#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fv5 n LEU 16 N 0.00 2.32 -0.36 0.99 4.77 -1.26 -4.47 117.00 118.99 3fv5 n LEU 16 Ca 0.00 -0.91 -0.02 0.00 -0.03 0.00 0.00 56.01 55.05 3fv5 n LEU 16 Cb 0.00 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.21 3fv5 n LEU 16 CO 0.00 0.41 1.28 -0.33 -1.33 0.00 0.00 177.39 177.43 3fv5 h GLU 17 N 3.19 1.29 -0.18 3.23 5.08 -1.97 -2.11 114.58 123.11 3fv5 h GLU 17 Ca 0.00 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 3fv5 h GLU 17 Cb 0.75 -0.29 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 3fv5 h GLU 17 CO 0.00 0.86 0.03 -1.00 -1.00 0.00 0.00 179.01 177.90 3fv5 h PRO 18 N 1.33 0.26 -0.53 2.33 0.13 -2.00 0.71 132.00 134.23 3fv5 h PRO 18 Ca 0.36 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 65.36 3fv5 h PRO 18 Cb -0.14 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 30.92 3fv5 h PRO 18 CO -0.08 0.26 -0.02 0.28 -0.23 0.00 0.00 178.00 178.21 3fv5 h VAL 19 N 0.26 1.27 0.00 1.56 2.07 -1.69 -2.11 116.25 117.61 3fv5 h VAL 19 Ca 0.06 -1.14 -0.07 0.00 0.82 0.00 0.00 66.70 66.37 3fv5 h VAL 19 Cb 0.13 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 3fv5 h VAL 19 CO -0.00 0.40 -0.36 0.03 0.02 0.00 0.00 177.57 177.67 3fv5 h ARG 20 N 0.82 0.00 -0.04 1.57 3.08 -0.75 -1.52 114.38 117.55 3fv5 h ARG 20 Ca 0.15 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.96 3fv5 h ARG 20 Cb 0.56 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.62 3fv5 h ARG 20 CO 0.03 0.36 -0.93 0.00 -1.07 0.00 0.00 179.97 178.36 3fv5 h ARG 21 N 0.00 0.59 -2.04 0.04 3.08 -0.72 -3.39 114.38 111.95 3fv5 h ARG 21 Ca -0.00 -0.59 -0.57 0.00 0.07 0.00 0.00 59.98 58.89 3fv5 h ARG 21 Cb 0.78 0.16 -0.40 0.00 0.08 0.00 0.00 29.97 30.59 3fv5 h ARG 21 CO 0.05 1.20 -1.02 0.54 -1.07 0.00 0.00 179.97 179.67 3fv5 n ARG 22 N -3.83 1.03 -0.02 0.04 1.74 -0.81 -4.97 116.66 109.84 3fv5 n ARG 22 Ca -0.08 -3.48 0.09 0.00 -0.77 0.00 0.00 57.85 53.61 3fv5 n ARG 22 Cb 0.82 -1.40 0.49 0.00 -1.02 0.00 0.00 32.46 31.36 3fv5 n ARG 22 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3fv5 h PRO 23 N 4.04 0.40 0.00 5.56 0.13 -1.47 -1.29 132.00 139.36 3fv5 h PRO 23 Ca 0.09 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 3fv5 h PRO 23 Cb 0.84 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.88 3fv5 h PRO 23 CO 0.53 0.26 0.00 0.41 -0.23 0.00 0.00 178.00 178.97 3fv5 n GLY 24 N -1.51 -0.97 0.00 1.56 0.00 -1.26 -0.59 105.19 102.43 3fv5 n GLY 24 Ca 0.06 0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.25 3fv5 n GLY 24 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3fv5 n MET 25 N -1.80 0.00 0.00 1.61 2.81 -0.49 -4.21 117.12 115.05 3fv5 n MET 25 Ca 0.02 -0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.91 3fv5 n MET 25 Cb 0.14 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.15 3fv5 n MET 25 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 3fv5 n TYR 26 N -1.50 0.00 -3.94 2.03 4.01 0.25 -5.10 117.16 112.90 3fv5 n TYR 26 Ca 0.07 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.72 3fv5 n TYR 26 Cb 0.34 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.33 3fv5 n TYR 26 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 3fv5 s THR 27 N -1.50 0.00 -0.38 -0.72 -1.32 -0.24 -5.07 115.64 106.40 3fv5 s THR 27 Ca 0.00 -1.24 -0.29 0.00 -1.21 0.00 0.00 61.69 58.95 3fv5 s THR 27 Cb 0.00 -2.13 0.02 0.00 -1.51 0.00 0.00 72.50 68.88 3fv5 s THR 27 CO 0.00 0.00 1.20 -0.62 -2.21 0.00 0.00 174.62 172.99 3fv5 s ASP 28 N -2.98 6.69 0.00 8.08 2.15 -1.26 -4.33 116.67 125.01 3fv5 s ASP 28 Ca 0.18 0.86 0.16 0.00 0.43 0.00 0.00 52.55 54.18 3fv5 s ASP 28 Cb -0.03 -2.54 0.53 0.00 -0.30 0.00 0.00 42.92 40.58 3fv5 s ASP 28 CO 0.08 -1.13 1.41 0.35 -0.17 0.00 0.00 175.17 175.71 3fv5 n THR 29 N 6.45 0.36 -0.11 1.71 -2.24 -1.26 -3.88 114.28 115.31 3fv5 n THR 29 Ca 0.13 -0.44 -0.09 0.00 -2.27 0.00 0.00 64.05 61.38 3fv5 n THR 29 Cb 0.48 0.33 -0.02 0.00 -2.10 0.00 0.00 70.33 69.02 3fv5 n THR 29 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3fv5 h THR 30 N 2.27 1.17 -3.39 4.28 2.02 -1.90 0.15 112.91 117.49 3fv5 h THR 30 Ca 0.00 -0.49 -0.03 0.00 0.77 0.00 0.00 66.41 66.65 3fv5 h THR 30 Cb 0.51 0.87 -0.11 0.00 -1.74 0.00 0.00 68.15 67.68 3fv5 h THR 30 CO 0.00 0.18 -0.03 -0.13 0.37 0.00 0.00 175.52 175.91 3fv5 s ARG 31 N -5.66 1.34 0.00 6.66 0.52 -1.25 -1.66 118.95 118.90 3fv5 s ARG 31 Ca -0.13 -0.91 0.08 0.00 -0.52 0.00 0.00 55.73 54.25 3fv5 s ARG 31 Cb 0.09 0.50 0.47 0.00 0.52 0.00 0.00 34.95 36.53 3fv5 s ARG 31 CO 0.73 -0.56 1.15 -0.35 0.02 0.00 0.00 175.30 176.30 3fv5 n PRO 32 N -0.32 0.82 -0.29 3.54 -0.04 -1.26 -4.18 135.00 133.28 3fv5 n PRO 32 Ca -0.10 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.42 3fv5 n PRO 32 Cb 0.63 -1.15 0.20 0.00 -0.04 0.00 0.00 33.50 33.14 3fv5 n PRO 32 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 3fv5 h ASN 33 N 0.00 0.53 -0.07 3.54 2.35 -1.88 -0.31 115.58 119.74 3fv5 h ASN 33 Ca 0.00 0.08 -0.05 0.00 -0.55 0.00 0.00 56.30 55.78 3fv5 h ASN 33 Cb 0.00 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 3fv5 h ASN 33 CO 0.00 0.25 -0.09 -0.74 -1.65 0.00 0.00 177.43 175.20 3fv5 h HIS 34 N 0.64 0.36 -0.40 1.19 2.76 -1.84 0.60 115.15 118.45 3fv5 h HIS 34 Ca 0.44 -0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.57 3fv5 h HIS 34 Cb 0.57 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 29.41 3fv5 h HIS 34 CO -0.09 0.44 0.27 -0.07 -1.30 0.00 0.00 177.93 177.17 3fv5 h LEU 35 N 0.33 0.46 -0.86 0.26 4.07 -1.38 -1.85 115.31 116.35 3fv5 h LEU 35 Ca 0.07 -0.01 0.06 0.00 0.08 0.00 0.00 57.88 58.08 3fv5 h LEU 35 Cb 0.37 -0.12 -0.06 0.00 1.08 0.00 0.00 40.66 41.93 3fv5 h LEU 35 CO 0.02 0.34 0.53 1.23 -1.08 0.00 0.00 178.44 179.48 3fv5 h GLY 36 N 0.55 1.29 1.39 0.83 0.00 -0.29 -2.28 103.07 104.57 3fv5 h GLY 36 Ca 0.15 -0.38 -0.05 0.00 0.00 0.00 0.00 47.33 47.05 3fv5 h GLY 36 CO -0.03 0.26 0.11 1.46 0.00 0.00 0.00 176.54 178.33 3fv5 h GLN 37 N 0.96 0.76 -0.46 4.80 1.08 -0.43 -0.18 115.11 121.64 3fv5 h GLN 37 Ca 0.37 -0.15 -0.05 0.00 -1.45 