#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f4v s ARG 3 N 0.00 2.19 -0.29 -0.52 0.52 -1.26 -5.11 118.95 114.48 2f4v s ARG 3 Ca 0.00 0.20 -0.12 0.00 -0.52 0.00 0.00 55.73 55.29 2f4v s ARG 3 Cb 0.00 -1.97 0.12 0.00 0.52 0.00 0.00 34.95 33.62 2f4v s ARG 3 CO 0.00 -1.46 0.69 0.45 0.02 0.00 0.00 175.30 175.01 2f4v s SER 4 N -4.52 -1.03 0.23 0.23 0.15 -1.26 -5.06 113.70 102.44 2f4v s SER 4 Ca 0.61 1.49 0.00 0.00 0.70 0.00 0.00 55.95 58.75 2f4v s SER 4 Cb -0.11 1.95 0.00 0.00 -1.71 0.00 0.00 66.02 66.15 2f4v s SER 4 CO 0.50 -0.22 0.00 -0.11 1.20 0.00 0.00 173.24 174.61 2f4v n LEU 5 N 5.01 -0.39 0.00 3.45 0.00 -1.26 -5.16 117.00 118.65 2f4v n LEU 5 Ca -0.15 0.39 0.00 0.00 0.00 0.00 0.00 56.01 56.26 2f4v n LEU 5 Cb 0.53 0.54 0.00 0.00 0.00 0.00 0.00 43.42 44.49 2f4v n LEU 5 CO -0.03 -0.64 0.00 0.29 0.00 0.00 0.00 177.39 177.00 2f4v n LYS 6 N -3.21 0.00 -2.70 1.96 5.02 -1.26 -4.94 118.16 113.03 2f4v n LYS 6 Ca 0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 2f4v n LYS 6 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2f4v n LYS 6 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 2f4v n LYS 7 N 0.00 3.32 0.00 1.97 2.85 -1.26 -4.79 118.16 120.25 2f4v n LYS 7 Ca 0.00 -3.57 0.00 0.00 -1.05 0.00 0.00 58.31 53.69 2f4v n LYS 7 Cb 0.00 -3.18 0.00 0.00 -0.65 0.00 0.00 35.03 31.20 2f4v n LYS 7 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2f4v n GLY 8 N 4.35 1.56 2.98 2.58 0.00 -1.26 -5.15 105.19 110.25 2f4v n GLY 8 Ca 0.42 -0.24 -0.18 0.00 0.00 0.00 0.00 46.02 46.02 2f4v n GLY 8 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2f4v n VAL 9 N 0.00 0.00 -3.80 1.61 0.31 -1.26 -5.05 118.33 110.14 2f4v n VAL 9 Ca 0.00 -0.05 -0.13 0.00 -0.01 0.00 0.00 64.34 64.15 2f4v n VAL 9 Cb 0.00 -0.33 -0.14 0.00 -0.91 0.00 0.00 33.84 32.46 2f4v n VAL 9 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 2f4v s PHE 10 N -2.06 -0.09 -0.02 3.52 5.36 -1.26 -5.10 117.98 118.32 2f4v s PHE 10 Ca 0.30 0.29 0.01 0.00 -0.96 0.00 0.00 56.93 56.57 2f4v s PHE 10 Cb -0.03 -0.06 0.01 0.00 -0.34 0.00 0.00 43.02 42.60 2f4v s PHE 10 CO 0.33 -0.09 -0.04 0.08 -1.46 0.00 0.00 175.22 174.03 2f4v s VAL 11 N 0.62 0.42 0.58 3.12 1.01 -1.26 -2.75 120.40 122.14 2f4v s VAL 11 Ca -0.05 -0.15 -0.19 0.00 0.00 0.00 0.00 61.98 61.60 2f4v s VAL 11 Cb -0.07 -0.41 -0.07 0.00 0.00 0.00 0.00 36.38 35.84 2f4v s VAL 11 CO -0.03 0.16 0.76 0.47 0.00 0.00 0.00 175.10 176.47 2f4v n ASP 12 N 3.46 -0.05 -2.03 3.32 8.00 -1.26 -4.93 116.55 123.07 2f4v n ASP 12 Ca -0.19 0.79 -0.23 0.00 0.71 0.00 0.00 54.79 55.87 2f4v n ASP 12 Cb 0.55 -1.29 0.15 0.00 -0.02 0.00 0.00 41.12 40.51 2f4v n ASP 12 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2f4v n ASP 13 N -0.13 4.51 -0.05 -2.24 5.75 -1.26 -3.59 116.55 119.54 2f4v n ASP 