#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1afk s GLU 2 N 0.00 4.23 0.73 1.64 2.12 -1.26 -5.05 118.70 121.11 1afk s GLU 2 Ca 0.00 0.71 -0.12 0.00 0.36 0.00 0.00 54.97 55.92 1afk s GLU 2 Cb 0.00 -3.58 0.03 0.00 0.26 0.00 0.00 34.13 30.85 1afk s GLU 2 CO 0.00 -0.26 1.09 0.95 -0.54 0.00 0.00 175.26 176.50 1afk s THR 3 N 1.98 3.38 0.32 -1.70 -4.23 -1.26 -4.83 115.64 109.30 1afk s THR 3 Ca 0.31 0.50 0.02 0.00 -1.18 0.00 0.00 61.69 61.34 1afk s THR 3 Cb -0.16 -3.02 0.17 0.00 1.34 0.00 0.00 72.50 70.83 1afk s THR 3 CO 0.11 -0.53 1.87 0.00 -0.54 0.00 0.00 174.62 175.53 1afk h ALA 4 N -0.74 1.34 -0.65 3.99 0.00 -1.97 -0.04 119.26 121.19 1afk h ALA 4 Ca -0.44 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.23 1afk h ALA 4 Cb 1.23 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1afk h ALA 4 CO 0.53 0.47 0.20 0.00 0.00 0.00 0.00 179.25 180.45 1afk h ALA 5 N 1.46 0.85 -0.43 0.00 0.00 -1.87 -0.77 119.26 118.50 1afk h ALA 5 Ca 0.15 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.70 1afk h ALA 5 Cb 0.26 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1afk h ALA 5 CO -0.00 0.53 -0.29 0.00 0.00 0.00 0.00 179.25 179.48 1afk h ALA 6 N 1.08 0.67 -0.72 0.00 0.00 -1.78 -2.68 119.26 115.82 1afk h ALA 6 Ca 0.21 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 1afk h ALA 6 Cb 0.30 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1afk h ALA 6 CO -0.01 0.67 0.20 -0.22 0.00 0.00 0.00 179.25 179.90 1afk h LYS 7 N 0.79 1.14 -0.46 0.00 3.64 -0.82 -1.35 116.57 119.52 1afk h LYS 7 Ca 0.09 -0.26 0.03 0.00 -1.27 0.00 0.00 60.65 59.24 1afk h LYS 7 Cb 0.87 -0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 32.50 1afk h LYS 7 CO 0.08 0.99 0.25 0.35 -2.27 0.00 0.00 179.45 178.85 1afk h PHE 8 N 1.09 0.47 -0.67 1.91 3.57 -0.92 0.36 116.94 122.74 1afk h PHE 8 Ca 0.23 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.69 1afk h PHE 8 Cb 0.34 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.91 1afk h PHE 8 CO 0.03 0.25 0.19 0.93 -2.23 0.00 0.00 178.31 177.48 1afk h GLU 9 N 0.51 1.06 -0.31 1.11 5.08 -1.25 0.13 114.58 120.92 1afk h GLU 9 Ca 0.19 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 1afk h GLU 9 Cb 0.06 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1afk h GLU 9 CO -0.11 0.93 0.05 -0.09 -1.00 0.00 0.00 179.01 178.79 1afk h ARG 10 N 0.99 0.50 0.00 2.33 2.43 -0.82 -1.97 114.38 117.84 1afk h ARG 10 Ca 0.21 -0.13 -0.15 0.00 -0.81 0.00 0.00 59.98 59.10 1afk h ARG 10 Cb 0.33 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 1afk h ARG 10 CO -0.00 0.60 -0.75 1.96 -1.51 0.00 0.00 179.97 180.27 1afk h GLN 11 N 0.33 0.00 0.00 0.20 4.20 -0.86 -3.41 115.11 115.57 1afk h GLN 11 Ca 0.09 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1afk h GLN 11 Cb 0.34 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.12 1afk h GLN 11 CO 0.01 0.67 0.00 0.72 -0.67 0.00 0.00 178.83 179.56 1afk n HIS 12 N -3.25 0.00 -4.04 2.96 8.25 0.46 -4.70 115.22 114.90 1afk n HIS 12 Ca 0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.12 1afk n HIS 12 Cb 0.82 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.84 1afk n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1afk s MET 13 N -0.66 3.78 -0.45 -0.41 -1.94 -0.74 0.27 119.30 119.15 1afk s MET 13 Ca 0.00 -0.33 0.06 0.00 -1.71 0.00 0.00 55.69 53.71 1afk s MET 13 Cb 0.00 -3.15 0.21 0.00 2.01 0.00 0.00 34.83 33.89 1afk s MET 13 CO 0.00 0.39 0.59 -3.47 -0.01 0.00 0.00 175.02 172.52 1afk n ASP 14 N 3.16 -1.61 0.10 3.03 2.03 -0.49 -4.84 116.55 117.94 1afk n ASP 14 Ca -0.17 -2.76 0.12 0.00 0.52 0.00 0.00 54.79 52.49 1afk n ASP 14 Cb 0.53 0.50 0.46 0.00 -0.72 0.00 0.00 41.12 41.88 1afk n ASP 14 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1afk n SER 15 N 2.34 0.59 -0.00 1.67 7.64 -1.26 -3.63 113.62 120.97 1afk n SER 15 Ca 0.21 0.62 0.02 0.00 1.01 0.00 0.00 58.87 60.73 1afk n SER 15 Cb 0.54 -0.76 0.10 0.00 -1.01 0.00 0.00 64.21 63.09 1afk n SER 