0.00 0.00 58.65 57.37 3fv5 h GLN 37 Cb 0.18 -0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 27.47 3fv5 h GLN 37 CO -0.18 0.70 0.09 0.93 -0.95 0.00 0.00 178.83 179.42 3fv5 h GLU 38 N 0.73 0.76 -0.15 1.46 5.08 -0.77 0.34 114.58 122.03 3fv5 h GLU 38 Ca 0.16 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 3fv5 h GLU 38 Cb 0.30 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 3fv5 h GLU 38 CO 0.00 0.77 -0.01 0.28 -1.00 0.00 0.00 179.01 179.05 3fv5 h VAL 39 N 0.63 1.26 -0.67 3.13 2.07 -1.21 -2.78 116.25 118.68 3fv5 h VAL 39 Ca 0.14 -0.87 0.10 0.00 0.82 0.00 0.00 66.70 66.89 3fv5 h VAL 39 Cb 0.37 1.55 -0.08 0.00 -1.52 0.00 0.00 31.29 31.61 3fv5 h VAL 39 CO 0.01 0.26 0.28 0.40 0.02 0.00 0.00 177.57 178.54 3fv5 h ILE 40 N -0.00 0.77 -0.91 4.57 2.04 -0.86 -1.79 117.51 121.32 3fv5 h ILE 40 Ca 0.04 -0.16 0.10 0.00 1.00 0.00 0.00 64.86 65.84 3fv5 h ILE 40 Cb 0.39 0.25 -0.08 0.00 -0.74 0.00 0.00 36.82 36.65 3fv5 h ILE 40 CO 0.01 0.09 0.55 0.44 0.00 0.00 0.00 178.15 179.24 3fv5 h ASP 41 N 0.48 0.82 -0.35 1.72 3.32 -0.16 0.14 116.42 122.38 3fv5 h ASP 41 Ca 0.34 0.04 -0.13 0.00 0.02 0.00 0.00 57.03 57.31 3fv5 h ASP 41 Cb 0.43 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 3fv5 h ASP 41 CO -0.32 0.46 -0.26 0.78 -1.72 0.00 0.00 179.24 178.19 3fv5 h ASN 42 N 0.92 0.89 -0.27 6.45 2.35 -1.07 0.61 115.58 125.46 3fv5 h ASN 42 Ca 0.44 -0.35 -0.02 0.00 -0.55 0.00 0.00 56.30 55.82 3fv5 h ASN 42 Cb 0.38 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 3fv5 h ASN 42 CO -0.24 1.10 0.08 0.28 -1.65 0.00 0.00 177.43 176.99 3fv5 h SER 43 N 0.74 0.40 -0.82 5.81 0.02 -0.79 -2.89 113.55 116.03 3fv5 h SER 43 Ca 0.09 -0.22 0.02 0.00 -0.84 0.00 0.00 61.79 60.85 3fv5 h SER 43 Cb 0.81 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 63.20 3fv5 h SER 43 CO 0.07 0.51 0.54 0.58 -1.14 0.00 0.00 176.83 177.39 3fv5 h VAL 44 N 0.27 1.16 -0.97 2.27 2.07 -0.47 -1.53 116.25 119.06 3fv5 h VAL 44 Ca 0.09 -0.36 0.04 0.00 0.82 0.00 0.00 66.70 67.29 3fv5 h VAL 44 Cb 0.26 0.02 -0.06 0.00 -1.52 0.00 0.00 31.29 30.00 3fv5 h VAL 44 CO -0.00 0.19 0.63 0.44 0.02 0.00 0.00 177.57 178.85 3fv5 h ASP 45 N 1.05 1.04 -0.04 0.57 3.32 -0.73 0.29 116.42 121.92 3fv5 h ASP 45 Ca 0.31 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.31 3fv5 h ASP 45 Cb -0.03 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.28 3fv5 h ASP 45 CO -0.08 0.70 -0.09 -0.33 -1.72 0.00 0.00 179.24 177.72 3fv5 h GLU 46 N 1.21 0.30 -0.10 3.56 4.39 -1.09 0.08 114.58 122.93 3fv5 h GLU 46 Ca 0.39 -0.06 -0.10 0.00 0.34 0.00 0.00 59.36 59.93 3fv5 h GLU 46 Cb 0.03 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 3fv5 h GLU 46 CO -0.13 0.40 -0.34 0.00 -1.16 0.00 0.00 179.01 177.78 3fv5 h ALA 47 N 1.63 0.17 -0.24 3.43 0.00 -0.58 -1.01 119.26 122.66 3fv5 h ALA 47 Ca 0.06 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 3fv5 h ALA 47 Cb 0.34 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3fv5 h ALA 47 CO 0.02 0.24 0.09 -0.07 0.00 0.00 0.00 179.25 179.52 3fv5 h LEU 48 N -0.04 0.29 0.00 0.00 3.38 -0.23 -0.49 115.31 118.23 3fv5 h LEU 48 Ca -0.01 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3fv5 h LEU 48 Cb 0.97 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.65 3fv5 h LEU 48 CO 0.07 0.28 0.00 0.00 0.09 0.00 0.00 178.44 178.88 3fv5 n ALA 49 N -2.50 2.10 -0.26 1.53 0.00 -0.01 -4.89 120.51 116.49 3fv5 n ALA 49 Ca 0.01 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3fv5 n ALA 49 Cb 0.13 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.21 3fv5 n ALA 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fv5 n GLY 50 N 0.79 0.86 0.11 0.00 0.00 -0.19 -4.97 105.19 101.79 3fv5 n GLY 50 Ca 0.08 -0.07 -0.15 0.00 0.00 0.00 0.00 46.02 45.89 3fv5 n GLY 50 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3fv5 n HIS 51 N -2.26 0.00 -3.49 1.61 8.25 -0.43 -4.95 115.22 113.96 3fv5 n HIS 51 Ca 0.00 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.08 3fv5 n HIS 51 Cb 0.00 -0.83 -0.06 0.00 1.12 0.00 0.00 29.99 30.22 3fv5 n HIS 51 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3fv5 s ALA 52 N -2.43 3.65 -0.40 -1.41 0.00 -0.94 -4.45 121.76 115.78 3fv5 s ALA 52 Ca -0.28 -0.26 0.09 0.00 0.00 0.00 0.00 51.96 51.51 3fv5 s ALA 52 Cb 0.07 -2.42 -0.10 0.00 0.00 0.00 0.00 23.12 20.68 3fv5 s ALA 52 CO 0.51 0.35 0.36 1.63 0.00 0.00 0.00 175.76 178.62 3fv5 n LYS 53 N 2.38 4.06 -3.76 0.00 5.02 -1.26 -4.41 118.16 120.19 3fv5 n LYS 53 Ca -0.13 -0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.04 3fv5 n LYS 53 Cb 0.52 -0.92 -0.12 0.00 -0.02 0.00 0.00 35.03 34.50 3fv5 n LYS 53 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 3fv5 s ARG 54 N -1.83 0.29 -0.13 1.97 3.52 -1.26 -1.15 118.95 120.36 3fv5 s ARG 54 Ca 0.03 0.43 -0.00 0.00 -0.13 0.00 0.00 55.73 56.06 3fv5 s ARG 54 Cb 0.07 0.08 0.02 0.00 -1.56 0.00 0.00 34.95 33.56 3fv5 s ARG 54 CO 0.36 -0.07 -0.11 0.08 -0.81 0.00 0.00 175.30 174.74 3fv5 s VAL 55 N 0.48 1.30 -0.12 7.11 1.01 0.17 -2.79 120.40 127.56 3fv5 s VAL 55 Ca -0.03 -0.46 -0.01 0.00 0.00 0.00 0.00 61.98 61.48 3fv5 s VAL 55 Cb -0.04 -1.26 -0.02 0.00 0.00 0.00 0.00 36.38 35.05 3fv5 s VAL 55 CO -0.02 0.41 -0.07 -1.81 0.00 0.00 0.00 175.10 173.60 3fv5 s ASP 56 N 1.60 4.51 -0.07 3.32 1.11 0.45 -1.34 116.67 126.25 3fv5 s ASP 56 Ca 0.05 -0.16 0.05 0.00 0.18 0.00 0.00 52.55 52.66 3fv5 s ASP 56 Cb -0.13 -1.56 -0.01 0.00 1.07 0.00 0.00 42.92 42.29 3fv5 s ASP 56 CO -0.09 0.22 -0.21 -0.69 1.18 0.00 0.00 175.17 175.58 3fv5 s VAL 57 N 0.04 2.45 -0.11 -1.27 1.01 -0.18 -0.62 120.40 121.72 3fv5 s VAL 57 Ca -0.02 -0.92 -0.00 0.00 0.00 0.00 0.00 61.98 61.04 3fv5 s VAL 57 Cb -0.14 -1.93 0.02 0.00 0.00 0.00 0.00 36.38 34.33 3fv5 s VAL 57 CO 0.03 0.57 -0.08 -0.63 0.00 0.00 0.00 175.10 174.99 3fv5 s ILE 58 N -0.21 1.03 -0.40 2.22 1.01 0.65 -0.83 121.20 124.68 3fv5 s ILE 58 Ca -0.01 -0.30 -0.19 0.00 0.00 0.00 0.00 60.65 60.14 3fv5 s ILE 58 Cb -0.13 -1.04 0.01 0.00 0.01 0.00 0.00 42.46 41.31 3fv5 s ILE 58 CO 0.03 0.37 0.56 -0.22 0.00 0.00 0.00 174.94 175.68 