.22 0.00 0.00 0.00 0.00 0.00 32.46 32.79 2vqe n ARG 81 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04