#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fl3 s GLU 2 N 0.00 4.22 0.58 1.64 2.12 -1.26 -4.97 118.70 121.03 3fl3 s GLU 2 Ca 0.00 2.35 -0.16 0.00 0.36 0.00 0.00 54.97 57.52 3fl3 s GLU 2 Cb 0.00 -3.14 -0.05 0.00 0.26 0.00 0.00 34.13 31.20 3fl3 s GLU 2 CO 0.00 -0.57 1.05 0.95 -0.54 0.00 0.00 175.26 176.15 3fl3 s THR 3 N 0.89 3.90 0.25 -1.70 -4.23 -1.26 -4.84 115.64 108.65 3fl3 s THR 3 Ca 0.68 0.92 -0.02 0.00 -1.18 0.00 0.00 61.69 62.08 3fl3 s THR 3 Cb -0.43 -3.43 0.23 0.00 1.34 0.00 0.00 72.50 70.20 3fl3 s THR 3 CO 0.34 -0.51 1.76 0.00 -0.54 0.00 0.00 174.62 175.67 3fl3 h ALA 4 N 0.58 1.20 -0.75 3.99 0.00 -1.99 0.77 119.26 123.05 3fl3 h ALA 4 Ca -0.47 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 3fl3 h ALA 4 Cb 1.22 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 3fl3 h ALA 4 CO 0.58 -0.10 0.32 0.00 0.00 0.00 0.00 179.25 180.05 3fl3 h ALA 5 N 1.54 0.97 -0.21 0.00 0.00 -2.00 -1.48 119.26 118.08 3fl3 h ALA 5 Ca 0.44 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 55.02 3fl3 h ALA 5 Cb 0.60 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3fl3 h ALA 5 CO -0.35 0.58 -0.48 0.00 0.00 0.00 0.00 179.25 179.00 3fl3 h ALA 6 N 1.16 0.77 -0.83 0.00 0.00 -1.73 -2.31 119.26 116.33 3fl3 h ALA 6 Ca 0.25 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 3fl3 h ALA 6 Cb 0.18 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 3fl3 h ALA 6 CO -0.02 0.67 0.47 -0.22 0.00 0.00 0.00 179.25 180.15 3fl3 h LYS 7 N 0.45 1.14 -0.41 0.00 3.64 -0.62 -0.80 116.57 119.96 3fl3 h LYS 7 Ca 0.02 -0.12 -0.04 0.00 -1.27 0.00 0.00 60.65 59.24 3fl3 h LYS 7 Cb 1.00 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.57 3fl3 h LYS 7 CO 0.09 0.82 0.09 0.35 -2.27 0.00 0.00 179.45 178.53 3fl3 h PHE 8 N 1.14 0.70 -0.81 1.91 3.04 -0.99 0.44 116.94 122.38 3fl3 h PHE 8 Ca 0.29 -0.09 0.01 0.00 3.98 0.00 0.00 57.97 62.17 3fl3 h PHE 8 Cb -0.00 -0.20 -0.04 0.00 2.56 0.00 0.00 35.95 38.27 3fl3 h PHE 8 CO 0.00 0.68 0.54 0.93 -2.02 0.00 0.00 178.31 178.43 3fl3 h GLU 9 N 0.53 1.06 -0.14 1.11 5.08 -1.13 0.18 114.58 121.27 3fl3 h GLU 9 Ca 0.13 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 3fl3 h GLU 9 Cb 0.34 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3fl3 h GLU 9 CO 0.00 0.70 0.06 -0.09 -1.00 0.00 0.00 179.01 178.69 3fl3 h ARG 10 N 1.09 0.20 0.00 2.33 2.43 -0.80 -1.16 114.38 118.47 3fl3 h ARG 10 Ca 0.30 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.34 3fl3 h ARG 10 Cb -0.11 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 3fl3 h ARG 10 CO -0.07 0.27 -0.47 1.96 -1.51 0.00 0.00 179.97 180.15 3fl3 h GLN 11 N 0.09 0.00 0.00 0.20 4.20 -0.76 -3.41 115.11 115.43 3fl3 h GLN 11 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 3fl3 h GLN 11 Cb 0.14 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.92 3fl3 h GLN 11 CO -0.01 0.47 -0.15 0.72 -0.67 0.00 0.00 178.83 179.20 3fl3 n HIS 12 N -3.71 0.00 -3.63 2.96 8.25 0.04 -5.04 115.22 114.08 3fl3 n HIS 12 Ca -0.01 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.09 3fl3 n HIS 12 Cb 0.54 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.57 3fl3 n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 3fl3 s MET 13 N -0.56 4.19 -0.44 -0.41 -1.94 -0.44 -4.98 119.30 114.72 3fl3 s MET 13 Ca 0.00 -0.10 0.07 0.00 -1.71 0.00 0.00 55.69 53.95 3fl3 s MET 13 Cb 0.00 -3.45 0.23 0.00 2.01 0.00 0.00 34.83 33.61 3fl3 s MET 13 CO 0.00 0.21 0.62 -3.47 -0.01 0.00 0.00 175.02 172.37 3fl3 n ASP 14 N 3.76 -1.26 -4.74 3.03 2.03 -1.26 -4.85 116.55 113.27 3fl3 n ASP 14 Ca -0.14 -2.85 -0.42 0.00 0.52 0.00 0.00 54.79 51.91 3fl3 n ASP 14 Cb 0.52 0.38 -0.02 0.00 -0.72 0.00 0.00 41.12 41.28 3fl3 n ASP 14 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 3fl3 s SER 15 N -0.91 6.44 0.43 1.67 0.01 -1.26 -4.92 113.70 115.16 3fl3 s SER 15 Ca 0.33 2.85 -0.25 0.00 1.31 0.00 0.00 55.95 60.19 3fl3 s SER 