13 Ca 0.13 -3.70 -0.02 0.00 -0.01 0.00 0.00 54.79 51.19 2f4v n ASP 13 Cb 0.47 -0.80 -0.01 0.00 -1.03 0.00 0.00 41.12 39.75 2f4v n ASP 13 CO 0.00 0.00 0.00 0.45 -0.11 0.00 0.00 177.20 177.54 2f4v h HIS 14 N 1.31 0.00 -0.13 2.11 3.86 -2.01 -3.40 115.15 116.89 2f4v h HIS 14 Ca 0.53 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.57 2f4v h HIS 14 Cb 2.05 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 30.52 2f4v h HIS 14 CO 1.41 0.00 -0.62 1.37 0.86 0.00 0.00 177.93 180.94 2f4v h LEU 15 N -0.87 0.54 -0.94 2.43 8.10 -1.95 -2.48 115.31 120.13 2f4v h LEU 15 Ca 0.00 -0.31 0.18 0.00 0.11 0.00 0.00 57.88 57.86 2f4v h LEU 15 Cb 0.17 -0.16 -0.17 0.00 -0.44 0.00 0.00 40.66 40.06 2f4v h LEU 15 CO 0.00 1.03 -0.26 -0.11 -4.11 0.00 0.00 178.44 174.99 2f4v n LEU 16 N -3.91 -0.38 -0.06 0.17 7.94 -1.24 0.25 117.00 119.77 2f4v n LEU 16 Ca -0.04 1.62 -0.15 0.00 -1.11 0.00 0.00 56.01 56.34 2f4v n LEU 16 Cb 0.64 -0.47 -0.13 0.00 0.53 0.00 0.00 43.42 43.99 2f4v n LEU 16 CO 0.47 -1.54 0.32 -0.33 -1.11 0.00 0.00 177.39 175.21 2f4v h GLU 17 N 0.00 0.03 0.00 1.96 5.08 -1.77 -3.07 114.58 116.81 2f4v h GLU 17 Ca 0.43 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.73 2f4v h GLU 17 Cb 0.67 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.94 2f4v h GLU 17 CO -0.96 1.03 -0.01 -0.22 -1.00 0.00 0.00 179.01 177.84 2f4v h LYS 18 N -0.93 0.00 0.00 2.33 3.64 -0.15 3.05 116.57 124.50 2f4v h LYS 18 Ca -0.03 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.21 2f4v h LYS 18 Cb 1.08 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.88 2f4v h LYS 18 CO 0.01 0.01 -0.92 0.28 -2.27 0.00 0.00 179.45 176.56 2f4v h VAL 19 N 0.00 0.70 0.00 2.00 2.07 0.31 -3.02 116.25 118.31 2f4v h VAL 19 Ca -0.00 -1.83 -0.03 0.00 0.82 0.00 0.00 66.70 65.65 2f4v h VAL 19 Cb 0.04 1.63 -0.00 0.00 -1.52 0.00 0.00 31.29 31.44 2f4v h VAL 19 CO 0.00 0.24 -0.15 0.25 0.02 0.00 0.00 177.57 177.93 2f4v h LEU 20 N -1.00 0.00 0.63 2.57 5.85 -1.27 -0.39 115.31 121.70 2f4v h LEU 20 Ca -0.22 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.47 2f4v h LEU 20 Cb 1.02 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.06 2f4v h LEU 20 CO -0.13 0.15 -0.30 -0.08 -0.34 0.00 0.00 178.44 177.74 2f4v h GLU 21 N 0.00 -0.81 -0.19 1.25 4.81 0.53 -3.22 114.58 116.95 2f4v h GLU 21 Ca -0.00 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 2f4v h GLU 21 Cb 0.32 0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.88 2f4v h GLU 21 CO 0.02 -0.54 0.00 1.28 -0.73 0.00 0.00 179.01 179.04 2f4v n LEU 22 N -4.77 0.19 -0.08 1.64 4.77 -0.90 -1.99 117.00 115.86 2f4v n LEU 22 Ca -0.10 -0.10 -0.12 0.00 -0.03 0.00 0.00 56.01 55.66 2f4v n LEU 22 Cb 0.33 -0.10 -0.09 0.00 -2.33 0.00 0.00 43.42 41.24 2f4v n LEU 22 CO 0.25 0.05 -0.01 -1.13 -1.33 0.00 