3fv5 s LEU 59 N 1.62 4.49 0.54 2.97 2.96 0.03 -0.98 118.68 130.31 3fv5 s LEU 59 Ca 0.03 -0.25 -0.07 0.00 -0.22 0.00 0.00 54.13 53.62 3fv5 s LEU 59 Cb -0.13 -2.62 -0.04 0.00 0.50 0.00 0.00 46.19 43.91 3fv5 s LEU 59 CO -0.07 -0.62 0.88 -1.00 -1.32 0.00 0.00 176.35 174.21 3fv5 s HIS 60 N 2.53 3.58 0.54 5.38 3.76 -0.46 -0.80 115.29 129.82 3fv5 s HIS 60 Ca 0.19 0.98 0.20 0.00 -0.15 0.00 0.00 55.06 56.28 3fv5 s HIS 60 Cb -0.15 -2.47 1.41 0.00 1.11 0.00 0.00 32.58 32.48 3fv5 s HIS 60 CO 0.16 -0.45 2.17 0.00 -0.85 0.00 0.00 174.74 175.77 3fv5 h ALA 61 N 0.01 1.91 -0.25 -1.40 0.00 -1.88 0.01 119.26 117.67 3fv5 h ALA 61 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3fv5 h ALA 61 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3fv5 h ALA 61 CO 0.62 -0.03 0.00 -0.40 0.00 0.00 0.00 179.25 179.43 3fv5 n ASP 62 N -4.36 2.11 -0.77 0.00 5.68 -1.26 -4.88 116.55 113.06 3fv5 n ASP 62 Ca -0.02 -2.17 -0.10 0.00 -0.50 0.00 0.00 54.79 52.00 3fv5 n ASP 62 Cb 0.11 -0.37 -0.04 0.00 -1.14 0.00 0.00 41.12 39.68 3fv5 n ASP 62 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3fv5 n GLN 63 N 0.28 -1.07 -2.62 0.11 1.13 -0.01 -5.02 117.38 110.18 3fv5 n GLN 63 Ca 0.10 0.81 -0.31 0.00 -1.94 0.00 0.00 57.00 55.66 3fv5 n GLN 63 Cb 0.41 -4.87 -0.03 0.00 0.11 0.00 0.00 30.24 25.86 3fv5 n GLN 63 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 3fv5 s SER 64 N -2.62 6.52 -0.03 1.08 1.04 -1.26 -4.70 113.70 113.75 3fv5 s SER 64 Ca 0.00 1.29 0.07 0.00 0.48 0.00 0.00 55.95 57.79 3fv5 s SER 64 Cb 0.00 -2.39 -0.02 0.00 0.10 0.00 0.00 66.02 63.70 3fv5 s SER 64 CO 0.00 -0.50 -0.22 -0.22 0.98 0.00 0.00 173.24 173.27 3fv5 s LEU 65 N -4.06 2.28 -0.08 2.42 2.96 -0.67 -1.36 118.68 120.18 3fv5 s LEU 65 Ca 0.54 -0.38 0.03 0.00 -0.22 0.00 0.00 54.13 54.10 3fv5 s LEU 65 Cb -0.10 -1.41 0.01 0.00 0.50 0.00 0.00 46.19 45.18 3fv5 s LEU 65 CO 0.33 0.33 -0.17 -0.70 -1.32 0.00 0.00 176.35 174.82 3fv5 s GLU 66 N -0.66 2.23 -0.08 1.98 2.12 -0.15 -1.17 118.70 122.97 3fv5 s GLU 66 Ca 0.11 -0.62 0.03 0.00 0.36 0.00 0.00 54.97 54.85 3fv5 s GLU 66 Cb -0.10 -1.77 0.01 0.00 0.26 0.00 0.00 34.13 32.52 3fv5 s GLU 66 CO -0.00 0.12 -0.17 0.08 -0.54 0.00 0.00 175.26 174.74 3fv5 s VAL 67 N 0.45 1.53 -0.03 3.70 1.01 0.11 -0.25 120.40 126.91 3fv5 s VAL 67 Ca -0.15 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.14 3fv5 s VAL 67 Cb -0.16 -1.35 0.01 0.00 0.00 0.00 0.00 36.38 34.88 3fv5 s VAL 67 CO 0.06 0.44 -0.09 -0.63 0.00 0.00 0.00 175.10 174.88 3fv5 s ILE 68 N 0.49 0.77 0.20 2.22 1.01 0.21 -0.73 121.20 125.38 3fv5 s ILE 68 Ca -0.16 -0.34 0.07 0.00 0.00 0.00 0.00 60.65 60.23 3fv5 s ILE 68 Cb -0.16 -0.70 -0.05 0.00 0.01 0.00 0.00 42.46 41.56 3fv5 s ILE 68 CO 0.06 0.25 -0.12 1.51 0.00 0.00 0.00 174.94 176.63 3fv5 s ASP 69 N 0.32 2.44 -0.59 3.58 1.47 -0.20 -0.42 116.67 123.27 3fv5 s ASP 69 Ca -0.05 -1.04 -0.00 0.00 1.18 0.00 0.00 52.55 52.63 3fv5 s ASP 69 Cb -0.10 -0.11 0.45 0.00 -0.34 0.00 0.00 42.92 42.82 3fv5 s ASP 69 CO 0.01 -0.23 1.87 -0.90 0.68 0.00 0.00 175.17 176.60 3fv5 n ASP 70 N -0.37 7.14 -2.79 2.11 5.75 -1.12 -1.55 116.55 125.73 3fv5 n ASP 70 Ca -0.08 -3.78 0.00 0.00 -0.01 0.00 0.00 54.79 50.92 3fv5 n ASP 70 Cb 0.61 -0.85 0.00 0.00 -1.03 0.00 0.00 41.12 39.85 3fv5 n ASP 70 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fv5 n GLY 71 N -0.88 0.29 0.17 6.12 0.00 -1.25 -4.53 105.19 105.11 3fv5 n GLY 71 Ca 0.59 -1.58 0.13 0.00 0.00 0.00 0.00 46.02 45.16 3fv5 n GLY 71 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3fv5 h ARG 72 N 0.00 0.00 0.00 1.61 3.08 -1.87 -2.17 114.38 115.03 3fv5 h ARG 72 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3fv5 h ARG 72 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3fv5 h ARG 72 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 3fv5 n GLY 73 N 0.65 -1.16 3.63 0.04 0.00 -1.26 -4.44 105.19 102.64 3fv5 n GLY 73 Ca 0.03 -1.17 -0.42 0.00 0.00 0.00 0.00 46.02 44.46 3fv5 n GLY 73 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3fv5 n MET 74 N 0.84 1.52 -1.87 1.61 2.81 -1.26 -4.89 117.12 115.88 3fv5 n MET 74 Ca 0.00 0.54 -0.42 0.00 -1.81 0.00 0.00 57.70 56.01 3fv5 n MET 74 Cb 0.00 -2.07 -0.02 0.00 -0.71 0.00 0.00 33.22 30.42 3fv5 n MET 74 CO 0.00 0.00 0.00 -2.14 1.51 0.00 0.00 175.97 175.34 3fv5 s PRO 75 N -1.90 4.18 0.00 0.03 0.02 -1.26 -4.91 135.00 131.16 3fv5 s PRO 75 Ca 0.61 2.46 0.04 0.00 0.02 0.00 0.00 61.00 64.13 3fv5 s PRO 75 Cb -0.59 -3.07 -0.03 0.00 0.02 0.00 0.00 34.50 30.84 3fv5 s PRO 75 CO 0.58 -0.56 0.30 1.33 -0.33 0.00 0.00 177.00 178.32 3fv5 n VAL 76 N 2.47 0.00 -1.59 3.83 0.24 -1.26 -0.92 118.33 121.10 3fv5 n VAL 76 Ca 0.09 -0.42 -0.31 0.00 -2.04 0.00 0.00 64.34 61.65 3fv5 n VAL 76 Cb 0.38 1.02 0.05 0.00 -1.47 0.00 0.00 33.84 33.83 3fv5 n VAL 76 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 3fv5 s ASP 77 N -1.17 5.25 -0.26 -1.34 -0.00 -1.26 -4.21 116.67 113.68 3fv5 s ASP 77 Ca 0.03 1.71 -0.19 0.00 -0.00 0.00 0.00 52.55 54.09 3fv5 s ASP 77 Cb 0.03 -2.51 -0.02 0.00 -0.00 0.00 0.00 42.92 40.42 3fv5 s ASP 77 CO 0.15 -1.53 0.59 -0.63 -0.00 0.00 0.00 175.17 173.75 3fv5 s ILE 78 N -2.89 5.01 0.31 0.77 1.01 -1.26 -1.25 121.20 122.90 3fv5 s ILE 78 Ca 0.60 1.04 -0.19 0.00 0.00 0.00 0.00 60.65 62.11 3fv5 s ILE 78 Cb -0.15 -3.90 -0.09 0.00 0.01 0.00 0.00 42.46 38.33 3fv5 s ILE 78 CO 0.52 0.05 0.79 -2.28 0.00 0.00 0.00 174.94 174.01 3fv5 s HIS 79 N 2.43 3.49 0.28 3.97 5.65 -1.26 -4.99 115.29 124.86 3fv5 s HIS 79 Ca 0.24 1.39 -0.30 0.00 0.25 0.00 0.00 55.06 56.65 3fv5 s HIS 79 Cb -0.16 -2.65 -0.13 0.00 -1.18 0.00 0.00 32.58 28.47 3fv5 s HIS 79 CO 0.09 0.15 1.44 -2.30 -0.65 0.00 0.00 174.74 173.47 3fv5 n PRO 80 N 0.04 2.27 0.00 2.88 -0.02 -1.26 -1.16 135.00 137.75 3fv5 n PRO 80 Ca 0.02 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 3fv5 n PRO 80 Cb 0.52 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 3fv5 n PRO 80 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3fv5 n GLU 81 N 1.69 0.00 -3.32 -0.52 1.02 -1.26 -5.04 120.64 113.21 3fv5 n GLU 81 Ca 0.09 