15 Cb 0.15 -2.62 -0.08 0.00 0.21 0.00 0.00 66.02 63.68 3fl3 s SER 15 CO -0.16 -0.88 1.27 -0.94 0.41 0.00 0.00 173.24 172.94 3fl3 s SER 16 N 0.69 6.21 0.91 2.44 1.04 -1.26 -5.03 113.70 118.71 3fl3 s SER 16 Ca 0.66 2.57 -0.13 0.00 0.48 0.00 0.00 55.95 59.52 3fl3 s SER 16 Cb -0.47 -2.63 0.14 0.00 0.10 0.00 0.00 66.02 63.17 3fl3 s SER 16 CO 0.42 -0.91 1.18 0.42 0.98 0.00 0.00 173.24 175.33 3fl3 s THR 17 N -1.33 1.97 0.05 2.02 -4.23 -1.26 -4.85 115.64 108.02 3fl3 s THR 17 Ca 0.59 0.00 -0.22 0.00 -1.18 0.00 0.00 61.69 60.89 3fl3 s THR 17 Cb -0.36 -2.85 -0.13 0.00 1.34 0.00 0.00 72.50 70.50 3fl3 s THR 17 CO 0.45 0.00 1.49 -1.28 -0.54 0.00 0.00 174.62 174.74 3fl3 h SER 18 N -1.48 0.22 0.01 3.99 0.87 -1.97 -1.90 113.55 113.28 3fl3 h SER 18 Ca -0.48 -0.30 -0.00 0.00 -1.23 0.00 0.00 61.79 59.79 3fl3 h SER 18 Cb 1.31 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 63.21 3fl3 h SER 18 CO 0.57 0.46 -0.00 -0.65 -0.53 0.00 0.00 176.83 176.67 3fl3 h PRO 19 N -0.04 0.00 -0.02 2.24 0.11 -2.02 -1.26 132.00 131.03 3fl3 h PRO 19 Ca 0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.15 3fl3 h PRO 19 Cb 0.35 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.46 3fl3 h PRO 19 CO 0.01 0.00 -0.04 0.00 -0.21 0.00 0.00 178.00 177.76 3fl3 n ALA 20 N -2.44 2.62 -1.78 -0.75 0.00 -1.14 -4.86 120.51 112.16 3fl3 n ALA 20 Ca -0.03 -0.51 -0.35 0.00 0.00 0.00 0.00 53.44 52.55 3fl3 n ALA 20 Cb 0.09 -1.07 -0.02 0.00 0.00 0.00 0.00 19.45 18.45 3fl3 n ALA 20 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3fl3 s SER 21 N -2.06 6.19 0.62 0.00 1.04 -0.48 -4.81 113.70 114.20 3fl3 s SER 21 Ca 0.34 2.08 0.37 0.00 0.48 0.00 0.00 55.95 59.22 3fl3 s SER 21 Cb 0.21 -2.58 2.07 0.00 0.10 0.00 0.00 66.02 65.82 3fl3 s SER 21 CO 0.35 -0.89 2.29 0.77 0.98 0.00 0.00 173.24 176.73 3fl3 h SER 22 N 1.66 0.00 0.24 7.02 4.64 -1.91 0.46 113.55 125.67 3fl3 h SER 22 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3fl3 h SER 22 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3fl3 h SER 22 CO 0.59 0.01 0.00 0.77 -0.87 0.00 0.00 176.83 177.33 3fl3 h SER 23 N 0.00 0.00 -0.57 4.97 4.64 -1.91 -1.22 113.55 119.46 3fl3 h SER 23 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3fl3 h SER 23 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 3fl3 h SER 23 CO 0.00 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.55 3fl3 n ASN 24 N -2.92 3.66 -0.09 4.97 3.02 0.15 -4.23 115.26 119.82 3fl3 n ASN 24 Ca -0.02 -1.99 -0.07 0.00 -0.03 0.00 0.00 54.58 52.48 3fl3 n ASN 24 Cb 0.12 -0.37 0.01 0.00 -0.61 0.00 0.00 39.78 38.92 3fl3 n ASN 24 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 3fl3 h TYR 25 N 4.10 0.19 -0.53 3.10 5.03 -1.29 -2.68 116.97 124.90 3fl3 h TYR 25 Ca 0.00 0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.27 3fl3 h TYR 25 Cb 0.96 -0.04 -0.02 0.00 1.55 0.00 0.00 36.73 39.18 3fl3 h TYR 25 CO 0.37 0.08 0.12 0.00 -1.32 0.00 0.00 178.16 177.41 3fl3 h ASN 27 N 0.74 0.51 -0.04 0.00 2.35 -1.77 0.79 115.58 118.15 3fl3 h ASN 27 Ca 0.16 0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.96 3fl3 h ASN 27 Cb 0.36 -0.02 -0.00 0.00 0.05 0.00 0.00 38.32 38.71 3fl3 h ASN 27 CO 0.00 0.27 -0.06 0.25 -1.65 0.00 0.00 177.43 176.25 3fl3 h LEU 28 N 0.64 0.12 -0.42 1.61 5.85 -1.09 -3.31 115.31 118.70 3fl3 h LEU 28 Ca 0.39 -0.52 -0.16 0.00 0.84 0.00 0.00 57.88 58.43 3fl3 h LEU 28 Cb 0.45 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 3fl3 h LEU 28 CO -0.29 0.62 -0.37 0.24 -0.34 0.00 0.00 178.44 178.30 3fl3 h MET 29 N -0.37 0.93 -4.43 1.25 2.86 -0.97 -3.41 114.93 110.78 3fl3 h MET 29 Ca 0.00 -0.47 -0.38 0.00 -2.06 0.00 0.00 59.70 56.79 3fl3 h MET 29 Cb 0.59 0.01 0.07 0.00 0.06 0.00 0.00 31.60 32.33 3fl3 h MET 29 CO 0.01 1.13 1.50 -1.33 1.06 0.00 0.00 176.91 179.28 3fl3 n MET 30 N -4.06 0.42 -0.97 1.72 2.81 0.26 -4.53 117.12 112.76 3fl3 n MET 30 Ca -0.02 -1.00 0.00 