0.00 177.39 175.22 2f4v h ASN 23 N 0.15 0.00 0.64 -1.43 -0.73 -1.09 -3.21 115.58 109.91 2f4v h ASN 23 Ca 0.00 -0.56 0.00 0.00 1.87 0.00 0.00 56.30 57.61 2f4v h ASN 23 Cb 0.10 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.69 2f4v h ASN 23 CO 0.00 1.01 0.00 0.00 -0.37 0.00 0.00 177.43 178.07 2f4v n ALA 24 N -2.98 1.58 0.41 1.57 0.00 -0.84 -2.41 120.51 117.84 2f4v n ALA 24 Ca -0.14 0.10 0.08 0.00 0.00 0.00 0.00 53.44 53.48 2f4v n ALA 24 Cb 0.42 -1.38 -0.11 0.00 0.00 0.00 0.00 19.45 18.38 2f4v n ALA 24 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2f4v n LYS 25 N -2.24 1.16 0.00 0.00 4.01 -1.25 -5.06 118.16 114.77 2f4v n LYS 25 Ca 0.02 -0.07 0.00 0.00 -0.51 0.00 0.00 58.31 57.75 2f4v n LYS 25 Cb 0.21 -1.32 0.00 0.00 -0.51 0.00 0.00 35.03 33.41 2f4v n LYS 25 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2f4v n GLY 26 N 1.46 3.75 3.54 0.72 0.00 -1.01 -5.04 105.19 108.61 2f4v n GLY 26 Ca 0.00 -0.82 -0.17 0.00 0.00 0.00 0.00 46.02 45.03 2f4v n GLY 26 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2f4v n GLU 27 N 0.00 0.39 -1.73 1.61 1.02 -1.23 -4.56 120.64 116.14 2f4v n GLU 27 Ca 0.00 -0.56 -0.30 0.00 -0.02 0.00 0.00 57.16 56.29 2f4v n GLU 27 Cb 0.00 -2.82 0.08 0.00 -0.02 0.00 0.00 31.44 28.68 2f4v n GLU 27 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2f4v s LYS 28 N 8.31 2.19 -0.11 3.49 1.02 -1.21 -4.98 119.74 128.45 2f4v s LYS 28 Ca 1.06 0.43 0.01 0.00 0.02 0.00 0.00 55.97 57.49 2f4v s LYS 28 Cb -0.37 -1.95 -0.02 0.00 -0.52 0.00 0.00 37.83 34.97 2f4v s LYS 28 CO 0.24 -1.50 -0.12 1.03 -0.92 0.00 0.00 175.35 174.09 2f4v s ARG 29 N -5.32 3.14 -0.18 1.68 0.52 -1.26 -4.44 118.95 113.09 2f4v s ARG 29 Ca 0.61 -0.66 -0.11 0.00 -0.52 0.00 0.00 55.73 55.04 2f4v s ARG 29 Cb -0.13 -2.59 0.04 0.00 0.52 0.00 0.00 34.95 32.79 2f4v s ARG 29 CO 0.52 0.36 0.23 1.28 0.02 0.00 0.00 175.30 177.71 2f4v n LEU 30 N 3.11 -5.91 -2.96 2.53 4.77 -1.09 -4.98 117.00 112.48 2f4v n LEU 30 Ca -0.18 2.13 -0.22 0.00 -0.03 0.00 0.00 56.01 57.71 2f4v n LEU 30 Cb 0.53 -3.13 -0.03 0.00 -2.33 0.00 0.00 43.42 38.46 2f4v n LEU 30 CO 0.29 -3.74 -0.01 -0.38 -1.33 0.00 0.00 177.39 172.22 2f4v n ILE 31 N 1.54 1.65 -1.71 -0.08 2.08 -1.08 -4.90 119.36 116.87 2f4v n ILE 31 Ca -0.38 -4.94 -0.66 0.00 0.56 0.00 0.00 62.75 57.33 2f4v n ILE 31 Cb 0.59 -0.80 -0.09 0.00 -0.75 0.00 0.00 39.64 38.59 2f4v n ILE 31 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 2f4v n LYS 32 N -0.06 0.10 -4.00 0.38 5.02 -1.26 -4.20 118.16 114.13 2f4v n LYS 32 Ca 0.28 0.04 -0.13 0.00 -2.02 0.00 0.00 58.31 56.48 2f4v n LYS 32 Cb 0.55 -1.55 -0.13 0.00 -0.02 0.00 0.00 35.03 33.88 2f4v n LYS 32 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2f4v s THR 33 N 2.53 0.22 -0.70 -0.18 2.01 -0.91 -4.97 115.64 113.64 2f4v s