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 56.89 3fv5 n GLU 81 Cb 0.34 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.70 3fv5 n GLU 81 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3fv5 s GLU 82 N 0.00 3.95 0.00 3.49 0.41 -0.31 -4.98 118.70 121.25 3fv5 s GLU 82 Ca 0.00 0.48 0.16 0.00 -0.41 0.00 0.00 54.97 55.20 3fv5 s GLU 82 Cb 0.00 -2.77 0.42 0.00 -1.78 0.00 0.00 34.13 30.00 3fv5 s GLU 82 CO 0.00 0.38 1.34 0.41 -0.49 0.00 0.00 175.26 176.89 3fv5 n GLY 83 N 0.34 2.40 3.00 -1.39 0.00 -1.26 -4.47 105.19 103.81 3fv5 n GLY 83 Ca -0.02 -0.55 -0.12 0.00 0.00 0.00 0.00 46.02 45.34 3fv5 n GLY 83 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fv5 s VAL 84 N -1.04 0.31 0.37 1.61 0.11 -1.26 -5.09 120.40 115.41 3fv5 s VAL 84 Ca 0.33 -0.79 -0.27 0.00 -2.93 0.00 0.00 61.98 58.32 3fv5 s VAL 84 Cb 0.17 -0.38 -0.11 0.00 -1.53 0.00 0.00 36.38 34.53 3fv5 s VAL 84 CO 0.23 -0.32 1.33 -2.65 -3.33 0.00 0.00 175.10 170.36 3fv5 n PRO 85 N 1.89 2.20 -0.20 1.54 -0.02 -1.26 -4.51 135.00 134.63 3fv5 n PRO 85 Ca -0.21 0.77 0.01 0.00 -2.02 0.00 0.00 63.50 62.06 3fv5 n PRO 85 Cb 0.56 -2.43 0.10 0.00 -0.02 0.00 0.00 33.50 31.71 3fv5 n PRO 85 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3fv5 h ALA 86 N 2.50 0.61 -0.77 3.55 0.00 -1.32 -0.05 119.26 123.77 3fv5 h ALA 86 Ca -0.48 0.18 0.10 0.00 0.00 0.00 0.00 54.91 54.72 3fv5 h ALA 86 Cb 1.28 0.32 -0.05 0.00 0.00 0.00 0.00 17.79 19.33 3fv5 h ALA 86 CO 0.62 -0.39 0.51 -0.24 0.00 0.00 0.00 179.25 179.75 3fv5 h VAL 87 N 0.13 0.93 -0.45 0.00 3.04 -1.32 0.17 116.25 118.74 3fv5 h VAL 87 Ca 0.32 -0.23 -0.12 0.00 -1.01 0.00 0.00 66.70 65.66 3fv5 h VAL 87 Cb 0.52 0.20 -0.01 0.00 -2.01 0.00 0.00 31.29 29.98 3fv5 h VAL 87 CO -0.52 0.12 -0.20 -0.08 -1.01 0.00 0.00 177.57 175.89 3fv5 h GLU 88 N 0.67 0.90 -0.43 4.17 4.81 -1.32 -1.80 114.58 121.59 3fv5 h GLU 88 Ca 0.36 -0.36 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 3fv5 h GLU 88 Cb 0.50 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 3fv5 h GLU 88 CO -0.13 1.02 -0.00 -0.07 -0.73 0.00 0.00 179.01 179.09 3fv5 h LEU 89 N 0.79 0.75 -1.09 1.64 -0.00 -0.77 -0.42 115.31 116.21 3fv5 h LEU 89 Ca 0.11 -0.31 0.04 0.00 -0.00 0.00 0.00 57.88 57.73 3fv5 h LEU 89 Cb 0.74 -0.20 -0.06 0.00 -0.00 0.00 0.00 40.66 41.15 3fv5 h LEU 89 CO 0.06 0.87 0.62 0.40 -0.00 0.00 0.00 178.44 180.39 3fv5 h ILE 90 N 0.60 1.14 0.00 1.22 2.04 -0.87 0.23 117.51 121.88 3fv5 h ILE 90 Ca 0.12 -0.40 -0.19 0.00 1.00 0.00 0.00 64.86 65.39 3fv5 h ILE 90 Cb 0.49 -0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.42 3fv5 h ILE 90 CO 0.02 0.21 -0.94 -0.07 0.00 0.00 0.00 178.15 177.37 3fv5 h LEU 91 N 1.16 0.00 0.00 1.44 -0.00 -1.07 -3.34 115.31 113.50 3fv5 h LEU 91 Ca 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.26 3fv5 h LEU 91 Cb 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.72 3fv5 h LEU 91 CO -0.13 0.87 -0.64 0.00 -0.00 0.00 0.00 178.44 178.54 3fv5 s ARG 93 N -1.96 4.09 -0.60 0.00 3.52 0.78 -4.70 118.95 120.08 3fv5 s ARG 93 Ca 0.01 -0.02 -0.26 0.00 -0.13 0.00 0.00 55.73 55.34 3fv5 s ARG 93 Cb 0.06 -3.58 0.04 0.00 -1.56 0.00 0.00 34.95 29.91 3fv5 s ARG 93 CO 0.32 -0.08 1.07 -1.17 -0.81 0.00 0.00 175.30 174.63 3fv5 s LEU 94 N 1.46 3.81 0.00 -0.88 2.96 -1.26 -4.71 118.68 120.06 3fv5 s LEU 94 Ca 0.14 -0.32 0.00 0.00 -0.22 0.00 0.00 54.13 53.72 3fv5 s LEU 94 Cb -0.15 -2.83 0.00 0.00 0.50 0.00 0.00 46.19 43.71 3fv5 s LEU 94 CO 0.08 -1.42 0.00 0.00 -1.32 0.00 0.00 176.35 173.68 3fv5 n ILE 116 N 6.32 0.00 0.23 6.68 3.06 -1.26 -5.05 119.36 129.34 3fv5 n ILE 116 Ca 0.03 0.00 0.09 0.00 -2.50 0.00 0.00 62.75 60.37 3fv5 n ILE 116 Cb 0.48 0.00 0.54 0.00 0.54 0.00 0.00 39.64 41.19 3fv5 n ILE 116 CO 0.00 0.00 0.00 0.77 -2.50 0.00 0.00 176.55 174.82 3fv5 h SER 117 N 0.00 0.00 -0.21 9.51 4.64 -1.72 -2.15 113.55 123.62 3fv5 h SER 117 Ca 0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 3fv5 h SER 117 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 3fv5 h SER 117 CO 0.00 0.23 -0.31 0.58 -0.87 0.00 0.00 176.83 176.46 3fv5 h VAL 118 N 0.00 1.28 -0.55 0.95 2.07 -1.93 -1.22 116.25 116.86 3fv5 h VAL 118 Ca -0.00 -1.45 -0.01 0.00 0.82 0.00 0.00 66.70 66.07 3fv5 h VAL 118 Cb 0.59 1.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.69 3fv5 h VAL 118 CO 0.03 0.47 0.32 0.58 0.02 0.00 0.00 177.57 178.99 3fv5 h VAL 119 N 0.61 1.17 -0.35 2.57 2.07 -1.76 -2.18 116.25 118.37 3fv5 h VAL 119 Ca 0.07 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 3fv5 h VAL 119 Cb 0.83 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 3fv5 h VAL 119 CO 0.07 0.18 0.18 -1.13 0.02 0.00 0.00 177.57 176.88 3fv5 h ASN 120 N 0.73 0.45 -0.84 0.57 -1.24 -1.26 -2.57 115.58 111.43 3fv5 h ASN 120 Ca 0.19 -0.11 0.04 0.00 0.71 0.00 0.00 56.30 57.13 3fv5 h ASN 120 Cb 0.00 -0.12 -0.05 0.00 0.73 0.00 0.00 38.32 38.89 3fv5 h ASN 120 CO -0.04 0.43 0.55 0.00 -1.29 0.00 0.00 177.43 177.09 3fv5 h ALA 121 N 1.04 1.50 -0.63 1.57 0.00 -0.93 -2.68 119.26 119.11 3fv5 h ALA 121 Ca 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3fv5 h ALA 121 Cb 0.09 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3fv5 h ALA 121 CO -0.02 0.41 0.00 1.28 0.00 0.00 0.00 179.25 180.93 3fv5 n LEU 122 N -4.45 4.80 -4.47 0.00 4.32 -0.85 -4.32 117.00 112.04 3fv5 n LEU 122 Ca 0.11 -2.49 -0.33 0.00 -0.02 0.00 0.00 56.01 53.29 3fv5 n LEU 122 Cb 0.12 -0.58 -0.13 0.00 -1.62 0.00 0.00 43.42 41.21 3fv5 n LEU 122 CO 0.35 0.80 -0.45 -0.44 -1.22 0.00 0.00 177.39 176.43 3fv5 s SER 123 N -0.93 4.06 0.41 -1.43 0.01 -0.99 -1.25 113.70 113.58 3fv5 s SER 123 Ca 0.51 -0.21 0.12 0.00 1.31 0.00 0.00 55.95 57.68 3fv5 s SER 123 Cb 0.33 -0.99 0.86 0.00 0.21 0.00 0.00 66.02 66.44 3fv5 s SER 123 CO 0.24 0.32 1.93 0.11 0.41 0.00 0.00 173.24 176.24 3fv5 h LYS 124 N 5.55 0.09 -2.33 12.44 1.57 -0.77 -1.87 116.57 131.26 3fv5 h LYS 124 Ca -0.43 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.25 3fv5 h LYS 124 Cb 1.16 -0.01 -0.21 0.00 0.08 0.00 0.00 32.23 33.25 3fv5 h LYS 124 CO 0.51 0.30 -0.00 0.50 -0.57 0.00 0.00 179.45 180.18 3fv5 