0.00 -1.81 0.00 0.00 57.70 54.88 3fl3 n MET 30 Cb 0.53 -2.39 0.00 0.00 -0.71 0.00 0.00 33.22 30.66 3fl3 n MET 30 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3fl3 n ARG 33 N 6.47 -1.93 -3.08 0.03 5.12 -1.26 -0.91 116.66 121.11 3fl3 n ARG 33 Ca 0.31 0.48 -0.19 0.00 -1.93 0.00 0.00 57.85 56.52 3fl3 n ARG 33 Cb 0.25 -4.96 0.04 0.00 -1.16 0.00 0.00 32.46 26.63 3fl3 n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 3fl3 n ASN 34 N -0.93 -5.54 -1.23 0.55 3.02 -1.26 -4.91 115.26 104.95 3fl3 n ASN 34 Ca 0.00 -0.31 0.11 0.00 -0.03 0.00 0.00 54.58 54.35 3fl3 n ASN 34 Cb 0.48 -4.30 0.29 0.00 -0.61 0.00 0.00 39.78 35.64 3fl3 n ASN 34 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3fl3 n LEU 35 N -3.74 3.59 -0.25 3.41 4.77 -0.09 -4.17 117.00 120.53 3fl3 n LEU 35 Ca -0.06 -1.76 0.04 0.00 -0.03 0.00 0.00 56.01 54.19 3fl3 n LEU 35 Cb 0.59 -0.43 0.05 0.00 -2.33 0.00 0.00 43.42 41.30 3fl3 n LEU 35 CO 0.45 0.88 0.40 0.35 -1.33 0.00 0.00 177.39 178.14 3fl3 n THR 36 N 1.47 0.82 -0.05 -5.08 -2.24 -1.22 -2.62 114.28 105.35 3fl3 n THR 36 Ca 0.22 -0.97 -0.15 0.00 -2.27 0.00 0.00 64.05 60.89 3fl3 n THR 36 Cb 0.57 0.26 -0.07 0.00 -2.10 0.00 0.00 70.33 68.99 3fl3 n THR 36 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3fl3 h LYS 37 N 0.00 0.57 0.00 -0.78 1.79 -1.90 -3.36 116.57 112.89 3fl3 h LYS 37 Ca 0.00 -0.38 -0.08 0.00 -2.18 0.00 0.00 60.65 58.00 3fl3 h LYS 37 Cb 1.13 0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 31.82 3fl3 h LYS 37 CO 0.00 1.00 -1.74 -0.25 -1.08 0.00 0.00 179.45 177.38 3fl3 n ASP 38 N -4.28 1.75 -3.67 0.86 8.00 -1.26 -5.05 116.55 112.90 3fl3 n ASP 38 Ca -0.06 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.43 3fl3 n ASP 38 Cb 0.53 1.36 -0.01 0.00 -0.02 0.00 0.00 41.12 42.99 3fl3 n ASP 38 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fl3 s ARG 39 N -2.75 0.85 -0.17 -1.24 3.03 -1.26 -5.08 118.95 112.33 3fl3 s ARG 39 Ca -0.06 -0.48 -0.26 0.00 2.03 0.00 0.00 55.73 56.96 3fl3 s ARG 39 Cb 0.07 0.28 -0.01 0.00 -1.03 0.00 0.00 34.95 34.26 3fl3 s ARG 39 CO 0.57 -0.39 0.85 0.00 -1.13 0.00 0.00 175.30 175.20 3fl3 s LYS 41 N 2.21 4.32 0.20 0.00 2.20 -1.08 -4.90 119.74 122.70 3fl3 s LYS 41 Ca 0.39 1.98 -0.10 0.00 -0.36 0.00 0.00 55.97 57.88 3fl3 s LYS 41 Cb -0.17 -3.39 0.26 0.00 -1.51 0.00 0.00 37.83 33.03 3fl3 s LYS 41 CO 0.12 -0.46 1.74 -1.35 -0.36 0.00 0.00 175.35 175.04 3fl3 h PRO 42 N 7.19 0.36 -3.49 4.03 0.11 -1.94 -3.43 132.00 134.82 3fl3 h PRO 42 Ca -0.40 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.55 3fl3 h PRO 42 Cb 1.20 -0.08 -0.20 0.00 0.11 0.00 0.00 31.00 32.03 3fl3 h PRO 42 CO 0.87 0.24 -0.45 0.08 -0.21 0.00 0.00 178.00 178.52 3fl3 s VAL 43 N -6.10 0.09 0.10 3.15 1.01 -1.26 -0.93 120.40 116.46 3fl3 s VAL 43 Ca -0.13 -0.73 -0.23 0.00 0.00 0.00 0.00 61.98 60.89 3fl3 s VAL 43 Cb 0.17 -0.57 0.06 0.00 0.00 0.00 0.00 36.38 36.04 3fl3 s VAL 43 CO 0.74 -0.40 0.56 0.21 0.00 0.00 0.00 175.10 176.21 3fl3 s ASN 44 N -1.56 -0.50 -0.04 3.32 2.47 -0.40 -5.00 114.94 113.23 3fl3 s ASN 44 Ca -0.12 0.08 0.03 0.00 0.42 0.00 0.00 52.86 53.27 3fl3 s ASN 44 Cb -0.06 0.55 0.00 0.00 -1.45 0.00 0.00 41.25 40.29 3fl3 s ASN 44 CO 0.01 -0.85 -0.12 -0.89 -3.72 0.00 0.00 177.10 171.53 3fl3 s THR 45 N -3.12 1.08 -0.07 -5.21 2.01 -1.26 -1.36 115.64 107.71 3fl3 s THR 45 Ca -0.02 -0.50 -0.01 0.00 0.31 0.00 0.00 61.69 61.47 3fl3 s THR 45 Cb -0.00 -0.96 -0.03 0.00 0.01 0.00 0.00 72.50 71.52 3fl3 s THR 45 CO -0.07 0.33 -0.02 -0.36 -0.69 0.00 0.00 174.62 173.81 3fl3 s PHE 46 N 0.26 3.08 -0.15 4.92 0.08 0.02 -4.96 117.98 121.23 3fl3 s PHE 46 Ca -0.06 0.13 -0.03 0.00 0.12 0.00 0.00 56.93 57.08 3fl3 s PHE 46 Cb -0.11 -1.75 -0.03 0.00 -0.57 0.00 0.00 43.02 40.56 3fl3 s PHE 46 CO 0.02 0.43 -0.04 0.08 -0.10 0.00 0.00 175.22 175.60 3fl3 s VAL 47 N -0.88 3.85 -2.62 -0.44 1.01 -1.26 -0.94 120.40 119.11 3fl3 s VAL 47 Ca 0.14 -0.38 