#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fk7 n ASP 5 N 0.00 0.00 0.05 -1.43 5.68 -1.26 -5.06 116.55 114.53 3fk7 n ASP 5 Ca 0.00 0.00 -0.22 0.00 -0.50 0.00 0.00 54.79 54.07 3fk7 n ASP 5 Cb 0.00 0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 39.83 3fk7 n ASP 5 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 3fk7 h LYS 6 N 0.00 0.35 -0.04 0.11 3.64 -1.95 -3.37 116.57 115.30 3fk7 h LYS 6 Ca 0.00 -0.59 -0.09 0.00 -1.27 0.00 0.00 60.65 58.70 3fk7 h LYS 6 Cb 0.00 0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 3fk7 h LYS 6 CO 0.00 1.28 -0.39 0.66 -2.27 0.00 0.00 179.45 178.74 3fk7 h SER 7 N 0.04 0.09 1.20 4.20 4.64 -1.97 -3.02 113.55 118.73 3fk7 h SER 7 Ca -0.36 -0.03 -0.09 0.00 -0.47 0.00 0.00 61.79 60.83 3fk7 h SER 7 Cb 2.04 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 64.09 3fk7 h SER 7 CO 0.14 0.47 -0.83 0.50 -0.87 0.00 0.00 176.83 176.24 3fk7 h LYS 8 N 0.07 0.00 0.14 4.77 3.64 -1.98 -3.00 116.57 120.22 3fk7 h LYS 8 Ca 0.01 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.40 3fk7 h LYS 8 Cb 0.72 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.50 3fk7 h LYS 8 CO 0.05 0.26 -0.40 0.28 -2.27 0.00 0.00 179.45 177.38 3fk7 h VAL 9 N 0.00 0.19 -0.97 2.00 2.07 -1.71 -2.69 116.25 115.14 3fk7 h VAL 9 Ca -0.06 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.65 3fk7 h VAL 9 Cb 1.32 0.19 -0.09 0.00 -1.52 0.00 0.00 31.29 31.19 3fk7 h VAL 9 CO 0.04 0.00 0.61 0.40 0.02 0.00 0.00 177.57 178.64 3fk7 h ILE 10 N -0.65 0.71 0.00 4.57 5.03 -1.43 0.12 117.51 125.87 3fk7 h ILE 10 Ca 0.02 -0.22 -0.19 0.00 -0.12 0.00 0.00 64.86 64.35 3fk7 h ILE 10 Cb 0.67 0.01 -0.03 0.00 -3.03 0.00 0.00 36.82 34.43 3fk7 h ILE 10 CO -0.22 0.12 -1.00 0.78 -0.68 0.00 0.00 178.15 177.15 3fk7 h ASN 11 N 0.65 0.00 -0.17 1.72 2.35 -1.46 -1.91 115.58 116.75 3fk7 h ASN 11 Ca 0.53 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 56.13 3fk7 h ASN 11 Cb 0.97 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.35 3fk7 h ASN 11 CO -0.29 0.81 -0.47 0.28 -1.65 0.00 0.00 177.43 176.11 3fk7 h SER 12 N 0.00 0.71 -0.11 5.81 0.02 -1.04 -3.19 113.55 115.75 3fk7 h SER 12 Ca -0.06 -0.58 -0.07 0.00 -0.84 0.00 0.00 61.79 60.23 3fk7 h SER 12 Cb 1.67 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.99 3fk7 h SER 12 CO 0.10 1.16 -0.14 0.00 -1.14 0.00 0.00 176.83 176.81 3fk7 h ALA 13 N 0.56 1.26 -0.54 3.77 0.00 -0.72 0.83 119.26 124.42 3fk7 h ALA 13 Ca -0.01 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.54 3fk7 h ALA 13 Cb 1.08 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 3fk7 h ALA 13 CO 0.10 0.49 -0.02 -0.07 0.00 0.00 0.00 179.25 179.75 3fk7 h LEU 14 N 0.43 0.91 -0.20 0.00 3.38 -1.45 -0.89 115.31 117.49 3fk7 h LEU 14 Ca 0.08 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.72 3fk7 h LEU 14 Cb 0.50 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 3fk7 h LEU 14 CO 0.03 0.98 -0.18 -0.08 0.09 0.00 0.00 178.44 179.28 3fk7 h GLU 15 N 0.86 0.47 -0.09 1.13 4.81 -1.36 -2.69 114.58 117.71 3fk7 h GLU 15 Ca 0.16 -0.24 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3fk7 h GLU 15 Cb 0.53 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.91 3fk7 h GLU 15 CO 0.03 0.81 0.06 1.25 -0.73 0.00 0.00 179.01 180.43 3fk7 h LEU 16 N 0.15 0.11 -0.55 1.64 5.85 -0.82 -2.14 115.31 119.54 3fk7 h LEU 16 Ca 0.03 -0.05 0.11 0.00 0.84 0.00 0.00 57.88 58.82 3fk7 h LEU 16 Cb 0.72 -0.03 -0.10 0.00 0.37 0.00 0.00 40.66 41.62 3fk7 h LEU 16 CO 0.05 0.12 -0.09 0.25 -0.34 0.00 0.00 178.44 178.43 3fk7 h LEU 17 N 0.09 -0.43 -1.50 2.25 5.85 -1.12 0.22 115.31 120.67 3fk7 h LEU 17 Ca 0.03 0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.94 3fk7 h LEU 17 Cb 0.03 0.31 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 3fk7 h LEU 17 CO -0.01 -0.16 0.38 0.78 -0.34 0.00 0.00 178.44 179.09 3fk7 h ASN 18 N 0.03 0.56 0.01 1.25 2.35 -1.37 0.38 115.58 118.80 3fk7 h ASN 18 Ca 0.27 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 56.02 3fk7 h ASN 18 Cb 0.42 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.66 3fk7 h ASN 18 CO -0.54 0.39 -0.00 -0.33 -1.65 0.00 0.00 177.43 175.30 3fk7 h GLU 19 N 0.65 -0.01 -0.00 0.81 5.08 -0.00 -3.41 114.58 117.70 3fk7 h GLU 19 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 3fk7 h GLU 19 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 3fk7 h GLU 19 CO -0.06 0.68 -0.17 1.33 -1.00 0.00 0.00 179.01 179.78 3fk7 n VAL 20 N -4.76 0.00 -0.29 3.13 0.24 0.28 -5.10 118.33 111.82 3fk7 n VAL 20 Ca -0.09 -0.41 0.04 0.00 -2.04 0.00 0.00 64.34 61.83 3fk7 n VAL 20 Cb 0.34 1.00 -0.01 0.00 -1.47 0.00 0.00 33.84 33.70 3fk7 n VAL 20 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3fk7 n GLY 21 N 1.07 -1.93 0.37 7.63 0.00 0.13 -3.87 105.19 108.59 3fk7 n GLY 21 Ca 0.01 -1.43 0.06 0.00 0.00 0.00 0.00 46.02 44.66 3fk7 n GLY 21 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3fk7 h ILE 22 N -0.28 0.98 -0.22 -0.61 2.10 -1.84 -1.90 117.51 115.74 3fk7 h ILE 22 Ca -0.01 -0.33 -0.01 0.00 1.08 0.00 0.00 64.86 65.59 3fk7 h ILE 22 Cb 0.27 -0.06 -0.01 0.00 -1.09 0.00 0.00 36.82 35.94 3fk7 h ILE 22 CO 0.01 0.17 0.09 -0.33 -1.08 0.00 0.00 178.15 177.01 3fk7 h GLU 23 N 0.95 0.33 0.00 2.19 5.08 -1.97 -2.86 114.58 118.30 3fk7 h GLU 23 Ca 0.43 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 3fk7 h GLU 23 Cb 0.39 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.58 3fk7 h GLU 23 CO -0.19 0.38 0.00 0.41 -1.00 0.00 0.00 179.01 178.61 3fk7 n GLY 24 N -0.73 -1.40 3.56 -3.84 0.00 -0.93 -4.63 105.19 97.22 3fk7 n GLY 24 Ca -0.03 -0.07 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 3fk7 n GLY 24 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3fk7 s LEU 25 N -3.21 3.31 0.25 0.99 2.96 -0.76 -4.86 118.68 117.36 3fk7 s LEU 25 Ca 0.12 -0.78 0.08 0.00 -0.22 0.00 0.00 54.13 53.33 3fk7 s LEU 25 Cb 0.16 -2.56 -0.04 0.00 0.50 0.00 0.00 46.19 44.25 3fk7 s LEU 25 CO 0.47 -1.94 0.08 0.42 -1.32 0.00 0.00 176.35 174.06 3fk7 s THR 26 N 6.65 3.87 0.15 3.68 -4.23 -1.26 -5.00 115.64 119.50 3fk7 s THR 26 Ca 0.50 -1.68 -0.21 0.00 -1.18 0.00 0.00 61.69 59.12 3fk7 s THR 26 Cb -0.05 -3.07 0.04 0.00 1.34 0.00 0.00 72.50 70.76 3fk7 s THR 26 CO 0.03 -0.35 1.64 0.74 -0.54 0.00 0.00 174.62 176.14 3fk7 h THR 27 N 1.77 0.45 0.05 3.99 2.02 -1.95 -1.65 112.91 117.59 3fk7 h THR 27 Ca -0.46 0.00 0.02 0.00 0.77 0.00 0.00 66.41 66.74 3fk7 h THR 27 Cb 1.24 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 68.08 3fk7 h THR 27 CO 0.60 0.00 -0.15 -0.09 0.37 0.00 0.00 175.52 176.25 3fk7 h ARG 28 N -0.18 -0.27 -0.42 6.66 2.43 -1.97 -1.89 114.38 118.73 3fk7 h ARG 28 Ca 0.15 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.29 3fk7 h ARG 28 Cb 0.41 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 3fk7 h ARG 28 CO -0.38 -0.18 0.08 0.87 -1.51 0.00 0.00 179.97 178.84 3fk7 h LYS 29 N -0.28 0.64 -0.29 0.20 1.57 -1.88 -2.40 116.57 114.12 3fk7 