15 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1afk n SER 16 N -2.13 0.00 -3.81 6.43 7.64 -1.26 -4.74 113.62 115.76 1afk n SER 16 Ca 0.03 -1.89 -0.12 0.00 1.01 0.00 0.00 58.87 57.90 1afk n SER 16 Cb 0.27 -0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.35 1afk n SER 16 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1afk s THR 17 N -2.00 0.01 -0.14 0.44 -4.23 -1.24 -5.03 115.64 103.45 1afk s THR 17 Ca 0.05 -0.11 0.15 0.00 -1.18 0.00 0.00 61.69 60.60 1afk s THR 17 Cb 0.02 -0.34 0.02 0.00 1.34 0.00 0.00 72.50 73.54 1afk s THR 17 CO 0.04 -0.06 1.33 0.28 -0.54 0.00 0.00 174.62 175.68 1afk h SER 18 N 5.53 0.00 -5.00 3.99 0.02 -1.86 -3.43 113.55 112.80 1afk h SER 18 Ca -0.26 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 60.71 1afk h SER 18 Cb 1.19 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.64 1afk h SER 18 CO 0.38 0.54 0.23 0.00 -1.14 0.00 0.00 176.83 176.84 1afk s ALA 19 N -2.94 -1.46 -0.14 3.77 0.00 -1.26 -4.85 121.76 114.88 1afk s ALA 19 Ca 0.03 0.19 -0.29 0.00 0.00 0.00 0.00 51.96 51.89 1afk s ALA 19 Cb 0.08 0.86 -0.06 0.00 0.00 0.00 0.00 23.12 23.99 1afk s ALA 19 CO 0.76 -0.88 2.13 0.00 0.00 0.00 0.00 175.76 177.77 1afk s ALA 20 N -3.79 3.01 0.00 0.00 0.00 -1.26 -4.92 121.76 114.81 1afk s ALA 20 Ca 0.05 0.95 -0.01 0.00 0.00 0.00 0.00 51.96 52.95 1afk s ALA 20 Cb -0.03 -4.00 -0.01 0.00 0.00 0.00 0.00 23.12 19.09 1afk s ALA 20 CO -0.05 -2.39 1.02 1.03 0.00 0.00 0.00 175.76 175.38 1afk h SER 21 N 13.54 -0.07 -3.32 0.00 0.87 -1.99 -3.47 113.55 119.11 1afk h SER 21 Ca -0.44 0.01 -0.15 0.00 -1.23 0.00 0.00 61.79 59.98 1afk h SER 21 Cb 1.24 0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 63.19 1afk h SER 21 CO 0.96 -0.02 -0.11 -1.54 -0.53 0.00 0.00 176.83 175.58 1afk n SER 22 N -2.59 1.84 0.18 6.23 3.41 -1.26 -5.01 113.62 116.41 1afk n SER 22 Ca -0.00 -1.52 0.14 0.00 -0.26 0.00 0.00 58.87 57.22 1afk n SER 22 Cb 0.02 0.15 0.50 0.00 -0.26 0.00 0.00 64.21 64.61 1afk n SER 22 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1afk h SER 23 N 0.33 0.00 0.03 4.04 0.02 -1.95 -2.75 113.55 113.27 1afk h SER 23 Ca -0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1afk h SER 23 Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1afk h SER 23 CO 0.15 0.00 -0.08 -3.20 -1.14 0.00 0.00 176.83 172.56 1afk n ASN 24 N -2.59 1.67 -0.20 3.07 2.85 -1.26 -4.44 115.26 114.36 1afk n ASN 24 Ca 0.02 -1.46 -0.01 0.00 -0.11 0.00 0.00 54.58 53.03 1afk n ASN 24 Cb 0.32 0.05 0.06 0.00 1.24 0.00 0.00 39.78 41.46 1afk n ASN 24 CO 0.00 0.00 0.00 0.22 -2.11 0.00 0.00 177.26 175.37 1afk h TYR 25 N 2.50 -0.29 -0.47 1.20 3.20 -1.88 -2.06 116.97 119.16 1afk h TYR 25 Ca 0.00 0.05 -0.09 0.00 3.14 0.00 0.00 58.73 61.84 1afk h TYR 25 Cb 0.59 0.22 -0.02 0.00 1.54 0.00 0.00 36.73 39.07 1afk h TYR 25 CO 0.00 -0.25 -0.04 0.00 -1.64 0.00 0.00 178.16 176.23 1afk h ASN 27 N 0.71 0.87 -0.05 0.00 2.35 -1.71 0.98 115.58 118.74 1afk h ASN 27 Ca 0.13 -0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.82 1afk h ASN 27 Cb 0.56 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.74 1afk h ASN 27 CO 0.03 0.60 -0.20 1.56 -1.65 0.00 0.00 177.43 177.77 1afk h GLN 28 N 1.03 0.22 -0.21 0.81 4.20 -1.21 -3.08 115.11 116.87 1afk h GLN 28 Ca 0.33 -0.17 -0.02 0.00 0.06 0.00 0.00 58.65 58.85 1afk h GLN 28 Cb 0.01 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 1afk h GLN 28 CO -0.11 0.82 0.06 0.52 -0.67 0.00 0.00 178.83 179.45 1afk h MET 29 N -0.34 0.32 -0.91 1.46 2.86 -0.56 -1.40 114.93 116.36 1afk h MET 29 Ca -0.01 -0.07 0.06 0.00 -2.06 0.00 0.00 59.70 57.61 1afk h MET 29 Cb 0.85 -0.05 -0.06 0.00 0.06 0.00 0.00 31.60 32.41 1afk h MET 29 CO 0.04 0.43 0.59 0.52 1.06 0.00 0.00 176.91 179.55 1afk h MET 30 N 0.16 1.03 -0.07 1.72 2.86 -0.92 -1.80 114.93 117.91 1afk h MET 30 Ca 0.07 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.58 1afk h MET 30 Cb 0.24 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 31.67 