THR 33 Ca 1.02 -0.37 -0.02 0.00 0.31 0.00 0.00 61.69 62.63 2f4v s THR 33 Cb -1.42 -0.24 0.38 0.00 0.01 0.00 0.00 72.50 71.23 2f4v s THR 33 CO 0.76 -0.10 2.07 0.79 -0.69 0.00 0.00 174.62 177.45 2f4v n TRP 34 N 2.56 2.96 -2.76 4.92 8.01 -1.26 -3.62 117.44 128.24 2f4v n TRP 34 Ca -0.16 -2.67 -0.29 0.00 -1.31 0.00 0.00 57.50 53.07 2f4v n TRP 34 Cb 0.58 -1.33 -0.02 0.00 -2.01 0.00 0.00 31.31 28.53 2f4v n TRP 34 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13 2f4v n SER 35 N -0.62 4.98 0.07 -0.99 2.88 -1.26 -4.63 113.62 114.05 2f4v n SER 35 Ca 0.57 -3.70 0.18 0.00 -1.33 0.00 0.00 58.87 54.59 2f4v n SER 35 Cb 0.51 -0.62 0.70 0.00 -0.75 0.00 0.00 64.21 64.04 2f4v n SER 35 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2f4v h ARG 36 N 3.02 0.00 -1.21 -1.46 3.08 -1.88 -2.80 114.38 113.13 2f4v h ARG 36 Ca 0.23 0.00 0.35 0.00 0.07 0.00 0.00 59.98 60.63 2f4v h ARG 36 Cb 0.56 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.56 2f4v h ARG 36 CO 0.89 0.00 1.12 0.00 -1.07 0.00 0.00 179.97 180.91 2f4v h ARG 37 N 0.00 0.00 -6.44 0.04 2.47 -1.88 -3.41 114.38 105.16 2f4v h ARG 37 Ca 0.19 0.00 -0.66 0.00 -1.26 0.00 0.00 59.98 58.25 2f4v h ARG 37 Cb 0.80 0.00 -0.14 0.00 -1.65 0.00 0.00 29.97 28.98 2f4v h ARG 37 CO -0.00 0.00 -0.70 0.45 0.56 0.00 0.00 179.97 180.28 2f4v s SER 38 N -4.03 4.70 1.05 7.04 0.15 -1.06 -4.87 113.70 116.70 2f4v s SER 38 Ca -0.04 -0.27 -0.17 0.00 0.70 0.00 0.00 55.95 56.17 2f4v s SER 38 Cb 0.19 -1.02 0.24 0.00 -1.71 0.00 0.00 66.02 63.71 2f4v s SER 38 CO 0.63 0.19 1.25 0.41 1.20 0.00 0.00 173.24 176.91 2f4v n THR 39 N 0.71 0.00 -3.89 6.45 -1.04 -1.11 -0.95 114.28 114.45 2f4v n THR 39 Ca -0.12 -0.85 -0.35 0.00 -2.04 0.00 0.00 64.05 60.69 2f4v n THR 39 Cb 0.52 -1.46 -0.14 0.00 -1.82 0.00 0.00 70.33 67.44 2f4v n THR 39 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2f4v s ILE 40 N -3.64 3.32 0.12 12.58 1.01 -0.74 -4.38 121.20 129.48 2f4v s ILE 40 Ca 0.73 -0.73 -0.07 0.00 0.00 0.00 0.00 60.65 60.57 2f4v s ILE 40 Cb -0.03 -2.62 -0.06 0.00 0.01 0.00 0.00 42.46 39.76 2f4v s ILE 40 CO 0.52 0.26 0.39 -0.69 0.00 0.00 0.00 174.94 175.42 2f4v s VAL 41 N 1.43 5.13 0.24 2.92 1.01 -1.26 -2.16 120.40 127.71 2f4v s VAL 41 Ca 0.03 0.23 0.16 0.00 0.00 0.00 0.00 61.98 62.41 2f4v s VAL 41 Cb -0.16 -3.63 0.26 0.00 0.00 0.00 0.00 36.38 32.86 2f4v s VAL 41 CO -0.02 0.15 0.93 -2.65 0.00 0.00 0.00 175.10 173.50 2f4v n PRO 42 N 0.45 -0.03 0.00 2.72 -0.02 -1.26 -0.65 135.00 136.22 2f4v n PRO 42 Ca -0.05 0.78 0.08 0.00 -2.02 0.00 0.00 63.50 62.29 2f4v n PRO 42 Cb 0.52 -1.47 0.38 0.00 -0.02 0.00 0.00 33.50 32.91 2f4v n PRO 42 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2f4v n GLU 43 N -4.07 0.13 0.19 -0.52 0.00 -1.26 -2.44 120.64 112.67 2f4v n GLU 43 Ca 0.23 0.17 0.06 0.00 