h LYS 29 Ca 0.03 -0.12 -0.10 0.00 -1.87 0.00 0.00 60.65 58.60 3fk7 h LYS 29 Cb 0.32 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 3fk7 h LYS 29 CO -0.11 0.60 -0.20 1.25 -0.57 0.00 0.00 179.45 180.42 3fk7 h LEU 30 N 0.62 0.68 -0.57 2.94 5.85 -1.02 -2.10 115.31 121.70 3fk7 h LEU 30 Ca 0.14 -0.44 0.09 0.00 0.84 0.00 0.00 57.88 58.51 3fk7 h LEU 30 Cb 0.27 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 41.04 3fk7 h LEU 30 CO 0.00 0.97 0.19 0.00 -0.34 0.00 0.00 178.44 179.26 3fk7 h ALA 31 N 0.73 0.71 0.11 1.25 0.00 -1.16 0.50 119.26 121.40 3fk7 h ALA 31 Ca 0.06 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.07 3fk7 h ALA 31 Cb 0.74 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 3fk7 h ALA 31 CO 0.05 -0.23 -0.23 1.96 0.00 0.00 0.00 179.25 180.81 3fk7 h GLN 32 N 0.36 -0.41 -0.44 0.00 4.20 -1.36 0.99 115.11 118.44 3fk7 h GLN 32 Ca 0.29 0.03 0.05 0.00 0.06 0.00 0.00 58.65 59.07 3fk7 h GLN 32 Cb 0.36 0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.21 3fk7 h GLN 32 CO -0.31 -0.27 0.29 -0.22 -0.67 0.00 0.00 178.83 177.65 3fk7 h LYS 33 N -0.42 0.39 0.01 1.46 3.64 -0.93 -0.65 116.57 120.07 3fk7 h LYS 33 Ca 0.03 -0.02 -0.23 0.00 -1.27 0.00 0.00 60.65 59.16 3fk7 h LYS 33 Cb 0.45 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.15 3fk7 h LYS 33 CO -0.13 0.26 -1.14 -0.07 -2.27 0.00 0.00 179.45 176.09 3fk7 h LEU 34 N 0.40 0.04 -2.46 5.20 3.38 -0.56 -3.49 115.31 117.82 3fk7 h LEU 34 Ca 0.19 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 58.01 3fk7 h LEU 34 Cb 0.23 -0.01 0.07 0.00 0.09 0.00 0.00 40.66 41.04 3fk7 h LEU 34 CO -0.04 1.04 -0.29 0.61 0.09 0.00 0.00 178.44 179.85 3fk7 n GLY 35 N 1.40 0.18 3.40 0.83 0.00 0.33 -5.08 105.19 106.26 3fk7 n GLY 35 Ca -0.04 -0.09 -0.10 0.00 0.00 0.00 0.00 46.02 45.79 3fk7 n GLY 35 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3fk7 s VAL 36 N -3.13 0.03 0.75 1.61 -7.23 -0.71 -5.03 120.40 106.69 3fk7 s VAL 36 Ca 0.10 -1.49 -0.11 0.00 -1.81 0.00 0.00 61.98 58.67 3fk7 s VAL 36 Cb -0.01 -2.07 0.04 0.00 0.56 0.00 0.00 36.38 34.90 3fk7 s VAL 36 CO 0.26 -0.15 1.08 -1.61 -0.31 0.00 0.00 175.10 174.37 3fk7 s GLU 37 N -4.02 2.47 0.17 4.82 0.41 -1.26 -4.42 118.70 116.88 3fk7 s GLU 37 Ca 0.23 1.10 -0.10 0.00 -0.41 0.00 0.00 54.97 55.79 3fk7 s GLU 37 Cb 0.03 -1.93 0.04 0.00 -1.78 0.00 0.00 34.13 30.49 3fk7 s GLU 37 CO 0.05 -1.47 1.61 0.37 -0.49 0.00 0.00 175.26 175.33 3fk7 h GLN 38 N -1.00 1.05 0.00 1.61 4.15 -1.94 -2.84 115.11 116.14 3fk7 h GLN 38 Ca -0.44 -0.37 0.00 0.00 0.77 0.00 0.00 58.65 58.61 3fk7 h GLN 38 Cb 1.22 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.84 3fk7 h GLN 38 CO 0.53 1.07 0.00 -1.35 -1.93 0.00 0.00 178.83 177.15 3fk7 h PRO 39 N 0.93 0.00 0.00 -2.39 0.11 -1.99 -3.07 132.00 125.59 3fk7 h PRO 39 Ca 0.15 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 66.06 3fk7 h PRO 39 Cb 0.64 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.72 3fk7 h PRO 39 CO 0.04 0.00 -1.18 1.79 -0.21 0.00 0.00 178.00 178.45 3fk7 h THR 40 N 0.00 1.01 -0.33 -1.15 1.35 -1.88 -3.05 112.91 108.86 3fk7 h THR 40 Ca 0.00 -2.63 -0.04 0.00 -0.55 0.00 0.00 66.41 63.19 3fk7 h THR 40 Cb 0.29 2.45 -0.02 0.00 -1.73 0.00 0.00 68.15 69.14 3fk7 h THR 40 CO 0.00 0.58 0.03 -0.07 -0.25 0.00 0.00 175.52 175.81 3fk7 h LEU 41 N 0.00 0.46 -1.78 3.87 4.07 -1.55 -3.12 115.31 117.27 3fk7 h LEU 41 Ca -0.12 -0.07 0.10 0.00 0.08 0.00 0.00 57.88 57.87 3fk7 h LEU 41 Cb 1.70 -0.12 -0.03 0.00 1.08 0.00 0.00 40.66 43.30 3fk7 h LEU 41 CO 0.08 0.51 0.35 0.22 -1.08 0.00 0.00 178.44 178.52 3fk7 h TYR 42 N 0.49 0.27 0.00 1.13 3.20 -1.50 0.36 116.97 120.92 3fk7 h TYR 42 Ca 0.11 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.98 3fk7 h TYR 42 Cb 0.26 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 38.45 3fk7 h TYR 42 CO 0.01 0.13 -0.01 -1.49 -1.64 0.00 0.00 178.16 175.16 3fk7 h TRP 43 N 0.25 0.00 0.00 -3.82 6.55 -1.63 -3.24 115.95 114.07 3fk7 h TRP 43 Ca 0.24 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.08 3fk7 h TRP 43 Cb 0.61 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.91 3fk7 h TRP 43 CO -0.00 0.01 -0.74 0.72 -1.05 0.00 0.00 178.44 177.38 3fk7 n HIS 44 N -3.39 -0.05 -3.81 0.49 8.25 -0.70 -4.93 115.22 111.08 3fk7 n HIS 44 Ca -0.03 0.01 -0.35 0.00 -0.26 0.00 0.00 57.72 57.09 3fk7 n HIS 44 Cb 0.10 0.05 -0.12 0.00 1.12 0.00 0.00 29.99 31.14 3fk7 n HIS 44 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3fk7 s VAL 45 N -2.00 3.18 0.06 1.59 1.01 0.12 -4.88 120.40 119.48 3fk7 s VAL 45 Ca 0.00 -2.51 -0.11 0.00 0.00 0.00 0.00 61.98 59.36 3fk7 s VAL 45 Cb 0.00 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.18 3fk7 s VAL 45 CO 0.00 -0.75 1.19 0.50 0.00 0.00 0.00 175.10 176.05 3fk7 h LYS 46 N 7.51 -0.02 0.00 2.72 3.64 -1.76 -3.32 116.57 125.35 3fk7 h LYS 46 Ca -0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 3fk7 h LYS 46 Cb 1.00 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 3fk7 h LYS 46 CO 0.68 -0.02 0.00 0.27 -2.27 0.00 0.00 179.45 178.11 3fk7 n ASN 47 N -3.78 0.00 0.07 4.20 0.23 -1.26 -4.58 115.26 110.14 3fk7 n ASN 47 Ca 0.00 -0.37 -0.11 0.00 -0.53 0.00 0.00 54.58 53.57 3fk7 n ASN 47 Cb 0.10 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 37.79 3fk7 n ASN 47 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 3fk7 h LYS 48 N 0.00 0.33 0.10 -3.83 3.64 -1.96 -2.17 116.57 112.67 3fk7 h LYS 48 Ca 0.00 -0.33 -0.00 0.00 -1.27 0.00 0.00 60.65 59.04 3fk7 h LYS 48 Cb 0.00 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 3fk7 h LYS 48 CO 0.00 1.01 -0.05 -0.09 -2.27 0.00 0.00 179.45 178.05 3fk7 h ARG 49 N 0.20 -0.13 -0.54 1.90 9.65 -1.98 0.29 114.38 123.77 3fk7 h ARG 49 Ca -0.05 0.01 0.02 0.00 -1.10 0.00 0.00 59.98 58.85 3fk7 h ARG 49 Cb 1.47 0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 30.05 3fk7 h ARG 49 CO 0.14 0.08 0.34 0.00 2.80 0.00 0.00 179.97 183.33 3fk7 h ALA 50 N 0.56 0.69 -0.07 2.80 0.00 -1.97 0.23 119.26 121.50 3fk7 h ALA 50 Ca -0.01 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.90 3fk7 h ALA 50 Cb 0.27 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3fk7 h ALA 50 CO 0.02 0.07 -0.07 1.25 0.00 0.00 0.00 179.25 180.52 3fk7 h LEU 51 N 0.67 -0.22 -0.83 0.00 5.85 -1.29 -0.20 115.31 119.30 3fk7 h LEU 51 Ca 0.21 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.97 3fk7 h LEU 51 Cb -0.01 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 3fk7 h LEU 51 CO -0.08 -0.10 0.50 -0.07 -0.34 0.00 0.00 178.44 178.35 3fk7 h LEU 52 N -0.09 1.00 -0.25 2.25 3.38 0.07 -0.09 115.31 121.58 3fk7 h LEU 52 Ca 0.05 -0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.00 3fk7 h LEU 52 Cb 0.17 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 3fk7 h LEU 52 CO -0.13 0.77 0.00 0.44 0.09 0.00 0.00 178.44 179.61 3fk7 h ASP 53 N 1.14 -0.09 -0.85 -0.43 3.45 -0.35 -0.93 116.42 118.35 3fk7 h ASP 53 Ca 0.30 0.05 -0.00 0.00 0.43 0.00 0.00 57.03 