#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 2.13 -0.30 0.99 4.77 -1.26 -4.48 117.00 118.85 3fv5 n LEU 16 Ca 0.00 -0.80 -0.03 0.00 -0.03 0.00 0.00 56.01 55.15 3fv5 n LEU 16 Cb 0.00 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.18 3fv5 n LEU 16 CO 0.00 0.39 1.21 -0.08 -1.33 0.00 0.00 177.39 177.58 3fv5 h GLU 17 N 2.71 1.06 -0.11 3.23 4.22 -1.98 -2.40 114.58 121.31 3fv5 h GLU 17 Ca 0.00 -0.06 -0.03 0.00 0.08 0.00 0.00 59.36 59.34 3fv5 h GLU 17 Cb 0.77 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 3fv5 h GLU 17 CO 0.00 0.70 -0.08 -1.00 -2.18 0.00 0.00 179.01 176.45 3fv5 h PRO 18 N 1.09 0.17 -0.56 0.92 0.13 -2.00 -0.99 132.00 130.76 3fv5 h PRO 18 Ca 0.31 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 65.33 3fv5 h PRO 18 Cb -0.08 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.01 3fv5 h PRO 18 CO -0.08 0.26 0.00 0.28 -0.23 0.00 0.00 178.00 178.23 3fv5 h VAL 19 N 0.16 1.26 0.00 1.56 2.07 -1.73 -1.57 116.25 118.01 3fv5 h VAL 19 Ca 0.04 -1.12 -0.07 0.00 0.82 0.00 0.00 66.70 66.37 3fv5 h VAL 19 Cb 0.26 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 3fv5 h VAL 19 CO 0.01 0.40 -0.32 0.03 0.02 0.00 0.00 177.57 177.71 3fv5 h ARG 20 N 0.86 0.00 0.06 1.57 3.08 -1.09 -0.95 114.38 117.92 3fv5 h ARG 20 Ca 0.16 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.96 3fv5 h ARG 20 Cb 0.54 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.60 3fv5 h ARG 20 CO 0.03 0.32 -1.09 0.00 -1.07 0.00 0.00 179.97 178.16 3fv5 h ARG 21 N 0.00 0.37 -2.06 0.04 3.08 -0.86 -3.39 114.38 111.57 3fv5 h ARG 21 Ca -0.00 -0.49 -0.57 0.00 0.07 0.00 0.00 59.98 58.99 3fv5 h ARG 21 Cb 0.64 0.16 -0.39 0.00 0.08 0.00 0.00 29.97 30.46 3fv5 h ARG 21 CO 0.04 1.17 -1.03 0.54 -1.07 0.00 0.00 179.97 179.62 3fv5 n ARG 22 N -3.67 0.91 0.18 0.04 1.74 -0.62 -4.96 116.66 110.28 3fv5 n ARG 22 Ca -0.08 -3.41 0.14 0.00 -0.77 0.00 0.00 57.85 53.73 3fv5 n ARG 22 Cb 0.92 -1.38 0.71 0.00 -1.02 0.00 0.00 32.46 31.70 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 4.14 0.00 0.00 5.56 0.13 -1.37 -1.24 132.00 139.21 3fv5 h PRO 23 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 3fv5 h PRO 23 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 3fv5 h PRO 23 CO 0.50 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.68 3fv5 n GLY 24 N -1.53 -1.13 0.03 1.56 0.00 -1.26 -1.04 105.19 101.83 3fv5 n GLY 24 Ca 0.01 0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.91 0.18 0.00 1.61 2.81 -0.47 -4.23 117.12 115.11 3fv5 n MET 25 Ca 0.02 -0.06 0.00 0.00 -1.81 0.00 0.00 57.70 55.85 3fv5 n MET 25 Cb 0.19 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.20 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 -1.36 0.00 -3.93 2.03 4.01 -0.20 -5.10 117.16 112.61 3fv5 n TYR 26 Ca 0.09 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.74 3fv5 n TYR 26 Cb 0.32 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.32 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 -1.43 0.00 -0.45 -0.72 -1.32 -0.32 -5.08 115.64 106.33 3fv5 s THR 27 Ca 0.00 -1.20 -0.27 0.00 -1.21 0.00 0.00 61.69 59.01 3fv5 s THR 27 Cb 0.00 -2.18 0.03 0.00 -1.51 0.00 0.00 72.50 68.84 3fv5 s THR 27 CO 0.00 0.00 0.99 -0.62 -2.21 0.00 0.00 174.62 172.78 3fv5 s ASP 28 N -2.99 6.58 0.00 8.08 2.15 -1.26 -4.38 116.67 124.85 3fv5 s ASP 28 Ca 0.17 0.32 0.12 0.00 0.43 0.00 0.00 52.55 53.59 3fv5 s ASP 28 Cb -0.03 -2.48 0.37 0.00 -0.30 0.00 0.00 42.92 40.47 3fv5 s ASP 28 CO 0.09 -1.08 1.29 0.35 -0.17 0.00 0.00 175.17 175.65 3fv5 n THR 29 N 6.46 0.39 -0.07 1.71 -2.24 -1.26 -3.75 114.28 115.52 3fv5 n THR 29 Ca 0.08 -0.41 -0.10 0.00 -2.27 0.00 0.00 64.05 61.36 3fv5 n THR 29 Cb 0.49 0.23 -0.03 0.00 -2.10 0.00 0.00 70.33 68.91 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 1.88 1.11 -2.77 4.28 2.02 -1.91 0.12 112.91 117.64 3fv5 h THR 30 Ca 0.00 -0.27 0.09 0.00 0.77 0.00 0.00 66.41 67.01 3fv5 h THR 30 Cb 0.43 0.83 -0.05 0.00 -1.74 0.00 0.00 68.15 67.62 3fv5 h THR 30 CO 0.00 0.10 0.34 0.00 0.37 0.00 0.00 175.52 176.33 3fv5 s ARG 31 N -5.94 1.65 0.00 6.66 1.70 -1.25 -1.95 118.95 119.83 3fv5 s ARG 31 Ca -0.13 -0.96 0.00 0.00 -0.47 0.00 0.00 55.73 54.17 3fv5 s ARG 31 Cb 0.09 0.53 0.00 0.00 -0.57 0.00 0.00 34.95 35.00 3fv5 s ARG 31 CO 0.71 -0.76 0.86 -0.35 -1.08 0.00 0.00 175.30 174.67 3fv5 n PRO 32 N -0.49 0.87 -0.29 3.89 -0.04 -1.26 -4.13 135.00 133.55 3fv5 n PRO 32 Ca -0.05 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.44 3fv5 n PRO 32 Cb 0.60 -1.01 0.17 0.00 -0.04 0.00 0.00 33.50 33.22 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 0.63 -0.57 3.54 2.35 -1.89 -0.82 115.58 118.83 3fv5 h ASN 33 Ca 0.00 0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 3fv5 h ASN 33 Cb 0.01 -0.07 -0.03 0.00 0.05 0.00 0.00 38.32 38.28 3fv5 h ASN 33 CO 0.00 0.36 0.29 -0.74 -1.65 0.00 0.00 177.43 175.68 3fv5 h HIS 34 N 0.75 0.84 -0.54 1.19 2.76 -1.85 0.96 115.15 119.27 3fv5 h HIS 34 Ca 0.40 -0.03 0.03 0.00 -2.20 0.00 0.00 60.37 58.57 3fv5 h HIS 34 Cb 0.39 -0.27 -0.04 0.00 1.55 0.00 0.00 27.41 29.05 3fv5 h HIS 34 CO -0.07 0.61 0.32 -0.07 -1.30 0.00 0.00 177.93 177.42 3fv5 h LEU 35 N 0.85 0.51 -0.73 0.26 4.07 -1.47 -1.34 115.31 117.46 3fv5 h LEU 35 Ca 0.21 0.01 0.02 0.00 0.08 0.00 0.00 57.88 58.20 3fv5 h LEU 35 Cb 0.09 -0.10 -0.04 0.00 1.08 0.00 0.00 40.66 41.68 3fv5 h LEU 35 CO -0.03 0.36 0.47 1.23 -1.08 0.00 0.00 178.44 179.39 3fv5 h GLY 36 N 0.63 1.04 1.50 0.83 0.00 -0.33 -2.31 103.07 104.43 3fv5 h GLY 36 Ca 0.22 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 47.15 3fv5 h GLY 36 CO -0.10 0.33 0.13 1.46 0.00 0.00 0.00 176.54 178.36 3fv5 h GLN 37 N 0.93 0.64 -0.37 4.80 4.20 -0.33 0.13 115.11 125.12 3fv5 h GLN 37 Ca 0.28 -0.10 -0.02 0.00 0.06 0.00 0.00 58.65 58.86 3fv5 h GLN 37 Cb -0.04 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.62 3fv5 h GLN 37 CO -0.09 0.57 0.14 0.93 -0.67 0.00 0.00 178.83 