#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2afp n ARG 2 N 0.00 -3.39 0.06 2.61 0.63 -1.26 -4.98 116.66 110.33 2afp n ARG 2 Ca 0.00 2.72 0.00 0.00 -0.92 0.00 0.00 57.85 59.65 2afp n ARG 2 Cb 0.00 -5.31 0.00 0.00 0.45 0.00 0.00 32.46 27.60 2afp n ARG 2 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2afp n ALA 3 N 0.65 0.00 -3.00 5.13 0.00 -1.26 -5.18 120.51 116.85 2afp n ALA 3 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2afp n ALA 3 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.47 2afp n ALA 3 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2afp n GLY 4 N -1.39 1.70 1.60 0.00 0.00 -1.26 -4.86 105.19 100.98 2afp n GLY 4 Ca 0.00 -0.76 -0.12 0.00 0.00 0.00 0.00 46.02 45.15 2afp n GLY 4 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2afp n PRO 5 N 0.00 -0.41 0.01 1.61 -0.04 -1.26 -4.90 135.00 130.01 2afp n PRO 5 Ca 0.00 -0.90 -0.08 0.00 -0.04 0.00 0.00 63.50 62.48 2afp n PRO 5 Cb 0.00 -0.52 -0.13 0.00 -0.04 0.00 0.00 33.50 32.80 2afp n PRO 5 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 2afp h ASN 6 N -0.65 0.00 -5.45 3.54 -0.73 -2.01 -3.41 115.58 106.88 2afp h ASN 6 Ca -0.17 0.00 -0.22 0.00 1.87 0.00 0.00 56.30 57.78 2afp h ASN 6 Cb 0.49 0.00 0.17 0.00 0.27 0.00 0.00 38.32 39.26 2afp h ASN 6 CO 0.13 1.00 -0.74 0.00 -0.37 0.00 0.00 177.43 177.44 2afp n PRO 8 N -3.04 0.00 -1.51 0.00 -0.04 -1.26 -4.83 135.00 124.32 2afp n PRO 8 Ca -0.06 0.34 0.02 0.00 -0.04 0.00 0.00 63.50 63.77 2afp n PRO 8 Cb 0.60 -0.83 0.01 0.00 -0.04 0.00 0.00 33.50 33.24 2afp n PRO 8 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2afp n ALA 9 N -1.72 2.55 -1.65 0.55 0.00 -1.26 -4.85 120.51 114.14 2afp n ALA 9 Ca 0.00 -2.15 0.06 0.00 0.00 0.00 0.00 53.44 51.35 2afp n ALA 9 Cb 0.00 -0.70 0.20 0.00 0.00 0.00 0.00 19.45 18.95 2afp n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2afp n GLY 10 N 0.37 4.88 0.00 0.00 0.00 -1.26 -5.03 105.19 104.14 2afp n GLY 10 Ca 0.02 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.76 2afp n GLY 10 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2afp n TRP 11 N -1.02 0.00 -3.24 1.61 7.02 -1.26 -5.07 117.44 115.48 2afp n TRP 11 Ca 0.18 0.00 -0.24 0.00 -1.02 0.00 0.00 57.50 56.42 2afp n TRP 11 Cb 0.72 0.00 -0.07 0.00 -2.42 0.00 0.00 31.31 29.54 2afp n TRP 11 CO 0.00 0.00 0.00 0.94 -2.02 0.00 0.00 177.69 176.61 2afp n GLN 12 N 0.00 1.32 -2.75 -0.99 7.27 -1.24 -5.06 117.38 115.94 2afp n GLN 12 Ca 0.00 -3.69 -0.42 0.00 0.07 0.00 0.00 57.00 52.96 2afp n GLN 12 Cb 0.00 -1.58 -0.03 0.00 2.41 0.00 0.00 30.24 31.04 2afp n GLN 12 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 2afp s PRO 13 N -1.73 3.21 0.05 3.69 0.04 -1.26 -3.06 135.00 135.93 2afp s PRO 13 Ca 0.37 -0.75 -0.33 0.00 0.04 0.00 0.00 61.00 60.33 