0.22 0.00 0.00 0.00 0.00 61.98 61.96 3fl3 s VAL 47 Cb -0.11 -2.68 0.24 0.00 0.00 0.00 0.00 36.38 33.83 3fl3 s VAL 47 CO 0.03 0.50 1.24 1.41 0.00 0.00 0.00 175.10 178.28 3fl3 n HIS 48 N 3.49 0.14 -1.34 5.22 -0.00 0.23 -4.93 115.22 118.03 3fl3 n HIS 48 Ca -0.17 -0.08 -0.29 0.00 -0.00 0.00 0.00 57.72 57.18 3fl3 n HIS 48 Cb 0.52 -0.00 0.16 0.00 -0.00 0.00 0.00 29.99 30.68 3fl3 n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 3fl3 s GLU 49 N -1.71 0.61 0.83 -0.41 0.41 -1.26 -4.97 118.70 112.20 3fl3 s GLU 49 Ca 0.29 0.35 -0.11 0.00 -0.41 0.00 0.00 54.97 55.10 3fl3 s GLU 49 Cb 0.19 -1.77 0.09 0.00 -1.78 0.00 0.00 34.13 30.86 3fl3 s GLU 49 CO 0.28 -2.57 1.10 -1.54 -0.49 0.00 0.00 175.26 172.04 3fl3 s SER 50 N -3.76 3.95 0.38 -0.19 1.04 -1.26 -4.86 113.70 109.01 3fl3 s SER 50 Ca 0.65 1.87 0.11 0.00 0.48 0.00 0.00 55.95 59.06 3fl3 s SER 50 Cb -0.16 -2.49 0.76 0.00 0.10 0.00 0.00 66.02 64.22 3fl3 s SER 50 CO 0.56 -2.39 1.88 0.25 0.98 0.00 0.00 173.24 174.51 3fl3 h LEU 51 N -1.38 0.13 -0.72 2.42 5.85 -1.96 -1.35 115.31 118.30 3fl3 h LEU 51 Ca -0.44 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.20 3fl3 h LEU 51 Cb 1.25 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.21 3fl3 h LEU 51 CO 0.49 0.38 0.28 0.00 -0.34 0.00 0.00 178.44 179.25 3fl3 h ALA 52 N 1.63 0.93 -0.02 1.25 0.00 -1.99 0.19 119.26 121.26 3fl3 h ALA 52 Ca 0.02 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 3fl3 h ALA 52 Cb 0.50 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3fl3 h ALA 52 CO 0.03 0.56 -0.51 -0.44 0.00 0.00 0.00 179.25 178.90 3fl3 h ASP 53 N 1.03 0.06 0.14 0.00 5.19 -1.71 -0.72 116.42 120.40 3fl3 h ASP 53 Ca 0.24 -0.03 -0.18 0.00 -0.62 0.00 0.00 57.03 56.44 3fl3 h ASP 53 Cb 0.23 -0.02 0.02 0.00 0.18 0.00 0.00 39.33 39.74 3fl3 h ASP 53 CO -0.02 0.56 -0.81 0.58 -3.12 0.00 0.00 179.24 176.43 3fl3 h VAL 54 N 0.04 1.51 -0.36 -1.35 2.07 -0.75 -3.16 116.25 114.24 3fl3 h VAL 54 Ca -0.00 -2.53 0.05 0.00 0.82 0.00 0.00 66.70 65.04 3fl3 h VAL 54 Cb 0.92 3.20 -0.02 0.00 -1.52 0.00 0.00 31.29 33.87 3fl3 h VAL 54 CO 0.07 0.71 0.25 1.56 0.02 0.00 0.00 177.57 180.18 3fl3 h GLN 55 N -0.39 0.28 0.00 1.57 4.20 -0.55 -1.66 115.11 118.55 3fl3 h GLN 55 Ca -0.14 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.55 3fl3 h GLN 55 Cb 1.63 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 29.34 3fl3 h GLN 55 CO 0.14 0.18 -0.02 0.00 -0.67 0.00 0.00 178.83 178.47 3fl3 h ALA 56 N 1.80 1.39 0.00 3.87 0.00 -1.09 -2.42 119.26 122.81 3fl3 h ALA 56 Ca 0.16 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 3fl3 h ALA 56 Cb 0.27 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 3fl3 h ALA 56 CO -0.03 0.02 -0.01 0.28 0.00 0.00 0.00 179.25 179.51 3fl3 h VAL 57 N 0.00 0.27 0.00 0.00 2.07 -1.33 -1.43 116.25 115.83 3fl3 h VAL 57 Ca -0.00 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.45 3fl3 h VAL 57 Cb 0.06 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 3fl3 h VAL 57 CO 0.00 0.01 0.00 0.00 0.02 0.00 0.00 177.57 177.60 3fl3 n SER 59 N -1.15 1.71 0.00 0.00 3.41 -0.54 -5.00 113.62 112.06 3fl3 n SER 59 Ca 0.10 -2.76 0.00 0.00 -0.26 0.00 0.00 58.87 55.95 3fl3 n SER 59 Cb 0.10 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 63.69 3fl3 n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3fl3 n GLN 60 N -1.03 0.51 -2.77 4.33 6.02 -0.31 -5.02 117.38 119.11 3fl3 n GLN 60 Ca 0.11 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.68 3fl3 n GLN 60 Cb 0.64 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.87 3fl3 n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 3fl3 s LYS 61 N 3.95 3.47 0.12 -1.09 2.47 -0.69 -4.86 119.74 123.12 3fl3 s LYS 61 Ca 0.00 0.05 -0.31 0.00 -1.56 0.00 0.00 55.97 54.15 3fl3 s LYS 61 Cb 0.00 -3.99 -0.09 0.00 -1.46 0.00 0.00 37.83 32.30 3fl3 s LYS 61 CO 0.00 -1.41 1.50 1.21 0.16 0.00 0.00 175.35 176.81 3fl3 s ASN 62 N 