179.71 3fv5 h GLU 38 N 0.63 0.56 -0.19 1.46 5.08 -0.72 0.31 114.58 121.72 3fv5 h GLU 38 Ca 0.15 -0.11 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 3fv5 h GLU 38 Cb 0.20 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3fv5 h GLU 38 CO -0.01 0.55 -0.04 0.28 -1.00 0.00 0.00 179.01 178.79 3fv5 h VAL 39 N 0.45 1.28 -0.67 3.13 2.07 -1.08 -2.66 116.25 118.76 3fv5 h VAL 39 Ca 0.12 -0.99 0.08 0.00 0.82 0.00 0.00 66.70 66.73 3fv5 h VAL 39 Cb 0.20 1.55 -0.07 0.00 -1.52 0.00 0.00 31.29 31.46 3fv5 h VAL 39 CO -0.01 0.30 0.33 0.40 0.02 0.00 0.00 177.57 178.61 3fv5 h ILE 40 N 0.08 0.87 -1.01 4.57 2.04 -0.62 -1.84 117.51 121.61 3fv5 h ILE 40 Ca 0.05 -0.20 0.11 0.00 1.00 0.00 0.00 64.86 65.81 3fv5 h ILE 40 Cb 0.47 0.23 -0.08 0.00 -0.74 0.00 0.00 36.82 36.70 3fv5 h ILE 40 CO 0.02 0.11 0.64 0.44 0.00 0.00 0.00 178.15 179.35 3fv5 h ASP 41 N 0.59 0.96 -0.35 1.72 3.32 -0.18 -0.16 116.42 122.32 3fv5 h ASP 41 Ca 0.32 0.04 -0.11 0.00 0.02 0.00 0.00 57.03 57.30 3fv5 h ASP 41 Cb 0.31 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 3fv5 h ASP 41 CO -0.25 0.54 -0.18 0.78 -1.72 0.00 0.00 179.24 178.41 3fv5 h ASN 42 N 1.05 0.83 -0.47 6.45 2.35 -0.99 -0.88 115.58 123.92 3fv5 h ASN 42 Ca 0.48 -0.29 -0.08 0.00 -0.55 0.00 0.00 56.30 55.86 3fv5 h ASN 42 Cb 0.40 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 3fv5 h ASN 42 CO -0.24 1.00 -0.03 0.28 -1.65 0.00 0.00 177.43 176.79 3fv5 h SER 43 N 0.73 0.83 -0.15 5.81 0.02 -1.00 -2.77 113.55 117.02 3fv5 h SER 43 Ca 0.11 -0.32 -0.05 0.00 -0.84 0.00 0.00 61.79 60.68 3fv5 h SER 43 Cb 0.70 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.00 3fv5 h SER 43 CO 0.05 0.96 -0.04 0.58 -1.14 0.00 0.00 176.83 177.24 3fv5 h VAL 44 N 0.69 1.19 -0.83 2.27 2.07 -0.84 -2.14 116.25 118.66 3fv5 h VAL 44 Ca 0.13 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 66.85 3fv5 h VAL 44 Cb 0.54 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.30 3fv5 h VAL 44 CO 0.03 0.26 0.45 0.44 0.02 0.00 0.00 177.57 178.77 3fv5 h ASP 45 N 0.42 1.04 -0.45 0.57 3.32 -0.95 0.38 116.42 120.76 3fv5 h ASP 45 Ca 0.09 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 3fv5 h ASP 45 Cb 0.34 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 3fv5 h ASP 45 CO 0.01 0.84 0.21 -0.33 -1.72 0.00 0.00 179.24 178.26 3fv5 h GLU 46 N 1.16 0.70 -0.15 3.56 4.39 -1.13 -1.03 114.58 122.07 3fv5 h GLU 46 Ca 0.29 -0.09 -0.16 0.00 0.34 0.00 0.00 59.36 59.74 3fv5 h GLU 46 Cb 0.04 -0.13 0.01 0.00 -0.10 0.00 0.00 28.75 28.56 3fv5 h GLU 46 CO -0.05 0.57 -0.52 0.00 -1.16 0.00 0.00 179.01 177.86 3fv5 h ALA 47 N 1.53 0.27 -0.13 3.43 0.00 -0.71 -1.32 119.26 122.34 3fv5 h ALA 47 Ca 0.17 -0.50 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 3fv5 h ALA 47 Cb 0.12 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3fv5 h ALA 47 CO -0.02 0.46 -0.09 -0.07 0.00 0.00 0.00 179.25 179.54 3fv5 h LEU 48 N 0.29 0.17 0.00 0.00 3.38 0.01 -0.80 115.31 118.36 3fv5 h LEU 48 Ca -0.02 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3fv5 h LEU 48 Cb 1.14 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3fv5 h LEU 48 CO 0.11 0.29 0.00 0.00 0.09 0.00 0.00 178.44 178.93 3fv5 n ALA 49 N -2.50 2.45 -0.43 1.53 0.00 -0.42 -4.89 120.51 116.26 3fv5 n ALA 49 Ca -0.01 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.28 3fv5 n ALA 49 Cb 0.22 -1.46 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 1.00 0.76 0.08 0.00 0.00 -0.31 -4.97 105.19 101.76 3fv5 n GLY 50 Ca 0.16 -0.24 -0.10 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.43 0.00 -4.02 1.61 8.25 -0.52 -4.96 115.22 113.15 3fv5 n HIS 51 Ca 0.00 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.10 3fv5 n HIS 51 Cb 0.00 -0.74 -0.08 0.00 1.12 0.00 0.00 29.99 30.29 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 -2.37 3.60 -0.46 -1.41 0.00 -1.07 -4.32 121.76 115.73 3fv5 s ALA 52 Ca -0.14 -0.71 0.11 0.00 0.00 0.00 0.00 51.96 51.22 3fv5 s ALA 52 Cb 0.05 -1.85 -0.13 0.00 0.00 0.00 0.00 23.12 21.20 3fv5 s ALA 52 CO 0.55 0.46 0.44 1.63 0.00 0.00 0.00 175.76 178.85 3fv5 n LYS 53 N 2.53 3.04 -3.77 0.00 5.02 -1.26 -4.42 118.16 119.29 3fv5 n LYS 53 Ca -0.18 -0.01 -0.13 0.00 -2.02 0.00 0.00 58.31 55.97 3fv5 n LYS 53 Cb 0.54 -1.04 -0.12 0.00 -0.02 0.00 0.00 35.03 34.38 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 -2.12 0.25 -0.16 1.97 3.52 -1.26 -0.92 118.95 120.24 3fv5 s ARG 54 Ca 0.03 0.39 0.00 0.00 -0.13 0.00 0.00 55.73 56.02 3fv5 s ARG 54 Cb 0.08 0.05 0.03 0.00 -1.56 0.00 0.00 34.95 33.55 3fv5 s ARG 54 CO 0.45 -0.08 -0.11 0.08 -0.81 0.00 0.00 175.30 174.84 3fv5 s VAL 55 N 0.50 1.41 -0.14 7.11 1.01 0.47 -2.86 120.40 127.91 3fv5 s VAL 55 Ca -0.03 -0.67 -0.03 0.00 0.00 0.00 0.00 61.98 61.25 3fv5 s VAL 55 Cb -0.05 -1.43 -0.03 0.00 0.00 0.00 0.00 36.38 34.88 3fv5 s VAL 55 CO -0.03 0.31 -0.03 -1.81 0.00 0.00 0.00 175.10 173.54 3fv5 s ASP 56 N 1.53 4.85 -0.09 3.32 -0.00 0.57 -1.39 116.67 125.46 3fv5 s ASP 56 Ca 0.03 -0.09 0.04 0.00 -0.00 0.00 0.00 52.55 52.53 3fv5 s ASP 56 Cb -0.14 -1.71 -0.01 0.00 -0.00 0.00 0.00 42.92 41.07 3fv5 s ASP 56 CO -0.09 0.21 -0.21 -0.69 -0.00 0.00 0.00 175.17 174.39 3fv5 s VAL 57 N 0.14 2.38 -0.14 -1.27 1.01 -0.15 -0.59 120.40 121.79 3fv5 s VAL 57 Ca -0.01 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.05 3fv5 s VAL 57 Cb -0.14 -1.92 0.02 0.00 0.00 0.00 0.00 36.38 34.35 3fv5 s VAL 57 CO 0.03 0.56 -0.12 -0.63 0.00 0.00 0.00 175.10 174.94 3fv5 s ILE 58 N 0.07 1.40 -0.40 2.22 1.01 0.48 -0.34 121.20 125.64 3fv5 s ILE 58 Ca -0.09 -0.54 -0.20 0.00 0.00 0.00 0.00 60.65 59.82 3fv5 s ILE 58 Cb -0.15 -1.35 0.01 0.00 0.01 0.00 0.00 42.46 40.98 3fv5 s ILE 58 CO 0.06 0.42 0.60 -0.22 0.00 0.00 0.00 174.94 175.79 3fv5 s LEU 59 N 1.55 4.44 0.54 2.97 2.96 0.12 -0.89 118.68 130.38 3fv5 s LEU 59 Ca 0.05 -0.19 -0.08 0.00 -0.22 0.00 0.00 54.13 53.69 3fv5 s LEU 59 Cb -0.13 -2.68 -0.04 0.00 0.50 0.00 0.00 46.19 43.84 3fv5 s LEU 59 CO -0.10 -0.66 0.89 -1.00 -1.32 0.00 0.00 176.35 174.16 3fv5 s HIS 60 N 2.65 3.58 0.49 5.38 3.76 -0.44 -0.78 115.29 129.93 3fv5 s HIS 60 Ca 0.21 1.00 0.15 0.00 -0.15 0.00 0.00 55.06 56.27 3fv5 s HIS 60 Cb -0.15 -2.49 1.16 0.00 1.11 0.00 0.00 32.58 32.21 3fv5 s HIS 60 CO 0.16 -0.47 2.09 0.00 -0.85 0.00 0.00 174.74 175.67 3fv5 h ALA 61 N -0.01 1.88 -0.12 -1.40 0.00 -1.88 0.36 119.26 118.09 3fv5 h ALA 61 Ca -0.46 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3fv5 h ALA 61 Cb 1.