s ARG 125 N -4.57 0.77 -0.04 3.15 3.52 -1.23 -2.92 118.95 117.63 3fv5 s ARG 125 Ca -0.04 0.56 0.01 0.00 -0.13 0.00 0.00 55.73 56.13 3fv5 s ARG 125 Cb 0.15 0.37 0.02 0.00 -1.56 0.00 0.00 34.95 33.93 3fv5 s ARG 125 CO 0.72 -0.15 -0.05 0.08 -0.81 0.00 0.00 175.30 175.08 3fv5 s VAL 126 N -0.25 0.57 -0.16 7.11 1.01 0.05 -0.67 120.40 128.05 3fv5 s VAL 126 Ca -0.04 -0.15 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 3fv5 s VAL 126 Cb -0.03 -0.58 -0.01 0.00 0.00 0.00 0.00 36.38 35.76 3fv5 s VAL 126 CO 0.03 0.23 -0.12 -1.61 0.00 0.00 0.00 175.10 173.63 3fv5 s GLU 127 N 0.85 3.30 -0.14 2.72 2.02 0.47 -0.68 118.70 127.24 3fv5 s GLU 127 Ca -0.12 -0.70 0.01 0.00 0.02 0.00 0.00 54.97 54.18 3fv5 s GLU 127 Cb -0.14 -2.71 -0.01 0.00 0.10 0.00 0.00 34.13 31.37 3fv5 s GLU 127 CO 0.01 0.02 -0.16 0.08 0.02 0.00 0.00 175.26 175.23 3fv5 s VAL 128 N 0.83 2.69 -0.06 2.63 1.01 -0.22 -1.02 120.40 126.26 3fv5 s VAL 128 Ca -0.04 -0.78 0.04 0.00 0.00 0.00 0.00 61.98 61.20 3fv5 s VAL 128 Cb -0.15 -2.12 0.00 0.00 0.00 0.00 0.00 36.38 34.11 3fv5 s VAL 128 CO 0.00 0.52 -0.17 0.20 0.00 0.00 0.00 175.10 175.66 3fv5 s ASN 129 N 0.59 2.21 -0.04 3.32 0.01 -0.31 -1.62 114.94 119.11 3fv5 s ASN 129 Ca -0.09 -0.37 0.04 0.00 -0.71 0.00 0.00 52.86 51.72 3fv5 s ASN 129 Cb -0.16 -0.77 -0.00 0.00 0.41 0.00 0.00 41.25 40.73 3fv5 s ASN 129 CO 0.03 0.13 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.92 3fv5 s VAL 130 N 0.23 1.19 -0.25 1.60 1.01 -0.15 -0.31 120.40 123.72 3fv5 s VAL 130 Ca -0.09 -0.58 -0.06 0.00 0.00 0.00 0.00 61.98 61.25 3fv5 s VAL 130 Cb -0.14 -1.04 -0.01 0.00 0.00 0.00 0.00 36.38 35.20 3fv5 s VAL 130 CO 0.04 0.35 0.03 -0.13 0.00 0.00 0.00 175.10 175.39 3fv5 s ARG 131 N 0.12 3.40 -0.09 2.72 0.52 -0.40 0.09 118.95 125.32 3fv5 s ARG 131 Ca -0.04 -0.63 -0.18 0.00 -0.52 0.00 0.00 55.73 54.35 3fv5 s ARG 131 Cb -0.11 -3.22 0.04 0.00 0.52 0.00 0.00 34.95 32.18 3fv5 s ARG 131 CO 0.02 -0.26 0.44 1.03 0.02 0.00 0.00 175.30 176.55 3fv5 s ARG 132 N 1.53 0.68 -1.40 3.54 0.52 -0.74 -1.61 118.95 121.48 3fv5 s ARG 132 Ca 0.05 0.25 -0.04 0.00 -0.52 0.00 0.00 55.73 55.47 3fv5 s ARG 132 Cb -0.15 0.32 0.02 0.00 0.52 0.00 0.00 34.95 35.66 3fv5 s ARG 132 CO 0.01 -0.16 0.31 -0.25 0.02 0.00 0.00 175.30 175.23 3fv5 n ASP 133 N 1.87 -4.92 -0.10 0.23 8.00 -1.26 -0.68 116.55 119.69 3fv5 n ASP 133 Ca -0.18 -0.14 -0.01 0.00 0.71 0.00 0.00 54.79 55.17 3fv5 n ASP 133 Cb 0.56 -4.06 -0.01 0.00 -0.02 0.00 0.00 41.12 37.60 3fv5 n ASP 133 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3fv5 n GLY 134 N -1.16 0.45 3.31 0.44 0.00 -1.26 -5.00 105.19 101.96 3fv5 n GLY 134 Ca -0.12 -0.14 -0.26 0.00 0.00 0.00 0.00 46.02 45.50 3fv5 n GLY 134 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fv5 s GLN 135 N -1.05 1.26 -0.22 1.61 -0.21 0.15 -1.05 119.66 120.15 3fv5 s GLN 135 Ca 0.00 -1.17 -0.09 0.00 0.02 0.00 0.00 55.36 54.13 3fv5 s GLN 135 Cb 0.00 -1.55 -0.04 0.00 1.00 0.00 0.00 33.01 32.42 3fv5 s GLN 135 CO 0.00 0.37 0.11 0.08 -2.12 0.00 0.00 175.29 173.73 3fv5 s VAL 136 N -1.06 4.91 -0.02 1.09 1.01 0.32 -1.79 120.40 124.87 3fv5 s VAL 136 Ca 0.09 0.02 0.04 0.00 0.00 0.00 0.00 61.98 62.13 3fv5 s VAL 136 Cb -0.10 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 3fv5 s VAL 136 CO 0.04 0.38 -0.12 -0.31 0.00 0.00 0.00 175.10 175.08 3fv5 s TYR 137 N 0.99 2.74 0.05 5.22 1.51 0.11 -0.77 117.35 127.21 3fv5 s TYR 137 Ca 0.05 -0.13 0.06 0.00 -1.01 0.00 0.00 57.07 56.04 3fv5 s TYR 137 Cb -0.14 -1.60 -0.03 0.00 -0.11 0.00 0.00 41.96 40.09 3fv5 s TYR 137 CO 0.03 0.26 -0.16 1.21 -1.11 0.00 0.00 175.55 175.78 3fv5 s ASN 138 N -1.04 1.92 -0.03 2.29 2.47 -0.02 -0.97 114.94 119.56 3fv5 s ASN 138 Ca 0.14 -0.53 -0.25 0.00 0.42 0.00 0.00 52.86 52.64 3fv5 s ASN 138 Cb -0.11 -0.12 0.05 0.00 -1.45 0.00 0.00 41.25 39.63 3fv5 s ASN 138 CO 0.03 0.04 0.54 -0.51 -3.72 0.00 0.00 177.10 173.48 3fv5 s ILE 139 N -0.96 0.02 0.00 -5.21 2.07 -0.64 -0.81 121.20 115.69 3fv5 s ILE 139 Ca 0.03 -0.18 -0.12 0.00 -1.41 0.00 0.00 60.65 58.96 3fv5 s ILE 139 Cb -0.09 -0.87 0.02 0.00 0.13 0.00 0.00 42.46 41.65 3fv5 s ILE 139 CO 0.02 -0.10 0.26 0.00 -1.91 0.00 0.00 174.94 173.20 3fv5 s ALA 140 N -1.38 -0.61 0.08 1.50 0.00 -1.15 -1.06 121.76 119.15 3fv5 s ALA 140 Ca -0.11 0.10 0.04 0.00 0.00 0.00 0.00 51.96 51.99 3fv5 s ALA 140 Cb -0.02 0.14 -0.03 0.00 0.00 0.00 0.00 23.12 23.21 3fv5 s ALA 140 CO 0.07 -0.28 -0.11 -0.06 0.00 0.00 0.00 175.76 175.38 3fv5 s PHE 141 N -1.67 1.04 -0.02 0.00 0.40 0.14 -1.08 117.98 116.79 3fv5 s PHE 141 Ca -0.12 -0.59 0.00 0.00 -0.60 0.00 0.00 56.93 55.63 3fv5 s PHE 141 Cb -0.05 -0.58 0.03 0.00 0.51 0.00 0.00 43.02 42.93 3fv5 s PHE 141 CO 0.02 0.00 0.02 -1.21 0.70 0.00 0.00 175.22 174.74 3fv5 s GLU 142 N -2.38 0.10 -1.64 0.44 2.02 0.96 -0.77 118.70 117.44 3fv5 s GLU 142 Ca 0.02 0.13 -0.01 0.00 0.02 0.00 0.00 54.97 55.13 3fv5 s GLU 142 Cb -0.05 -0.32 0.00 0.00 0.10 0.00 0.00 34.13 33.85 3fv5 s GLU 142 CO 0.01 -0.14 0.08 0.09 0.02 0.00 0.00 175.26 175.32 3fv5 n ASN 143 N 4.08 -5.59 0.00 -0.19 3.02 -0.70 -1.51 115.26 114.37 3fv5 n ASN 143 Ca -0.27 -0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.26 3fv5 n ASN 143 Cb 0.51 -4.65 0.00 0.00 -0.61 0.00 0.00 39.78 35.03 3fv5 n ASN 143 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3fv5 n GLY 144 N -1.05 0.81 3.40 7.41 0.00 -1.13 -4.91 105.19 109.73 3fv5 n GLY 144 Ca -0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.50 3fv5 n GLY 144 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fv5 s GLU 145 N -0.27 2.11 0.18 1.61 2.02 -0.57 -4.85 118.70 118.93 3fv5 s GLU 145 Ca 0.00 -0.94 -0.31 0.00 0.02 0.00 0.00 54.97 53.74 3fv5 s GLU 145 Cb 0.00 -2.15 -0.09 0.00 0.10 0.00 0.00 34.13 31.99 3fv5 s GLU 145 CO 0.00 0.56 1.46 0.21 0.02 0.00 0.00 175.26 177.51 3fv5 s LYS 146 N -1.06 4.27 -0.00 1.61 2.20 -1.26 -0.02 119.74 125.48 3fv5 s LYS 146 Ca 0.12 2.24 0.03 0.00 -0.36 0.00 0.00 55.97 58.00 3fv5 s LYS 146 Cb -0.10 -3.17 -0.04 0.00 -1.51 0.00 0.00 37.83 33.01 3fv5 s LYS 146 CO 0.02 -0.48 0.12 1.33 -0.36 0.00 0.00 175.35 