1afk h MET 30 CO -0.00 0.68 -0.22 -0.22 1.06 0.00 0.00 176.91 178.21 1afk h LYS 31 N 1.06 0.28 0.00 1.72 3.64 -1.43 -1.33 116.57 120.51 1afk h LYS 31 Ca 0.38 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1afk h LYS 31 Cb 0.15 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1afk h LYS 31 CO -0.14 0.82 0.00 -1.13 -2.27 0.00 0.00 179.45 176.73 1afk n SER 32 N -4.52 0.56 -1.35 4.20 3.41 -0.54 -1.64 113.62 113.72 1afk n SER 32 Ca -0.08 0.66 0.10 0.00 -0.26 0.00 0.00 58.87 59.29 1afk n SER 32 Cb 0.43 -0.77 0.32 0.00 -0.26 0.00 0.00 64.21 63.93 1afk n SER 32 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1afk n ARG 33 N -2.14 3.21 -2.43 4.33 5.12 -0.71 -4.94 116.66 119.09 1afk n ARG 33 Ca 0.01 -2.70 -0.17 0.00 -1.93 0.00 0.00 57.85 53.06 1afk n ARG 33 Cb 0.18 -1.69 -0.00 0.00 -1.16 0.00 0.00 32.46 29.79 1afk n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1afk n ASN 34 N 1.20 -4.97 -0.72 0.55 3.02 -0.65 -4.83 115.26 108.85 1afk n ASN 34 Ca 0.23 -0.06 0.13 0.00 -0.03 0.00 0.00 54.58 54.85 1afk n ASN 34 Cb 0.73 -4.02 0.33 0.00 -0.61 0.00 0.00 39.78 36.20 1afk n ASN 34 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1afk n LEU 35 N -2.56 2.24 -0.08 3.41 4.77 -0.50 -3.78 117.00 120.50 1afk n LEU 35 Ca -0.18 -0.79 0.04 0.00 -0.03 0.00 0.00 56.01 55.06 1afk n LEU 35 Cb 0.64 -0.03 0.06 0.00 -2.33 0.00 0.00 43.42 41.76 1afk n LEU 35 CO 0.26 0.40 0.48 0.35 -1.33 0.00 0.00 177.39 177.55 1afk n THR 36 N 0.74 1.19 0.23 -5.08 -2.24 -1.22 -2.31 114.28 105.59 1afk n THR 36 Ca 0.17 -1.36 -0.17 0.00 -2.27 0.00 0.00 64.05 60.42 1afk n THR 36 Cb 0.46 0.22 -0.09 0.00 -2.10 0.00 0.00 70.33 68.83 1afk n THR 36 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1afk h LYS 37 N 0.00 -0.82 -0.00 -0.78 3.11 -1.90 -3.35 116.57 112.83 1afk h LYS 37 Ca 0.00 0.06 0.00 0.00 -2.81 0.00 0.00 60.65 57.90 1afk h LYS 37 Cb 0.86 0.19 0.00 0.00 -1.00 0.00 0.00 32.23 32.28 1afk h LYS 37 CO 0.00 -0.55 -0.12 -0.25 -2.81 0.00 0.00 179.45 175.73 1afk n ASP 38 N -5.51 0.39 -3.61 4.20 8.00 -1.26 -5.06 116.55 113.70 1afk n ASP 38 Ca -0.10 -0.69 -0.05 0.00 0.71 0.00 0.00 54.79 54.65 1afk n ASP 38 Cb 0.42 0.79 -0.02 0.00 -0.02 0.00 0.00 41.12 42.29 1afk n ASP 38 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1afk s ARG 39 N -1.08 0.81 -0.30 -1.24 1.70 -1.26 -5.10 118.95 112.48 1afk s ARG 39 Ca 0.02 -0.38 -0.21 0.00 -0.47 0.00 0.00 55.73 54.69 1afk s ARG 39 Cb 0.02 0.32 -0.01 0.00 -0.57 0.00 0.00 34.95 34.72 1afk s ARG 39 CO 0.11 -0.36 0.68 0.00 -1.08 0.00 0.00 175.30 174.65 1afk s LYS 41 N 2.71 4.18 0.24 0.00 2.20 -0.98 -4.90 119.74 123.19 1afk s LYS 41 Ca 0.28 2.24 -0.05 0.00 -0.36 0.00 0.00 55.97 58.07 1afk s LYS 41 Cb -0.15 -3.96 0.36 0.00 -1.51 0.00 0.00 37.83 32.58 1afk s LYS 41 CO 0.12 -0.84 1.81 -1.35 -0.36 0.00 0.00 175.35 174.73 1afk h PRO 42 N 9.49 0.76 -3.69 4.03 0.11 -1.94 -3.44 132.00 137.32 1afk h PRO 42 Ca -0.41 -0.05 -0.19 0.00 0.11 0.00 0.00 66.00 65.47 1afk h PRO 42 Cb 1.19 -0.17 -0.24 0.00 0.11 0.00 0.00 31.00 31.88 1afk h PRO 42 CO 0.95 0.50 -0.64 0.08 -0.21 0.00 0.00 178.00 178.68 1afk s VAL 43 N -6.05 0.05 -0.20 3.15 1.01 -1.26 -0.36 120.40 116.74 1afk s VAL 43 Ca -0.12 -0.40 -0.27 0.00 0.00 0.00 0.00 61.98 61.19 1afk s VAL 43 Cb 0.19 -0.20 0.08 0.00 0.00 0.00 0.00 36.38 36.44 1afk s VAL 43 CO 0.78 -0.22 0.74 0.21 0.00 0.00 0.00 175.10 176.61 1afk s ASN 44 N -0.67 -0.68 -0.10 3.32 2.47 -0.32 -5.01 114.94 113.95 1afk s ASN 44 Ca -0.07 1.15 0.03 0.00 0.42 0.00 0.00 52.86 54.38 1afk s ASN 44 Cb -0.05 1.10 -0.01 0.00 -1.45 0.00 0.00 41.25 40.84 1afk s ASN 44 CO 0.00 -0.35 -0.18 -0.89 -3.72 0.00 0.00 177.10 171.95 1afk s THR 45 N -0.16 2.61 -0.09 -5.21 2.01 -1.26 -0.33 115.64 113.20 1afk s THR 45 Ca -0.03 -0.84 -0.02 0.00 0.31 0.00 0.00 61.69 61.11 1afk s THR 45 Cb -0.03 -2.04 -0.03 0.00 0.01 0.00 0.00 72.50 70.41 1afk s THR 45 CO 0.03 0.55 -0.01 -0.36 -0.69 0.00 0.00 174.62 174.14 1afk s PHE 46 N 0.13 3.10 -0.16 4.92 0.08 -0.18 -4.40 117.98 121.48 1afk s PHE 46 Ca -0.09 0.10 -0.03 0.00 0.12 0.00 0.00 56.93 57.03 1afk s PHE 46 Cb -0.16 -1.80 -0.02 0.00 -0.57 0.00 0.00 43.02 40.47 1afk s PHE 46 CO 0.06 0.38 -0.05 0.08 -0.10 0.00 0.00 175.22 175.58 1afk s VAL 47 N -0.70 3.73 -0.90 -0.44 1.01 0.14 -0.85 120.40 122.39 1afk s VAL 47 Ca 0.11 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1afk s VAL 47 Cb -0.12 -2.63 0.33 0.00 0.00 0.00 0.00 36.38 33.96 1afk s VAL 47 CO 0.02 0.49 1.56 1.41 0.00 0.00 0.00 175.10 178.59 1afk n HIS 48 N 3.61 3.16 -4.28 5.22 -0.00 0.05 -1.39 115.22 121.59 1afk n HIS 48 Ca -0.18 -2.99 -0.15 0.00 -0.00 0.00 0.00 57.72 54.40 1afk n HIS 48 Cb 0.52 -0.99 -0.10 0.00 -0.00 0.00 0.00 29.99 29.43 1afk n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1afk s GLU 49 N -4.06 1.32 0.55 -0.41 0.41 -1.26 -4.60 118.70 110.65 1afk s GLU 49 Ca 0.42 -1.70 -0.19 0.00 -0.41 0.00 0.00 54.97 53.09 1afk s GLU 49 Cb 0.22 -0.17 -0.05 0.00 -1.78 0.00 0.00 34.13 32.34 1afk s GLU 49 CO -0.13 -0.28 1.14 -1.54 -0.49 0.00 0.00 175.26 173.96 1afk s SER 50 N -3.26 5.61 0.29 -0.19 1.04 -1.26 -4.23 113.70 111.70 1afk s SER 50 Ca 0.35 2.21 0.00 0.00 0.48 0.00 0.00 55.95 59.00 1afk s SER 50 Cb 0.07 -2.58 0.51 0.00 0.10 0.00 0.00 66.02 64.12 1afk s SER 50 CO 0.12 -1.29 1.89 0.25 0.98 0.00 0.00 173.24 175.18 1afk h LEU 51 N 1.12 0.94 -0.95 2.42 5.85 -1.98 -2.09 115.31 120.64 1afk h LEU 51 Ca -0.50 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.22 1afk h LEU 51 Cb 1.27 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 42.07 1afk h LEU 51 CO 0.57 0.58 0.50 0.00 -0.34 0.00 0.00 178.44 179.75 1afk h ALA 52 N 1.50 1.20 -0.37 1.25 0.00 -1.99 0.48 119.26 121.33 1afk h ALA 52 Ca 0.43 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 1afk h ALA 52 Cb 0.27 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1afk h ALA 52 CO -0.18 0.65 -0.26 -0.44 0.00 0.00 0.00 179.25 179.03 1afk h ASP 53 N 1.25 0.79 -0.15 0.00 3.32 -1.77 -1.76 116.42 118.09 1afk h ASP 53 Ca 0.32 -0.30 -0.22 0.00 0.02 0.00 0.00 57.03 56.85 1afk h ASP 53 Cb 0.01 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 39.35 1afk h ASP 53 CO -0.05 1.01 -0.76 0.58 -1.72 0.00 0.00 179.24 178.29 1afk h VAL 54 N 0.66 1.28 -0.31 -1.35 2.07 -1.07 -3.12 116.25 114.41 1afk h VAL 54 Ca 0.09 -1.96 -0.03 0.00 0.82 0.00 0.00 66.70 65.62 1afk h VAL 54 Cb 0.77 1.99 -0.02 0.00 -1.52 0.00 0.00 31.29 32.51 1afk h VAL 54 CO 0.06 0.62 0.07 1.56 0.02 0.00 0.00 177.57 179.90 1afk h GLN 55 N 0.52 0.45 0.00 1.57 4.20 -0.84 -1.58 115.11 119.44 1afk h GLN 55 Ca -0.05 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.59 1afk h GLN 55 Cb 1.39 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 29.09 1afk h GLN 55 CO 0.16 0.43 -0.01 0.00 -0.67 0.00 0.00 178.83 178.74 1afk h ALA 56 N 1.63 1.05 0.00 3.87 0.00 -1.25 -2.13 119.26 122.42 1afk h ALA 56 Ca 0.11 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1afk h ALA 56 Cb 0.19 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1afk h ALA 56 CO -0.00 0.01 -0.08 0.28 0.00 0.00 0.00 179.25 179.45 1afk h VAL 57 N 0.00 0.65 0.00 0.00 2.07 -1.32 -1.73 116.25 115.92 1afk h VAL 57 Ca -0.00 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1afk h VAL 57 Cb 0.10 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1afk h VAL 57 CO 0.00 0.08 0.00 0.00 0.02 0.00 0.00 177.57 177.67 1afk n SER 59 N -1.34 2.29 0.00 0.00 3.41 -0.65 -5.02 113.62 112.32 1afk n SER 59 Ca 0.04 -3.05 0.00 0.00 -0.26 0.00 0.00 58.87 55.60 1afk n SER 59 Cb 0.08 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.61 1afk n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1afk n GLN 60 N -1.40 1.88 -2.33 4.33 6.02 -0.51 -5.03 117.38 120.33 1afk n GLN 60 Ca 0.15 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.72 1afk n GLN 60 Cb 0.64 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.87 1afk n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1afk