0.00 0.00 0.00 57.16 57.63 2f4v n GLU 43 Cb 0.86 -1.50 0.37 0.00 0.00 0.00 0.00 31.44 31.17 2f4v n GLU 43 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.13 177.65 2f4v h MET 44 N 0.00 0.00 -6.22 3.44 2.86 -1.28 -3.47 114.93 110.27 2f4v h MET 44 Ca 0.00 0.00 -0.69 0.00 -2.06 0.00 0.00 59.70 56.95 2f4v h MET 44 Cb 0.21 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.89 2f4v h MET 44 CO 0.00 0.35 0.90 0.28 1.06 0.00 0.00 176.91 179.50 2f4v n VAL 45 N -3.57 0.33 0.00 -2.22 0.31 -1.02 -1.80 118.33 110.35 2f4v n VAL 45 Ca -0.00 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 2f4v n VAL 45 Cb 0.48 -1.38 0.00 0.00 -0.91 0.00 0.00 33.84 32.03 2f4v n VAL 45 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2f4v n GLY 46 N 3.99 2.78 3.93 2.92 0.00 -1.18 -5.09 105.19 112.55 2f4v n GLY 46 Ca 0.24 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.00 2f4v n GLY 46 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2f4v s HIS 47 N -2.49 3.01 -0.65 1.61 4.02 -0.75 -4.89 115.29 115.14 2f4v s HIS 47 Ca 0.00 0.50 0.05 0.00 1.02 0.00 0.00 55.06 56.64 2f4v s HIS 47 Cb 0.00 -3.08 0.19 0.00 -1.02 0.00 0.00 32.58 28.67 2f4v s HIS 47 CO 0.00 -1.26 0.54 2.41 1.02 0.00 0.00 174.74 177.44 2f4v n THR 48 N -2.84 1.44 -2.40 1.30 -1.04 -1.26 -3.57 114.28 105.90 2f4v n THR 48 Ca 0.07 -4.78 -0.43 0.00 -2.04 0.00 0.00 64.05 56.88 2f4v n THR 48 Cb 0.60 -2.11 -0.02 0.00 -1.82 0.00 0.00 70.33 66.98 2f4v n THR 48 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2f4v s ILE 49 N -1.53 4.14 0.24 12.58 1.09 -1.24 -2.65 121.20 133.84 2f4v s ILE 49 Ca 0.29 1.32 -0.22 0.00 -1.10 0.00 0.00 60.65 60.94 2f4v s ILE 49 Cb 0.01 -4.09 -0.09 0.00 -1.06 0.00 0.00 42.46 37.24 2f4v s ILE 49 CO -0.14 -0.38 0.79 0.00 -0.10 0.00 0.00 174.94 175.11 2f4v s ALA 50 N 4.23 3.36 -0.01 9.38 0.00 -1.26 -2.35 121.76 135.11 2f4v s ALA 50 Ca 0.57 0.29 0.04 0.00 0.00 0.00 0.00 51.96 52.85 2f4v s ALA 50 Cb -0.18 -2.94 -0.01 0.00 0.00 0.00 0.00 23.12 19.99 2f4v s ALA 50 CO 0.21 0.28 -0.12 0.08 0.00 0.00 0.00 175.76 176.22 2f4v s VAL 51 N -1.51 0.93 0.01 0.00 1.01 0.10 -2.14 120.40 118.81 2f4v s VAL 51 Ca 0.44 -0.52 -0.30 0.00 0.00 0.00 0.00 61.98 61.60 2f4v s VAL 51 Cb -0.18 -0.78 -0.03 0.00 0.00 0.00 0.00 36.38 35.39 2f4v s VAL 51 CO 0.22 0.25 1.02 -0.47 0.00 0.00 0.00 175.10 176.12 2f4v s TYR 52 N -0.30 3.62 -0.95 5.22 5.04 -1.24 0.18 117.35 128.92 2f4v s TYR 52 Ca 0.04 1.63 0.09 0.00 -2.44 0.00 0.00 57.07 56.39 2f4v s TYR 52 Cb -0.05 -3.17 0.37 0.00 0.35 0.00 0.00 41.96 39.47 2f4v s TYR 52 CO -0.00 -0.22 1.27 0.09 -1.34 0.00 0.00 175.55 175.34 2f4v n ASN 53 N 3.92 0.05 0.00 4.32 5.03 0.19 -4.75 115.26 124.02 2f4v n ASN 53 Ca 0.07 0.52 0.00 0.00 0.87 0.00 0.00 54.58 56.03 2f4v n ASN 53 Cb 0.50 -0.53 0.00 0.00 -1.02 