2afp s PRO 13 Cb 0.19 -4.35 -0.19 0.00 0.04 0.00 0.00 34.50 30.19 2afp s PRO 13 CO -0.08 -1.94 1.46 -0.07 0.04 0.00 0.00 177.00 176.41 2afp h LEU 14 N 11.89 -0.89 -3.03 -3.56 4.07 -1.88 -3.44 115.31 118.46 2afp h LEU 14 Ca -0.21 0.02 -0.01 0.00 0.08 0.00 0.00 57.88 57.75 2afp h LEU 14 Cb 1.06 0.23 -0.01 0.00 1.08 0.00 0.00 40.66 43.01 2afp h LEU 14 CO 1.22 -0.59 -0.02 0.61 -1.08 0.00 0.00 178.44 178.59 2afp n GLY 15 N -1.28 -0.73 2.58 0.83 0.00 -1.26 -5.05 105.19 100.28 2afp n GLY 15 Ca -0.14 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 2afp n GLY 15 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2afp n ASP 16 N -0.12 -1.99 0.00 1.61 9.92 -1.26 -5.05 116.55 119.66 2afp n ASP 16 Ca -0.02 -3.12 0.00 0.00 -0.53 0.00 0.00 54.79 51.13 2afp n ASP 16 Cb 0.52 1.09 0.00 0.00 -0.64 0.00 0.00 41.12 42.09 2afp n ASP 16 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2afp n ARG 17 N 1.60 0.00 -3.60 -1.24 5.12 -1.26 -4.53 116.66 112.75 2afp n ARG 17 Ca 0.13 0.00 -0.15 0.00 -1.93 0.00 0.00 57.85 55.90 2afp n ARG 17 Cb 0.60 0.00 -0.07 0.00 -1.16 0.00 0.00 32.46 31.83 2afp n ARG 17 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2afp s ILE 19 N -0.06 0.03 0.00 0.00 2.07 -1.17 0.10 121.20 122.17 2afp s ILE 19 Ca -0.03 -0.22 0.00 0.00 -1.41 0.00 0.00 60.65 58.99 2afp s ILE 19 Cb -0.04 -1.06 0.00 0.00 0.13 0.00 0.00 42.46 41.49 2afp s ILE 19 CO 0.03 -0.12 0.00 -1.22 -1.91 0.00 0.00 174.94 171.72 2afp n TYR 20 N -0.31 0.00 -3.52 3.50 4.02 0.26 -3.59 117.16 117.52 2afp n TYR 20 Ca -0.17 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.61 2afp n TYR 20 Cb 0.64 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.93 2afp n TYR 20 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 2afp s TYR 21 N -1.25 -0.44 0.32 -0.72 5.04 -1.26 -4.19 117.35 114.86 2afp s TYR 21 Ca 0.00 0.54 0.05 0.00 -2.44 0.00 0.00 57.07 55.22 2afp s TYR 21 Cb 0.00 0.49 -0.03 0.00 0.35 0.00 0.00 41.96 42.77 2afp s TYR 21 CO 0.00 -0.52 0.23 -2.00 -1.34 0.00 0.00 175.55 171.91 2afp s GLU 22 N -2.15 1.69 0.00 4.97 2.56 -1.05 -4.98 118.70 119.75 2afp s GLU 22 Ca -0.01 -1.98 0.00 0.00 0.00 0.00 0.00 54.97 52.98 2afp s GLU 22 Cb -0.01 0.14 0.00 0.00 2.00 0.00 0.00 34.13 36.26 2afp s GLU 22 CO -0.02 -0.57 0.00 0.25 -0.56 0.00 0.00 175.26 174.36 2afp n THR 23 N -0.61 0.00 -1.71 -1.70 -2.24 -1.26 -4.56 114.28 102.20 2afp n THR 23 Ca 0.04 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.39 2afp n THR 23 Cb 0.63 -0.33 -0.02 0.00 -2.10 0.00 0.00 70.33 68.51 2afp n THR 23 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2afp n THR 24 N -2.14 0.66 -1.68 4.28 -1.04 -1.26 -4.52 114.28 108.58 2afp n THR 24 Ca 0.00 -0.17 -0.43 0.00 -2.04 0.00 0.00 64.05 61.41 2afp n THR 24 Cb 0.01 -1.80 -0.03 0.00 -1.82 