s LYS 61 N 4.63 3.63 -0.01 -1.09 2.20 -1.00 -4.87 119.74 123.23 1afk s LYS 61 Ca 0.00 1.06 -0.30 0.00 -0.36 0.00 0.00 55.97 56.36 1afk s LYS 61 Cb 0.00 -4.01 -0.04 0.00 -1.51 0.00 0.00 37.83 32.27 1afk s LYS 61 CO 0.00 -1.49 1.23 1.21 -0.36 0.00 0.00 175.35 175.94 1afk s ASN 62 N 3.87 7.03 0.13 1.43 3.04 -1.26 0.10 114.94 129.28 1afk s ASN 62 Ca 0.62 1.93 -0.00 0.00 0.04 0.00 0.00 52.86 55.44 1afk s ASN 62 Cb -0.15 -2.57 -0.04 0.00 -1.54 0.00 0.00 41.25 36.95 1afk s ASN 62 CO 0.31 -0.56 0.04 0.68 -3.04 0.00 0.00 177.10 174.52 1afk s VAL 63 N 1.84 0.24 0.44 -5.21 -7.23 0.05 -4.92 120.40 105.61 1afk s VAL 63 Ca 0.58 -1.92 -0.22 0.00 -1.81 0.00 0.00 61.98 58.61 1afk s VAL 63 Cb -0.27 -2.02 -0.09 0.00 0.56 0.00 0.00 36.38 34.56 1afk s VAL 63 CO 0.25 -0.51 1.03 0.00 -0.31 0.00 0.00 175.10 175.55 1afk s ALA 64 N -3.95 2.98 0.60 1.32 0.00 -1.26 -2.90 121.76 118.54 1afk s ALA 64 Ca 0.23 0.61 -0.06 0.00 0.00 0.00 0.00 51.96 52.73 1afk s ALA 64 Cb 0.07 -3.24 0.01 0.00 0.00 0.00 0.00 23.12 19.96 1afk s ALA 64 CO 0.01 -0.20 0.91 0.00 0.00 0.00 0.00 175.76 176.48 1afk h LYS 66 N -0.20 0.14 -0.03 0.00 3.64 -1.92 -1.30 116.57 116.90 1afk h LYS 66 Ca -0.45 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1afk h LYS 66 Cb 1.26 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1afk h LYS 66 CO 0.60 0.17 0.00 0.27 -2.27 0.00 0.00 179.45 178.22 1afk n ASN 67 N -4.44 0.36 0.00 4.20 6.94 -1.26 -4.90 115.26 116.16 1afk n ASN 67 Ca -0.01 -1.40 0.00 0.00 -0.02 0.00 0.00 54.58 53.14 1afk n ASN 67 Cb 0.15 -0.02 0.00 0.00 -2.36 0.00 0.00 39.78 37.55 1afk n ASN 67 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1afk n GLY 68 N 0.90 2.81 3.73 4.83 0.00 -0.49 -5.07 105.19 111.90 1afk n GLY 68 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1afk n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1afk s GLN 69 N -0.89 1.65 -0.17 1.61 -0.21 -1.26 -4.70 119.66 115.70 1afk s GLN 69 Ca 0.00 1.12 0.17 0.00 0.02 0.00 0.00 55.36 56.68 1afk s GLN 69 Cb 0.00 -1.83 0.45 0.00 1.00 0.00 0.00 33.01 32.63 1afk s GLN 69 CO 0.00 -2.06 1.34 0.25 -2.12 0.00 0.00 175.29 172.70 1afk n THR 70 N -3.80 2.17 -1.20 -0.19 -2.24 -1.26 0.19 114.28 107.95 1afk n THR 70 Ca 0.09 -2.02 -0.24 0.00 -2.27 0.00 0.00 64.05 59.60 1afk n THR 70 Cb 0.53 -0.25 0.18 0.00 -2.10 0.00 0.00 70.33 68.69 1afk n THR 70 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1afk n ASN 71 N -0.82 3.82 -4.92 3.42 6.94 -1.26 -4.73 115.26 117.71 1afk n ASN 71 Ca 0.20 -3.59 -0.30 0.00 -0.02 0.00 0.00 54.58 50.87 1afk n ASN 71 Cb 0.82 -0.84 -0.04 0.00 -2.36 0.00 0.00 39.78 37.36 1afk n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1afk s TYR 73 N -1.57 0.44 -0.17 0.00 1.51 0.49 -0.77 117.35 117.27 1afk s TYR 73 Ca 0.36 -0.08 -0.07 0.00 -1.01 0.00 0.00 57.07 56.26 1afk s TYR 73 Cb -0.13 -0.33 -0.04 0.00 -0.11 0.00 0.00 41.96 41.35 1afk s TYR 73 CO 0.28 -0.04 0.08 -1.14 -1.11 0.00 0.00 175.55 173.62 1afk s GLN 74 N 0.15 3.84 0.32 -0.62 0.74 0.12 -1.41 119.66 122.79 1afk s GLN 74 Ca -0.01 -0.29 -0.29 0.00 0.05 0.00 0.00 55.36 54.81 1afk s GLN 74 Cb -0.05 -3.21 -0.10 0.00 1.10 0.00 0.00 33.01 30.75 1afk s GLN 74 CO -0.00 0.40 1.34 -1.54 -0.55 0.00 0.00 175.29 174.94 1afk s SER 75 N 0.03 6.71 0.13 6.67 1.04 -0.12 -2.37 113.70 125.80 1afk s SER 75 Ca 0.07 2.72 -0.13 0.00 0.48 0.00 0.00 55.95 59.09 1afk s SER 75 Cb -0.12 -2.65 -0.02 0.00 0.10 0.00 0.00 66.02 63.33 1afk s SER 75 CO 0.00 -0.59 1.52 1.88 0.98 0.00 0.00 173.24 177.03 1afk h TYR 76 N 3.61 0.97 -2.28 5.02 0.05 -1.95 -3.43 116.97 118.95 1afk h TYR 76 Ca -0.49 -0.23 -0.44 0.00 0.05 0.00 0.00 58.73 57.62 1afk h TYR 76 Cb 1.23 -0.23 0.03 0.00 1.01 0.00 0.00 36.73 38.77 1afk h TYR 76 CO 0.56 0.99 -0.12 -1.12 -1.05 0.00 0.00 178.16 177.43 1afk s SER 77 N -6.54 5.52 0.44 3.88 0.01 -1.26 -5.06 113.70 110.70 1afk s SER 77 Ca -0.12 -0.05 -0.08 0.00 1.31 0.00 0.00 55.95 57.01 1afk s SER 77 Cb 0.11 -0.99 -0.05 0.00 0.21 0.00 