175.98 3fv5 n VAL 147 N 3.41 0.00 -3.77 4.02 0.24 -0.24 -4.84 118.33 117.15 3fv5 n VAL 147 Ca 0.11 -0.36 -0.22 0.00 -2.04 0.00 0.00 64.34 61.83 3fv5 n VAL 147 Cb 0.40 0.90 -0.18 0.00 -1.47 0.00 0.00 33.84 33.49 3fv5 n VAL 147 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3fv5 s GLN 148 N -1.45 0.40 0.56 7.34 2.00 -0.89 -4.98 119.66 122.65 3fv5 s GLN 148 Ca 0.01 0.18 -0.20 0.00 -2.00 0.00 0.00 55.36 53.34 3fv5 s GLN 148 Cb 0.02 -0.80 -0.04 0.00 0.80 0.00 0.00 33.01 32.99 3fv5 s GLN 148 CO 0.12 -0.29 1.29 -0.51 -0.50 0.00 0.00 175.29 175.40 3fv5 s ASP 149 N 1.92 5.24 0.01 6.67 1.01 -1.26 -2.92 116.67 127.34 3fv5 s ASP 149 Ca 0.03 2.59 -0.38 0.00 0.71 0.00 0.00 52.55 55.51 3fv5 s ASP 149 Cb -0.12 -2.62 -0.17 0.00 1.01 0.00 0.00 42.92 41.02 3fv5 s ASP 149 CO -0.04 -1.58 1.36 -0.11 0.21 0.00 0.00 175.17 175.01 3fv5 n LEU 150 N -1.25 1.50 -3.81 1.23 7.94 -1.26 -4.63 117.00 116.72 3fv5 n LEU 150 Ca 0.12 1.12 -0.13 0.00 -1.11 0.00 0.00 56.01 56.01 3fv5 n LEU 150 Cb 0.47 -1.14 -0.14 0.00 0.53 0.00 0.00 43.42 43.14 3fv5 n LEU 150 CO 0.49 -1.08 -0.30 0.00 -1.11 0.00 0.00 177.39 175.39 3fv5 s GLN 151 N 0.88 0.04 -0.19 1.96 -2.07 0.01 -4.97 119.66 115.32 3fv5 s GLN 151 Ca 0.88 0.16 -0.29 0.00 -1.82 0.00 0.00 55.36 54.28 3fv5 s GLN 151 Cb -1.03 -0.09 -0.00 0.00 -1.09 0.00 0.00 33.01 30.80 3fv5 s GLN 151 CO 0.51 -0.08 1.16 0.08 -1.32 0.00 0.00 175.29 175.65 3fv5 s VAL 152 N 0.53 4.45 0.00 3.63 1.01 -1.26 -0.84 120.40 127.92 3fv5 s VAL 152 Ca -0.04 1.76 0.00 0.00 0.00 0.00 0.00 61.98 63.70 3fv5 s VAL 152 Cb -0.06 -4.13 0.00 0.00 0.00 0.00 0.00 36.38 32.19 3fv5 s VAL 152 CO -0.02 -0.15 0.54 1.33 0.00 0.00 0.00 175.10 176.81 3fv5 n VAL 153 N 5.30 0.18 -3.87 2.92 0.24 0.05 -4.99 118.33 118.17 3fv5 n VAL 153 Ca 0.13 -0.53 0.02 0.00 -2.04 0.00 0.00 64.34 61.92 3fv5 n VAL 153 Cb 0.45 1.01 0.01 0.00 -1.47 0.00 0.00 33.84 33.84 3fv5 n VAL 153 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3fv5 s GLY 154 N -0.18 -0.20 0.12 7.63 0.00 -1.18 -4.96 107.32 108.55 3fv5 s GLY 154 Ca 0.00 0.22 0.06 0.00 0.00 0.00 0.00 44.72 44.99 3fv5 s GLY 154 CO 0.00 3.72 -0.14 -0.51 0.00 0.00 0.00 173.10 176.17 3fv5 s THR 155 N -2.15 1.33 0.28 0.90 -4.23 -1.26 -0.52 115.64 109.99 3fv5 s THR 155 Ca 0.24 -1.72 -0.09 0.00 -1.18 0.00 0.00 61.69 58.94 3fv5 s THR 155 Cb 0.01 -1.54 -0.00 0.00 1.34 0.00 0.00 72.50 72.31 3fv5 s THR 155 CO -0.01 -0.42 0.46 0.00 -0.54 0.00 0.00 174.62 174.10 3fv5 n GLY 157 N -0.43 -0.04 0.30 0.00 0.00 -1.26 -4.44 105.19 99.32 3fv5 n GLY 157 Ca -0.01 -0.28 0.06 0.00 0.00 0.00 0.00 46.02 45.79 3fv5 n GLY 157 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fv5 h LYS 158 N -0.01 0.42 -0.01 1.61 1.57 -1.95 -1.59 116.57 116.61 3fv5 h LYS 158 Ca -0.48 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 3fv5 h LYS 158 Cb 1.33 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.55 3fv5 h LYS 158 CO 0.49 0.28 -0.28 0.54 -0.57 0.00 0.00 179.45 179.91 3fv5 n ARG 159 N -4.49 0.92 -2.63 3.15 1.74 -1.26 -4.56 116.66 109.53 3fv5 n ARG 159 Ca 0.03 -0.59 -0.42 0.00 -0.77 0.00 0.00 57.85 56.10 3fv5 n ARG 159 Cb 0.10 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.02 3fv5 n ARG 159 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3fv5 s ASN 160 N -2.48 6.24 0.11 0.55 3.04 -0.60 -4.98 114.94 116.82 3fv5 s ASN 160 Ca 0.24 -0.80 0.03 0.00 0.04 0.00 0.00 52.86 52.37 3fv5 s ASN 160 Cb 0.19 -2.53 -0.04 0.00 -1.54 0.00 0.00 41.25 37.33 3fv5 s ASN 160 CO 0.52 -1.67 -0.08 0.42 -3.04 0.00 0.00 177.10 173.25 3fv5 s THR 161 N 5.14 0.88 -5.00 -5.21 -4.23 -1.26 -4.43 115.64 101.53 3fv5 s THR 161 Ca 0.34 -1.88 0.00 0.00 -1.18 0.00 0.00 61.69 58.97 3fv5 s THR 161 Cb -0.08 -1.62 0.00 0.00 1.34 0.00 0.00 72.50 72.13 3fv5 s THR 161 CO 0.09 -0.75 0.00 0.61 -0.54 0.00 0.00 174.62 174.03 3fv5 n GLY 162 N 0.09 -1.85 2.95 3.99 0.00 -0.63 -3.95 105.19 105.79 3fv5 n GLY 162 Ca -0.13 -1.50 -0.18 0.00 0.00 0.00 0.00 46.02 44.21 3fv5 n GLY 162 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fv5 s THR 163 N -1.73 0.54 -0.09 2.61 2.01 -0.60 -1.27 115.64 117.12 3fv5 s THR 163 Ca 0.00 -0.23 0.03 0.00 0.31 0.00 0.00 61.69 61.80 3fv5 s THR 163 Cb 0.00 -0.50 0.00 0.00 0.01 0.00 0.00 72.50 72.02 3fv5 s THR 163 CO 0.00 0.18 -0.20 -0.55 -0.69 0.00 0.00 174.62 173.36 3fv5 s SER 164 N 0.22 2.63 -0.14 3.53 0.15 0.57 -1.03 113.70 119.63 3fv5 s SER 164 Ca -0.03 -0.47 0.01 0.00 0.70 0.00 0.00 55.95 56.17 3fv5 s SER 164 Cb -0.07 -1.19 0.02 0.00 -1.71 0.00 0.00 66.02 63.07 3fv5 s SER 164 CO -0.00 0.12 -0.18 -0.69 1.20 0.00 0.00 173.24 173.69 3fv5 s VAL 165 N 0.44 1.77 -0.18 4.45 1.01 0.09 -1.16 120.40 126.82 3fv5 s VAL 165 Ca -0.17 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.03 3fv5 s VAL 165 Cb -0.17 -1.61 0.03 0.00 0.00 0.00 0.00 36.38 34.64 3fv5 s VAL 165 CO 0.07 0.49 -0.13 -2.28 0.00 0.00 0.00 175.10 173.25 3fv5 s HIS 166 N 1.12 2.46 0.09 5.22 5.04 -0.19 -0.71 115.29 128.31 3fv5 s HIS 166 Ca -0.02 -1.54 0.07 0.00 -1.54 0.00 0.00 55.06 52.03 3fv5 s HIS 166 Cb -0.14 -1.70 -0.03 0.00 0.04 0.00 0.00 32.58 30.75 3fv5 s HIS 166 CO -0.06 -0.74 -0.17 -0.59 -2.34 0.00 0.00 174.74 170.84 3fv5 s PHE 167 N 1.39 1.48 -0.40 3.88 -0.71 -0.31 -0.40 117.98 122.91 3fv5 s PHE 167 Ca 0.01 -0.45 0.01 0.00 -1.04 0.00 0.00 56.93 55.47 3fv5 s PHE 167 Cb -0.15 -0.82 0.11 0.00 -1.21 0.00 0.00 43.02 40.95 3fv5 s PHE 167 CO -0.10 0.13 0.15 -1.58 -1.34 0.00 0.00 175.22 172.48 3fv5 s TRP 168 N -1.26 3.64 0.42 3.49 0.51 0.15 -1.67 118.94 124.20 3fv5 s TRP 168 Ca 0.02 -2.77 -0.26 0.00 -2.12 0.00 0.00 56.10 50.98 3fv5 s TRP 168 Cb -0.10 -3.06 -0.10 0.00 -0.81 0.00 0.00 33.47 29.41 3fv5 s TRP 168 CO 0.03 -0.94 1.34 -2.30 -0.51 0.00 0.00 176.95 174.57 3fv5 n PRO 169 N 4.27 2.11 -2.66 4.98 -0.02 -1.26 -0.15 135.00 142.27 3fv5 n PRO 169 Ca 0.02 0.75 -0.43 0.00 -2.02 0.00 0.00 63.50 61.82 3fv5 n PRO 169 Cb 0.41 -2.47 -0.02 0.00 -0.02 0.00 0.00 33.50 31.40 3fv5 n PRO 169 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3fv5 s ASP 170 N -0.45 6.82 0.64 2.55 -1.08 -0.38 -4.49 116.67 