2.60 6.70 0.13 1.43 2.47 -1.26 0.08 114.94 127.09 3fl3 s ASN 62 Ca 0.36 2.45 0.00 0.00 0.42 0.00 0.00 52.86 56.10 3fl3 s ASN 62 Cb -0.10 -2.58 -0.04 0.00 -1.45 0.00 0.00 41.25 37.07 3fl3 s ASN 62 CO 0.24 -0.76 0.02 0.68 -3.72 0.00 0.00 177.10 173.56 3fl3 s VAL 63 N 1.40 0.36 0.31 -5.21 -7.23 -0.30 -4.89 120.40 104.85 3fl3 s VAL 63 Ca 0.68 -1.92 -0.28 0.00 -1.81 0.00 0.00 61.98 58.64 3fl3 s VAL 63 Cb -0.40 -1.97 -0.10 0.00 0.56 0.00 0.00 36.38 34.47 3fl3 s VAL 63 CO 0.31 -0.57 1.14 0.00 -0.31 0.00 0.00 175.10 175.67 3fl3 s ALA 64 N -3.87 3.37 0.54 1.32 0.00 -1.26 -3.70 121.76 118.16 3fl3 s ALA 64 Ca 0.21 0.96 -0.16 0.00 0.00 0.00 0.00 51.96 52.97 3fl3 s ALA 64 Cb 0.07 -3.36 -0.07 0.00 0.00 0.00 0.00 23.12 19.76 3fl3 s ALA 64 CO 0.00 -0.30 1.00 0.00 0.00 0.00 0.00 175.76 176.46 3fl3 h LYS 66 N 0.71 0.38 -0.00 0.00 1.57 -1.91 -1.89 116.57 115.42 3fl3 h LYS 66 Ca -0.46 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 3fl3 h LYS 66 Cb 1.19 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.41 3fl3 h LYS 66 CO 0.61 0.25 -0.03 0.27 -0.57 0.00 0.00 179.45 179.98 3fl3 n ASN 67 N -4.48 0.04 0.00 0.86 2.04 -1.26 -4.93 115.26 107.53 3fl3 n ASN 67 Ca 0.06 0.27 0.00 0.00 -0.44 0.00 0.00 54.58 54.47 3fl3 n ASN 67 Cb 0.24 -0.40 0.00 0.00 -2.53 0.00 0.00 39.78 37.09 3fl3 n ASN 67 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3fl3 n GLY 68 N 1.44 1.92 3.74 4.83 0.00 -0.71 -5.09 105.19 111.32 3fl3 n GLY 68 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 3fl3 n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fl3 s GLN 69 N -0.63 0.73 -0.17 1.61 -0.21 -1.26 -4.78 119.66 114.94 3fl3 s GLN 69 Ca 0.00 0.33 0.17 0.00 0.02 0.00 0.00 55.36 55.87 3fl3 s GLN 69 Cb 0.00 -1.79 0.45 0.00 1.00 0.00 0.00 33.01 32.67 3fl3 s GLN 69 CO 0.00 -2.49 1.33 0.25 -2.12 0.00 0.00 175.29 172.27 3fl3 n THR 70 N -3.97 2.18 -1.28 -0.19 -2.24 -1.26 -1.50 114.28 106.02 3fl3 n THR 70 Ca 0.06 -2.12 -0.20 0.00 -2.27 0.00 0.00 64.05 59.52 3fl3 n THR 70 Cb 0.59 -0.26 0.18 0.00 -2.10 0.00 0.00 70.33 68.74 3fl3 n THR 70 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3fl3 n ASN 71 N -0.88 3.55 -4.87 3.42 6.94 -1.26 -4.82 115.26 117.34 3fl3 n ASN 71 Ca 0.21 -3.65 -0.32 0.00 -0.02 0.00 0.00 54.58 50.80 3fl3 n ASN 71 Cb 0.82 -0.80 -0.05 0.00 -2.36 0.00 0.00 39.78 37.39 3fl3 n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3fl3 s TYR 73 N -1.41 0.54 -0.10 0.00 1.51 0.50 -1.15 117.35 117.24 3fl3 s TYR 73 Ca 0.31 -0.12 -0.03 0.00 -1.01 0.00 0.00 57.07 56.21 3fl3 s TYR 73 Cb -0.13 -0.35 -0.03 0.00 -0.11 0.00 0.00 41.96 41.34 3fl3 s TYR 73 CO 0.23 -0.01 0.03 -1.14 -1.11 0.00 0.00 175.55 173.55 3fl3 s GLN 74 N -0.22 3.17 0.39 -0.62 0.74 0.11 -1.22 119.66 122.01 3fl3 s GLN 74 Ca 0.02 -0.36 -0.26 0.00 0.05 0.00 0.00 55.36 54.80 3fl3 s GLN 74 Cb -0.03 -2.90 -0.09 0.00 1.10 0.00 0.00 33.01 31.10 3fl3 s GLN 74 CO -0.00 0.66 1.23 -1.54 -0.55 0.00 0.00 175.29 175.08 3fl3 s SER 75 N -0.75 6.53 0.37 6.67 1.04 0.07 -1.70 113.70 125.94 3fl3 s SER 75 Ca 0.12 2.49 0.05 0.00 0.48 0.00 0.00 55.95 59.09 3fl3 s SER 75 Cb -0.12 -2.63 0.73 0.00 0.10 0.00 0.00 66.02 64.10 3fl3 s SER 75 CO 0.02 -0.68 2.00 1.88 0.98 0.00 0.00 173.24 177.44 3fl3 h TYR 76 N 2.82 0.61 -1.57 5.02 0.05 -1.95 -3.43 116.97 118.51 3fl3 h TYR 76 Ca -0.49 -0.00 -0.62 0.00 0.05 0.00 0.00 58.73 57.67 3fl3 h TYR 76 Cb 1.24 -0.20 -0.13 0.00 1.01 0.00 0.00 36.73 38.65 3fl3 h TYR 76 CO 0.55 0.43 -0.58 -1.54 -1.05 0.00 0.00 178.16 175.97 3fl3 s SER 77 N -6.64 3.66 0.57 3.88 1.04 -1.26 -5.06 113.70 109.89 3fl3 s SER 77 Ca -0.09 -1.46 -0.16 0.00 0.48 0.00 0.00 55.95 54.73 3fl3 s SER 77 Cb 0.17 -0.08 -0.05 0.00 0.10 0.00 0.00 66.02 66.16 3fl3 s SER 77 CO 0.75 -0.60 1.03 0.42 0.98 0.00 0.00 173.24 175.83 3fl3 s THR 78 N -2.86 4.09 0.14 2.02 -4.23 -1.26 -4.38 115.64 109.16 3fl3 s THR 78 Ca 0.28 0.97 0.07 0.00 -1.18 0.00 0.00 