57.81 3fk7 h ASP 53 Cb -0.05 0.10 -0.04 0.00 -0.56 0.00 0.00 39.33 38.78 3fk7 h ASP 53 CO -0.06 -0.02 0.53 0.00 -1.57 0.00 0.00 179.24 178.12 3fk7 h ALA 54 N 1.21 1.31 -0.39 3.45 0.00 -0.44 -2.67 119.26 121.73 3fk7 h ALA 54 Ca 0.12 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3fk7 h ALA 54 Cb 0.15 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3fk7 h ALA 54 CO -0.20 0.60 -0.01 -0.07 0.00 0.00 0.00 179.25 179.57 3fk7 h LEU 55 N 1.18 0.69 -0.25 0.00 3.38 -0.52 -1.35 115.31 118.44 3fk7 h LEU 55 Ca 0.31 -0.31 0.05 0.00 0.09 0.00 0.00 57.88 58.02 3fk7 h LEU 55 Cb -0.07 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.45 3fk7 h LEU 55 CO -0.06 0.84 -0.06 0.00 0.09 0.00 0.00 178.44 179.25 3fk7 h ALA 56 N 0.88 0.17 -0.61 1.53 0.00 -1.02 -0.19 119.26 120.02 3fk7 h ALA 56 Ca 0.11 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 3fk7 h ALA 56 Cb 0.49 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 3fk7 h ALA 56 CO 0.02 -0.46 0.36 0.28 0.00 0.00 0.00 179.25 179.44 3fk7 h VAL 57 N 0.01 1.19 -0.58 0.00 2.07 -1.34 -2.61 116.25 114.99 3fk7 h VAL 57 Ca 0.12 -0.44 -0.08 0.00 0.82 0.00 0.00 66.70 67.13 3fk7 h VAL 57 Cb 0.18 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 3fk7 h VAL 57 CO -0.25 0.20 0.05 -0.08 0.02 0.00 0.00 177.57 177.50 3fk7 h GLU 58 N 0.83 0.96 -0.78 1.57 4.57 -0.92 -0.89 114.58 119.92 3fk7 h GLU 58 Ca 0.22 -0.26 -0.03 0.00 -1.18 0.00 0.00 59.36 58.10 3fk7 h GLU 58 Cb 0.00 -0.11 -0.04 0.00 -0.16 0.00 0.00 28.75 28.45 3fk7 h GLU 58 CO -0.04 0.92 0.37 0.82 -1.18 0.00 0.00 179.01 179.90 3fk7 h ILE 59 N 0.89 1.25 -0.07 2.32 2.04 -0.71 -1.13 117.51 122.11 3fk7 h ILE 59 Ca 0.17 -0.71 -0.25 0.00 1.00 0.00 0.00 64.86 65.07 3fk7 h ILE 59 Cb 0.46 0.27 0.02 0.00 -0.74 0.00 0.00 36.82 36.83 3fk7 h ILE 59 CO 0.02 0.30 -0.92 -0.07 0.00 0.00 0.00 178.15 177.47 3fk7 h LEU 60 N 1.10 0.94 -1.14 1.44 3.38 -1.36 -0.32 115.31 119.35 3fk7 h LEU 60 Ca 0.27 -0.69 0.07 0.00 0.09 0.00 0.00 57.88 57.62 3fk7 h LEU 60 Cb 0.13 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.54 3fk7 h LEU 60 CO -0.03 1.49 0.59 0.00 0.09 0.00 0.00 178.44 180.58 3fk7 h ALA 61 N 0.47 1.51 0.17 1.53 0.00 -0.96 -0.23 119.26 121.75 3fk7 h ALA 61 Ca -0.10 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.53 3fk7 h ALA 61 Cb 1.57 -0.27 0.02 0.00 0.00 0.00 0.00 17.79 19.11 3fk7 h ALA 61 CO 0.19 0.34 -1.21 0.00 0.00 0.00 0.00 179.25 178.57 3fk7 h ARG 62 N 1.03 0.35 0.00 0.00 3.08 -1.18 -3.43 114.38 114.23 3fk7 h ARG 62 Ca 0.40 -0.60 0.00 0.00 0.07 0.00 0.00 59.98 59.85 3fk7 h ARG 62 Cb 0.22 0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.49 3fk7 h ARG 62 CO -0.15 1.29 0.00 0.72 -1.07 0.00 0.00 179.97 180.75 3fk7 n HIS 63 N -3.93 0.00 -3.28 3.04 8.25 -0.14 -4.83 115.22 114.33 3fk7 n HIS 63 Ca -0.19 0.00 -0.47 0.00 -0.26 0.00 0.00 57.72 56.81 3fk7 n HIS 63 Cb 0.93 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 32.02 3fk7 n HIS 63 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 3fk7 s LYS 64 N -0.20 3.53 0.00 -0.41 2.20 -0.11 -3.96 119.74 120.79 3fk7 s LYS 64 Ca 0.00 -2.29 0.27 0.00 -0.36 0.00 0.00 55.97 53.59 3fk7 s LYS 64 Cb 0.00 -4.46 1.27 0.00 -1.51 0.00 0.00 37.83 33.12 3fk7 s LYS 64 CO 0.00 -1.35 1.85 -0.40 -0.36 0.00 0.00 175.35 175.09 3fk7 n ASP 65 N 4.43 0.88 -4.11 1.43 5.68 -1.26 -4.66 116.55 118.94 3fk7 n ASP 65 Ca 0.12 -1.37 -0.30 0.00 -0.50 0.00 0.00 54.79 52.74 3fk7 n ASP 65 Cb 0.46 -0.02 -0.17 0.00 -1.14 0.00 0.00 41.12 40.26 3fk7 n ASP 65 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 3fk7 s TYR 66 N -1.96 2.21 0.00 2.11 6.14 -1.26 -4.97 117.35 119.61 3fk7 s TYR 66 Ca 0.39 -1.03 0.00 0.00 0.64 0.00 0.00 57.07 57.07 3fk7 s TYR 66 Cb 0.20 -1.55 0.00 0.00 0.42 0.00 0.00 41.96 41.03 3fk7 s TYR 66 CO 0.32 -0.49 0.00 0.43 0.64 0.00 0.00 175.55 176.45 3fk7 n SER 67 N 4.03 0.94 -4.40 4.32 7.64 -1.26 -4.72 113.62 120.18 3fk7 n SER 67 Ca -0.20 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.38 3fk7 n SER 67 Cb 0.52 0.09 -0.14 0.00 -1.01 0.00 0.00 64.21 63.67 3fk7 n SER 67 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3fk7 s LEU 68 N -1.67 2.37 0.41 -3.43 1.43 -1.26 -4.90 118.68 111.63 3fk7 s LEU 68 Ca 0.00 -0.46 -0.26 0.00 -1.03 0.00 0.00 54.13 52.38 3fk7 s LEU 68 Cb 0.00 -1.41 -0.09 0.00 0.03 0.00 0.00 46.19 44.72 3fk7 s LEU 68 CO 0.00 0.28 1.29 -2.16 0.23 0.00 0.00 176.35 175.99 3fk7 s PRO 69 N -1.14 3.96 0.72 1.29 0.04 -1.26 -5.02 135.00 133.58 3fk7 s PRO 69 Ca 0.12 2.12 -0.11 0.00 0.04 0.00 0.00 61.00 63.18 3fk7 s PRO 69 Cb -0.10 -2.74 0.02 0.00 0.04 0.00 0.00 34.50 31.72 3fk7 s PRO 69 CO 0.02 -0.49 1.07 0.00 0.04 0.00 0.00 177.00 177.65 3fk7 s ALA 70 N -1.28 2.59 0.21 8.56 0.00 -1.26 -4.97 121.76 125.61 3fk7 s ALA 70 Ca 0.57 -0.02 -0.32 0.00 0.00 0.00 0.00 51.96 52.19 3fk7 s ALA 70 Cb -0.37 -3.15 -0.12 0.00 0.00 0.00 0.00 23.12 19.48 3fk7 s ALA 70 CO 0.48 -1.33 1.70 0.00 0.00 0.00 0.00 175.76 176.61 3fk7 n ALA 71 N -3.19 2.63 -0.56 0.00 0.00 -1.26 -2.23 120.51 115.90 3fk7 n ALA 71 Ca 0.07 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.92 3fk7 n ALA 71 Cb 0.54 -2.50 0.00 0.00 0.00 0.00 0.00 19.45 17.50 3fk7 n ALA 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fk7 n GLY 72 N 3.82 0.97 3.74 0.00 0.00 -1.26 -5.02 105.19 107.44 3fk7 n GLY 72 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 3fk7 n GLY 72 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3fk7 s GLU 73 N -0.35 4.75 0.62 1.61 2.12 -0.95 -5.02 118.70 121.47 3fk7 s GLU 73 Ca 0.00 1.44 -0.17 0.00 0.36 0.00 0.00 54.97 56.59 3fk7 s GLU 73 Cb 0.00 -3.33 -0.02 0.00 0.26 0.00 0.00 34.13 31.03 3fk7 s GLU 73 CO 0.00 0.35 1.16 -1.54 -0.54 0.00 0.00 175.26 174.69 3fk7 s SER 74 N -0.50 5.16 0.46 -1.70 1.04 -1.26 -4.89 113.70 112.00 3fk7 s SER 74 Ca 0.44 2.23 0.14 0.00 0.48 0.00 0.00 55.95 59.24 3fk7 s SER 74 Cb -0.24 -2.58 1.04 0.00 0.10 0.00 0.00 66.02 64.34 3fk7 s SER 74 CO 0.30 -1.60 2.03 4.11 0.98 0.00 0.00 173.24 179.06 3fk7 h TRP 75 N 0.59 0.05 -0.27 5.02 5.08 -1.97 -1.11 115.95 123.34 3fk7 h TRP 75 Ca -0.49 -0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.47 3fk7 h TRP 75 Cb 1.28 -0.01 -0.01 0.00 -3.00 0.00 0.00 29.16 27.41 3fk7 h TRP 75 CO 0.50 0.16 0.13 1.96 -1.28 0.00 0.00 178.44 179.91 3fk7 h GLN 76 N 0.05 0.38 -0.37 0.12 7.50 -1.99 0.11 115.11 120.91 3fk7 h GLN 76 Ca 0.01 -0.05 -0.13 0.00 0.50 0.00 0.00 58.65 58.97 3fk7 h GLN 76 Cb 0.22 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 27.67 3fk7 h GLN 76 CO 0.01 0.37 -0.30 1.03 -1.50 0.00 0.00 178.83 178.44 3fk7 h SER 77 N 0.30 0.83 -0.07 1.46 0.87 -1.85 -1.64 113.55 113.45 3fk7 h SER 77 Ca 0.09 -0.34 0.01 0.00 -1.23 0.00 0.00 61.79 60.32 3fk7 h SER 77 Cb 0.11 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 3fk7 h SER 77 CO -0.01 1.07 0.03 0.15 -0.53 0.00 0.00 176.83 177.53 3fk7 h PHE 78 N 0.68 0.05 -0.62 2.24 3.57 -0.93 -0.84 116.94 121.09 3fk7 