0.00 0.00 39.78 38.74 2f4v n ASN 53 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2f4v n GLY 54 N -0.73 2.15 0.00 7.41 0.00 -1.26 -4.77 105.19 107.99 2f4v n GLY 54 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2f4v n GLY 54 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2f4v n LYS 55 N -2.00 0.34 -4.24 1.61 4.81 -1.26 -5.13 118.16 112.29 2f4v n LYS 55 Ca 0.00 0.00 -0.16 0.00 -0.87 0.00 0.00 58.31 57.28 2f4v n LYS 55 Cb 0.00 -0.70 -0.09 0.00 0.02 0.00 0.00 35.03 34.26 2f4v n LYS 55 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 2f4v s GLN 56 N -1.41 1.49 -0.03 1.64 -1.52 -1.26 -5.14 119.66 113.43 2f4v s GLN 56 Ca 0.00 -1.82 0.01 0.00 -1.95 0.00 0.00 55.36 51.60 2f4v s GLN 56 Cb 0.00 0.30 -0.03 0.00 -0.22 0.00 0.00 33.01 33.06 2f4v s GLN 56 CO 0.00 -0.53 -0.02 -1.01 -0.25 0.00 0.00 175.29 173.48 2f4v s HIS 57 N -3.78 3.05 -0.01 0.91 3.76 -1.26 0.54 115.29 118.50 2f4v s HIS 57 Ca 0.40 0.08 -0.00 0.00 -0.15 0.00 0.00 55.06 55.38 2f4v s HIS 57 Cb 0.04 -1.70 0.02 0.00 1.11 0.00 0.00 32.58 32.06 2f4v s HIS 57 CO 0.20 0.43 0.02 0.14 -0.85 0.00 0.00 174.74 174.68 2f4v s VAL 58 N -0.98 -0.04 -0.61 -0.90 -7.23 0.13 -4.77 120.40 106.01 2f4v s VAL 58 Ca 0.17 0.13 -0.28 0.00 -1.81 0.00 0.00 61.98 60.19 2f4v s VAL 58 Cb -0.11 -0.06 0.02 0.00 0.56 0.00 0.00 36.38 36.78 2f4v s VAL 58 CO 0.06 0.05 1.40 -2.16 -0.31 0.00 0.00 175.10 174.15 2f4v s PRO 59 N 0.65 3.25 -0.64 4.82 0.04 -1.26 0.02 135.00 141.88 2f4v s PRO 59 Ca -0.05 0.29 -0.16 0.00 0.04 0.00 0.00 61.00 61.12 2f4v s PRO 59 Cb -0.08 -4.15 0.15 0.00 0.04 0.00 0.00 34.50 30.46 2f4v s PRO 59 CO -0.02 -2.02 0.64 0.08 0.04 0.00 0.00 177.00 175.72 2f4v s VAL 60 N 6.11 5.20 0.22 -0.36 1.01 -0.99 -4.99 120.40 126.61 2f4v s VAL 60 Ca 0.49 -1.64 -0.31 0.00 0.00 0.00 0.00 61.98 60.52 2f4v s VAL 60 Cb -0.10 -4.43 -0.11 0.00 0.00 0.00 0.00 36.38 31.75 2f4v s VAL 60 CO 0.22 -1.00 1.55 -0.47 0.00 0.00 0.00 175.10 175.40 2f4v s TYR 61 N 1.53 2.97 -0.37 5.22 6.04 -1.26 -3.70 117.35 127.78 2f4v s TYR 61 Ca 0.10 0.76 0.01 0.00 0.04 0.00 0.00 57.07 57.98 2f4v s TYR 61 Cb -0.22 -3.95 0.11 0.00 -1.04 0.00 0.00 41.96 36.86 2f4v s TYR 61 CO 0.00 -3.32 0.15 -1.50 -1.54 0.00 0.00 175.55 169.35 2f4v s ILE 62 N 0.54 1.30 0.52 3.14 2.07 -1.23 -5.07 121.20 122.46 2f4v s ILE 62 Ca 0.66 -2.02 0.08 0.00 -1.41 0.00 0.00 60.65 57.96 2f4v s ILE 62 Cb -0.45 -1.95 0.06 0.00 0.13 0.00 0.00 42.46 40.25 2f4v s ILE 62 CO 0.39 -0.76 0.72 0.42 -1.91 0.00 0.00 174.94 173.79 2f4v s THR 63 N 0.98 2.51 0.51 4.00 -4.23 -1.26 -3.10 115.64 115.05 2f4v s THR 63 Ca 0.13 -0.96 0.27 0.00 -1.18 0.00 0.00 61.69 59.96 2f4v s THR 63 Cb -0.21 -2.56 0.45 0.00 1.34 0.00 0.00 72.50 71.53 2f4v s THR 63 CO -0.12 0.00 1.89 -0.08 -0.54 0.00 0.00 174.62 175.77 2f4v h GLU 64 N 