61.69 61.83 3fl3 s THR 78 Cb 0.07 -3.51 -0.04 0.00 1.34 0.00 0.00 72.50 70.36 3fl3 s THR 78 CO 0.14 -0.60 -0.17 -0.04 -0.54 0.00 0.00 174.62 173.41 3fl3 s MET 79 N -4.15 1.15 -0.16 3.99 -1.94 0.26 -4.84 119.30 113.61 3fl3 s MET 79 Ca 0.61 -1.30 -0.29 0.00 -1.71 0.00 0.00 55.69 53.01 3fl3 s MET 79 Cb -0.14 -1.17 -0.02 0.00 2.01 0.00 0.00 34.83 35.51 3fl3 s MET 79 CO 0.36 0.24 1.35 0.45 -0.01 0.00 0.00 175.02 177.41 3fl3 s SER 80 N -2.45 6.85 0.15 3.03 0.15 -1.26 -1.38 113.70 118.79 3fl3 s SER 80 Ca 0.11 1.73 0.00 0.00 0.70 0.00 0.00 55.95 58.50 3fl3 s SER 80 Cb -0.06 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.67 3fl3 s SER 80 CO 0.05 -0.84 0.03 0.27 1.20 0.00 0.00 173.24 173.95 3fl3 s ILE 81 N 3.75 0.37 -0.07 6.45 -4.36 -0.57 -0.60 121.20 126.18 3fl3 s ILE 81 Ca 0.59 -1.94 0.03 0.00 -0.26 0.00 0.00 60.65 59.06 3fl3 s ILE 81 Cb -0.23 -2.08 0.01 0.00 1.25 0.00 0.00 42.46 41.41 3fl3 s ILE 81 CO 0.18 -0.47 -0.14 -0.89 0.24 0.00 0.00 174.94 173.86 3fl3 s THR 82 N -3.86 1.30 -0.17 8.37 2.01 -0.12 -0.96 115.64 122.21 3fl3 s THR 82 Ca 0.24 -0.58 -0.08 0.00 0.31 0.00 0.00 61.69 61.58 3fl3 s THR 82 Cb 0.07 -1.16 -0.04 0.00 0.01 0.00 0.00 72.50 71.37 3fl3 s THR 82 CO 0.03 0.39 0.11 -0.62 -0.69 0.00 0.00 174.62 173.83 3fl3 s ASP 83 N 0.53 6.04 -0.12 3.53 -1.08 0.31 -0.80 116.67 125.08 3fl3 s ASP 83 Ca -0.14 0.25 0.01 0.00 -0.52 0.00 0.00 52.55 52.15 3fl3 s ASP 83 Cb -0.15 -2.01 -0.01 0.00 -1.46 0.00 0.00 42.92 39.28 3fl3 s ASP 83 CO 0.04 0.25 -0.17 0.00 0.52 0.00 0.00 175.17 175.81 3fl3 s ARG 85 N 0.35 0.90 0.32 0.00 0.52 -0.84 -1.28 118.95 118.93 3fl3 s ARG 85 Ca -0.14 -0.17 -0.29 0.00 -0.52 0.00 0.00 55.73 54.61 3fl3 s ARG 85 Cb -0.17 -0.86 -0.11 0.00 0.52 0.00 0.00 34.95 34.32 3fl3 s ARG 85 CO 0.07 -0.03 1.54 0.39 0.02 0.00 0.00 175.30 177.29 3fl3 n GLU 86 N 3.83 2.66 -1.67 3.54 1.02 -0.11 -0.54 120.64 129.38 3fl3 n GLU 86 Ca -0.24 0.94 -0.31 0.00 -0.02 0.00 0.00 57.16 57.54 3fl3 n GLU 86 Cb 0.52 -2.70 0.04 0.00 -0.02 0.00 0.00 31.44 29.28 3fl3 n GLU 86 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3fl3 s THR 87 N -0.45 4.20 0.37 2.62 -4.23 0.52 -4.77 115.64 113.90 3fl3 s THR 87 Ca 0.60 0.73 0.06 0.00 -1.18 0.00 0.00 61.69 61.89 3fl3 s THR 87 Cb -0.49 -3.52 0.20 0.00 1.34 0.00 0.00 72.50 70.02 3fl3 s THR 87 CO 0.55 -0.92 1.94 1.23 -0.54 0.00 0.00 174.62 176.88 3fl3 h GLY 88 N -0.56 0.54 0.70 3.99 0.00 -1.94 -1.39 103.07 104.42 3fl3 h GLY 88 Ca -0.44 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 46.61 3fl3 h GLY 88 CO 0.58 0.26 -0.02 -1.14 0.00 0.00 0.00 176.54 176.22 3fl3 n SER 89 N -4.35 0.41 -4.73 0.19 3.41 -1.26 -4.90 113.62 102.39 3fl3 n SER 89 Ca 0.02 -0.97 -0.42 0.00 -0.26 0.00 0.00 58.87 57.24 3fl3 n SER 89 Cb 0.18 -0.03 -0.00 0.00 -0.26 0.00 0.00 64.21 64.09 3fl3 n SER 89 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3fl3 n SER 90 N -0.75 3.14 -3.35 4.04 2.88 -0.53 -4.96 113.62 114.08 3fl3 n SER 90 Ca 0.21 1.20 -0.03 0.00 -1.33 0.00 0.00 58.87 58.91 3fl3 n SER 90 Cb 0.20 -1.54 -0.05 0.00 -0.75 0.00 0.00 64.21 62.07 3fl3 n SER 90 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 3fl3 s LYS 91 N -2.04 0.46 0.24 -1.46 2.36 -0.87 -4.92 119.74 113.51 3fl3 s LYS 91 Ca 0.56 0.91 -0.30 0.00 -2.55 0.00 0.00 55.97 54.59 3fl3 s LYS 91 Cb -0.52 0.22 -0.15 0.00 -1.05 0.00 0.00 37.83 36.34 3fl3 s LYS 91 CO 0.62 -0.52 1.10 0.98 1.55 0.00 0.00 175.35 179.08 3fl3 n TYR 92 N 5.41 1.34 1.28 4.03 9.36 -1.26 -0.57 117.16 136.75 3fl3 n TYR 92 Ca -0.04 0.67 0.07 0.00 3.32 0.00 0.00 57.90 61.92 3fl3 n TYR 92 Cb 0.50 -2.28 0.26 0.00 -0.63 0.00 0.00 39.34 37.20 3fl3 n TYR 92 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3fl3 n PRO 93 N 1.23 1.59 -2.73 2.98 -0.04 -1.26 -4.97 135.00 131.80 3fl3 n PRO 93 Ca 0.12 -0.90 -0.43 0.00 -0.04 0.00 0.00 63.50 62.25 3fl3 n PRO 93 Cb 0.29 -1.28 0.01 0.00 -0.04 0.00 0.00 33.50 32.47 