h PHE 78 Ca 0.08 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.60 3fk7 h PHE 78 Cb 0.84 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.53 3fk7 h PHE 78 CO 0.05 0.03 0.40 -0.07 -2.23 0.00 0.00 178.31 176.48 3fk7 h LEU 79 N 0.07 0.67 0.08 0.59 3.38 -0.71 -0.58 115.31 118.80 3fk7 h LEU 79 Ca 0.03 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3fk7 h LEU 79 Cb 0.01 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.60 3fk7 h LEU 79 CO -0.03 0.48 -0.04 -0.09 0.09 0.00 0.00 178.44 178.86 3fk7 h ARG 80 N 0.80 -0.10 -0.77 1.13 2.43 -1.15 -0.43 114.38 116.29 3fk7 h ARG 80 Ca 0.24 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.37 3fk7 h ARG 80 Cb -0.05 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.49 3fk7 h ARG 80 CO -0.07 0.11 0.31 -0.91 -1.51 0.00 0.00 179.97 177.90 3fk7 h ASN 81 N -0.30 1.06 -0.48 -3.80 2.35 -1.12 -0.99 115.58 112.30 3fk7 h ASN 81 Ca -0.01 -0.16 -0.05 0.00 -0.55 0.00 0.00 56.30 55.53 3fk7 h ASN 81 Cb 0.26 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 3fk7 h ASN 81 CO 0.02 0.94 0.12 0.78 -1.65 0.00 0.00 177.43 177.64 3fk7 h ASN 82 N 1.12 0.73 -0.31 5.81 2.35 -0.97 -1.02 115.58 123.30 3fk7 h ASN 82 Ca 0.26 -0.23 -0.02 0.00 -0.55 0.00 0.00 56.30 55.75 3fk7 h ASN 82 Cb 0.21 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 3fk7 h ASN 82 CO -0.02 0.77 0.10 0.00 -1.65 0.00 0.00 177.43 176.63 3fk7 h ALA 83 N 0.99 0.41 -0.38 -0.83 0.00 -0.88 -1.46 119.26 117.11 3fk7 h ALA 83 Ca 0.15 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 3fk7 h ALA 83 Cb 0.32 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3fk7 h ALA 83 CO 0.00 0.04 -0.15 0.52 0.00 0.00 0.00 179.25 179.66 3fk7 h MET 84 N 0.34 0.77 -0.81 0.00 2.86 -1.10 -0.68 114.93 116.31 3fk7 h MET 84 Ca 0.10 -0.32 0.00 0.00 -2.06 0.00 0.00 59.70 57.42 3fk7 h MET 84 Cb 0.25 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 31.84 3fk7 h MET 84 CO -0.00 0.94 0.52 1.03 1.06 0.00 0.00 176.91 180.45 3fk7 h SER 85 N 0.57 0.95 -0.27 1.22 0.87 -1.19 -0.82 113.55 114.88 3fk7 h SER 85 Ca 0.09 -0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.54 3fk7 h SER 85 Cb 0.69 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 3fk7 h SER 85 CO 0.05 0.70 -0.10 0.15 -0.53 0.00 0.00 176.83 177.10 3fk7 h PHE 86 N 1.11 0.62 -0.19 2.24 3.57 -1.01 -1.95 116.94 121.32 3fk7 h PHE 86 Ca 0.30 -0.14 0.03 0.00 3.53 0.00 0.00 57.97 61.68 3fk7 h PHE 86 Cb -0.10 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.47 3fk7 h PHE 86 CO 0.00 0.77 -0.01 -0.09 -2.23 0.00 0.00 178.31 176.75 3fk7 h ARG 87 N 0.28 0.05 -0.92 1.11 2.43 -0.85 0.01 114.38 116.48 3fk7 h ARG 87 Ca 0.06 -0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.27 3fk7 h ARG 87 Cb 0.60 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 30.08 3fk7 h ARG 87 CO 0.03 0.03 0.59 -0.09 -1.51 0.00 0.00 179.97 179.03 3fk7 h ARG 88 N 0.05 1.10 -0.33 0.20 9.65 -1.07 -1.49 114.38 122.49 3fk7 h ARG 88 Ca 0.09 -0.07 -0.05 0.00 -1.10 0.00 0.00 59.98 58.85 3fk7 h ARG 88 Cb 0.12 -0.25 -0.01 0.00 -1.39 0.00 0.00 29.97 28.44 3fk7 h ARG 88 CO -0.16 0.73 0.01 0.00 2.80 0.00 0.00 179.97 183.35 3fk7 h ALA 89 N 1.39 0.44 -0.14 2.80 0.00 -1.00 -2.77 119.26 119.98 3fk7 h ALA 89 Ca 0.37 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 3fk7 h ALA 89 Cb 0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3fk7 h ALA 89 CO -0.13 0.18 0.07 -0.07 0.00 0.00 0.00 179.25 179.29 3fk7 h LEU 90 N 0.38 0.16 -0.01 0.00 3.38 -0.66 -2.37 115.31 116.19 3fk7 h LEU 90 Ca 0.09 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3fk7 h LEU 90 Cb 0.42 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3fk7 h LEU 90 CO 0.01 0.14 -0.03 0.18 0.09 0.00 0.00 178.44 178.84 3fk7 n LEU 91 N -4.49 0.04 -0.05 1.67 4.77 -0.59 -3.93 117.00 114.42 3fk7 n LEU 91 Ca -0.01 0.38 -0.13 0.00 -0.03 0.00 0.00 56.01 56.22 3fk7 n LEU 91 Cb 0.10 -0.40 -0.07 0.00 -2.33 0.00 0.00 43.42 40.72 3fk7 n LEU 91 CO 0.35 0.01 0.62 -0.09 -1.33 0.00 0.00 177.39 176.95 3fk7 h ARG 92 N 0.03 0.31 -6.38 3.23 9.65 -1.21 -3.45 114.38 116.56 3fk7 h ARG 92 Ca 0.00 -0.16 -0.63 0.00 -1.10 0.00 0.00 59.98 58.09 3fk7 h ARG 92 Cb 0.42 0.00 -0.12 0.00 -1.39 0.00 0.00 29.97 28.88 3fk7 h ARG 92 CO 0.00 0.69 -0.67 0.71 2.80 0.00 0.00 179.97 183.50 3fk7 s TYR 93 N -4.37 2.89 0.30 2.20 2.02 -1.26 -5.08 117.35 114.05 3fk7 s TYR 93 Ca -0.14 -0.09 -0.29 0.00 -0.37 0.00 0.00 57.07 56.17 3fk7 s TYR 93 Cb 0.05 -1.45 -0.10 0.00 -0.40 0.00 0.00 41.96 40.05 3fk7 s TYR 93 CO 0.74 0.48 1.42 0.50 -1.57 0.00 0.00 175.55 177.12 3fk7 s ARG 94 N -2.56 4.26 -1.20 -0.62 3.52 -1.26 -2.13 118.95 118.96 3fk7 s ARG 94 Ca 0.26 2.34 0.00 0.00 -0.13 0.00 0.00 55.73 58.19 3fk7 s ARG 94 Cb -0.11 -3.07 0.00 0.00 -1.56 0.00 0.00 34.95 30.21 3fk7 s ARG 94 CO 0.18 -0.38 0.00 -0.25 -0.81 0.00 0.00 175.30 174.03 3fk7 n ASP 95 N 1.57 -3.80 -0.09 -2.12 8.00 -1.26 -4.66 116.55 114.19 3fk7 n ASP 95 Ca 0.04 0.23 0.13 0.00 0.71 0.00 0.00 54.79 55.90 3fk7 n ASP 95 Cb 0.40 -3.34 0.51 0.00 -0.02 0.00 0.00 41.12 38.68 3fk7 n ASP 95 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 3fk7 h GLY 96 N 0.00 0.56 1.28 0.44 0.00 -1.55 0.07 103.07 103.88 3fk7 h GLY 96 Ca -0.29 -0.16 -0.32 0.00 0.00 0.00 0.00 47.33 46.56 3fk7 h GLY 96 CO 0.37 0.09 -1.41 0.00 0.00 0.00 0.00 176.54 175.59 3fk7 h ALA 97 N 1.69 -0.11 -0.97 3.60 0.00 -1.85 -3.10 119.26 118.52 3fk7 h ALA 97 Ca 0.29 -0.84 0.06 0.00 0.00 0.00 0.00 54.91 54.42 3fk7 h ALA 97 Cb 0.62 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.50 3fk7 h ALA 97 CO -0.08 0.71 0.63 0.87 0.00 0.00 0.00 179.25 181.38 3fk7 h LYS 98 N 0.18 1.11 -0.98 0.00 1.57 -1.72 -1.95 116.57 114.78 3fk7 h LYS 98 Ca -0.23 -0.07 0.06 0.00 -1.87 0.00 0.00 60.65 58.54 3fk7 h LYS 98 Cb 2.09 -0.25 -0.06 0.00 0.08 0.00 0.00 32.23 34.09 3fk7 h LYS 98 CO 0.26 0.74 0.64 0.28 -0.57 0.00 0.00 179.45 180.80 3fk7 h VAL 99 N 1.15 1.11 0.00 0.50 2.07 -1.02 -2.87 116.25 117.19 3fk7 h VAL 99 Ca 0.42 -0.40 -0.05 0.00 0.82 0.00 0.00 66.70 67.49 3fk7 h VAL 99 Cb 0.15 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 29.74 3fk7 h VAL 99 CO -0.17 0.21 -0.22 0.45 0.02 0.00 0.00 177.57 177.87 3fk7 h HIS 100 N 1.18 0.00 -2.01 1.57 3.86 -1.29 -3.44 115.15 115.01 3fk7 h HIS 100 Ca 0.42 0.00 -0.63 0.00 -1.16 0.00 0.00 60.37 59.00 3fk7 h HIS 100 Cb 0.12 0.00 0.04 0.00 1.06 0.00 0.00 27.41 28.63 3fk7 h HIS 100 CO -0.01 0.22 0.82 1.28 0.86 0.00 0.00 177.93 181.10 3fk7 n LEU 101 N -3.23 2.83 0.00 2.43 4.77 -0.92 -2.04 117.00 120.84 3fk7 n LEU 101 Ca 0.02 1.06 0.00 0.00 -0.03 0.00 0.00 56.01 57.06 3fk7 n LEU 101 Cb 0.53 -1.