0.31 0.10 -0.14 3.99 4.81 -1.98 -2.24 114.58 119.44 2f4v h GLU 64 Ca -0.35 -0.01 -0.21 0.00 -0.13 0.00 0.00 59.36 58.66 2f4v h GLU 64 Cb 1.28 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.65 2f4v h GLU 64 CO 0.43 0.07 -0.77 -2.95 -0.73 0.00 0.00 179.01 175.06 2f4v h ASN 65 N 0.11 0.84 0.11 1.04 -1.07 -2.03 -3.06 115.58 111.52 2f4v h ASN 65 Ca 0.42 -0.55 0.00 0.00 0.07 0.00 0.00 56.30 56.24 2f4v h ASN 65 Cb 1.51 -0.25 0.00 0.00 -2.07 0.00 0.00 38.32 37.51 2f4v h ASN 65 CO -0.05 1.34 -0.15 1.15 0.07 0.00 0.00 177.43 179.79 2f4v n MET 66 N -3.91 1.26 -1.57 4.14 0.00 -0.87 -4.83 117.12 111.33 2f4v n MET 66 Ca -0.07 -0.76 -0.40 0.00 0.00 0.00 0.00 57.70 56.47 2f4v n MET 66 Cb 0.74 -1.48 0.02 0.00 0.00 0.00 0.00 33.22 32.50 2f4v n MET 66 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2f4v n VAL 67 N -0.21 2.61 0.00 3.17 0.31 -1.05 -2.26 118.33 120.90 2f4v n VAL 67 Ca 0.15 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 2f4v n VAL 67 Cb 0.36 -1.01 0.00 0.00 -0.91 0.00 0.00 33.84 32.28 2f4v n VAL 67 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2f4v n GLY 68 N 1.37 2.03 3.76 2.92 0.00 -0.92 -5.00 105.19 109.35 2f4v n GLY 68 Ca 0.11 -0.21 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 2f4v n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2f4v s HIS 69 N -0.56 2.51 0.23 1.61 4.02 -0.96 -4.55 115.29 117.59 2f4v s HIS 69 Ca 0.00 1.56 -0.30 0.00 1.02 0.00 0.00 55.06 57.34 2f4v s HIS 69 Cb 0.00 -3.25 -0.09 0.00 -1.02 0.00 0.00 32.58 28.23 2f4v s HIS 69 CO 0.00 -1.86 1.17 0.21 1.02 0.00 0.00 174.74 175.29 2f4v s LYS 70 N -3.95 4.53 0.68 1.40 2.47 -1.26 -1.79 119.74 121.82 2f4v s LYS 70 Ca 0.69 1.88 -0.11 0.00 -1.56 0.00 0.00 55.97 56.86 2f4v s LYS 70 Cb -0.23 -3.21 0.16 0.00 -1.46 0.00 0.00 37.83 33.10 2f4v s LYS 70 CO 0.40 0.00 0.72 -0.11 0.16 0.00 0.00 175.35 176.53 2f4v n LEU 71 N 1.94 0.00 0.00 5.43 0.00 -0.13 -4.35 117.00 119.89 2f4v n LEU 71 Ca 0.02 -0.78 0.00 0.00 0.00 0.00 0.00 56.01 55.26 2f4v n LEU 71 Cb 0.44 -0.61 0.00 0.00 0.00 0.00 0.00 43.42 43.25 2f4v n LEU 71 CO 0.55 -1.44 0.00 0.61 0.00 0.00 0.00 177.39 177.11 2f4v n GLY 72 N -1.21 2.66 3.85 -3.96 0.00 -1.26 -4.71 105.19 100.57 2f4v n GLY 72 Ca 0.10 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2f4v n GLY 72 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2f4v n GLU 73 N 14.00 0.00 0.00 1.61 2.13 -1.26 -3.84 120.64 133.28 2f4v n GLU 73 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2f4v n GLU 73 Cb 0.00 -2.47 0.00 0.00 0.27 0.00 0.00 31.44 29.24 2f4v n GLU 73 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2f4v n PHE 74 N -1.01 0.00 -3.27 4.31 3.01 -1.26 -4.87 117.46 114.37 2f4v n PHE 74 Ca 0.00 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.03 2f4v n PHE 