0.00 0.00 70.33 66.69 2afp n THR 24 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2afp n ALA 25 N 2.62 1.85 -3.15 2.41 0.00 -1.26 -4.43 120.51 118.55 2afp n ALA 25 Ca 0.12 0.30 0.04 0.00 0.00 0.00 0.00 53.44 53.90 2afp n ALA 25 Cb 0.34 -2.58 -0.01 0.00 0.00 0.00 0.00 19.45 17.20 2afp n ALA 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2afp s MET 26 N 3.12 0.54 0.94 0.00 0.00 0.22 -4.82 119.30 119.31 2afp s MET 26 Ca 0.84 0.80 -0.12 0.00 0.00 0.00 0.00 55.69 57.21 2afp s MET 26 Cb -0.51 0.42 0.16 0.00 0.00 0.00 0.00 34.83 34.89 2afp s MET 26 CO 0.40 -0.75 1.12 0.99 0.00 0.00 0.00 175.02 176.78 2afp s THR 27 N 2.86 2.09 0.00 3.16 2.01 -1.23 -3.59 115.64 120.94 2afp s THR 27 Ca 0.16 0.03 0.00 0.00 0.31 0.00 0.00 61.69 62.19 2afp s THR 27 Cb -0.13 -2.67 0.00 0.00 0.01 0.00 0.00 72.50 69.71 2afp s THR 27 CO -0.22 -0.04 0.00 1.87 -0.69 0.00 0.00 174.62 175.54 2afp n TRP 28 N -3.92 0.00 0.41 4.92 -0.00 -1.26 0.12 117.44 117.71 2afp n TRP 28 Ca 0.06 0.00 -0.16 0.00 -0.00 0.00 0.00 57.50 57.40 2afp n TRP 28 Cb 0.58 -0.45 -0.08 0.00 -0.00 0.00 0.00 31.31 31.37 2afp n TRP 28 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2afp h ALA 29 N 0.00 -1.13 -0.61 5.87 0.00 -1.94 0.82 119.26 122.27 2afp h ALA 29 Ca 0.00 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 2afp h ALA 29 Cb 0.00 0.41 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2afp h ALA 29 CO 0.00 -1.05 0.24 -0.07 0.00 0.00 0.00 179.25 178.37 2afp h LEU 30 N -1.20 0.81 0.60 0.00 3.38 0.38 -1.43 115.31 117.84 2afp h LEU 30 Ca -0.11 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 2afp h LEU 30 Cb 0.81 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 41.36 2afp h LEU 30 CO 0.18 0.73 -0.29 0.00 0.09 0.00 0.00 178.44 179.15 2afp h ALA 31 N 1.39 -0.80 -0.80 1.53 0.00 0.95 -3.05 119.26 118.47 2afp h ALA 31 Ca 0.21 -0.19 0.23 0.00 0.00 0.00 0.00 54.91 55.16 2afp h ALA 31 Cb 0.18 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2afp h ALA 31 CO -0.02 -0.77 0.58 1.49 0.00 0.00 0.00 179.25 180.54 2afp h GLU 32 N -1.17 0.00 0.21 0.00 4.81 0.72 0.34 114.58 119.50 2afp h GLU 32 Ca -0.08 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2afp h GLU 32 Cb 0.64 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.03 2afp h GLU 32 CO 0.13 0.00 -0.10 1.15 -0.73 0.00 0.00 179.01 179.46 2afp h THR 33 N 0.00 0.00 -0.23 0.32 2.02 -1.16 0.69 112.91 114.56 2afp h THR 33 Ca 0.38 -0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.53 2afp h THR 33 Cb 1.55 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 2afp h THR 33 CO -0.00 0.00 0.03 -0.55 0.37 0.00 0.00 175.52 175.36 2afp h ASN 34 N -0.29 0.29 0.72 4.18 -1.07 -1.34 -1.14 115.58 116.93 2afp h ASN 34 Ca -0.03 -0.03 -0.04 0.00 0.07 0.00 0.00 56.30 