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.28 3fk7 n LEU 101 CO 0.35 -0.39 0.00 0.61 -1.33 0.00 0.00 177.39 176.63 3fk7 n GLY 102 N 3.59 0.82 3.85 -0.72 0.00 -1.26 -5.02 105.19 106.45 3fk7 n GLY 102 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 3fk7 n GLY 102 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fk7 s THR 103 N -3.27 4.61 0.30 2.61 -4.23 -0.87 -5.08 115.64 109.71 3fk7 s THR 103 Ca 0.00 1.06 0.10 0.00 -1.18 0.00 0.00 61.69 61.67 3fk7 s THR 103 Cb 0.00 -3.75 -0.06 0.00 1.34 0.00 0.00 72.50 70.03 3fk7 s THR 103 CO 0.00 -0.75 -0.14 -0.13 -0.54 0.00 0.00 174.62 173.06 3fk7 s ARG 104 N -4.26 1.71 0.30 3.99 1.81 -1.26 -5.10 118.95 116.14 3fk7 s ARG 104 Ca 0.57 -1.83 -0.29 0.00 -1.72 0.00 0.00 55.73 52.46 3fk7 s ARG 104 Cb -0.10 -1.64 -0.13 0.00 -0.45 0.00 0.00 34.95 32.63 3fk7 s ARG 104 CO 0.36 0.21 1.26 -2.30 -0.68 0.00 0.00 175.30 174.14 3fk7 n PRO 105 N -0.68 1.92 -3.02 3.54 -0.02 -1.26 -4.99 135.00 130.50 3fk7 n PRO 105 Ca -0.05 0.68 -0.27 0.00 -2.02 0.00 0.00 63.50 61.83 3fk7 n PRO 105 Cb 0.62 -2.23 -0.01 0.00 -0.02 0.00 0.00 33.50 31.86 3fk7 n PRO 105 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3fk7 s ASP 106 N -0.21 6.34 0.34 2.55 2.15 -1.26 -4.96 116.67 121.62 3fk7 s ASP 106 Ca 0.59 0.77 0.10 0.00 0.43 0.00 0.00 52.55 54.45 3fk7 s ASP 106 Cb -0.62 -2.17 0.87 0.00 -0.30 0.00 0.00 42.92 40.70 3fk7 s ASP 106 CO 0.59 -0.40 1.79 1.05 -0.17 0.00 0.00 175.17 178.03 3fk7 h GLU 107 N 0.80 0.61 0.00 4.34 4.11 -2.01 0.24 114.58 122.66 3fk7 h GLU 107 Ca -0.48 -0.04 0.00 0.00 0.07 0.00 0.00 59.36 58.91 3fk7 h GLU 107 Cb 1.20 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.32 3fk7 h GLU 107 CO 0.63 0.40 0.00 1.63 0.07 0.00 0.00 179.01 181.74 3fk7 n LYS 108 N -4.70 0.18 0.00 1.06 5.02 -1.26 -2.82 118.16 115.64 3fk7 n LYS 108 Ca 0.23 0.49 0.07 0.00 -2.02 0.00 0.00 58.31 57.08 3fk7 n LYS 108 Cb 0.65 -1.90 -0.00 0.00 -0.02 0.00 0.00 35.03 33.76 3fk7 n LYS 108 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3fk7 n GLN 109 N -2.25 1.74 -0.14 1.97 6.02 0.80 -4.74 117.38 120.78 3fk7 n GLN 109 Ca 0.01 -0.76 -0.05 0.00 -0.01 0.00 0.00 57.00 56.19 3fk7 n GLN 109 Cb 0.17 -1.25 0.03 0.00 1.02 0.00 0.00 30.24 30.22 3fk7 n GLN 109 CO 0.00 0.00 0.00 1.88 -1.01 0.00 0.00 177.06 177.93 3fk7 h TYR 110 N 1.64 0.36 -0.61 1.08 0.05 -1.31 -0.76 116.97 117.42 3fk7 h TYR 110 Ca 0.00 0.02 -0.05 0.00 0.05 0.00 0.00 58.73 58.75 3fk7 h TYR 110 Cb 0.51 -0.10 -0.03 0.00 1.01 0.00 0.00 36.73 38.13 3fk7 h TYR 110 CO 0.00 0.17 0.20 -0.44 -1.05 0.00 0.00 178.16 177.04 3fk7 h ASP 111 N 0.40 0.86 0.26 3.88 3.32 -1.85 0.57 116.42 123.86 3fk7 h ASP 111 Ca 0.19 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 3fk7 h ASP 111 Cb 0.13 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.46 3fk7 h ASP 111 CO -0.15 0.80 -0.12 0.74 -1.72 0.00 0.00 179.24 178.78 3fk7 h THR 112 N 0.90 0.79 -0.52 0.35 2.02 -1.78 -2.40 112.91 112.26 3fk7 h THR 112 Ca 0.20 -0.40 0.00 0.00 0.77 0.00 0.00 66.41 66.98 3fk7 h THR 112 Cb 0.25 1.02 -0.03 0.00 -1.74 0.00 0.00 68.15 67.65 3fk7 h THR 112 CO -0.01 0.09 0.33 0.58 0.37 0.00 0.00 175.52 176.88 3fk7 h VAL 113 N -0.56 1.15 -0.49 3.16 2.07 -0.99 -1.28 116.25 119.31 3fk7 h VAL 113 Ca -0.04 -0.32 0.04 0.00 0.82 0.00 0.00 66.70 67.21 3fk7 h VAL 113 Cb 0.41 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 3fk7 h VAL 113 CO 0.06 0.15 0.25 -0.08 0.02 0.00 0.00 177.57 177.97 3fk7 h GLU 114 N 0.71 0.48 -0.89 1.57 4.57 -0.95 -0.13 114.58 119.94 3fk7 h GLU 114 Ca 0.19 -0.03 0.03 0.00 -1.18 0.00 0.00 59.36 58.37 3fk7 h GLU 114 Cb -0.04 -0.11 -0.05 0.00 -0.16 0.00 0.00 28.75 28.39 3fk7 h GLU 114 CO -0.04 0.32 0.58 1.15 -1.18 0.00 0.00 179.01 179.85 3fk7 h THR 115 N 0.50 1.18 -0.35 0.32 2.02 -1.01 0.18 112.91 115.75 3fk7 h THR 115 Ca 0.21 -0.40 -0.03 0.00 0.77 0.00 0.00 66.41 66.96 3fk7 h THR 115 Cb 0.10 -0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 66.42 3fk7 h THR 115 CO -0.14 0.21 0.09 1.56 0.37 0.00 0.00 175.52 177.61 3fk7 h GLN 116 N 1.15 0.56 -0.52 6.66 4.20 -0.72 0.65 115.11 127.09 3fk7 h GLN 116 Ca 0.35 -0.13 -0.04 0.00 0.06 0.00 0.00 58.65 58.88 3fk7 h GLN 116 Cb -0.05 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 3fk7 h GLN 116 CO -0.10 0.60 0.15 -0.07 -0.67 0.00 0.00 178.83 178.74 3fk7 h LEU 117 N 0.41 0.77 0.32 1.46 3.38 -0.66 -2.23 115.31 118.77 3fk7 h LEU 117 Ca 0.11 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 3fk7 h LEU 117 Cb 0.29 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3fk7 h LEU 117 CO 0.00 0.78 -0.15 -0.09 0.09 0.00 0.00 178.44 179.07 3fk7 h ARG 118 N 0.72 -0.41 -0.89 1.13 2.43 -0.56 -2.37 114.38 114.42 3fk7 h ARG 118 Ca 0.17 0.03 0.15 0.00 -0.81 0.00 0.00 59.98 59.52 3fk7 h ARG 118 Cb 0.30 0.09 -0.16 0.00 -0.42 0.00 0.00 29.97 29.79 3fk7 h ARG 118 CO -0.00 -0.27 -0.32 0.35 -1.51 0.00 0.00 179.97 178.21 3fk7 h PHE 119 N -0.44 -0.84 0.04 2.20 3.57 -0.76 0.34 116.94 121.05 3fk7 h PHE 119 Ca -0.04 0.09 0.02 0.00 3.53 0.00 0.00 57.97 61.57 3fk7 h PHE 119 Cb 0.33 0.50 -0.03 0.00 2.79 0.00 0.00 35.95 39.55 3fk7 h PHE 119 CO -0.05 -0.40 -0.16 0.52 -2.23 0.00 0.00 178.31 175.99 3fk7 h MET 120 N -0.03 -0.28 -0.71 1.11 2.86 -1.15 -2.26 114.93 114.46 3fk7 h MET 120 Ca 0.36 0.02 0.06 0.00 -2.06 0.00 0.00 59.70 58.07 3fk7 h MET 120 Cb 0.61 0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.29 3fk7 h MET 120 CO -0.91 -0.19 0.47 1.79 1.06 0.00 0.00 176.91 179.13 3fk7 h THR 121 N -0.29 1.04 0.00 2.22 1.35 -0.60 0.33 112.91 116.95 3fk7 h THR 121 Ca 0.04 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.64 3fk7 h THR 121 Cb 0.34 0.20 0.00 0.00 -1.73 0.00 0.00 68.15 66.96 3fk7 h THR 121 CO -0.13 0.14 0.00 -0.62 -0.25 0.00 0.00 175.52 174.66 3fk7 n GLU 122 N -4.47 0.16 -0.48 4.72 1.02 -0.05 -3.28 120.64 118.25 3fk7 n GLU 122 Ca 0.10 0.43 0.08 0.00 -0.02 0.00 0.00 57.16 57.75 3fk7 n GLU 122 Cb 0.20 -1.82 0.27 0.00 -0.02 0.00 0.00 31.44 30.07 3fk7 n GLU 122 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3fk7 n ASN 123 N -2.12 4.06 0.00 1.62 3.02 0.11 -4.94 115.26 117.01 3fk7 n ASN 123 Ca 0.02 -2.87 0.00 0.00 -0.03 0.00 0.00 54.58 51.70 3fk7 n ASN 123 Cb 0.19 -0.53 0.00 0.00 -0.61 0.00 0.00 39.78 38.83 3fk7 n ASN 123 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3fk7 n GLY 124 N -0.18 0.46 3.81 7.41 0.00 -1.18 -5.06 105.19 110.45 3fk7 n GLY 124 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 3fk7 n GLY 124 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3fk7 s PHE 125 N -2.00 3.62 0.59 1.61 0.40 -1.15 -5.04 117.98 116.01 3fk7 s PHE 125 Ca 0.00 1.46 -0.16 0.00 -0.60 0.00 0.00 56.93 57.63 3fk7 s PHE 125 Cb 0.00 -2.68 -0.04 0.00 0.51 0.00 0.00 43.02 40.81 3fk7 s PHE 125 CO 0.00 0.27 1.06 -1.54 0.70 0.00 0.00 175.22 175.72 3fk7 s SER 126 N -1.72 5.78 0.23 1.36 1.04 -1.26 -4.02 113.70 115.11 3fk7 s SER 126 Ca 0.46 1.85 -0.09 0.00 0.48 0.00 0.00 55.95 58.65 3fk7 s SER 126 Cb -0.16 -2.54 0.35 0.00 0.10 0.00 0.00 66.02 63.77 3fk7 s SER 126 CO 0.21 -1.17 1.65 0.25 0.98 0.00 0.00 173.24 175.16 3fk7 h LEU 127 N 0.53 -0.35 -0.34 2.42 5.85 -1.94 0.26 115.31 121.73 3fk7 h LEU 127 Ca -0.47 0.18 0.06 0.00 0.84 0.00 0.00 57.88 58.49 3fk7 h LEU 