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3fv5 h ALA 61 CO 0.62 0.09 0.00 -0.40 0.00 0.00 0.00 179.25 179.56 3fv5 n ASP 62 N -4.45 1.09 -0.78 0.00 5.68 -1.26 -4.86 116.55 111.96 3fv5 n ASP 62 Ca -0.03 -2.06 -0.10 0.00 -0.50 0.00 0.00 54.79 52.10 3fv5 n ASP 62 Cb 0.15 -0.25 -0.04 0.00 -1.14 0.00 0.00 41.12 39.84 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 -0.04 -1.00 -2.33 0.11 1.13 0.12 -5.02 117.38 110.34 3fv5 n GLN 63 Ca 0.04 0.81 -0.30 0.00 -1.94 0.00 0.00 57.00 55.62 3fv5 n GLN 63 Cb 0.22 -4.85 -0.01 0.00 0.11 0.00 0.00 30.24 25.71 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 -2.66 6.35 -0.03 1.08 1.04 -1.26 -4.73 113.70 113.49 3fv5 s SER 64 Ca 0.00 1.26 0.07 0.00 0.48 0.00 0.00 55.95 57.75 3fv5 s SER 64 Cb 0.00 -2.39 -0.01 0.00 0.10 0.00 0.00 66.02 63.72 3fv5 s SER 64 CO 0.00 -0.66 -0.24 -0.22 0.98 0.00 0.00 173.24 173.10 3fv5 s LEU 65 N -4.66 2.04 -0.08 2.42 2.96 -0.75 -1.32 118.68 119.29 3fv5 s LEU 65 Ca 0.53 -0.46 0.03 0.00 -0.22 0.00 0.00 54.13 54.01 3fv5 s LEU 65 Cb -0.11 -1.27 0.01 0.00 0.50 0.00 0.00 46.19 45.32 3fv5 s LEU 65 CO 0.44 0.27 -0.19 -0.70 -1.32 0.00 0.00 176.35 174.85 3fv5 s GLU 66 N -0.38 2.46 -0.07 1.98 2.12 -0.07 -1.20 118.70 123.53 3fv5 s GLU 66 Ca 0.04 -0.68 0.05 0.00 0.36 0.00 0.00 54.97 54.74 3fv5 s GLU 66 Cb -0.11 -1.91 -0.01 0.00 0.26 0.00 0.00 34.13 32.36 3fv5 s GLU 66 CO 0.01 0.11 -0.24 0.08 -0.54 0.00 0.00 175.26 174.68 3fv5 s VAL 67 N 0.48 2.03 -0.04 3.70 1.01 0.08 -0.39 120.40 127.28 3fv5 s VAL 67 Ca -0.17 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 60.79 3fv5 s VAL 67 Cb -0.17 -1.73 0.02 0.00 0.00 0.00 0.00 36.38 34.50 3fv5 s VAL 67 CO 0.07 0.56 -0.06 -0.63 0.00 0.00 0.00 175.10 175.03 3fv5 s ILE 68 N 0.05 0.65 0.22 2.22 1.01 0.24 -0.69 121.20 124.90 3fv5 s ILE 68 Ca -0.10 -0.21 0.09 0.00 0.00 0.00 0.00 60.65 60.43 3fv5 s ILE 68 Cb -0.15 -0.63 -0.05 0.00 0.01 0.00 0.00 42.46 41.64 3fv5 s ILE 68 CO 0.06 0.24 -0.16 1.51 0.00 0.00 0.00 174.94 176.59 3fv5 s ASP 69 N 0.70 2.84 -0.51 3.58 1.47 -0.15 -0.31 116.67 124.29 3fv5 s ASP 69 Ca -0.10 -1.02 0.02 0.00 1.18 0.00 0.00 52.55 52.63 3fv5 s ASP 69 Cb -0.13 -0.18 0.49 0.00 -0.34 0.00 0.00 42.92 42.76 3fv5 s ASP 69 CO 0.01 -0.11 1.78 -0.90 0.68 0.00 0.00 175.17 176.62 3fv5 n ASP 70 N -0.42 5.89 -3.07 2.11 5.75 -1.14 -1.67 116.55 124.00 3fv5 n ASP 70 Ca -0.07 -3.76 0.00 0.00 -0.01 0.00 0.00 54.79 50.95 3fv5 n ASP 70 Cb 0.60 -0.79 0.00 0.00 -1.03 0.00 0.00 41.12 39.91 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 -0.94 0.12 0.23 6.12 0.00 -1.26 -4.56 105.19 104.90 3fv5 n GLY 71 Ca 0.55 -1.50 0.11 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.47 114.38 114.72 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 0.17 0.00 0.41 -1.07 0.00 0.00 179.97 179.48 3fv5 n GLY 73 N 0.30 -0.29 3.68 0.04 0.00 -1.26 -4.31 105.19 103.35 3fv5 n GLY 73 Ca 0.01 -1.27 -0.43 0.00 0.00 0.00 0.00 46.02 44.32 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 1.28 2.00 -1.89 1.61 0.00 -1.26 -4.91 117.12 113.96 3fv5 n MET 74 Ca 0.00 0.71 -0.39 0.00 0.00 0.00 0.00 57.70 58.01 3fv5 n MET 74 Cb 0.00 -2.27 0.02 0.00 0.00 0.00 0.00 33.22 30.96 3fv5 n MET 74 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 175.97 173.83 3fv5 s PRO 75 N -1.54 3.62 0.00 0.03 0.02 -1.26 -4.89 135.00 130.98 3fv5 s PRO 75 Ca 0.58 2.26 0.00 0.00 0.02 0.00 0.00 61.00 63.87 3fv5 s PRO 75 Cb -0.60 -2.56 0.00 0.00 0.02 0.00 0.00 34.50 31.35 3fv5 s PRO 75 CO 0.59 -0.81 0.57 1.33 -0.33 0.00 0.00 177.00 178.36 3fv5 n VAL 76 N -0.34 0.19 -2.19 3.83 0.24 -1.26 -1.46 118.33 117.34 3fv5 n VAL 76 Ca 0.06 -0.57 -0.37 0.00 -2.04 0.00 0.00 64.34 61.42 3fv5 n VAL 76 Cb 0.43 0.95 -0.00 0.00 -1.47 0.00 0.00 33.84 33.75 3fv5 n VAL 76 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 3fv5 s ASP 77 N -0.19 5.98 -0.03 -1.34 -4.77 -1.26 -4.21 116.67 110.85 3fv5 s ASP 77 Ca 0.00 2.36 -0.30 0.00 -3.30 0.00 0.00 52.55 51.31 3fv5 s ASP 77 Cb 0.00 -2.61 -0.05 0.00 -1.09 0.00 0.00 42.92 39.18 3fv5 s ASP 77 CO 0.00 -1.05 1.38 -0.63 0.70 0.00 0.00 175.17 175.56 3fv5 s ILE 78 N -1.53 3.84 -0.26 2.11 -1.09 -1.26 -0.87 121.20 122.13 3fv5 s ILE 78 Ca 0.66 1.18 -0.27 0.00 -2.23 0.00 0.00 60.65 59.99 3fv5 s ILE 78 Cb -0.30 -3.76 0.01 0.00 -1.58 0.00 0.00 42.46 36.83 3fv5 s ILE 78 CO 0.36 -0.02 0.97 -1.00 -1.23 0.00 0.00 174.94 174.02 3fv5 s HIS 79 N 2.58 3.28 0.42 3.97 3.76 -0.78 -4.92 115.29 123.61 3fv5 s HIS 79 Ca 0.62 1.26 0.09 0.00 -0.15 0.00 0.00 55.06 56.89 3fv5 s HIS 79 Cb -0.30 -3.30 0.90 0.00 1.11 0.00 0.00 32.58 31.00 3fv5 s HIS 79 CO 0.25 -0.53 2.02 -1.00 -0.85 0.00 0.00 174.74 174.63 3fv5 h PRO 80 N 7.71 0.34 -0.74 8.40 0.13 -1.94 0.58 132.00 146.48 3fv5 h PRO 80 Ca -0.21 -0.04 0.16 0.00 -0.87 0.00 0.00 66.00 65.05 3fv5 h PRO 80 Cb 1.07 -0.07 -0.11 0.00 0.13 0.00 0.00 31.00 32.02 3fv5 h PRO 80 CO 0.96 0.30 0.16 0.93 -0.23 0.00 0.00 178.00 180.12 3fv5 h GLU 81 N 0.34 0.24 0.00 0.86 3.07 -1.96 -2.95 114.58 114.19 3fv5 h GLU 81 Ca 0.09 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 3fv5 h GLU 81 Cb 0.10 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 3fv5 h GLU 81 CO -0.01 0.16 -0.73 -0.85 -1.40 0.00 0.00 179.01 176.18 3fv5 n GLU 82 N -5.18 2.91 -1.89 2.33 0.00 -1.01 -5.01 120.64 112.78 3fv5 n GLU 82 Ca 0.14 -0.03 -0.11 0.00 0.00 0.00 0.00 57.16 57.17 3fv5 n GLU 82 Cb 