0.00 66.02 65.29 1afk s SER 77 CO 0.84 -0.92 0.77 0.42 0.41 0.00 0.00 173.24 174.76 1afk s THR 78 N -2.59 4.86 0.07 1.44 -4.23 -1.26 -4.43 115.64 109.50 1afk s THR 78 Ca 0.54 0.40 0.02 0.00 -1.18 0.00 0.00 61.69 61.47 1afk s THR 78 Cb -0.10 -3.80 -0.03 0.00 1.34 0.00 0.00 72.50 69.91 1afk s THR 78 CO 0.37 -0.68 -0.08 -0.04 -0.54 0.00 0.00 174.62 173.65 1afk s MET 79 N -4.28 0.68 -0.15 3.99 -1.94 0.11 -4.85 119.30 112.87 1afk s MET 79 Ca 0.49 -1.01 -0.29 0.00 -1.71 0.00 0.00 55.69 53.17 1afk s MET 79 Cb -0.10 -0.32 -0.02 0.00 2.01 0.00 0.00 34.83 36.40 1afk s MET 79 CO 0.38 0.04 1.31 0.45 -0.01 0.00 0.00 175.02 177.19 1afk s SER 80 N -2.19 6.91 0.14 3.03 0.15 -1.26 -1.68 113.70 118.80 1afk s SER 80 Ca -0.00 1.77 0.02 0.00 0.70 0.00 0.00 55.95 58.43 1afk s SER 80 Cb -0.04 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.69 1afk s SER 80 CO -0.01 -0.78 -0.03 0.27 1.20 0.00 0.00 173.24 173.89 1afk s ILE 81 N 3.55 0.69 -0.11 6.45 -4.36 -0.00 -0.77 121.20 126.64 1afk s ILE 81 Ca 0.57 -1.97 -0.01 0.00 -0.26 0.00 0.00 60.65 58.99 1afk s ILE 81 Cb -0.23 -1.94 0.03 0.00 1.25 0.00 0.00 42.46 41.56 1afk s ILE 81 CO 0.17 -0.63 -0.05 -0.89 0.24 0.00 0.00 174.94 173.77 1afk s THR 82 N -3.64 0.86 -0.14 8.37 2.01 -0.03 -0.55 115.64 122.51 1afk s THR 82 Ca 0.19 -0.25 -0.19 0.00 0.31 0.00 0.00 61.69 61.76 1afk s THR 82 Cb 0.06 -0.95 -0.04 0.00 0.01 0.00 0.00 72.50 71.57 1afk s THR 82 CO 0.00 0.28 0.50 -1.81 -0.69 0.00 0.00 174.62 172.91 1afk s ASP 83 N 1.77 6.67 -0.21 3.53 1.01 0.98 -1.01 116.67 129.41 1afk s ASP 83 Ca 0.04 0.80 -0.03 0.00 0.71 0.00 0.00 52.55 54.07 1afk s ASP 83 Cb -0.13 -2.29 -0.00 0.00 1.01 0.00 0.00 42.92 41.50 1afk s ASP 83 CO -0.07 -0.05 -0.08 0.00 0.21 0.00 0.00 175.17 175.17 1afk s ARG 85 N 1.39 1.22 0.34 0.00 3.52 -1.01 -1.17 118.95 123.23 1afk s ARG 85 Ca 0.05 -0.31 -0.29 0.00 -0.13 0.00 0.00 55.73 55.05 1afk s ARG 85 Cb -0.14 -1.08 -0.11 0.00 -1.56 0.00 0.00 34.95 32.05 1afk s ARG 85 CO -0.05 0.05 1.51 -1.91 -0.81 0.00 0.00 175.30 174.09 1afk n GLU 86 N 3.61 2.61 -1.48 5.12 2.13 0.52 -0.31 120.64 132.83 1afk n GLU 86 Ca -0.21 0.92 -0.30 0.00 0.66 0.00 0.00 57.16 58.23 1afk n GLU 86 Cb 0.53 -2.66 0.09 0.00 0.27 0.00 0.00 31.44 29.67 1afk n GLU 86 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 1afk s THR 87 N -0.65 3.14 0.40 6.31 -4.23 -0.61 -4.81 115.64 115.18 1afk s THR 87 Ca 0.58 0.37 0.21 0.00 -1.18 0.00 0.00 61.69 61.67 1afk s THR 87 Cb -0.50 -3.06 0.22 0.00 1.34 0.00 0.00 72.50 70.51 1afk s THR 87 CO 0.57 -0.48 1.99 1.23 -0.54 0.00 0.00 174.62 177.39 1afk h GLY 88 N -1.12 0.00 -2.97 3.99 0.00 -1.94 -2.72 103.07 98.31 1afk h GLY 88 Ca -0.47 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.81 1afk h GLY 88 CO 0.58 0.00 0.05 -1.14 0.00 0.00 0.00 176.54 176.03 1afk n SER 89 N -3.90 4.95 -4.78 0.19 3.41 -1.26 -4.98 113.62 107.25 1afk n SER 89 Ca -0.02 -3.05 -0.38 0.00 -0.26 0.00 0.00 58.87 55.17 1afk n SER 89 Cb 0.28 -0.66 -0.06 0.00 -0.26 0.00 0.00 64.21 63.51 1afk n SER 89 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1afk s SER 90 N -1.23 7.37 -0.16 4.04 0.15 -1.03 -4.96 113.70 117.87 1afk s SER 90 Ca 0.51 1.76 -0.10 0.00 0.70 0.00 0.00 55.95 58.82 1afk s SER 90 Cb 0.40 -2.54 0.06 0.00 -1.71 0.00 0.00 66.02 62.22 1afk s SER 90 CO 0.13 0.05 0.40 -0.75 1.20 0.00 0.00 173.24 174.27 1afk s LYS 91 N -1.69 0.39 0.45 5.44 2.47 -1.16 -4.95 119.74 120.69 1afk s LYS 91 Ca 0.44 0.75 -0.25 0.00 -1.56 0.00 0.00 55.97 55.35 1afk s LYS 91 Cb -0.21 -0.00 -0.08 0.00 -1.46 0.00 0.00 37.83 36.08 1afk s LYS 91 CO 0.26 -0.15 1.39 -0.47 0.16 0.00 0.00 175.35 176.53 1afk s TYR 92 N 1.27 2.53 -2.19 4.03 5.04 -1.26 0.63 117.35 127.40 1afk s TYR 92 Ca -0.09 1.31 0.28 0.00 -2.44 0.00 0.00 57.07 56.14 1afk s TYR 92 Cb -0.08 -3.84 1.45 0.00 0.35 0.00 0.00 41.96 39.84 1afk s TYR 92 CO -0.11 -2.71 1.96 -2.30 -1.34 0.00 0.00 175.55 171.06 1afk n PRO 93 N -0.21 1.28 -2.74 4.97 -0.02 -1.26 -4.95 135.00 