120.28 3fv5 s ASP 170 Ca 0.60 0.84 0.41 0.00 -0.52 0.00 0.00 52.55 53.87 3fv5 s ASP 170 Cb -0.50 -2.53 2.22 0.00 -1.46 0.00 0.00 42.92 40.65 3fv5 s ASP 170 CO 0.59 -0.96 2.25 1.05 0.52 0.00 0.00 175.17 178.62 3fv5 h GLU 171 N 8.41 0.00 0.00 4.34 9.09 -1.91 -2.06 114.58 132.45 3fv5 h GLU 171 Ca -0.21 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.20 3fv5 h GLU 171 Cb 1.06 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.16 3fv5 h GLU 171 CO 1.05 0.00 0.00 1.79 0.05 0.00 0.00 179.01 181.90 3fv5 h THR 172 N 0.00 0.00 -0.00 -1.06 1.35 -1.96 -2.83 112.91 108.41 3fv5 h THR 172 Ca 0.00 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.46 3fv5 h THR 172 Cb 0.10 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 67.80 3fv5 h THR 172 CO 0.00 0.00 -0.59 0.49 -0.25 0.00 0.00 175.52 175.17 3fv5 n PHE 173 N -2.65 0.00 -4.63 4.73 3.72 -0.77 -4.96 117.46 112.91 3fv5 n PHE 173 Ca 0.02 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.15 3fv5 n PHE 173 Cb 0.29 -0.18 -0.14 0.00 -0.94 0.00 0.00 39.48 38.51 3fv5 n PHE 173 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 3fv5 s PHE 174 N -2.95 2.03 0.18 1.38 0.08 -1.07 -4.81 117.98 112.82 3fv5 s PHE 174 Ca 0.12 -0.39 -0.13 0.00 0.12 0.00 0.00 56.93 56.64 3fv5 s PHE 174 Cb 0.17 -1.18 0.10 0.00 -0.57 0.00 0.00 43.02 41.54 3fv5 s PHE 174 CO 0.72 0.16 1.84 -0.44 -0.10 0.00 0.00 175.22 177.40 3fv5 h ASP 175 N 4.58 0.64 -3.99 1.36 3.32 -0.73 -3.41 116.42 118.19 3fv5 h ASP 175 Ca -0.46 -0.01 -0.47 0.00 0.02 0.00 0.00 57.03 56.11 3fv5 h ASP 175 Cb 1.16 -0.15 -0.30 0.00 0.22 0.00 0.00 39.33 40.26 3fv5 h ASP 175 CO 0.42 0.46 -0.80 -0.55 -1.72 0.00 0.00 179.24 177.05 3fv5 s SER 176 N -5.70 1.53 0.22 6.45 0.15 -0.66 -5.02 113.70 110.67 3fv5 s SER 176 Ca -0.13 -0.24 0.25 0.00 0.70 0.00 0.00 55.95 56.53 3fv5 s SER 176 Cb 0.13 -0.31 0.90 0.00 -1.71 0.00 0.00 66.02 65.04 3fv5 s SER 176 CO 0.75 0.12 1.75 -0.81 1.20 0.00 0.00 173.24 176.25 3fv5 n PRO 177 N 3.03 0.22 -2.58 5.44 -0.04 -1.26 -4.14 135.00 135.66 3fv5 n PRO 177 Ca -0.16 0.31 -0.42 0.00 -0.04 0.00 0.00 63.50 63.18 3fv5 n PRO 177 Cb 0.55 -1.82 -0.03 0.00 -0.04 0.00 0.00 33.50 32.15 3fv5 n PRO 177 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3fv5 s ARG 178 N -3.20 4.48 0.19 0.54 0.52 -1.26 -4.67 118.95 115.55 3fv5 s ARG 178 Ca 0.08 1.57 -0.30 0.00 -0.52 0.00 0.00 55.73 56.55 3fv5 s ARG 178 Cb 0.11 -3.43 -0.09 0.00 0.52 0.00 0.00 34.95 32.06 3fv5 s ARG 178 CO 0.49 -0.18 1.30 -0.06 0.02 0.00 0.00 175.30 176.88 3fv5 s PHE 179 N 1.20 3.27 -0.24 -0.53 0.40 -1.26 -4.48 117.98 116.34 3fv5 s PHE 179 Ca 0.55 1.22 -0.29 0.00 -0.60 0.00 0.00 56.93 57.80 3fv5 s PHE 179 Cb -0.24 -3.59 0.01 0.00 0.51 0.00 0.00 43.02 39.71 3fv5 s PHE 179 CO 0.27 -1.85 1.09 0.45 0.70 0.00 0.00 175.22 175.89 3fv5 s SER 180 N 0.40 7.02 0.20 1.36 0.15 -1.26 -4.94 113.70 116.64 3fv5 s SER 180 Ca 0.57 1.34 -0.08 0.00 0.70 0.00 0.00 55.95 58.49 3fv5 s SER 180 Cb -0.36 -2.54 0.13 0.00 -1.71 0.00 0.00 66.02 61.54 3fv5 s SER 180 CO 0.37 -0.75 1.71 0.58 1.20 0.00 0.00 173.24 176.35 3fv5 h VAL 181 N 5.54 1.26 -0.56 4.45 2.07 -1.99 -2.25 116.25 124.77 3fv5 h VAL 181 Ca -0.21 -1.01 -0.07 0.00 0.82 0.00 0.00 66.70 66.23 3fv5 h VAL 181 Cb 1.07 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 3fv5 h VAL 181 CO 0.99 0.38 0.08 0.77 0.02 0.00 0.00 177.57 179.82 3fv5 h SER 182 N 1.04 0.90 -0.79 0.57 4.64 -1.99 -0.84 113.55 117.09 3fv5 h SER 182 Ca 0.21 -0.27 -0.05 0.00 -0.47 0.00 0.00 61.79 61.22 3fv5 h SER 182 Cb 0.41 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.23 3fv5 h SER 182 CO 0.01 0.94 0.30 0.03 -0.87 0.00 0.00 176.83 177.24 3fv5 h ARG 183 N 0.83 1.18 -0.68 4.77 3.08 -1.95 -0.86 114.38 120.76 3fv5 h ARG 183 Ca 0.17 -0.22 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 3fv5 h ARG 183 Cb 0.43 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 3fv5 h ARG 183 CO 0.01 0.96 0.30 -0.07 -1.07 0.00 0.00 179.97 180.10 3fv5 h LEU 184 N 1.15 0.91 -0.51 3.04 3.38 -1.13 -1.92 115.31 120.23 3fv5 h LEU 184 Ca 0.26 -0.15 -0.12 0.00 0.09 0.00 0.00 57.88 57.96 3fv5 h LEU 184 Cb 0.23 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 3fv5 h LEU 184 CO -0.02 0.82 -0.14 0.71 0.09 0.00 0.00 178.44 179.90 3fv5 h THR 185 N 0.95 1.27 -0.53 0.22 1.35 -0.77 -0.89 112.91 114.51 3fv5 h THR 185 Ca 0.23 -1.29 0.00 0.00 -0.55 0.00 0.00 66.41 64.80 3fv5 h THR 185 Cb 0.17 1.04 -0.03 0.00 -1.73 0.00 0.00 68.15 67.60 3fv5 h THR 185 CO -0.02 0.45 0.34 0.45 -0.25 0.00 0.00 175.52 176.49 3fv5 h HIS 186 N 0.86 0.66 -0.16 4.73 3.86 -1.07 -0.70 115.15 123.33 3fv5 h HIS 186 Ca 0.13 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.35 3fv5 h HIS 186 Cb 0.71 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.94 3fv5 h HIS 186 CO 0.05 0.42 0.10 0.28 0.86 0.00 0.00 177.93 179.64 3fv5 h VAL 187 N 0.71 1.06 -0.20 2.45 2.07 -1.10 -1.57 116.25 119.68 3fv5 h VAL 187 Ca 0.19 -0.14 -0.16 0.00 0.82 0.00 0.00 66.70 67.41 3fv5 h VAL 187 Cb -0.07 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 3fv5 h VAL 187 CO -0.04 0.06 -0.53 -0.07 0.02 0.00 0.00 177.57 177.01 3fv5 h LEU 188 N 0.19 0.65 -0.80 2.57 3.38 -0.97 -0.52 115.31 119.81 3fv5 h LEU 188 Ca 0.06 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3fv5 h LEU 188 Cb 0.01 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 3fv5 h LEU 188 CO -0.01 1.06 0.52 0.50 0.09 0.00 0.00 178.44 180.59 3fv5 h LYS 189 N 0.45 1.07 -0.58 1.13 3.11 -1.11 -0.72 116.57 119.93 3fv5 h LYS 189 Ca 0.01 -0.08 -0.01 0.00 -2.81 0.00 0.00 60.65 57.76 3fv5 h LYS 189 Cb 1.08 -0.24 -0.03 0.00 -1.00 0.00 0.00 32.23 32.04 3fv5 h LYS 189 CO 0.10 0.73 0.31 0.00 -2.81 0.00 0.00 179.45 177.77 3fv5 h ALA 190 N 1.28 0.75 -0.52 5.00 0.00 -0.56 -2.44 119.26 122.77 3fv5 h ALA 190 Ca 0.29 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 3fv5 h ALA 190 Cb -0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 3fv5 h ALA 190 CO -0.06 0.28 -0.06 0.87 0.00 0.00 0.00 179.25 180.29 3fv5 h LYS 191 N 0.79 0.92 -0.65 0.00 1.79 -0.84 -2.55 116.57 116.02 3fv5 h LYS 191 Ca 0.20 -0.30 -0.03 0.00 -2.18 0.00 0.00 60.65 58.35 3fv5 h LYS 191 Cb 0.07 -0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 30.61 3fv5 h LYS 191 CO -0.03 0.94 0.31 0.00 -1.08 0.00 0.00 179.45 179.59 3fv5 h ALA 192 N 1.10 0.84 -0.06 3.86 0.00 -0.83 -1.42 119.26 122.74 3fv5 h ALA 192 Ca 0.15 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 3fv5 h ALA 192 Cb 0.57 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3fv5 h ALA 192 CO 0.03 0.41 -0.40 0.28 0.00 0.00 0.00 179.25 179.58 3fv5 h VAL 193 N 0.90 1.30 0.00 0.00 2.07 -1.37 -2.42 116.25 116.74 3fv5 h VAL 193 Ca 0.22 -1.44 -0.07 0.00 0.82 0.00 0.00 66.70 66.23 3fv5 h VAL 193 Cb 0.13 1.