0.47 -0.99 -0.02 0.00 0.00 0.00 0.00 31.44 30.90 3fv5 n GLU 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3fv5 n GLY 83 N 1.48 0.36 3.16 -1.84 0.00 0.20 -5.02 105.19 103.54 3fv5 n GLY 83 Ca 0.00 -0.48 -0.19 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.48 1.13 0.49 1.61 0.11 -1.20 -4.91 120.40 115.16 3fv5 s VAL 84 Ca 0.00 -1.15 -0.23 0.00 -2.93 0.00 0.00 61.98 57.67 3fv5 s VAL 84 Cb 0.00 -1.05 -0.07 0.00 -1.53 0.00 0.00 36.38 33.72 3fv5 s VAL 84 CO 0.00 -0.09 1.28 -2.65 -3.33 0.00 0.00 175.10 170.30 3fv5 n PRO 85 N 1.61 1.74 -0.21 1.54 -0.02 -1.26 -1.86 135.00 136.53 3fv5 n PRO 85 Ca -0.19 0.63 0.02 0.00 -2.02 0.00 0.00 63.50 61.94 3fv5 n PRO 85 Cb 0.54 -2.45 0.13 0.00 -0.02 0.00 0.00 33.50 31.70 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 1.66 0.79 -0.57 3.55 0.00 -1.16 -1.31 119.26 122.22 3fv5 h ALA 86 Ca -0.49 0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.60 3fv5 h ALA 86 Cb 1.30 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 19.24 3fv5 h ALA 86 CO 0.58 -0.30 0.38 -0.24 0.00 0.00 0.00 179.25 179.66 3fv5 h VAL 87 N 0.28 1.03 -0.24 0.00 3.04 -1.55 -0.47 116.25 118.34 3fv5 h VAL 87 Ca 0.34 -0.21 -0.16 0.00 -1.01 0.00 0.00 66.70 65.67 3fv5 h VAL 87 Cb 0.53 0.38 -0.01 0.00 -2.01 0.00 0.00 31.29 30.18 3fv5 h VAL 87 CO -0.43 0.11 -0.50 -0.08 -1.01 0.00 0.00 177.57 175.66 3fv5 h GLU 88 N 0.60 0.65 -0.58 4.17 4.81 -1.56 -2.32 114.58 120.34 3fv5 h GLU 88 Ca 0.24 -0.39 -0.07 0.00 -0.13 0.00 0.00 59.36 59.01 3fv5 h GLU 88 Cb 0.19 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 3fv5 h GLU 88 CO -0.07 1.00 0.11 -0.07 -0.73 0.00 0.00 179.01 179.25 3fv5 h LEU 89 N 0.51 0.92 -1.16 1.64 -0.00 -0.92 -0.59 115.31 115.71 3fv5 h LEU 89 Ca 0.02 -0.25 -0.01 0.00 -0.00 0.00 0.00 57.88 57.64 3fv5 h LEU 89 Cb 1.05 -0.24 -0.04 0.00 -0.00 0.00 0.00 40.66 41.43 3fv5 h LEU 89 CO 0.10 0.94 0.43 0.40 -0.00 0.00 0.00 178.44 180.31 3fv5 h ILE 90 N 0.86 1.21 0.00 1.22 2.04 -0.99 0.67 117.51 122.52 3fv5 h ILE 90 Ca 0.18 -0.48 -0.08 0.00 1.00 0.00 0.00 64.86 65.48 3fv5 h ILE 90 Cb 0.40 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.65 3fv5 h ILE 90 CO 0.01 0.22 -0.81 -0.07 0.00 0.00 0.00 178.15 177.50 3fv5 h LEU 91 N 1.02 0.00 0.00 1.44 4.07 -1.20 -3.33 115.31 117.31 3fv5 h LEU 91 Ca 0.26 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.22 3fv5 h LEU 91 Cb -0.02 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.72 3fv5 h LEU 91 CO -0.05 0.32 -0.92 0.00 -1.08 0.00 0.00 178.44 176.71 3fv5 s ARG 93 N -2.23 4.12 -0.45 0.00 3.52 0.21 -4.65 118.95 119.46 3fv5 s ARG 93 Ca -0.00 0.01 -0.29 0.00 -0.13 0.00 0.00 55.73 55.32 3fv5 s ARG 93 Cb 0.06 -3.55 0.03 0.00 -1.56 0.00 0.00 34.95 29.93 3fv5 s ARG 93 CO 0.37 -0.04 1.15 -1.17 -0.81 0.00 0.00 175.30 174.81 3fv5 s LEU 94 N 1.32 3.67 -0.00 -0.88 2.96 -1.26 -4.71 118.68 119.78 3fv5 s LEU 94 Ca 0.14 0.57 -0.04 0.00 -0.22 0.00 0.00 54.13 54.59 3fv5 s LEU 94 Cb -0.14 -3.55 -0.28 0.00 0.50 0.00 0.00 46.19 42.72 3fv5 s LEU 94 CO 0.07 -1.22 0.83 1.23 -1.32 0.00 0.00 176.35 175.94 3fv5 h GLY 115 N 11.16 0.31 1.14 7.98 0.00 -1.95 -3.49 103.07 118.22 3fv5 h GLY 115 Ca -0.23 -0.79 0.12 0.00 0.00 0.00 0.00 47.33 46.43 3fv5 h GLY 115 CO 1.11 0.69 0.32 1.19 0.00 0.00 0.00 176.54 179.85 3fv5 h ILE 116 N 0.07 0.81 -0.21 2.60 6.09 -1.87 -0.49 117.51 124.51 3fv5 h ILE 116 Ca -0.26 -0.02 -0.06 0.00 -1.37 0.00 0.00 64.86 63.15 3fv5 h ILE 116 Cb 2.03 0.74 -0.01 0.00 0.47 0.00 0.00 36.82 40.04 3fv5 h ILE 116 CO 0.16 0.01 -0.12 0.77 -3.07 0.00 0.00 178.15 175.90 3fv5 h SER 117 N 0.07 0.33 -0.49 2.19 4.64 -1.72 -1.94 113.55 116.63 3fv5 h SER 117 Ca 0.21 -0.07 -0.08 0.00 -0.47 0.00 0.00 61.79 61.37 3fv5 h SER 117 Cb 0.76 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.74 3fv5 h SER 117 CO -0.02 0.49 0.00 0.58 -0.87 0.00 0.00 176.83 177.01 3fv5 h VAL 118 N 0.33 1.26 -0.65 0.95 2.07 -1.38 -0.27 116.25 118.56 3fv5 h VAL 118 Ca 0.06 -1.08 0.01 0.00 0.82 0.00 0.00 66.70 66.52 3fv5 h VAL 118 Cb 0.42 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 30.99 3fv5 h VAL 118 CO 0.02 0.39 0.42 0.58 0.02 0.00 0.00 177.57 179.00 3fv5 h VAL 119 N 0.85 1.14 -0.30 2.57 2.07 -1.34 -2.29 116.25 118.94 3fv5 h VAL 119 Ca 0.16 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 3fv5 h VAL 119 Cb 0.50 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 3fv5 h VAL 119 CO 0.02 0.15 0.12 -1.13 0.02 0.00 0.00 177.57 176.75 3fv5 h ASN 120 N 0.84 0.42 -0.63 0.57 -1.24 -0.93 -2.67 115.58 111.94 3fv5 h ASN 120 Ca 0.25 -0.17 0.05 0.00 0.71 0.00 0.00 56.30 57.14 3fv5 h ASN 120 Cb -0.06 -0.11 -0.04 0.00 0.73 0.00 0.00 38.32 38.85 3fv5 h ASN 120 CO -0.07 0.47 0.42 0.00 -1.29 0.00 0.00 177.43 176.96 3fv5 h ALA 121 N 0.96 1.74 -0.53 1.57 0.00 -0.79 -2.84 119.26 119.36 3fv5 h ALA 121 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3fv5 h ALA 121 Cb 0.19 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3fv5 h ALA 121 CO -0.01 0.17 0.00 1.28 0.00 0.00 0.00 179.25 180.69 3fv5 n LEU 122 N -4.47 4.39 -4.44 0.00 4.32 -0.89 -4.37 117.00 111.54 3fv5 n LEU 122 Ca 0.08 -2.50 -0.33 0.00 -0.02 0.00 0.00 56.01 53.25 3fv5 n LEU 122 Cb 0.20 -0.52 -0.14 0.00 -1.62 0.00 0.00 43.42 41.34 3fv5 n LEU 122 CO 0.34 0.77 -0.46 -0.44 -1.22 0.00 0.00 177.39 176.38 3fv5 s SER 123 N -1.10 3.95 0.41 -1.43 0.01 -1.03 -1.12 113.70 113.39 3fv5 s SER 123 Ca 0.46 -0.25 0.08 0.00 1.31 0.00 0.00 55.95 57.55 3fv5 s SER 123 Cb 0.30 -1.00 0.85 0.00 0.21 0.00 0.00 66.02 66.38 3fv5 s SER 123 CO 0.20 0.30 2.02 0.11 0.41 0.00 0.00 173.24 176.28 3fv5 h LYS 124 N 5.68 0.44 -2.50 12.44 1.57 -0.59 -1.62 116.57 132.00 3fv5 h LYS 124 Ca -0.41 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.23 3fv5 h LYS 124 Cb 1.17 -0.09 -0.21 0.00 0.08 0.00 0.00 32.23 33.17 3fv5 h LYS 124 CO 0.51 0.36 -0.08 0.50 -0.57 0.00 0.00 179.45 180.17 3fv5 s ARG 125 N -5.26 0.73 -0.06 3.15 3.52 -1.21 -2.75 118.95 117.07 3fv5 s ARG 125 Ca -0.07 0.38 0.01 0.00 -0.13 0.00 0.00 55.73 55.91 3fv5 s ARG 125 Cb 0.17 0.35 0.02 0.00 -1.56 0.00 0.00 34.95 33.92 3fv5 s ARG 125 CO 0.73 -0.16 -0.06 0.08 -0.81 0.00 0.00 175.30 175.08 3fv5 s VAL 126 N -0.49 0.70 -0.17 7.11 1.01 -0.09 -0.81 120.40 127.65 3fv5 s VAL 126 Ca -0.06 -0.20 -0.03 0.00 0.00 0.00 0.00 61.98 61.70 3fv5 s VAL 126 Cb -0.03 -0.71 -0.02 0.00 0.00 0.00 0.00 36.38 35.63 3fv5 s VAL 126 CO 0.04 0.27 -0.07 -1.61 0.00 0.00 0.00 175.10 173.73 3fv5 s GLU 127 N 1.00 3.46 -0.12 2.72 2.02 0.13 -0.96 118.70 126.95 3fv5 s GLU 127 Ca -0.09 -0.62 0.02 0.00 0.02 0.00 0.00 54.97 54.30 3fv5 s GLU 127 Cb -0.14 -2.86 -0.00 0.00 0.10 0.00 0.00 34.13 31.23 3fv5 s GLU 127 CO -0.00 0.06 -0.20 0.08 0.02 0.00 0.00 175.26 175.22 3fv5 s VAL 128 N 0.80 2.41 -0.06 2.63 1.01 -0.35 -1.16 120.40 125.68 3fv5 s VAL 128 Ca -0.03 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.09 3fv5 s VAL 128 Cb -0.15 -1.96 0.01 0.00 0.00 0.00 0.00 36.38 34.28 3fv5 s VAL 128 CO 0.01 0.54 -0.13 0.20 0.00 0.00 0.00 175.10 175.73 3fv5 s ASN 129 N 0.41 1.84 -0.05 3.32 0.01 -0.53 -1.73 114.94 118.22 3fv5 s ASN 129 Ca -0.15 -0.31 0.05 0.00 -0.71 0.00 0.00 52.86 51.74 3fv5 s ASN 129 Cb -0.17 -0.79 -0.00 0.00 0.41 0.00 0.00 41.25 40.69 3fv5 s ASN 129 CO 0.07 0.06 -0.18 -0.69 -1.51 0.00 0.00 177.10 174.84 3fv5 s VAL 130 N 0.54 1.53 -0.24 1.60 1.01 -0.39 -0.46 120.40 123.99 3fv5 s VAL 130 Ca -0.13 -0.77 -0.04 0.00 0.00 0.00 0.00 61.98 61.04 3fv5 s VAL 130 Cb -0.15 -1.31 -0.00 0.00 0.00 0.00 0.00 36.38 34.92 3fv5 s VAL 130 CO 0.04 0.44 -0.01 -0.13 0.00 0.00 0.00 175.10 175.43 3fv5 s ARG 131 N 0.01 3.31 -0.17 2.72 0.52 -0.06 -0.10 118.95 125.18 3fv5 s ARG 131 Ca -0.04 -0.68 -0.17 0.00 -0.52 0.00 0.00 55.73 54.33 3fv5 s ARG 131 Cb -0.12 -3.09 0.05 0.00 0.52 0.00 0.00 34.95 32.31 3fv5 s ARG 131 CO 0.02 -0.25 0.48 1.03 0.02 0.00 0.00 175.30 176.60 3fv5 s ARG 132 N 1.48 0.58 -1.39 3.54 0.52 -0.86 -1.09 118.95 121.73 3fv5 s ARG 132 Ca 0.05 0.62 -0.01 0.00 -0.52 0.00 0.00 55.73 55.87 3fv5 s ARG 132 Cb -0.15 0.28 0.00 0.00 0.52 0.00 0.00 34.95 35.60 3fv5 s ARG 132 CO -0.02 -0.08 0.05 -0.25 0.02 0.00 0.00 175.30 175.03 3fv5 n ASP 133 N 2.70 -4.85 0.00 0.23 8.00 -1.26 -1.03 116.55 120.34 3fv5 n ASP 133 Ca -0.14 0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.42 3fv5 n ASP 133 Cb 0.57 -4.06 0.00 0.00 -0.02 0.00 0.00 41.12 37.61 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 -0.95 0.63 3.37 0.44 0.00 -1.26 -5.02 105.19 102.41 3fv5 n GLY 134 Ca -0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.07 1.48 -0.24 1.61 -1.52 -0.20 -1.41 119.66 119.31 3fv5 s GLN 135 Ca 0.00 -1.28 -0.09 0.00 -1.95 0.00 0.00 55.36 52.04 3fv5 s GLN 135 Cb 0.00 -1.88 -0.04 0.00 -0.22 0.00 0.00 33.01 30.87 3fv5 s GLN 135 CO 0.00 0.46 0.12 0.08 -0.25 0.00 0.00 175.29 175.69 3fv5 s VAL 136 N -1.00 4.89 -0.04 1.09 1.01 0.18 -2.02 120.40 124.51 3fv5 s VAL 136 Ca 0.13 0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.15 3fv5 s VAL 136 Cb -0.10 -3.28 -0.03 0.00 0.00 0.00 0.00 36.38 32.97 3fv5 s VAL 136 CO 0.05 0.34 -0.06 -0.31 0.00 0.00 0.00 175.10 175.12 3fv5 s TYR 137 N 1.28 2.93 0.03 5.22 1.51 0.85 -0.77 117.35 128.41 3fv5 s TYR 137 Ca 0.06 0.01 0.05 0.00 -1.01 0.00 0.00 57.07 56.18 3fv5 s TYR 137 Cb -0.14 -1.68 -0.02 0.00 -0.11 0.00 0.00 41.96 40.01 3fv5 s TYR 137 CO 0.05 0.36 -0.14 1.21 -1.11 0.00 0.00 175.55 175.92 3fv5 s ASN 138 N -1.06 1.69 -0.01 2.29 2.47 0.20 -1.26 114.94 119.26 3fv5 s ASN 138 Ca 0.14 -0.41 -0.19 0.00 0.42 0.00 0.00 52.86 52.82 3fv5 s ASN 138 Cb -0.11 -0.13 0.04 0.00 -1.45 0.00 0.00 41.25 39.60 3fv5 s ASN 138 CO 0.04 0.07 0.41 -0.51 -3.72 0.00 0.00 177.10 173.40 3fv5 s ILE 139 N -0.72 0.04 0.01 -5.21 2.07 -0.70 -0.97 121.20 115.72 3fv5 s ILE 139 Ca 0.03 -0.37 -0.11 0.00 -1.41 0.00 0.00 60.65 58.79 3fv5 s ILE 139 Cb -0.07 -0.78 0.01 0.00 0.13 0.00 0.00 42.46 41.75 3fv5 s ILE 139 CO 0.01 -0.20 0.22 0.00 -1.91 0.00 0.00 174.94 173.06 3fv5 s ALA 140 N -1.54 -0.51 0.09 1.50 0.00 -1.09 -1.21 121.76 118.99 3fv5 s ALA 140 Ca -0.11 -0.00 0.04 0.00 0.00 0.00 0.00 51.96 51.89 3fv5 s ALA 140 Cb -0.03 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.20 3fv5 s ALA 140 CO 0.04 -0.27 -0.12 -0.06 0.00 0.00 0.00 175.76 175.35 3fv5 s PHE 141 N -1.69 1.12 -0.02 0.00 0.40 -0.14 -0.60 117.98 117.05 3fv5 s PHE 141 Ca -0.12 -0.57 0.00 0.00 -0.60 0.00 0.00 56.93 55.65 3fv5 s PHE 141 Cb -0.05 -0.61 0.02 0.00 0.51 0.00 0.00 43.02 42.89 3fv5 s PHE 141 CO 0.01 0.03 0.01 -1.21 0.70 0.00 0.00 175.22 174.76 3fv5 s GLU 142 N -2.34 0.10 -1.48 0.44 2.02 0.14 -0.92 118.70 116.67 3fv5 s GLU 142 Ca 0.02 0.11 -0.02 0.00 0.02 0.00 0.00 54.97 55.10 3fv5 s GLU 142 Cb -0.06 -0.30 0.01 0.00 0.10 0.00 0.00 34.13 33.88 3fv5 s GLU 142 CO 0.01 -0.12 0.15 0.09 0.02 0.00 0.00 175.26 175.41 3fv5 n ASN 143 N 3.96 -5.15 0.00 -0.19 3.02 -0.61 -1.31 115.26 114.97 3fv5 n ASN 143 Ca -0.25 -0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.27 3fv5 n ASN 143 Cb 0.52 -4.28 0.00 0.00 -0.61 0.00 0.00 39.78 35.41 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 0.79 3.46 7.41 0.00 -1.15 -4.92 105.19 109.73 3fv5 n GLY 144 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.21 2.36 0.16 1.61 2.02 -0.43 -4.86 118.70 119.35 3fv5 s GLU 145 Ca 0.00 -0.79 -0.31 0.00 0.02 0.00 0.00 54.97 53.89 3fv5 s GLU 145 Cb 0.00 -2.30 -0.09 0.00 0.10 0.00 0.00 34.13 31.84 3fv5 s GLU 145 CO 0.00 0.60 1.49 0.21 0.02 0.00 0.00 175.26 177.58 3fv5 s LYS 146 N -0.90 4.26 -0.00 1.61 2.20 -1.26 0.27 119.74 125.92 3fv5 s LYS 146 Ca 0.12 2.25 0.01 0.00 -0.36 0.00 0.00 55.97 58.00 3fv5 s LYS 146 Cb -0.11 -3.18 -0.02 0.00 -1.51 0.00 0.00 37.83 33.02 3fv5 s LYS 146 CO 0.02 -0.52 0.05 1.33 -0.36 0.00 0.00 175.35 175.86 3fv5 n VAL 147 N 3.76 0.00 -3.84 4.02 0.24 0.24 -4.85 118.33 117.90 3fv5 n VAL 147 Ca 0.12 -0.31 -0.26 