132.06 1afk n PRO 93 Ca 0.05 -0.41 -0.43 0.00 -2.02 0.00 0.00 63.50 60.69 1afk n PRO 93 Cb 0.43 -1.46 0.00 0.00 -0.02 0.00 0.00 33.50 32.45 1afk n PRO 93 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1afk n ASN 94 N -0.48 5.55 -4.70 2.55 4.13 0.21 -4.99 115.26 117.52 1afk n ASN 94 Ca 0.21 -3.17 -0.42 0.00 1.68 0.00 0.00 54.58 52.88 1afk n ASN 94 Cb 0.21 -1.42 -0.03 0.00 -1.54 0.00 0.00 39.78 36.99 1afk n ASN 94 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1afk s ALA 96 N 1.68 1.67 0.11 0.00 0.00 -1.26 -4.95 121.76 119.00 1afk s ALA 96 Ca 0.61 -0.81 0.05 0.00 0.00 0.00 0.00 51.96 51.81 1afk s ALA 96 Cb -0.31 -0.49 -0.04 0.00 0.00 0.00 0.00 23.12 22.28 1afk s ALA 96 CO 0.27 0.35 -0.13 0.71 0.00 0.00 0.00 175.76 176.97 1afk s TYR 97 N -0.21 1.30 -0.06 0.00 1.51 -1.26 -1.58 117.35 117.04 1afk s TYR 97 Ca 0.01 -0.57 -0.12 0.00 -1.01 0.00 0.00 57.07 55.38 1afk s TYR 97 Cb -0.10 -0.69 -0.05 0.00 -0.11 0.00 0.00 41.96 41.01 1afk s TYR 97 CO 0.01 0.10 0.30 0.21 -1.11 0.00 0.00 175.55 175.06 1afk s LYS 98 N -2.62 3.80 -0.22 -0.62 2.47 0.57 -4.70 119.74 118.43 1afk s LYS 98 Ca 0.07 0.19 -0.07 0.00 -1.56 0.00 0.00 55.97 54.60 1afk s LYS 98 Cb -0.05 -3.24 -0.03 0.00 -1.46 0.00 0.00 37.83 33.05 1afk s LYS 98 CO 0.02 0.66 0.05 0.99 0.16 0.00 0.00 175.35 177.23 1afk s THR 99 N -0.84 4.32 -0.17 3.43 2.01 -1.26 -2.41 115.64 120.72 1afk s THR 99 Ca 0.20 -0.18 -0.01 0.00 0.31 0.00 0.00 61.69 62.01 1afk s THR 99 Cb -0.15 -2.98 0.05 0.00 0.01 0.00 0.00 72.50 69.43 1afk s THR 99 CO 0.09 0.39 -0.04 -0.89 -0.69 0.00 0.00 174.62 173.49 1afk s THR 100 N 1.13 1.03 0.16 -0.82 2.01 -0.38 -5.00 115.64 113.77 1afk s THR 100 Ca 0.04 -0.65 -0.18 0.00 0.31 0.00 0.00 61.69 61.21 1afk s THR 100 Cb -0.14 -1.27 -0.07 0.00 0.01 0.00 0.00 72.50 71.03 1afk s THR 100 CO 0.03 0.05 0.63 -1.58 -0.69 0.00 0.00 174.62 173.06 1afk s GLN 101 N 1.66 4.16 0.26 4.92 2.00 -1.26 -0.02 119.66 131.38 1afk s GLN 101 Ca -0.00 0.72 -0.21 0.00 -2.00 0.00 0.00 55.36 53.87 1afk s GLN 101 Cb -0.16 -2.99 0.02 0.00 0.80 0.00 0.00 33.01 30.68 1afk s GLN 101 CO -0.07 0.48 0.69 0.00 -0.50 0.00 0.00 175.29 175.89 1afk s ALA 102 N -1.40 -1.20 -0.30 1.58 0.00 0.29 -4.97 121.76 115.77 1afk s ALA 102 Ca 0.38 -0.26 0.03 0.00 0.00 0.00 0.00 51.96 52.11 1afk s ALA 102 Cb -0.17 0.87 0.08 0.00 0.00 0.00 0.00 23.12 23.90 1afk s ALA 102 CO 0.20 -0.99 -0.00 -0.80 0.00 0.00 0.00 175.76 174.16 1afk s ASN 103 N -2.91 4.45 0.17 0.00 0.01 -1.26 -0.82 114.94 114.58 1afk s ASN 103 Ca 0.11 -1.73 -0.02 0.00 -0.71 0.00 0.00 52.86 50.50 1afk s ASN 103 Cb -0.05 -1.45 -0.04 0.00 0.41 0.00 0.00 41.25 40.13 1afk s ASN 103 CO 0.05 -0.31 0.13 -0.54 -1.51 0.00 0.00 177.10 174.92 1afk s LYS 104 N 1.12 1.11 0.29 -0.60 1.02 -0.68 -4.76 119.74 117.24 1afk s LYS 104 Ca 0.03 -1.50 -0.25 0.00 0.02 0.00 0.00 55.97 54.27 1afk s LYS 104 Cb -0.19 0.28 -0.09 0.00 -0.52 0.00 0.00 37.83 37.30 1afk s LYS 104 CO -0.09 -0.35 0.90 -1.01 -0.92 0.00 0.00 175.35 173.88 1afk s HIS 105 N -4.09 3.72 0.17 3.18 3.76 0.48 0.04 115.29 122.54 1afk s HIS 105 Ca 0.31 1.72 0.07 0.00 -0.15 0.00 0.00 55.06 57.01 1afk s HIS 105 Cb 0.06 -2.87 -0.04 0.00 1.11 0.00 0.00 32.58 30.84 1afk s HIS 105 CO 0.07 0.26 0.00 0.96 -0.85 0.00 0.00 174.74 175.18 1afk s ILE 106 N -1.55 3.77 -0.13 0.60 -4.36 -1.26 0.11 121.20 118.38 1afk s ILE 106 Ca 0.48 -1.38 0.00 0.00 -0.26 0.00 0.00 60.65 59.49 1afk s ILE 106 Cb -0.19 -2.89 0.02 0.00 1.25 0.00 0.00 42.46 40.65 1afk s ILE 106 CO 0.24 -0.10 -0.13 -0.63 0.24 0.00 0.00 174.94 174.57 1afk s ILE 107 N -1.70 1.41 0.11 8.37 1.01 0.90 -0.94 121.20 130.36 1afk s ILE 107 Ca 0.27 -0.54 0.06 0.00 0.00 0.00 0.00 60.65 60.44 1afk s ILE 107 Cb -0.09 -1.33 -0.04 0.00 0.01 0.00 0.00 42.46 41.01 1afk s ILE 107 CO 0.19 0.43 -0.14 0.68 0.00 0.00 0.00 174.94 176.10 1afk s VAL 108 N 1.42 1.26 -0.06 2.92 -7.23 -0.50 -0.32 120.40 117.89 1afk s VAL 108 Ca 0.02 -1.65 -0.15 0.00 -1.81 0.00 0.00 61.98 58.39 1afk s VAL 