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 3fv5 h VAL 193 CO -0.03 0.42 -0.32 0.25 0.02 0.00 0.00 177.57 177.91 3fv5 h LEU 194 N 0.11 0.00 -5.93 2.57 5.85 -0.96 -3.33 115.31 113.62 3fv5 h LEU 194 Ca 0.01 0.00 -0.59 0.00 0.84 0.00 0.00 57.88 58.14 3fv5 h LEU 194 Cb 0.76 0.00 -0.42 0.00 0.37 0.00 0.00 40.66 41.37 3fv5 h LEU 194 CO 0.06 0.32 -0.67 0.00 -0.34 0.00 0.00 178.44 177.81 3fv5 n PRO 196 N 0.59 1.62 0.00 0.00 -0.04 -1.19 -1.60 135.00 134.37 3fv5 n PRO 196 Ca 0.29 0.57 0.00 0.00 -0.04 0.00 0.00 63.50 64.32 3fv5 n PRO 196 Cb 0.43 -2.05 0.00 0.00 -0.04 0.00 0.00 33.50 31.84 3fv5 n PRO 196 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3fv5 n GLY 197 N 1.06 3.19 3.73 0.55 0.00 0.18 -4.94 105.19 108.95 3fv5 n GLY 197 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 3fv5 n GLY 197 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fv5 s VAL 198 N -2.28 4.86 -0.05 1.61 0.11 -0.63 -4.93 120.40 119.09 3fv5 s VAL 198 Ca 0.00 1.68 -0.24 0.00 -2.93 0.00 0.00 61.98 60.49 3fv5 s VAL 198 Cb 0.00 -4.14 -0.04 0.00 -1.53 0.00 0.00 36.38 30.67 3fv5 s VAL 198 CO 0.00 0.28 0.71 -0.70 -3.33 0.00 0.00 175.10 172.05 3fv5 s GLU 199 N 0.49 4.44 -0.08 1.54 2.12 -0.30 -4.49 118.70 122.42 3fv5 s GLU 199 Ca 0.41 0.90 0.05 0.00 0.36 0.00 0.00 54.97 56.70 3fv5 s GLU 199 Cb -0.20 -3.43 -0.01 0.00 0.26 0.00 0.00 34.13 30.75 3fv5 s GLU 199 CO 0.23 0.11 -0.23 0.42 -0.54 0.00 0.00 175.26 175.24 3fv5 s ILE 200 N 0.63 2.19 0.10 -3.70 1.01 -0.22 -0.65 121.20 120.55 3fv5 s ILE 200 Ca 0.37 -1.00 0.07 0.00 0.00 0.00 0.00 60.65 60.09 3fv5 s ILE 200 Cb -0.18 -1.82 -0.03 0.00 0.01 0.00 0.00 42.46 40.44 3fv5 s ILE 200 CO 0.19 0.56 -0.19 0.42 0.00 0.00 0.00 174.94 175.93 3fv5 s THR 201 N 0.01 1.55 -0.16 2.92 -4.23 -0.45 -0.57 115.64 114.71 3fv5 s THR 201 Ca -0.08 -1.53 -0.02 0.00 -1.18 0.00 0.00 61.69 58.88 3fv5 s THR 201 Cb -0.15 -1.46 0.05 0.00 1.34 0.00 0.00 72.50 72.28 3fv5 s THR 201 CO 0.05 -0.15 0.01 0.12 -0.54 0.00 0.00 174.62 174.12 3fv5 s PHE 202 N -1.33 1.04 -0.32 3.99 5.36 0.56 -1.01 117.98 126.26 3fv5 s PHE 202 Ca 0.05 -0.72 -0.10 0.00 -0.96 0.00 0.00 56.93 55.21 3fv5 s PHE 202 Cb -0.09 -1.01 0.00 0.00 -0.34 0.00 0.00 43.02 41.58 3fv5 s PHE 202 CO 0.04 -0.54 0.16 0.21 -1.46 0.00 0.00 175.22 173.62 3fv5 s LYS 203 N 1.85 3.19 -0.52 10.12 2.20 -0.01 -0.70 119.74 135.88 3fv5 s LYS 203 Ca 0.01 -0.82 -0.14 0.00 -0.36 0.00 0.00 55.97 54.66 3fv5 s LYS 203 Cb -0.16 -3.58 0.13 0.00 -1.51 0.00 0.00 37.83 32.71 3fv5 s LYS 203 CO -0.07 -0.48 0.45 0.34 -0.36 0.00 0.00 175.35 175.23 3fv5 s ASP 204 N 1.59 6.04 0.00 1.43 -1.08 0.62 -0.79 116.67 124.47 3fv5 s ASP 204 Ca 0.04 -1.83 0.27 0.00 -0.52 0.00 0.00 52.55 50.50 3fv5 s ASP 204 Cb -0.18 -2.15 1.42 0.00 -1.46 0.00 0.00 42.92 40.55 3fv5 s ASP 204 CO 0.06 -0.81 1.93 -0.62 0.52 0.00 0.00 175.17 176.25 3fv5 n GLU 205 N 5.13 1.20 -0.07 4.34 1.02 0.02 0.34 120.64 132.64 3fv5 n GLU 205 Ca -0.12 -0.29 -0.22 0.00 -0.02 0.00 0.00 57.16 56.51 3fv5 n GLU 205 Cb 0.40 -1.43 -0.12 0.00 -0.02 0.00 0.00 31.44 30.27 3fv5 n GLU 205 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3fv5 h ILE 206 N 0.67 0.88 -0.09 -3.67 2.04 -1.84 -3.39 117.51 112.10 3fv5 h ILE 206 Ca 0.00 -2.24 0.00 0.00 1.00 0.00 0.00 64.86 63.62 3fv5 h ILE 206 Cb 0.14 2.36 0.00 0.00 -0.74 0.00 0.00 36.82 38.59 3fv5 h ILE 206 CO 0.00 0.49 0.00 0.59 0.00 0.00 0.00 178.15 179.23 3fv5 n ASN 207 N -4.17 2.99 -3.38 1.72 4.13 -1.19 -4.99 115.26 110.38 3fv5 n ASN 207 Ca -0.31 -1.95 -0.16 0.00 1.68 0.00 0.00 54.58 53.83 3fv5 n ASN 207 Cb 0.78 -0.04 0.09 0.00 -1.54 0.00 0.00 39.78 39.07 3fv5 n ASN 207 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 3fv5 n ASN 208 N 1.31 -2.90 -4.28 6.41 3.02 0.15 -5.03 115.26 113.95 3fv5 n ASN 208 Ca 0.14 -0.63 -0.19 0.00 -0.03 0.00 0.00 54.58 53.87 3fv5 n ASN 208 Cb 0.57 -5.11 -0.11 0.00 -0.61 0.00 0.00 39.78 34.52 3fv5 n ASN 208 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3fv5 s THR 209 N -3.36 1.51 -0.04 3.41 -4.23 -0.78 -5.00 115.64 107.16 3fv5 s THR 209 Ca 0.09 -1.85 0.01 0.00 -1.18 0.00 0.00 61.69 58.76 3fv5 s THR 209 Cb -0.01 -1.70 0.02 0.00 1.34 0.00 0.00 72.50 72.14 3fv5 s THR 209 CO 0.73 -0.42 -0.06 -0.70 -0.54 0.00 0.00 174.62 173.63 3fv5 s GLU 210 N -2.88 0.81 0.01 3.99 2.12 -1.26 -0.28 118.70 121.23 3fv5 s GLU 210 Ca 0.13 -0.16 0.06 0.00 0.36 0.00 0.00 54.97 55.36 3fv5 s GLU 210 Cb -0.04 -0.80 -0.03 0.00 0.26 0.00 0.00 34.13 33.52 3fv5 s GLU 210 CO 0.04 -0.02 -0.18 -0.65 -0.54 0.00 0.00 175.26 173.92 3fv5 s GLN 211 N 0.63 2.19 -0.04 4.30 -0.21 0.12 -4.96 119.66 121.70 3fv5 s GLN 211 Ca -0.09 -0.90 0.03 0.00 0.02 0.00 0.00 55.36 54.43 3fv5 s GLN 211 Cb -0.12 -2.23 0.00 0.00 1.00 0.00 0.00 33.01 31.66 3fv5 s GLN 211 CO 0.00 0.56 -0.13 1.03 -2.12 0.00 0.00 175.29 174.63 3fv5 s ARG 212 N -1.20 1.44 0.00 2.91 0.52 -1.26 -0.32 118.95 121.04 3fv5 s ARG 212 Ca 0.14 -0.46 0.06 0.00 -0.52 0.00 0.00 55.73 54.95 3fv5 s ARG 212 Cb -0.10 -1.27 -0.02 0.00 0.52 0.00 0.00 34.95 34.08 3fv5 s ARG 212 CO 0.04 0.17 -0.20 -1.58 0.02 0.00 0.00 175.30 173.74 3fv5 s TRP 213 N 0.17 1.80 -0.30 -0.53 0.51 0.26 -5.00 118.94 115.85 3fv5 s TRP 213 Ca -0.05 -0.35 -0.02 0.00 -2.12 0.00 0.00 56.10 53.56 3fv5 s TRP 213 Cb -0.11 -1.14 0.19 0.00 -0.81 0.00 0.00 33.47 31.61 3fv5 s TRP 213 CO 0.02 0.00 0.64 0.00 -0.51 0.00 0.00 176.95 177.10