0.00 -2.04 0.00 0.00 64.34 61.86 3fv5 n VAL 147 Cb 0.40 0.80 -0.17 0.00 -1.47 0.00 0.00 33.84 33.40 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 -1.49 1.09 0.63 7.34 2.00 -0.80 -4.97 119.66 123.46 3fv5 s GLN 148 Ca 0.00 -0.18 -0.19 0.00 -2.00 0.00 0.00 55.36 53.00 3fv5 s GLN 148 Cb 0.01 -1.48 -0.02 0.00 0.80 0.00 0.00 33.01 32.32 3fv5 s GLN 148 CO 0.06 -0.34 1.31 -0.51 -0.50 0.00 0.00 175.29 175.31 3fv5 s ASP 149 N 1.81 4.70 0.13 6.67 1.01 -1.26 -2.67 116.67 127.06 3fv5 s ASP 149 Ca 0.04 2.67 -0.35 0.00 0.71 0.00 0.00 52.55 55.61 3fv5 s ASP 149 Cb -0.13 -2.62 -0.16 0.00 1.01 0.00 0.00 42.92 41.02 3fv5 s ASP 149 CO -0.07 -1.95 1.37 -0.11 0.21 0.00 0.00 175.17 174.62 3fv5 n LEU 150 N -1.76 2.10 -3.81 1.23 7.94 -1.26 -4.64 117.00 116.81 3fv5 n LEU 150 Ca 0.15 1.12 -0.13 0.00 -1.11 0.00 0.00 56.01 56.04 3fv5 n LEU 150 Cb 0.47 -1.27 -0.13 0.00 0.53 0.00 0.00 43.42 43.02 3fv5 n LEU 150 CO 0.48 -0.86 -0.21 0.00 -1.11 0.00 0.00 177.39 175.69 3fv5 s GLN 151 N 0.35 0.16 -0.21 1.96 -2.07 -0.15 -4.97 119.66 114.73 3fv5 s GLN 151 Ca 0.80 0.24 -0.28 0.00 -1.82 0.00 0.00 55.36 54.29 3fv5 s GLN 151 Cb -0.84 0.03 0.00 0.00 -1.09 0.00 0.00 33.01 31.11 3fv5 s GLN 151 CO 0.46 -0.05 0.97 0.08 -1.32 0.00 0.00 175.29 175.43 3fv5 s VAL 152 N 0.29 4.75 0.00 3.63 1.01 -1.26 -0.63 120.40 128.18 3fv5 s VAL 152 Ca -0.02 1.89 0.00 0.00 0.00 0.00 0.00 61.98 63.86 3fv5 s VAL 152 Cb -0.03 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 32.10 3fv5 s VAL 152 CO -0.01 -0.12 0.61 1.33 0.00 0.00 0.00 175.10 176.91 3fv5 n VAL 153 N 5.16 0.33 -3.77 2.92 0.24 0.05 -4.99 118.33 118.26 3fv5 n VAL 153 Ca 0.09 -0.57 0.01 0.00 -2.04 0.00 0.00 64.34 61.83 3fv5 n VAL 153 Cb 0.47 0.95 0.00 0.00 -1.47 0.00 0.00 33.84 33.79 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 -0.33 -0.25 0.21 7.63 0.00 -1.20 -4.96 107.32 108.42 3fv5 s GLY 154 Ca 0.00 0.32 0.09 0.00 0.00 0.00 0.00 44.72 45.13 3fv5 s GLY 154 CO 0.00 2.03 -0.18 -0.51 0.00 0.00 0.00 173.10 174.44 3fv5 s THR 155 N -2.35 2.00 0.29 0.90 -4.23 -1.26 -0.64 115.64 110.35 3fv5 s THR 155 Ca 0.19 -2.15 -0.12 0.00 -1.18 0.00 0.00 61.69 58.44 3fv5 s THR 155 Cb 0.02 -2.05 0.01 0.00 1.34 0.00 0.00 72.50 71.82 3fv5 s THR 155 CO -0.01 -0.41 0.54 0.00 -0.54 0.00 0.00 174.62 174.20 3fv5 n GLY 157 N -0.45 0.33 0.37 0.00 0.00 -1.26 -4.44 105.19 99.74 3fv5 n GLY 157 Ca -0.02 -0.26 0.12 0.00 0.00 0.00 0.00 46.02 45.86 3fv5 n GLY 157 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3fv5 h LYS 158 N 0.07 0.59 -0.02 1.61 3.64 -1.95 -1.75 116.57 118.76 3fv5 h LYS 158 Ca -0.49 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 3fv5 h LYS 158 Cb 1.33 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 3fv5 h LYS 158 CO 0.51 0.39 -0.23 0.54 -2.27 0.00 0.00 179.45 178.38 3fv5 n ARG 159 N -4.51 1.56 -2.57 1.90 1.74 -1.26 -4.56 116.66 108.95 3fv5 n ARG 159 Ca 0.15 -1.21 -0.41 0.00 -0.77 0.00 0.00 57.85 55.61 3fv5 n ARG 159 Cb 0.44 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.37 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 -2.27 6.21 0.12 0.55 3.04 -0.66 -4.98 114.94 116.96 3fv5 s ASN 160 Ca 0.25 -0.64 0.03 0.00 0.04 0.00 0.00 52.86 52.54 3fv5 s ASN 160 Cb 0.19 -2.55 -0.04 0.00 -1.54 0.00 0.00 41.25 37.31 3fv5 s ASN 160 CO 0.45 -1.76 -0.08 0.42 -3.04 0.00 0.00 177.10 173.08 3fv5 s THR 161 N 5.52 0.93 -5.00 -5.21 -4.23 -1.26 -4.46 115.64 101.93 3fv5 s THR 161 Ca 0.36 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.87 3fv5 s THR 161 Cb -0.07 -1.78 0.00 0.00 1.34 0.00 0.00 72.50 71.99 3fv5 s THR 161 CO 0.11 -0.80 0.00 0.61 -0.54 0.00 0.00 174.62 174.00 3fv5 n GLY 162 N -0.13 -0.95 3.04 3.99 0.00 -0.25 -4.03 105.19 106.88 3fv5 n GLY 162 Ca -0.11 -1.64 -0.20 0.00 0.00 0.00 0.00 46.02 44.07 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 -1.51 0.86 -0.08 2.61 2.01 -0.67 -0.88 115.64 117.99 3fv5 s THR 163 Ca 0.00 -0.45 0.03 0.00 0.31 0.00 0.00 61.69 61.58 3fv5 s THR 163 Cb 0.00 -0.74 0.01 0.00 0.01 0.00 0.00 72.50 71.78 3fv5 s THR 163 CO 0.00 0.25 -0.17 -0.55 -0.69 0.00 0.00 174.62 173.46 3fv5 s SER 164 N -0.12 2.30 -0.15 3.53 0.15 0.39 -0.98 113.70 118.82 3fv5 s SER 164 Ca 0.02 -0.40 0.01 0.00 0.70 0.00 0.00 55.95 56.27 3fv5 s SER 164 Cb -0.06 -1.06 0.02 0.00 -1.71 0.00 0.00 66.02 63.21 3fv5 s SER 164 CO -0.00 0.08 -0.16 -0.69 1.20 0.00 0.00 173.24 173.67 3fv5 s VAL 165 N 0.56 1.68 -0.20 4.45 1.01 0.14 -1.45 120.40 126.59 3fv5 s VAL 165 Ca -0.16 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.13 3fv5 s VAL 165 Cb -0.17 -1.55 0.03 0.00 0.00 0.00 0.00 36.38 34.69 3fv5 s VAL 165 CO 0.05 0.48 -0.16 -2.28 0.00 0.00 0.00 175.10 173.19 3fv5 s HIS 166 N 1.39 2.78 0.05 5.22 5.04 -0.31 -0.74 115.29 128.72 3fv5 s HIS 166 Ca 0.04 -1.75 0.05 0.00 -1.54 0.00 0.00 55.06 51.86 3fv5 s HIS 166 Cb -0.13 -1.86 -0.02 0.00 0.04 0.00 0.00 32.58 30.61 3fv5 s HIS 166 CO -0.10 -0.80 -0.15 -0.59 -2.34 0.00 0.00 174.74 170.75 3fv5 s PHE 167 N 1.28 1.31 -0.40 3.88 -0.71 -0.34 -0.69 117.98 122.30 3fv5 s PHE 167 Ca 0.01 -0.38 -0.04 0.00 -1.04 0.00 0.00 56.93 55.48 3fv5 s PHE 167 Cb -0.15 -0.77 0.09 0.00 -1.21 0.00 0.00 43.02 40.99 3fv5 s PHE 167 CO -0.10 0.05 0.19 -1.58 -1.34 0.00 0.00 175.22 172.44 3fv5 s TRP 168 N -0.93 3.48 0.41 3.49 0.51 0.01 -1.81 118.94 124.10 3fv5 s TRP 168 Ca 0.02 -2.11 -0.27 0.00 -2.12 0.00 0.00 56.10 51.62 3fv5 s TRP 168 Cb -0.08 -3.02 -0.10 0.00 -0.81 0.00 0.00 33.47 29.46 3fv5 s TRP 168 CO 0.02 -0.92 1.42 -2.30 -0.51 0.00 0.00 176.95 174.66 3fv5 n PRO 169 N 4.69 2.37 -2.75 4.98 -0.02 -1.26 0.07 135.00 143.07 3fv5 n PRO 169 Ca -0.06 0.84 -0.43 0.00 -2.02 0.00 0.00 63.50 61.83 3fv5 n PRO 169 Cb 0.42 -2.59 -0.03 0.00 -0.02 0.00 0.00 33.50 31.27 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 -0.34 6.78 0.62 2.55 -1.08 -0.27 -4.48 116.67 120.45 3fv5 s ASP 170 Ca 0.58 0.80 0.36 0.00 -0.52 0.00 0.00 52.55 53.76 3fv5 