74 Cb 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.39 2f4v n PHE 74 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2f4v s ALA 75 N -0.63 3.42 0.22 4.37 0.00 -1.25 -4.98 121.76 122.91 2f4v s ALA 75 Ca 0.00 -1.34 -0.30 0.00 0.00 0.00 0.00 51.96 50.32 2f4v s ALA 75 Cb 0.00 -3.08 -0.08 0.00 0.00 0.00 0.00 23.12 19.96 2f4v s ALA 75 CO 0.00 -1.53 1.13 -2.14 0.00 0.00 0.00 175.76 173.23 2f4v s PRO 76 N 2.31 4.58 0.00 0.00 0.02 -1.26 -4.93 135.00 135.71 2f4v s PRO 76 Ca 0.15 1.80 0.00 0.00 0.02 0.00 0.00 61.00 62.98 2f4v s PRO 76 Cb -0.16 -3.23 0.00 0.00 0.02 0.00 0.00 34.50 31.13 2f4v s PRO 76 CO 0.15 0.07 0.00 2.41 -0.33 0.00 0.00 177.00 179.30 2f4v n THR 77 N 1.95 0.00 -1.08 0.99 -1.04 -1.26 -4.87 114.28 108.97 2f4v n THR 77 Ca 0.02 0.00 -0.44 0.00 -2.04 0.00 0.00 64.05 61.59 2f4v n THR 77 Cb 0.45 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.89 2f4v n THR 77 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 2f4v n ARG 78 N 0.00 0.00 -2.89 -2.82 0.00 -1.26 -4.81 116.66 104.88 2f4v n ARG 78 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.85 57.43 2f4v n ARG 78 Cb 0.00 -1.00 -0.04 0.00 -0.00 0.00 0.00 32.46 31.42 2f4v n ARG 78 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 2f4v s THR 79 N 2.54 4.80 0.00 8.89 -4.23 -1.26 -5.03 115.64 121.36 2f4v s THR 79 Ca 0.73 1.47 0.03 0.00 -1.18 0.00 0.00 61.69 62.74 2f4v s THR 79 Cb -1.00 -4.15 -0.01 0.00 1.34 0.00 0.00 72.50 68.68 2f4v s THR 79 CO 0.52 -0.15 -0.10 -0.47 -0.54 0.00 0.00 174.62 173.87 2f4v s TYR 80 N 2.93 0.93 -0.07 3.99 5.04 -1.26 -5.05 117.35 123.86 2f4v s TYR 80 Ca 0.35 -0.22 0.19 0.00 -2.44 0.00 0.00 57.07 54.96 2f4v s TYR 80 Cb -0.15 -0.59 0.36 0.00 0.35 0.00 0.00 41.96 41.93 2f4v s TYR 80 CO 0.09 -0.01 1.15 0.54 -1.34 0.00 0.00 175.55 175.98 2f4v n ARG 81 N 2.61 0.43 -0.66 4.97 1.74 -1.26 -5.14 116.66 119.34 2f4v n ARG 81 Ca -0.15 -2.03 0.08 0.00 -0.77 0.00 0.00 57.85 54.98 2f4v n ARG 81 Cb 0.56 -0.18 -0.04 0.00 -1.02 0.00 0.00 32.46 31.78 2f4v n ARG 81 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2f4v n GLY 82 N 0.04 -2.69 0.01 -0.13 0.00 -1.26 -4.77 105.19 96.39 2f4v n GLY 82 Ca -0.02 -1.29 0.11 0.00 0.00 0.00 0.00 46.02 44.82 2f4v n GLY 82 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2f4v n HIS 83 N -3.18 0.00 -3.49 1.61 -0.00 -1.26 -5.03 115.22 103.87 2f4v n HIS 83 Ca -0.03 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.26 2f4v n HIS 83 Cb 0.31 -0.27 -0.08 0.00 -0.00 0.00 0.00 29.99 29.95 2f4v n HIS 83 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.34 176.54 2f4v s GLY 84 N -3.82 2.02 0.00 -1.41 0.00 -1.26 -5.35 107.32 97.49 2f4v s GLY 84 Ca -0.01 -2.25 0.21 0.00 0.00 0.00 0.00 44.72 42.68 2f4v s GLY 84 CO 0.89 1.05 1.17 0.28 0.00 0.00 0.00 173.10 176.49