127 Cb 1.22 0.32 -0.06 0.00 0.37 0.00 0.00 40.66 42.52 3fk7 h LEU 127 CO 0.57 -0.16 -0.02 -0.09 -0.34 0.00 0.00 178.44 178.41 3fk7 h ARG 128 N 0.10 0.07 0.03 1.25 2.43 -1.99 0.09 114.38 116.36 3fk7 h ARG 128 Ca 0.36 -0.00 -0.22 0.00 -0.81 0.00 0.00 59.98 59.31 3fk7 h ARG 128 Cb 0.61 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 3fk7 h ARG 128 CO -0.61 0.05 -0.98 -0.44 -1.51 0.00 0.00 179.97 176.48 3fk7 h ASP 129 N 0.07 0.23 -0.43 -3.80 3.32 -1.51 -0.25 116.42 114.05 3fk7 h ASP 129 Ca 0.17 -0.21 -0.05 0.00 0.02 0.00 0.00 57.03 56.95 3fk7 h ASP 129 Cb 0.23 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 3fk7 h ASP 129 CO -0.29 1.07 0.06 1.23 -1.72 0.00 0.00 179.24 179.58 3fk7 h GLY 130 N 2.06 0.78 0.93 2.75 0.00 -0.44 -1.71 103.07 107.45 3fk7 h GLY 130 Ca -0.05 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 46.75 3fk7 h GLY 130 CO 0.15 0.49 0.00 -2.00 0.00 0.00 0.00 176.54 175.18 3fk7 h LEU 131 N 0.57 0.01 -1.15 3.11 5.85 -0.83 -2.33 115.31 120.53 3fk7 h LEU 131 Ca 0.13 -0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.82 3fk7 h LEU 131 Cb 0.40 -0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 3fk7 h LEU 131 CO 0.01 0.07 0.58 1.88 -0.34 0.00 0.00 178.44 180.65 3fk7 h TYR 132 N -0.06 1.07 -0.04 1.25 0.05 -0.94 0.78 116.97 119.08 3fk7 h TYR 132 Ca 0.00 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.81 3fk7 h TYR 132 Cb 0.07 -0.36 -0.00 0.00 1.01 0.00 0.00 36.73 37.45 3fk7 h TYR 132 CO -0.06 0.62 0.02 0.00 -1.05 0.00 0.00 178.16 177.69 3fk7 h ALA 133 N 1.48 0.05 -0.25 3.88 0.00 -1.27 0.70 119.26 123.85 3fk7 h ALA 133 Ca 0.35 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3fk7 h ALA 133 Cb 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3fk7 h ALA 133 CO -0.11 -0.36 0.16 0.82 0.00 0.00 0.00 179.25 179.76 3fk7 h ILE 134 N -0.09 1.08 -0.52 0.00 2.04 -0.85 -0.89 117.51 118.28 3fk7 h ILE 134 Ca 0.01 -0.17 -0.03 0.00 1.00 0.00 0.00 64.86 65.68 3fk7 h ILE 134 Cb 0.16 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 3fk7 h ILE 134 CO -0.00 0.08 0.20 -0.07 0.00 0.00 0.00 178.15 178.35 3fk7 h LEU 135 N 0.33 0.68 -0.51 1.44 3.38 -0.80 0.57 115.31 120.39 3fk7 h LEU 135 Ca 0.09 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 3fk7 h LEU 135 Cb -0.01 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 3fk7 h LEU 135 CO -0.02 0.62 0.20 0.00 0.09 0.00 0.00 178.44 179.33 3fk7 h ALA 136 N 1.48 0.66 -0.44 1.53 0.00 -0.39 0.28 119.26 122.39 3fk7 h ALA 136 Ca 0.18 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 3fk7 h ALA 136 Cb 0.16 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3fk7 h ALA 136 CO -0.02 0.28 0.15 0.28 0.00 0.00 0.00 179.25 179.95 3fk7 h VAL 137 N 0.69 1.22 -0.44 0.00 2.07 -0.70 -1.22 116.25 117.87 3fk7 h VAL 137 Ca 0.17 -0.70 -0.03 0.00 0.82 0.00 0.00 66.70 66.95 3fk7 h VAL 137 Cb 0.21 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 3fk7 h VAL 137 CO -0.01 0.25 0.14 0.40 0.02 0.00 0.00 177.57 178.37 3fk7 h ILE 138 N 0.57 1.22 -0.41 4.57 2.04 -0.64 -1.76 117.51 123.10 3fk7 h ILE 138 Ca 0.14 -0.72 -0.08 0.00 1.00 0.00 0.00 64.86 65.21 3fk7 h ILE 138 Cb 0.24 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 3fk7 h ILE 138 CO -0.01 0.26 -0.05 0.45 0.00 0.00 0.00 178.15 178.80 3fk7 h HIS 139 N 0.56 0.84 -0.54 1.37 3.86 -0.38 -0.54 115.15 120.32 3fk7 h HIS 139 Ca 0.14 -0.16 0.04 0.00 -1.16 0.00 0.00 60.37 59.23 3fk7 h HIS 139 Cb 0.26 -0.21 -0.05 0.00 1.06 0.00 0.00 27.41 28.47 3fk7 h HIS 139 CO 0.01 0.86 0.28 0.35 0.86 0.00 0.00 177.93 180.29 3fk7 h PHE 140 N 0.58 0.52 -0.11 2.45 3.57 -1.18 -1.08 116.94 121.69 3fk7 h PHE 140 Ca 0.11 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 3fk7 h PHE 140 Cb 0.55 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 39.13 3fk7 h PHE 140 CO 0.04 0.26 0.01 1.15 -2.23 0.00 0.00 178.31 177.55 3fk7 h THR 141 N 0.55 1.22 -0.25 4.41 2.02 -1.22 -0.15 112.91 119.50 3fk7 h THR 141 Ca 0.24 -0.70 0.05 0.00 0.77 0.00 0.00 66.41 66.76 3fk7 h THR 141 Cb 0.13 1.48 -0.05 0.00 -1.74 0.00 0.00 68.15 67.97 3fk7 h THR 141 CO -0.15 0.20 -0.06 -0.07 0.37 0.00 0.00 175.52 175.81 3fk7 h LEU 142 N -0.05 -0.23 -0.78 2.58 3.38 -0.93 -1.14 115.31 118.14 3fk7 h LEU 142 Ca 0.03 0.07 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 3fk7 h LEU 142 Cb 0.30 0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 3fk7 h LEU 142 CO 0.00 -0.08 0.15 1.23 0.09 0.00 0.00 178.44 179.83 3fk7 h GLY 143 N -0.00 1.15 0.92 0.83 0.00 -1.12 -0.54 103.07 104.30 3fk7 h GLY 143 Ca 0.12 -0.72 -0.02 0.00 0.00 0.00 0.00 47.33 46.71 3fk7 h GLY 143 CO -0.26 0.67 0.12 0.00 0.00 0.00 0.00 176.54 177.08 3fk7 h ALA 144 N 1.14 0.40 -0.24 3.60 0.00 -0.71 -1.39 119.26 122.07 3fk7 h ALA 144 Ca 0.21 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 3fk7 h ALA 144 Cb 0.37 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 3fk7 h ALA 144 CO 0.00 -0.00 -0.25 0.28 0.00 0.00 0.00 179.25 179.28 3fk7 h VAL 145 N 0.35 1.32 -0.26 0.00 2.07 -1.15 -2.20 116.25 116.37 3fk7 h VAL 145 Ca 0.10 -1.42 -0.03 0.00 0.82 0.00 0.00 66.70 66.18 3fk7 h VAL 145 Cb 0.18 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 3fk7 h VAL 145 CO -0.01 0.44 0.04 -0.07 0.02 0.00 0.00 177.57 177.99 3fk7 h LEU 146 N 0.30 0.35 -0.02 2.57 3.38 -1.01 0.55 115.31 121.42 3fk7 h LEU 146 Ca 0.04 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3fk7 h LEU 146 Cb 0.81 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 3fk7 h LEU 146 CO 0.06 0.38 -0.01 -0.33 0.09 0.00 0.00 178.44 178.63 3fk7 h GLU 147 N 0.38 0.04 0.56 1.13 4.39 -1.20 -1.63 114.58 118.24 3fk7 h GLU 147 Ca 0.09 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.75 3fk7 h GLU 147 Cb 0.20 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 3fk7 h GLU 147 CO 0.00 0.47 -0.49 0.37 -1.16 0.00 0.00 179.01 178.20 3fk7 h GLN 148 N -0.39 -0.99 -0.85 2.33 4.15 -1.02 0.00 115.11 118.33 3fk7 h GLN 148 Ca 0.00 0.07 0.16 0.00 0.77 0.00 0.00 58.65 59.65 3fk7 h GLN 148 Cb 0.46 0.23 -0.10 0.00 0.21 0.00 0.00 27.48 28.28 3fk7 h GLN 148 CO 0.00 -0.66 0.43 1.96 -1.93 0.00 0.00 178.83 178.63 3fk7 h GLN 149 N -1.03 0.57 0.02 1.69 4.20 0.01 -2.24 115.11 118.33 3fk7 h GLN 149 Ca -0.07 -0.03 -0.21 0.00 0.06 0.00 0.00 58.65 58.40 3fk7 h GLN 149 Cb 0.88 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 3fk7 h GLN 149 CO -0.02 0.37 -0.93 1.49 -0.67 0.00 0.00 178.83 179.07 3fk7 h GLU 150 N 0.58 0.17 -0.40 1.46 4.57 -1.15 -2.93 114.58 116.89 3fk7 h GLU 150 Ca 0.48 -0.21 -0.12 0.00 -1.18 0.00 0.00 59.36 58.33 3fk7 h GLU 150 Cb 0.71 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.36 3fk7 h GLU 150 CO -0.39 0.98 -0.22 1.25 -1.18 0.00 0.00 179.01 179.45 3fk7 h HIS 151 N 0.09 0.98 -0.11 0.92 2.76 -0.42 -1.11 115.15 118.26 3fk7 h HIS 151 Ca -0.05 -0.25 -0.01 0.00 -2.20 0.00 0.00 60.37 57.86 3fk7 h HIS 151 Cb 1.58 -0.22 -0.00 0.00 1.55 0.00 0.00 27.41 30.31 3fk7 