3fl3 n PRO 93 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3fl3 n ASN 94 N 0.17 5.70 -4.79 3.54 4.13 0.26 -5.00 115.26 119.28 3fl3 n ASN 94 Ca 0.12 -3.22 -0.36 0.00 1.68 0.00 0.00 54.58 52.80 3fl3 n ASN 94 Cb 0.24 -1.39 -0.04 0.00 -1.54 0.00 0.00 39.78 37.06 3fl3 n ASN 94 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3fl3 s ALA 96 N -1.75 -0.70 0.05 0.00 0.00 -1.26 -4.92 121.76 113.18 3fl3 s ALA 96 Ca 0.61 0.89 0.05 0.00 0.00 0.00 0.00 51.96 53.51 3fl3 s ALA 96 Cb -0.21 -0.53 -0.03 0.00 0.00 0.00 0.00 23.12 22.36 3fl3 s ALA 96 CO 0.26 -0.16 -0.14 0.71 0.00 0.00 0.00 175.76 176.44 3fl3 s TYR 97 N 0.44 1.17 -0.06 0.00 2.02 -1.26 -0.36 117.35 119.30 3fl3 s TYR 97 Ca -0.02 -0.41 -0.16 0.00 -0.37 0.00 0.00 57.07 56.11 3fl3 s TYR 97 Cb -0.04 -0.68 -0.05 0.00 -0.40 0.00 0.00 41.96 40.79 3fl3 s TYR 97 CO -0.02 0.04 0.41 0.21 -1.57 0.00 0.00 175.55 174.62 3fl3 s LYS 98 N -1.43 4.09 -0.17 -0.62 2.20 0.30 -4.61 119.74 119.49 3fl3 s LYS 98 Ca -0.01 0.38 -0.08 0.00 -0.36 0.00 0.00 55.97 55.91 3fl3 s LYS 98 Cb -0.09 -3.31 -0.04 0.00 -1.51 0.00 0.00 37.83 32.88 3fl3 s LYS 98 CO 0.02 0.47 0.09 0.99 -0.36 0.00 0.00 175.35 176.56 3fl3 s THR 99 N -0.37 5.05 -0.12 3.43 2.01 -1.26 -1.99 115.64 122.39 3fl3 s THR 99 Ca 0.23 0.05 -0.01 0.00 0.31 0.00 0.00 61.69 62.28 3fl3 s THR 99 Cb -0.16 -3.26 0.04 0.00 0.01 0.00 0.00 72.50 69.13 3fl3 s THR 99 CO 0.11 0.50 -0.02 -0.89 -0.69 0.00 0.00 174.62 173.63 3fl3 s THR 100 N 0.00 0.67 0.24 -0.82 2.01 -0.39 -4.94 115.64 112.40 3fl3 s THR 100 Ca 0.07 -0.23 -0.16 0.00 0.31 0.00 0.00 61.69 61.69 3fl3 s THR 100 Cb -0.12 -0.87 -0.08 0.00 0.01 0.00 0.00 72.50 71.44 3fl3 s THR 100 CO 0.00 0.17 0.67 -1.10 -0.69 0.00 0.00 174.62 173.68 3fl3 s GLN 101 N 1.84 4.08 0.33 4.92 -0.21 -1.26 -0.53 119.66 128.83 3fl3 s GLN 101 Ca 0.03 0.68 -0.16 0.00 0.02 0.00 0.00 55.36 55.93 3fl3 s GLN 101 Cb -0.14 -2.74 0.03 0.00 1.00 0.00 0.00 33.01 31.16 3fl3 s GLN 101 CO -0.07 0.34 0.71 0.00 -2.12 0.00 0.00 175.29 174.15 3fl3 s ALA 102 N -1.67 -0.72 -0.25 6.09 0.00 -0.13 -4.94 121.76 120.14 3fl3 s ALA 102 Ca 0.45 -0.68 -0.00 0.00 0.00 0.00 0.00 51.96 51.73 3fl3 s ALA 102 Cb -0.14 0.82 0.07 0.00 0.00 0.00 0.00 23.12 23.87 3fl3 s ALA 102 CO 0.20 -0.97 0.02 -0.80 0.00 0.00 0.00 175.76 174.20 3fl3 s ASN 103 N -3.03 3.73 0.05 0.00 0.01 -1.26 -1.51 114.94 112.94 3fl3 s ASN 103 Ca 0.16 -1.29 -0.03 0.00 -0.71 0.00 0.00 52.86 50.98 3fl3 s ASN 103 Cb -0.05 -0.98 -0.02 0.00 0.41 0.00 0.00 41.25 40.61 3fl3 s ASN 103 CO 0.10 -0.31 0.04 -0.54 -1.51 0.00 0.00 177.10 174.88 3fl3 s LYS 104 N 1.54 0.64 0.50 -0.60 -0.14 -0.48 -4.78 119.74 116.42 3fl3 s LYS 104 Ca 0.01 -1.04 -0.21 0.00 -1.36 0.00 0.00 55.97 53.37 3fl3 s LYS 104 Cb -0.18 0.24 -0.07 0.00 -1.68 0.00 0.00 37.83 36.14 3fl3 s LYS 104 CO -0.12 -0.15 1.12 -1.01 -0.76 0.00 0.00 175.35 174.44 3fl3 s HIS 105 N -3.51 2.82 0.22 3.18 3.76 0.13 0.91 115.29 122.79 3fl3 s HIS 105 Ca 0.03 1.55 0.09 0.00 -0.15 0.00 0.00 55.06 56.58 3fl3 s HIS 105 Cb 0.04 -3.28 -0.04 0.00 1.11 0.00 0.00 32.58 30.41 3fl3 s HIS 105 CO -0.09 -1.39 -0.07 0.96 -0.85 0.00 0.00 174.74 173.30 3fl3 s ILE 106 N -1.72 3.21 -0.14 0.60 -4.36 -1.26 -1.01 121.20 116.52 3fl3 s ILE 106 Ca 0.68 -1.82 0.01 0.00 -0.26 0.00 0.00 60.65 59.27 3fl3 s ILE 106 Cb -0.24 -2.65 0.02 0.00 1.25 0.00 0.00 42.46 40.84 3fl3 s ILE 106 CO 0.28 -0.23 -0.16 -0.63 0.24 0.00 0.00 174.94 174.44 3fl3 s ILE 107 N -2.00 1.66 0.24 8.37 1.01 0.12 -0.75 121.20 129.86 3fl3 s ILE 107 Ca 0.28 -0.71 0.08 0.00 0.00 0.00 0.00 60.65 60.29 3fl3 s ILE 107 Cb -0.08 -1.52 -0.05 0.00 0.01 0.00 0.00 42.46 40.82 3fl3 s ILE 107 CO 0.17 0.47 -0.12 0.68 0.00 0.00 0.00 174.94 176.14 3fl3 s VAL 108 N 1.19 1.81 -0.03 2.92 -7.23 -0.36 -0.52 120.40 118.18 3fl3 s VAL 108 Ca -0.01 -2.21 -0.03 0.00 -1.81 0.00 0.00 61.98 57.92 3fl3 s VAL 108 Cb -0.14 -2.22 -0.04 0.00 0.56 0.00 0.00 36.38 