s ASP 170 Cb -0.48 -2.49 2.06 0.00 -1.46 0.00 0.00 42.92 40.55 3fv5 s ASP 170 CO 0.60 -0.84 2.29 1.05 0.52 0.00 0.00 175.17 178.80 3fv5 h GLU 171 N 8.27 0.00 0.00 4.34 9.09 -1.92 -2.04 114.58 132.33 3fv5 h GLU 171 Ca -0.22 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.19 3fv5 h GLU 171 Cb 1.07 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.17 3fv5 h GLU 171 CO 0.99 0.01 0.00 1.79 0.05 0.00 0.00 179.01 181.85 3fv5 h THR 172 N 0.00 0.00 -0.00 -1.06 1.35 -1.96 -2.36 112.91 108.88 3fv5 h THR 172 Ca -0.00 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.69 3fv5 h THR 172 Cb 0.03 0.87 0.00 0.00 -1.73 0.00 0.00 68.15 67.32 3fv5 h THR 172 CO 0.00 0.00 -0.63 0.49 -0.25 0.00 0.00 175.52 175.13 3fv5 n PHE 173 N -2.41 0.00 -4.34 4.73 3.72 -0.77 -4.97 117.46 113.42 3fv5 n PHE 173 Ca 0.00 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.14 3fv5 n PHE 173 Cb 0.16 -0.11 -0.13 0.00 -0.94 0.00 0.00 39.48 38.47 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 -2.85 2.07 0.20 1.38 0.08 -0.89 -4.81 117.98 113.16 3fv5 s PHE 174 Ca 0.13 -0.40 -0.11 0.00 0.12 0.00 0.00 56.93 56.67 3fv5 s PHE 174 Cb 0.17 -1.12 0.12 0.00 -0.57 0.00 0.00 43.02 41.63 3fv5 s PHE 174 CO 0.71 0.29 1.84 -0.44 -0.10 0.00 0.00 175.22 177.52 3fv5 h ASP 175 N 3.91 0.82 -3.82 1.36 3.32 -0.77 -3.42 116.42 117.81 3fv5 h ASP 175 Ca -0.48 -0.06 -0.33 0.00 0.02 0.00 0.00 57.03 56.18 3fv5 h ASP 175 Cb 1.18 -0.21 -0.29 0.00 0.22 0.00 0.00 39.33 40.23 3fv5 h ASP 175 CO 0.40 0.63 -0.75 -0.55 -1.72 0.00 0.00 179.24 177.25 3fv5 s SER 176 N -5.90 0.61 0.07 6.45 0.15 -0.82 -5.02 113.70 109.23 3fv5 s SER 176 Ca -0.13 -0.09 0.24 0.00 0.70 0.00 0.00 55.95 56.67 3fv5 s SER 176 Cb 0.14 -0.12 0.96 0.00 -1.71 0.00 0.00 66.02 65.29 3fv5 s SER 176 CO 0.78 0.04 1.75 -0.81 1.20 0.00 0.00 173.24 176.19 3fv5 n PRO 177 N 3.17 0.07 -2.68 5.44 -0.04 -1.26 -4.15 135.00 135.55 3fv5 n PRO 177 Ca -0.15 0.16 -0.42 0.00 -0.04 0.00 0.00 63.50 63.04 3fv5 n PRO 177 Cb 0.57 -1.60 -0.03 0.00 -0.04 0.00 0.00 33.50 32.40 3fv5 n PRO 177 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 3fv5 s ARG 178 N -3.06 4.42 0.26 0.54 3.52 -1.26 -4.64 118.95 118.73 3fv5 s ARG 178 Ca 0.10 1.41 -0.30 0.00 -0.13 0.00 0.00 55.73 56.81 3fv5 s ARG 178 Cb 0.14 -3.54 -0.10 0.00 -1.56 0.00 0.00 34.95 29.89 3fv5 s ARG 178 CO 0.45 -0.32 1.30 -0.06 -0.81 0.00 0.00 175.30 175.87 3fv5 s PHE 179 N 2.02 3.19 -0.26 5.12 0.40 -1.26 -4.57 117.98 122.61 3fv5 s PHE 179 Ca 0.49 1.31 -0.28 0.00 -0.60 0.00 0.00 56.93 57.85 3fv5 s PHE 179 Cb -0.19 -3.63 0.01 0.00 0.51 0.00 0.00 43.02 39.73 3fv5 s PHE 179 CO 0.18 -1.84 1.01 0.45 0.70 0.00 0.00 175.22 175.72 3fv5 s SER 180 N -0.07 6.99 0.19 1.36 0.15 -1.26 -4.94 113.70 116.12 3fv5 s SER 180 Ca 0.53 1.20 -0.06 0.00 0.70 0.00 0.00 55.95 58.31 3fv5 s SER 180 Cb -0.38 -2.52 0.12 0.00 -1.71 0.00 0.00 66.02 61.53 3fv5 s SER 180 CO 0.44 -0.71 1.59 0.58 1.20 0.00 0.00 173.24 176.34 3fv5 h VAL 181 N 5.54 1.27 -0.52 4.45 2.07 -1.99 -2.06 116.25 125.00 3fv5 h VAL 181 Ca -0.20 -1.39 -0.07 0.00 0.82 0.00 0.00 66.70 65.86 3fv5 h VAL 181 Cb 1.07 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 3fv5 h VAL 181 CO 0.98 0.47 0.06 0.77 0.02 0.00 0.00 177.57 179.86 3fv5 h SER 182 N 0.72 0.86 -0.45 0.57 4.64 -1.99 -0.38 113.55 117.52 3fv5 h SER 182 Ca 0.09 -0.28 -0.05 0.00 -0.47 0.00 0.00 61.79 61.09 3fv5 h SER 182 Cb 0.79 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.62 3fv5 h SER 182 CO 0.07 0.92 0.13 0.03 -0.87 0.00 0.00 176.83 177.10 3fv5 h ARG 183 N 0.77 0.78 -0.39 4.77 3.08 -1.96 -0.83 114.38 120.60 3fv5 h ARG 183 Ca 0.16 -0.15 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 3fv5 h ARG 183 Cb 0.44 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 3fv5 h ARG 183 CO 0.02 0.70 0.07 -0.07 -1.07 0.00 0.00 179.97 179.62 3fv5 h LEU 184 N 0.76 0.61 -0.75 3.04 3.38 -1.03 -2.45 115.31 118.86 3fv5 h LEU 184 Ca 0.17 -0.25 -0.12 0.00 0.09 0.00 0.00 57.88 57.77 3fv5 h LEU 184 Cb 0.27 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3fv5 h LEU 184 CO -0.00 0.71 -0.32 0.71 0.09 0.00 0.00 178.44 179.63 3fv5 h THR 185 N 0.49 1.28 -0.56 0.22 1.35 -0.68 -1.15 112.91 113.86 3fv5 h THR 185 Ca 0.12 -1.43 -0.05 0.00 -0.55 0.00 0.00 66.41 64.50 3fv5 h THR 185 Cb 0.35 1.42 -0.02 0.00 -1.73 0.00 0.00 68.15 68.16 3fv5 h THR 185 CO 0.01 0.46 0.15 0.45 -0.25 0.00 0.00 175.52 176.33 3fv5 h HIS 186 N 0.50 0.94 0.21 4.73 3.86 -1.14 -0.47 115.15 123.77 3fv5 h HIS 186 Ca 0.06 -0.11 -0.01 0.00 -1.16 0.00 0.00 60.37 59.15 3fv5 h HIS 186 Cb 0.80 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 29.00 3fv5 h HIS 186 CO 0.03 0.80 -0.10 0.28 0.86 0.00 0.00 177.93 179.80 3fv5 h VAL 187 N 0.80 0.79 -0.52 2.45 2.07 -1.17 -1.76 116.25 118.91 3fv5 h VAL 187 Ca 0.18 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.60 3fv5 h VAL 187 Cb 0.33 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 3fv5 h VAL 187 CO -0.00 0.00 -0.06 -0.07 0.02 0.00 0.00 177.57 177.46 3fv5 h LEU 188 N -0.28 0.93 -0.59 2.57 3.38 -1.09 0.93 115.31 121.15 3fv5 h LEU 188 Ca -0.03 -0.28 0.01 0.00 0.09 0.00 0.00 57.88 57.67 3fv5 h LEU 188 Cb 0.22 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3fv5 h LEU 188 CO 0.05 1.02 0.39 0.50 0.09 0.00 0.00 178.44 180.49 3fv5 h LYS 189 N 0.85 0.78 -0.76 1.13 3.11 -1.10 -0.13 116.57 120.45 3fv5 h LYS 189 Ca 0.15 -0.05 0.01 0.00 -2.81 0.00 0.00 60.65 57.95 3fv5 h LYS 189 Cb 0.59 -0.18 -0.04 0.00 -1.00 0.00 0.00 32.23 31.60 3fv5 h LYS 189 CO 0.04 0.52 0.50 0.00 -2.81 0.00 0.00 179.45 177.69 3fv5 h ALA 190 N 1.22 0.97 -0.21 5.00 0.00 -0.35 -2.15 119.26 123.74 3fv5 h ALA 190 Ca 0.22 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 3fv5 h ALA 190 Cb -0.09 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 3fv5 h ALA 190 CO -0.05 0.36 -0.37 0.87 0.00 0.00 0.00 179.25 180.07 3fv5 h LYS 191 N 1.02 0.45 -0.54 0.00 