h HIS 151 CO 0.03 1.03 0.02 1.79 -1.30 0.00 0.00 177.93 179.49 3fk7 h THR 152 N 0.66 1.22 -0.89 6.26 1.35 -1.50 -2.42 112.91 117.58 3fk7 h THR 152 Ca 0.09 -0.68 0.20 0.00 -0.55 0.00 0.00 66.41 65.47 3fk7 h THR 152 Cb 0.78 1.45 -0.12 0.00 -1.73 0.00 0.00 68.15 68.54 3fk7 h THR 152 CO 0.06 0.20 0.42 0.00 -0.25 0.00 0.00 175.52 175.95 3fk7 h ALA 153 N 0.79 1.42 0.00 6.62 0.00 -1.46 -2.69 119.26 123.94 3fk7 h ALA 153 Ca 0.03 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3fk7 h ALA 153 Cb 0.29 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3fk7 h ALA 153 CO 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 179.25 178.98 3fk7 h ALA 154 N 1.67 1.00 0.00 0.00 0.00 -0.71 -3.14 119.26 118.08 3fk7 h ALA 154 Ca 0.54 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.39 3fk7 h ALA 154 Cb 0.96 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3fk7 h ALA 154 CO -0.48 0.00 -0.27 -0.07 0.00 0.00 0.00 179.25 178.43 3fk7 h LEU 155 N 0.00 0.00 -1.43 0.00 3.38 -1.23 -0.70 115.31 115.33 3fk7 h LEU 155 Ca 0.00 0.00 0.23 0.00 0.09 0.00 0.00 57.88 58.20 3fk7 h LEU 155 Cb 0.69 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.36 3fk7 h LEU 155 CO 0.00 0.27 0.63 0.74 0.09 0.00 0.00 178.44 180.17 3fk7 h THR 156 N 0.00 0.62 0.00 0.22 2.02 -1.69 -3.22 112.91 110.86 3fk7 h THR 156 Ca -0.00 -0.14 -0.26 0.00 0.77 0.00 0.00 66.41 66.77 3fk7 h THR 156 Cb 0.72 0.16 -0.05 0.00 -1.74 0.00 0.00 68.15 67.25 3fk7 h THR 156 CO 0.03 0.08 -1.99 0.47 0.37 0.00 0.00 175.52 174.48 3fk7 n ASP 157 N -4.56 1.75 -4.78 4.18 8.00 -0.78 -5.02 116.55 115.33 3fk7 n ASP 157 Ca 0.22 -0.02 -0.38 0.00 0.71 0.00 0.00 54.79 55.31 3fk7 n ASP 157 Cb 0.77 0.58 -0.06 0.00 -0.02 0.00 0.00 41.12 42.38 3fk7 n ASP 157 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3fk7 s ARG 158 N -2.35 4.51 0.00 -1.24 0.52 -0.34 -5.17 118.95 114.89 3fk7 s ARG 158 Ca -0.11 1.13 0.00 0.00 -0.52 0.00 0.00 55.73 56.23 3fk7 s ARG 158 Cb 0.05 -3.11 0.00 0.00 0.52 0.00 0.00 34.95 32.40 3fk7 s ARG 158 CO 0.55 0.49 0.00 -0.35 0.02 0.00 0.00 175.30 176.01 3fk7 n PRO 159 N 1.25 0.00 0.00 3.54 -0.04 -1.26 -4.83 135.00 133.66 3fk7 n PRO 159 Ca -0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 3fk7 n PRO 159 Cb 0.49 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.95 3fk7 n PRO 159 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 3fk7 n ASN 165 N 0.00 0.00 -4.68 3.54 4.05 -1.26 -5.12 115.26 111.79 3fk7 n ASN 165 Ca 0.00 0.00 -0.23 0.00 0.45 0.00 0.00 54.58 54.80 3fk7 n ASN 165 Cb 0.00 0.00 -0.07 0.00 1.23 0.00 0.00 39.78 40.94 3fk7 n ASN 165 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 3fk7 s LEU 166 N 0.00 3.20 0.46 1.20 1.43 -1.26 -5.11 118.68 118.60 3fk7 s LEU 166 Ca 0.00 -0.75 -0.24 0.00 -1.03 0.00 0.00 54.13 52.11 3fk7 s LEU 166 Cb 0.00 -1.68 -0.07 0.00 0.03 0.00 0.00 46.19 44.47 3fk7 s LEU 166 CO 0.00 -0.17 1.31 -2.84 0.23 0.00 0.00 176.35 174.89 3fk7 s PRO 167 N -3.76 3.68 0.23 1.29 0.02 -1.26 -4.83 135.00 130.36 3fk7 s PRO 167 Ca 0.35 2.15 -0.08 0.00 0.02 0.00 0.00 61.00 63.44 3fk7 s PRO 167 Cb -0.04 -2.55 0.25 0.00 0.02 0.00 0.00 34.50 32.18 3fk7 s PRO 167 CO 0.21 -0.73 1.87 -1.00 -0.33 0.00 0.00 177.00 177.02 3fk7 h PRO 168 N 2.20 1.01 -0.01 5.54 0.13 -1.99 0.18 132.00 139.06 3fk7 h PRO 168 Ca -0.50 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 64.56 3fk7 h PRO 168 Cb 1.26 -0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.17 3fk7 h PRO 168 CO 0.61 0.67 -0.02 -0.07 -0.23 0.00 0.00 178.00 178.95 3fk7 h LEU 169 N 1.04 0.04 -0.98 1.56 3.38 -1.99 -2.13 115.31 116.23 3fk7 h LEU 169 Ca 0.33 -0.62 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 3fk7 h LEU 169 Cb 0.01 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 3fk7 h LEU 169 CO -0.11 0.65 0.40 0.25 0.09 0.00 0.00 178.44 179.71 3fk7 h LEU 170 N -0.57 1.02 -0.48 1.67 5.85 -1.94 0.32 115.31 121.17 3fk7 h LEU 170 Ca -0.00 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 3fk7 h LEU 170 Cb 0.64 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 3fk7 h LEU 170 CO 0.01 0.84 0.29 -0.09 -0.34 0.00 0.00 178.44 179.15 3fk7 h ARG 171 N 1.12 0.65 -0.56 1.25 2.43 -0.98 -0.95 114.38 117.34 3fk7 h ARG 171 Ca 0.28 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.31 3fk7 h ARG 171 Cb 0.08 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.47 3fk7 h ARG 171 CO -0.04 0.48 0.04 1.49 -1.51 0.00 0.00 179.97 180.42 3fk7 h GLU 172 N 0.65 0.94 -0.09 0.20 4.81 -0.65 -2.35 114.58 118.08 3fk7 h GLU 172 Ca 0.17 -0.26 -0.00 0.00 -0.13 0.00 0.00 59.36 59.15 3fk7 h GLU 172 Cb -0.01 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.26 3fk7 h GLU 172 CO -0.03 0.91 0.06 0.00 -0.73 0.00 0.00 179.01 179.21 3fk7 h ALA 173 N 1.16 0.12 -0.88 2.92 0.00 0.08 -1.38 119.26 121.27 3fk7 h ALA 173 Ca 0.17 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 3fk7 h ALA 173 Cb 0.46 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 3fk7 h ALA 173 CO 0.02 -0.37 0.48 -0.07 0.00 0.00 0.00 179.25 179.31 3fk7 h LEU 174 N 0.09 1.10 -0.96 0.00 3.38 -1.08 -0.93 115.31 116.92 3fk7 h LEU 174 Ca 0.03 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 3fk7 h LEU 174 Cb 0.03 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 3fk7 h LEU 174 CO -0.01 0.89 0.22 1.56 0.09 0.00 0.00 178.44 181.19 3fk7 h GLN 175 N 1.23 0.97 -0.27 1.13 4.20 -1.17 -1.09 115.11 120.11 3fk7 h GLN 175 Ca 0.31 -0.18 -0.03 0.00 0.06 0.00 0.00 58.65 58.81 3fk7 h GLN 175 Cb 0.03 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.64 3fk7 h GLN 175 CO -0.05 0.82 0.05 0.82 -0.67 0.00 0.00 178.83 179.80 3fk7 h ILE 176 N 0.94 1.23 -0.35 2.54 2.04 -0.50 -2.62 117.51 120.79 3fk7 h ILE 176 Ca 0.21 -0.77 -0.10 0.00 1.00 0.00 0.00 64.86 65.21 3fk7 h ILE 176 Cb 0.25 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 3fk7 h ILE 176 CO -0.01 0.25 -0.21 0.24 0.00 0.00 0.00 178.15 178.42 3fk7 h MET 177 N 0.27 0.67 0.00 2.37 2.86 -1.02 -2.85 114.93 117.23 3fk7 h MET 177 Ca 0.08 -0.25 0.00 0.00 -2.06 0.00 0.00 59.70 57.47 3fk7 h MET 177 Cb 0.32 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.94 3fk7 h MET 177 CO 0.00 0.83 0.00 -0.25 1.06 0.00 0.00 176.91 178.55 3fk7 n ASP 178 N -4.13 0.00 0.12 1.22 8.00 -0.43 -3.87 116.55 117.46 3fk7 n ASP 178 Ca 0.00 0.30 0.03 0.00 0.71 0.00 0.00 54.79 55.83 3fk7 n ASP 178 Cb 0.41 -0.43 0.41 0.00 -0.02 0.00 0.00 41.12 41.49 3fk7 n ASP 178 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 3fk7 h SER 179 N 0.00 0.23 -0.79 -2.24 0.87 -1.21 -3.46 113.55 106.95 3fk7 h SER 179 Ca 0.00 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 3fk7 h SER 179 Cb 0.38 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 3fk7 h SER 179 CO 0.00 0.36 0.00 -0.90 -0.53 0.00 0.00 176.83 175.76 3fk7 n ASP 180 N -4.31 0.00 -0.93 6.23 5.68 -1.25 -5.03 116.55 116.94 3fk7 n ASP 180 Ca -0.01 -0.44 0.03 0.00 -0.50 0.00 0.00 54.79 53.88 3fk7 