34.54 3fl3 s VAL 108 CO -0.06 -0.47 0.15 0.00 -0.31 0.00 0.00 175.10 174.40 3fl3 s ALA 109 N -2.92 3.83 0.16 1.32 0.00 0.23 -0.37 121.76 124.01 3fl3 s ALA 109 Ca 0.26 -0.77 0.10 0.00 0.00 0.00 0.00 51.96 51.55 3fl3 s ALA 109 Cb 0.00 -1.81 -0.04 0.00 0.00 0.00 0.00 23.12 21.27 3fl3 s ALA 109 CO 0.10 0.71 -0.23 0.00 0.00 0.00 0.00 175.76 176.33 3fl3 s GLU 111 N -2.42 1.14 0.00 0.00 0.41 -0.26 -4.89 118.70 112.69 3fl3 s GLU 111 Ca 0.16 -0.35 0.00 0.00 -0.41 0.00 0.00 54.97 54.37 3fl3 s GLU 111 Cb -0.08 0.53 0.00 0.00 -1.78 0.00 0.00 34.13 32.80 3fl3 s GLU 111 CO 0.07 -0.49 0.00 0.41 -0.49 0.00 0.00 175.26 174.77 3fl3 n GLY 112 N -0.19 -3.65 2.68 -1.39 0.00 -1.26 -2.06 105.19 99.32 3fl3 n GLY 112 Ca -0.15 -2.13 -0.28 0.00 0.00 0.00 0.00 46.02 43.46 3fl3 n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3fl3 s ASN 113 N -0.59 3.23 0.81 1.61 2.47 -1.26 -2.50 114.94 118.71 3fl3 s ASN 113 Ca 0.00 -1.08 -0.12 0.00 0.42 0.00 0.00 52.86 52.07 3fl3 s ASN 113 Cb 0.00 -0.56 0.08 0.00 -1.45 0.00 0.00 41.25 39.32 3fl3 s ASN 113 CO 0.00 -0.36 1.15 -2.16 -3.72 0.00 0.00 177.10 172.01 3fl3 s PRO 114 N 1.89 1.78 -0.54 0.43 0.04 -1.26 -5.08 135.00 132.25 3fl3 s PRO 114 Ca 0.04 1.52 -0.26 0.00 0.04 0.00 0.00 61.00 62.34 3fl3 s PRO 114 Cb -0.17 -1.82 0.03 0.00 0.04 0.00 0.00 34.50 32.59 3fl3 s PRO 114 CO -0.18 -2.06 1.06 -0.47 0.04 0.00 0.00 177.00 175.39 3fl3 s TYR 115 N -2.47 2.74 0.28 0.56 5.04 -1.04 -4.84 117.35 117.61 3fl3 s TYR 115 Ca 0.68 0.29 0.02 0.00 -2.44 0.00 0.00 57.07 55.62 3fl3 s TYR 115 Cb -0.23 -4.27 -0.05 0.00 0.35 0.00 0.00 41.96 37.75 3fl3 s TYR 115 CO 0.52 -1.40 0.09 0.14 -1.34 0.00 0.00 175.55 173.57 3fl3 s VAL 116 N 4.36 0.70 0.17 3.14 -7.23 -0.88 -4.83 120.40 115.84 3fl3 s VAL 116 Ca 0.38 -2.00 -0.31 0.00 -1.81 0.00 0.00 61.98 58.24 3fl3 s VAL 116 Cb -0.10 -2.67 -0.10 0.00 0.56 0.00 0.00 36.38 34.08 3fl3 s VAL 116 CO 0.24 0.00 1.53 -2.84 -0.31 0.00 0.00 175.10 173.72 3fl3 s PRO 117 N -4.00 4.24 0.00 4.82 0.02 -1.26 -1.11 135.00 137.71 3fl3 s PRO 117 Ca 0.37 2.31 0.00 0.00 0.02 0.00 0.00 61.00 63.71 3fl3 s PRO 117 Cb 0.08 -3.16 0.00 0.00 0.02 0.00 0.00 34.50 31.44 3fl3 s PRO 117 CO 0.14 -0.56 0.00 1.33 -0.33 0.00 0.00 177.00 177.58 3fl3 n VAL 118 N 3.75 0.00 -3.77 3.83 0.24 0.62 -4.89 118.33 118.11 3fl3 n VAL 118 Ca 0.13 -0.33 -0.13 0.00 -2.04 0.00 0.00 64.34 61.97 3fl3 n VAL 118 Cb 0.39 0.88 -0.11 0.00 -1.47 0.00 0.00 33.84 33.53 3fl3 n VAL 118 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 3fl3 s HIS 119 N -1.02 -0.30 -0.29 6.34 5.65 -1.12 -4.97 115.29 119.58 3fl3 s HIS 119 Ca 0.00 0.71 -0.14 0.00 0.25 0.00 0.00 55.06 55.89 3fl3 s HIS 119 Cb 0.00 0.11 -0.03 0.00 -1.18 0.00 0.00 32.58 31.47 3fl3 s HIS 119 CO 0.00 -0.20 0.30 0.12 -0.65 0.00 0.00 174.74 174.31 3fl3 s PHE 120 N -0.12 3.23 -0.14 3.88 2.19 -1.26 -0.60 117.98 125.16 3fl3 s PHE 120 Ca -0.03 0.18 0.02 0.00 0.33 0.00 0.00 56.93 57.43 3fl3 s PHE 120 Cb -0.03 -2.53 -0.23 0.00 -1.31 0.00 0.00 43.02 38.92 3fl3 s PHE 120 CO 0.01 -0.26 0.28 -3.47 1.83 0.00 0.00 175.22 173.61 3fl3 n ASP 121 N 5.24 1.58 -3.61 6.13 2.03 0.32 -4.95 116.55 123.29 3fl3 n ASP 121 Ca -0.11 0.16 -0.03 0.00 0.52 0.00 0.00 54.79 55.33 3fl3 n ASP 121 Cb 0.51 -0.38 -0.01 0.00 -0.72 0.00 0.00 41.12 40.51 3fl3 n ASP 121 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3fl3 s ALA 122 N -2.55 -2.00 0.07 -1.67 0.00 -1.01 -4.92 121.76 109.68 3fl3 s ALA 122 Ca -0.20 0.98 0.08 0.00 0.00 0.00 0.00 51.96 52.82 3fl3 s ALA 122 Cb 0.07 0.25 -0.03 0.00 0.00 0.00 0.00 23.12 23.41 3fl3 s ALA 122 CO 0.75 -0.82 -0.20 -1.54 0.00 0.00 0.00 175.76 173.96 3fl3 s SER 123 N -2.59 3.71 0.00 0.00 1.04 -1.26 0.14 113.70 114.74 3fl3 s SER 123 Ca 0.10 -0.51 0.00 0.00 0.48 0.00 0.00 55.95 56.02 3fl3 s SER 123 Cb 0.01 -0.52 0.00 0.00 0.10 0.00 0.00 66.02 65.61 3fl3 s SER 123 CO -0.04 0.23 0.00 0.52 0.98 0.00 0.00 173.24 174.92