1.79 -0.41 -2.21 116.57 116.68 3fv5 h LYS 191 Ca 0.28 -0.21 -0.08 0.00 -2.18 0.00 0.00 60.65 58.46 3fv5 h LYS 191 Cb -0.10 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.52 3fv5 h LYS 191 CO -0.07 0.76 0.03 0.00 -1.08 0.00 0.00 179.45 179.09 3fv5 h ALA 192 N 1.23 0.72 0.00 3.86 0.00 -0.55 -1.77 119.26 122.74 3fv5 h ALA 192 Ca 0.04 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 3fv5 h ALA 192 Cb 0.82 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3fv5 h ALA 192 CO 0.07 0.51 -0.40 0.28 0.00 0.00 0.00 179.25 179.71 3fv5 h VAL 193 N 0.80 1.15 0.00 0.00 2.07 -1.29 -2.40 116.25 116.59 3fv5 h VAL 193 Ca 0.16 -1.44 -0.08 0.00 0.82 0.00 0.00 66.70 66.16 3fv5 h VAL 193 Cb 0.49 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.06 3fv5 h VAL 193 CO 0.02 0.39 -0.37 0.25 0.02 0.00 0.00 177.57 177.88 3fv5 h LEU 194 N 0.00 0.00 -6.23 2.57 7.12 -0.87 -3.35 115.31 114.55 3fv5 h LEU 194 Ca -0.00 0.00 -0.59 0.00 0.13 0.00 0.00 57.88 57.42 3fv5 h LEU 194 Cb 0.77 0.00 -0.41 0.00 -0.53 0.00 0.00 40.66 40.50 3fv5 h LEU 194 CO 0.05 0.37 -0.81 0.00 -0.13 0.00 0.00 178.44 177.92 3fv5 n PRO 196 N 1.33 2.12 0.00 0.00 -0.04 -1.19 -1.97 135.00 135.26 3fv5 n PRO 196 Ca 0.26 0.75 0.00 0.00 -0.04 0.00 0.00 63.50 64.46 3fv5 n PRO 196 Cb 0.45 -2.33 0.00 0.00 -0.04 0.00 0.00 33.50 31.58 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 0.88 3.05 3.73 0.55 0.00 0.00 -4.94 105.19 108.46 3fv5 n GLY 197 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.76 4.68 -0.08 1.61 0.11 -0.83 -4.93 120.40 118.20 3fv5 s VAL 198 Ca 0.00 1.88 -0.23 0.00 -2.93 0.00 0.00 61.98 60.70 3fv5 s VAL 198 Cb 0.00 -4.24 -0.03 0.00 -1.53 0.00 0.00 36.38 30.58 3fv5 s VAL 198 CO 0.00 0.30 0.70 -0.70 -3.33 0.00 0.00 175.10 172.07 3fv5 s GLU 199 N 0.23 4.41 -0.09 1.54 2.12 -0.09 -4.48 118.70 122.34 3fv5 s GLU 199 Ca 0.44 0.87 0.04 0.00 0.36 0.00 0.00 54.97 56.68 3fv5 s GLU 199 Cb -0.22 -3.46 -0.01 0.00 0.26 0.00 0.00 34.13 30.70 3fv5 s GLU 199 CO 0.26 0.02 -0.21 0.42 -0.54 0.00 0.00 175.26 175.22 3fv5 s ILE 200 N 0.95 2.40 0.16 -3.70 1.01 -0.28 -0.39 121.20 121.35 3fv5 s ILE 200 Ca 0.37 -0.92 0.08 0.00 0.00 0.00 0.00 60.65 60.18 3fv5 s ILE 200 Cb -0.17 -1.93 -0.04 0.00 0.01 0.00 0.00 42.46 40.32 3fv5 s ILE 200 CO 0.17 0.56 -0.17 0.42 0.00 0.00 0.00 174.94 175.92 3fv5 s THR 201 N 0.05 1.73 -0.18 2.92 -4.23 -0.48 -0.59 115.64 114.86 3fv5 s THR 201 Ca -0.08 -1.93 -0.04 0.00 -1.18 0.00 0.00 61.69 58.46 3fv5 s THR 201 Cb -0.15 -1.82 0.06 0.00 1.34 0.00 0.00 72.50 71.93 3fv5 s THR 201 CO 0.05 -0.37 0.07 0.12 -0.54 0.00 0.00 174.62 173.96 3fv5 s PHE 202 N -2.18 0.45 -0.30 3.99 5.36 0.18 -0.97 117.98 124.50 3fv5 s PHE 202 Ca 0.16 -0.49 -0.13 0.00 -0.96 0.00 0.00 56.93 55.51 3fv5 s PHE 202 Cb -0.05 -0.80 -0.03 0.00 -0.34 0.00 0.00 43.02 41.80 3fv5 s PHE 202 CO 0.06 -0.55 0.28 0.21 -1.46 0.00 0.00 175.22 173.77 3fv5 s LYS 203 N 2.05 3.82 -0.49 10.12 2.20 0.54 -1.10 119.74 136.87 3fv5 s LYS 203 Ca 0.01 -0.30 -0.11 0.00 -0.36 0.00 0.00 55.97 55.22 3fv5 s LYS 203 Cb -0.16 -3.71 0.12 0.00 -1.51 0.00 0.00 37.83 32.57 3fv5 s LYS 203 CO -0.09 -0.32 0.38 0.34 -0.36 0.00 0.00 175.35 175.30 3fv5 s ASP 204 N 1.72 5.83 0.00 1.43 -1.08 0.99 -0.70 116.67 124.86 3fv5 s ASP 204 Ca 0.10 -1.87 0.11 0.00 -0.52 0.00 0.00 52.55 50.37 3fv5 s ASP 204 Cb -0.16 -2.06 0.36 0.00 -1.46 0.00 0.00 42.92 39.60 3fv5 s ASP 204 CO 0.11 -0.73 1.28 -0.62 0.52 0.00 0.00 175.17 175.73 3fv5 n GLU 205 N 5.00 1.65 -0.11 4.34 1.02 0.04 0.10 120.64 132.68 3fv5 n GLU 205 Ca -0.10 -1.01 -0.23 0.00 -0.02 0.00 0.00 57.16 55.80 3fv5 n GLU 205 Cb 0.41 -1.25 -0.11 0.00 -0.02 0.00 0.00 31.44 30.47 3fv5 n GLU 205 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 3fv5 n ILE 206 N 0.30 1.53 1.20 -3.67 5.41 -1.26 -4.28 119.36 118.59 3fv5 n ILE 206 Ca 0.11 -0.11 0.13 0.00 1.00 0.00 0.00 62.75 63.87 3fv5 n ILE 206 Cb 0.25 -2.02 0.29 0.00 -0.71 0.00 0.00 39.64 37.45 3fv5 n ILE 206 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3fv5 n ASN 207 N -4.39 2.36 -3.44 4.38 4.13 -1.21 -4.98 115.26 112.11 3fv5 n ASN 207 Ca -0.37 -1.79 -0.21 0.00 1.68 0.00 0.00 54.58 53.89 3fv5 n ASN 207 Cb 0.72 -0.01 0.06 0.00 -1.54 0.00 0.00 39.78 39.01 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 0.84 -5.44 -4.16 6.41 3.02 0.11 -5.03 115.26 111.03 3fv5 n ASN 208 Ca 0.16 -0.81 -0.12 0.00 -0.03 0.00 0.00 54.58 53.79 3fv5 n ASN 208 Cb 0.49 -4.54 -0.10 0.00 -0.61 0.00 0.00 39.78 35.02 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 -3.44 0.73 -0.02 3.41 -4.23 -0.48 -4.99 115.64 106.62 3fv5 s THR 209 Ca 0.39 -1.76 0.01 0.00 -1.18 0.00 0.00 61.69 59.16 3fv5 s THR 209 Cb -0.08 -1.47 0.01 0.00 1.34 0.00 0.00 72.50 72.30 3fv5 s THR 209 CO 0.78 -0.74 -0.04 -0.70 -0.54 0.00 0.00 174.62 173.38 3fv5 s GLU 210 N -3.31 0.56 -0.00 3.99 2.12 -1.26 -0.00 118.70 120.80 3fv5 s GLU 210 Ca 0.08 -0.12 0.08 0.00 0.36 0.00 0.00 54.97 55.36 3fv5 s GLU 210 Cb 0.01 -0.59 -0.02 0.00 0.26 0.00 0.00 34.13 33.79 3fv5 s GLU 210 CO -0.03 0.01 -0.24 -0.65 -0.54 0.00 0.00 175.26 173.81 3fv5 s GLN 211 N 0.43 2.07 -0.05 4.30 -0.21 -0.26 -4.97 119.66 120.97 3fv5 s GLN 211 Ca -0.05 -0.96 0.03 0.00 0.02 0.00 0.00 55.36 54.40 3fv5 s GLN 211 Cb -0.09 -2.07 0.01 0.00 1.00 0.00 0.00 33.01 31.86 3fv5 s GLN 211 CO -0.00 0.55 -0.13 1.03 -2.12 0.00 0.00 175.29 174.62 3fv5 s ARG 212 N -0.86 1.58 0.01 2.91 0.52 -1.26 -0.65 118.95 121.20 3fv5 s ARG 212 Ca 0.11 -0.44 0.06 0.00 -0.52 0.00 0.00 55.73 54.94 3fv5 s ARG 212 Cb -0.10 -1.35 -0.02 0.00 0.52 0.00 0.00 34.95 34.00 3fv5 s ARG 212 CO 0.00 0.10 -0.20 -1.58 0.02 0.00 0.00 175.30 173.65 3fv5 s TRP 213 N 0.41 1.76 -0.30 -0.53 0.51 0.25 -5.01 118.94 116.02 3fv5 s TRP 213 Ca -0.10 -0.35 -0.03 0.00 -2.12 0.00 0.00 56.10 53.51 3fv5 s TRP 213 Cb -0.13 -1.09 0.19 0.00 -0.81 0.00 0.00 33.47 31.62 3fv5 s TRP 213 CO 0.03 0.02 0.76 0.00 -0.51 0.00 0.00 176.95 177.25