108 Cb -0.13 -1.45 -0.05 0.00 0.56 0.00 0.00 36.38 35.31 1afk s VAL 108 CO -0.08 -0.40 0.40 0.00 -0.31 0.00 0.00 175.10 174.70 1afk s ALA 109 N -2.05 3.64 0.09 1.32 0.00 -0.17 -0.38 121.76 124.21 1afk s ALA 109 Ca 0.07 -0.26 0.08 0.00 0.00 0.00 0.00 51.96 51.85 1afk s ALA 109 Cb -0.05 -2.43 -0.04 0.00 0.00 0.00 0.00 23.12 20.59 1afk s ALA 109 CO 0.03 0.31 -0.17 0.00 0.00 0.00 0.00 175.76 175.93 1afk s GLU 111 N -1.96 0.92 0.39 0.00 2.12 -0.56 -4.91 118.70 114.71 1afk s GLU 111 Ca 0.17 -0.27 0.00 0.00 0.36 0.00 0.00 54.97 55.24 1afk s GLU 111 Cb -0.11 0.42 0.00 0.00 0.26 0.00 0.00 34.13 34.71 1afk s GLU 111 CO 0.09 -0.39 0.00 0.41 -0.54 0.00 0.00 175.26 174.83 1afk n GLY 112 N -0.12 -2.38 2.71 -1.50 0.00 -1.26 -2.65 105.19 99.99 1afk n GLY 112 Ca -0.11 -1.63 -0.27 0.00 0.00 0.00 0.00 46.02 44.01 1afk n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1afk s ASN 113 N -2.80 2.76 0.63 1.61 3.04 -1.26 -2.07 114.94 116.86 1afk s ASN 113 Ca 0.00 -0.76 -0.19 0.00 0.04 0.00 0.00 52.86 51.95 1afk s ASN 113 Cb 0.00 -0.51 -0.02 0.00 -1.54 0.00 0.00 41.25 39.19 1afk s ASN 113 CO 0.00 -0.32 1.31 -2.16 -3.04 0.00 0.00 177.10 172.90 1afk s PRO 114 N 1.93 2.63 -0.72 0.43 0.04 -1.26 -5.08 135.00 132.97 1afk s PRO 114 Ca -0.00 2.11 -0.27 0.00 0.04 0.00 0.00 61.00 62.88 1afk s PRO 114 Cb -0.17 -1.91 0.03 0.00 0.04 0.00 0.00 34.50 32.49 1afk s PRO 114 CO -0.08 -1.55 1.31 -0.47 0.04 0.00 0.00 177.00 176.25 1afk s TYR 115 N -1.37 2.26 0.28 0.56 5.04 -0.88 -4.88 117.35 118.38 1afk s TYR 115 Ca 0.81 0.05 0.03 0.00 -2.44 0.00 0.00 57.07 55.52 1afk s TYR 115 Cb -0.39 -4.58 -0.06 0.00 0.35 0.00 0.00 41.96 37.29 1afk s TYR 115 CO 0.41 -2.06 0.05 0.14 -1.34 0.00 0.00 175.55 172.76 1afk s VAL 116 N 5.91 0.96 0.26 3.14 -7.23 -1.08 -4.84 120.40 117.51 1afk s VAL 116 Ca 0.38 -2.01 -0.30 0.00 -1.81 0.00 0.00 61.98 58.24 1afk s VAL 116 Cb -0.08 -2.64 -0.10 0.00 0.56 0.00 0.00 36.38 34.12 1afk s VAL 116 CO 0.16 -0.08 1.34 -2.84 -0.31 0.00 0.00 175.10 173.37 1afk s PRO 117 N -3.93 4.35 0.00 4.82 0.02 -1.26 -1.49 135.00 137.51 1afk s PRO 117 Ca 0.35 2.17 0.00 0.00 0.02 0.00 0.00 61.00 63.54 1afk s PRO 117 Cb 0.08 -3.13 0.00 0.00 0.02 0.00 0.00 34.50 31.46 1afk s PRO 117 CO 0.13 -0.27 0.18 1.33 -0.33 0.00 0.00 177.00 178.05 1afk n VAL 118 N 1.96 0.00 -3.68 3.83 0.24 0.32 -4.54 118.33 116.45 1afk n VAL 118 Ca 0.04 -0.35 -0.13 0.00 -2.04 0.00 0.00 64.34 61.86 1afk n VAL 118 Cb 0.42 1.16 -0.08 0.00 -1.47 0.00 0.00 33.84 33.86 1afk n VAL 118 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1afk s HIS 119 N -0.33 -0.64 -0.34 6.34 5.65 -1.19 -4.65 115.29 120.13 1afk s HIS 119 Ca 0.00 1.54 -0.14 0.00 0.25 0.00 0.00 55.06 56.72 1afk s HIS 119 Cb 0.00 0.23 -0.02 0.00 -1.18 0.00 0.00 32.58 31.61 1afk s HIS 119 CO 0.00 -0.31 0.30 0.12 -0.65 0.00 0.00 174.74 174.20 1afk s PHE 120 N 0.36 3.22 -0.17 3.88 5.36 -1.26 -1.00 117.98 128.37 1afk s PHE 120 Ca -0.00 -0.09 -0.18 0.00 -0.96 0.00 0.00 56.93 55.69 1afk s PHE 120 Cb -0.04 -2.57 -0.23 0.00 -0.34 0.00 0.00 43.02 39.85 1afk s PHE 120 CO 0.00 -0.38 0.35 0.22 -1.46 0.00 0.00 175.22 173.95 1afk h ASP 121 N 8.46 0.16 -4.80 6.13 3.58 -1.01 -3.48 116.42 125.45 1afk h ASP 121 Ca -0.31 -0.70 0.30 0.00 0.42 0.00 0.00 57.03 56.74 1afk h ASP 121 Cb 1.15 -0.05 -0.17 0.00 1.72 0.00 0.00 39.33 41.98 1afk h ASP 121 CO 0.66 1.55 0.85 0.00 -2.88 0.00 0.00 179.24 179.42 1afk s ALA 122 N -2.41 -2.17 -0.01 -0.78 0.00 -1.04 -4.95 121.76 110.40 1afk s ALA 122 Ca -0.25 1.32 0.08 0.00 0.00 0.00 0.00 51.96 53.10 1afk s ALA 122 Cb 0.05 0.02 -0.02 0.00 0.00 0.00 0.00 23.12 23.17 1afk s ALA 122 CO 0.67 -0.76 -0.24 -1.54 0.00 0.00 0.00 175.76 173.88 1afk s SER 123 N -2.46 3.22 0.00 0.00 1.04 -1.26 -0.07 113.70 114.17 1afk s SER 123 Ca 0.12 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 56.09 1afk s SER 123 Cb 0.01 -0.41 0.00 0.00 0.10 0.00 0.00 66.02 65.73 1afk s SER 123 CO -0.04 0.31 0.26 0.52 0.98 0.00 0.00 173.24 175.27