n ASP 180 Cb 0.24 0.00 0.15 0.00 -1.14 0.00 0.00 41.12 40.37 3fk7 n ASP 180 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 3fk7 n ASP 181 N -1.15 2.55 0.00 -1.12 5.75 -1.26 -4.79 116.55 116.53 3fk7 n ASP 181 Ca 0.00 -2.28 0.00 0.00 -0.01 0.00 0.00 54.79 52.50 3fk7 n ASP 181 Cb 0.00 -0.49 0.00 0.00 -1.03 0.00 0.00 41.12 39.60 3fk7 n ASP 181 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fk7 n GLY 182 N 0.40 0.47 0.12 6.12 0.00 -1.26 -4.92 105.19 106.13 3fk7 n GLY 182 Ca 0.11 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.02 3fk7 n GLY 182 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3fk7 h GLU 183 N 4.63 0.32 -0.40 1.61 4.81 -1.95 -0.80 114.58 122.81 3fk7 h GLU 183 Ca 0.00 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.08 3fk7 h GLU 183 Cb 0.00 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 3fk7 h GLU 183 CO 0.00 0.37 -0.14 0.37 -0.73 0.00 0.00 179.01 178.88 3fk7 h GLN 184 N 0.20 0.72 -0.48 1.92 4.15 -1.97 0.29 115.11 119.92 3fk7 h GLN 184 Ca 0.07 -0.24 -0.07 0.00 0.77 0.00 0.00 58.65 59.18 3fk7 h GLN 184 Cb 0.17 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 3fk7 h GLN 184 CO -0.01 0.82 0.04 0.00 -1.93 0.00 0.00 178.83 177.75 3fk7 h ALA 185 N 1.20 0.65 0.23 3.38 0.00 -1.91 -2.14 119.26 120.67 3fk7 h ALA 185 Ca 0.11 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3fk7 h ALA 185 Cb 0.60 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 3fk7 h ALA 185 CO 0.04 0.42 -0.21 0.35 0.00 0.00 0.00 179.25 179.85 3fk7 h PHE 186 N 0.69 -0.56 -0.60 0.00 3.57 -0.79 -2.30 116.94 116.95 3fk7 h PHE 186 Ca 0.14 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.64 3fk7 h PHE 186 Cb 0.46 0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.38 3fk7 h PHE 186 CO 0.03 -0.32 0.37 -0.07 -2.23 0.00 0.00 178.31 176.10 3fk7 h LEU 187 N -0.47 0.70 -0.01 0.59 3.38 -0.83 0.31 115.31 118.98 3fk7 h LEU 187 Ca -0.01 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 3fk7 h LEU 187 Cb 0.43 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 3fk7 h LEU 187 CO -0.04 0.53 0.01 -0.74 0.09 0.00 0.00 178.44 178.29 3fk7 h HIS 188 N 0.82 0.01 -0.27 1.13 2.76 -1.19 -1.09 115.15 117.32 3fk7 h HIS 188 Ca 0.22 -0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.33 3fk7 h HIS 188 Cb -0.05 -0.00 -0.02 0.00 1.55 0.00 0.00 27.41 28.89 3fk7 h HIS 188 CO 0.00 0.07 -0.07 0.78 -1.30 0.00 0.00 177.93 177.41 3fk7 h GLY 189 N -0.05 0.46 0.85 5.26 0.00 -0.97 -1.63 103.07 106.99 3fk7 h GLY 189 Ca 0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 47.33 47.01 3fk7 h GLY 189 CO -0.00 0.27 0.00 -2.00 0.00 0.00 0.00 176.54 174.81 3fk7 h LEU 190 N 0.41 0.42 -1.10 3.11 5.85 -0.80 -1.67 115.31 121.52 3fk7 h LEU 190 Ca 0.08 -0.31 -0.03 0.00 0.84 0.00 0.00 57.88 58.46 3fk7 h LEU 190 Cb 0.39 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 3fk7 h LEU 190 CO 0.02 0.62 0.26 -0.33 -0.34 0.00 0.00 178.44 178.67 3fk7 h GLU 191 N 0.20 0.90 -0.49 1.25 4.39 -1.06 -1.70 114.58 118.06 3fk7 h GLU 191 Ca 0.07 -0.14 -0.02 0.00 0.34 0.00 0.00 59.36 59.61 3fk7 h GLU 191 Cb 0.41 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.88 3fk7 h GLU 191 CO 0.01 0.73 0.23 0.77 -1.16 0.00 0.00 179.01 179.58 3fk7 h SER 192 N 0.89 0.66 -0.02 1.42 0.02 -1.16 0.22 113.55 115.57 3fk7 h SER 192 Ca 0.21 -0.14 0.03 0.00 -0.84 0.00 0.00 61.79 61.05 3fk7 h SER 192 Cb 0.16 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.49 3fk7 h SER 192 CO -0.02 0.62 -0.16 -0.07 -1.14 0.00 0.00 176.83 176.06 3fk7 h LEU 193 N 0.65 -0.46 -0.09 5.07 3.38 -1.04 -0.40 115.31 122.43 3fk7 h LEU 193 Ca 0.17 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.21 3fk7 h LEU 193 Cb 0.14 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3fk7 h LEU 193 CO -0.02 -0.21 0.04 0.40 0.09 0.00 0.00 178.44 178.73 3fk7 h ILE 194 N -0.25 0.99 -0.73 1.22 2.04 -1.00 -0.54 117.51 119.25 3fk7 h ILE 194 Ca 0.06 -0.03 0.07 0.00 1.00 0.00 0.00 64.86 65.96 3fk7 h ILE 194 Cb 0.33 0.90 -0.05 0.00 -0.74 0.00 0.00 36.82 37.26 3fk7 h ILE 194 CO -0.17 0.02 0.48 0.03 0.00 0.00 0.00 178.15 178.51 3fk7 h ARG 195 N 0.09 0.72 -0.46 2.37 3.08 -0.45 -0.97 114.38 118.75 3fk7 h ARG 195 Ca 0.04 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 3fk7 h ARG 195 Cb 0.01 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 3fk7 h ARG 195 CO -0.03 0.48 -0.13 0.78 -1.07 0.00 0.00 179.97 180.00 3fk7 h GLY 196 N 0.74 0.98 0.92 0.04 0.00 -0.48 -2.43 103.07 102.84 3fk7 h GLY 196 Ca 0.32 -0.82 0.02 0.00 0.00 0.00 0.00 47.33 46.85 3fk7 h GLY 196 CO -0.11 0.75 0.28 0.74 0.00 0.00 0.00 176.54 178.20 3fk7 h PHE 197 N 0.74 0.53 -0.35 5.60 0.04 -0.31 -1.87 116.94 121.33 3fk7 h PHE 197 Ca 0.12 0.02 0.05 0.00 2.80 0.00 0.00 57.97 60.95 3fk7 h PHE 197 Cb 0.68 -0.17 -0.05 0.00 2.20 0.00 0.00 35.95 38.61 3fk7 h PHE 197 CO 0.05 0.32 0.05 0.93 -0.60 0.00 0.00 178.31 179.06 3fk7 h GLU 198 N 0.57 0.16 -0.46 1.51 5.08 -1.15 0.14 114.58 120.44 3fk7 h GLU 198 Ca 0.18 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.57 3fk7 h GLU 198 Cb -0.01 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.16 3fk7 h GLU 198 CO -0.07 0.11 0.22 0.28 -1.00 0.00 0.00 179.01 178.54 3fk7 h VAL 199 N 0.17 0.95 -0.32 3.13 2.07 -1.33 -1.27 116.25 119.65 3fk7 h VAL 199 Ca 0.16 -0.15 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 3fk7 h VAL 199 Cb 0.20 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 3fk7 h VAL 199 CO -0.23 0.08 0.07 1.56 0.02 0.00 0.00 177.57 179.07 3fk7 h GLN 200 N 0.44 0.51 -0.78 1.57 4.20 -0.89 0.80 115.11 120.95 3fk7 h GLN 200 Ca 0.20 -0.13 -0.02 0.00 0.06 0.00 0.00 58.65 58.77 3fk7 h GLN 200 Cb 0.12 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.80 3fk7 h GLN 200 CO -0.15 0.58 0.42 1.25 -0.67 0.00 0.00 178.83 180.26 3fk7 h LEU 201 N 0.36 0.98 -0.29 1.46 5.85 -0.88 -1.81 115.31 120.98 3fk7 h LEU 201 Ca 0.10 -0.09 -0.13 0.00 0.84 0.00 0.00 57.88 58.60 3fk7 h LEU 201 Cb 0.30 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.08 3fk7 h LEU 201 CO 0.00 0.80 -0.33 0.74 -0.34 0.00 0.00 178.44 179.31 3fk7 h THR 202 N 1.10 1.30 -0.24 1.05 2.02 -1.04 -3.24 112.91 113.85 3fk7 h THR 202 Ca 0.28 -1.50 0.06 0.00 0.77 0.00 0.00 66.41 66.01 3fk7 h THR 202 Cb 0.04 1.60 -0.07 0.00 -1.74 0.00 0.00 68.15 67.98 3fk7 h THR 202 CO -0.04 0.48 -0.27 0.00 0.37 0.00 0.00 175.52 176.06 3fk7 h ALA 203 N 0.70 -0.18 -0.67 6.16 0.00 -0.44 -2.79 119.26 122.03 3fk7 h ALA 203 Ca 0.04 0.07 0.09 0.00 0.00 0.00 0.00 54.91 55.11 3fk7 h ALA 203 Cb 0.91 0.55 -0.07 0.00 0.00 0.00 0.00 17.79 19.18 3fk7 h ALA 203 CO 0.08 -0.70 0.31 -0.07 0.00 0.00 0.00 179.25 178.87 3fk7 h LEU 204 N -0.28 0.39 0.00 0.00 3.38 -1.38 -3.51 115.31 113.91 3fk7 h LEU 204 Ca 0.13 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3fk7 h LEU 204 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 3fk7 h LEU 204 CO -0.40 0.22 0.00 0.18 0.09 0.00 0.00 178.44 178.53