56.27 2afp h ASN 34 Cb 0.22 -0.08 0.01 0.00 -2.07 0.00 0.00 38.32 36.40 2afp h ASN 34 CO 0.05 0.33 -0.35 0.00 0.07 0.00 0.00 177.43 177.53 2afp h MET 36 N -1.18 0.00 -0.05 0.00 1.85 0.50 -0.38 114.93 115.66 2afp h MET 36 Ca -0.10 0.00 0.01 0.00 -0.61 0.00 0.00 59.70 59.01 2afp h MET 36 Cb 0.74 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 32.77 2afp h MET 36 CO 0.16 0.00 0.04 0.87 -0.40 0.00 0.00 176.91 177.59 2afp h LYS 37 N 0.00 0.00 -0.90 0.39 1.57 -1.10 -0.16 116.57 116.38 2afp h LYS 37 Ca 0.08 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.53 2afp h LYS 37 Cb 0.34 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 32.45 2afp h LYS 37 CO -0.00 0.00 0.42 1.28 -0.57 0.00 0.00 179.45 180.58 2afp n LEU 38 N -4.15 6.01 -2.76 2.94 4.77 -0.15 -4.97 117.00 118.68 2afp n LEU 38 Ca -0.02 -3.17 -0.01 0.00 -0.03 0.00 0.00 56.01 52.79 2afp n LEU 38 Cb 0.14 -0.76 -0.01 0.00 -2.33 0.00 0.00 43.42 40.46 2afp n LEU 38 CO 0.31 0.88 -0.52 0.61 -1.33 0.00 0.00 177.39 177.34 2afp n GLY 39 N -0.55 -3.92 0.00 -0.72 0.00 -0.07 -4.93 105.19 95.00 2afp n GLY 39 Ca 0.45 0.60 0.00 0.00 0.00 0.00 0.00 46.02 47.07 2afp n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2afp n GLY 40 N 0.95 -0.41 0.73 -0.02 0.00 -1.26 -4.67 105.19 100.51 2afp n GLY 40 Ca -0.06 -1.09 -0.03 0.00 0.00 0.00 0.00 46.02 44.84 2afp n GLY 40 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2afp n HIS 41 N 9.00 -0.89 -0.63 1.61 8.25 -1.26 -4.17 115.22 127.13 2afp n HIS 41 Ca 0.00 -0.45 -0.31 0.00 -0.26 0.00 0.00 57.72 56.71 2afp n HIS 41 Cb 0.00 0.14 0.19 0.00 1.12 0.00 0.00 29.99 31.44 2afp n HIS 41 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2afp n LEU 42 N 0.00 0.70 0.00 2.41 4.77 -1.26 -3.27 117.00 120.35 2afp n LEU 42 Ca -0.01 0.17 -0.14 0.00 -0.03 0.00 0.00 56.01 56.00 2afp n LEU 42 Cb 0.12 -1.32 0.13 0.00 -2.33 0.00 0.00 43.42 40.03 2afp n LEU 42 CO 0.06 -2.85 0.15 0.00 -1.33 0.00 0.00 177.39 173.43 2afp n ALA 43 N -4.41 -2.35 0.00 -1.18 0.00 73.56 -4.32 120.51 181.81 2afp n ALA 43 Ca 0.07 -0.68 0.00 0.00 0.00 0.00 0.00 53.44 52.83 2afp n ALA 43 Cb 0.54 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.93 2afp n ALA 43 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2afp n SER 44 N -3.61 0.00 -0.26 0.00 7.64 -1.26 -4.88 113.62 111.24 2afp n SER 44 Ca 0.06 0.00 0.01 0.00 1.01 0.00 0.00 58.87 59.95 2afp n SER 44 Cb 0.27 0.10 -0.00 0.00 -1.01 0.00 0.00 64.21 63.57 2afp n SER 44 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 2afp n ILE 45 N -1.53 0.00 0.11 0.44 -5.35 -1.26 -4.96 119.36 106.80 2afp n ILE 45 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 2afp n ILE 45 Cb 0.00 -0.03 0.00 0.00 -1.74 0.00 0.00 39.64 37.87 2afp n ILE 45 CO 0.00 0.00 0.00 1.57 -1.76 0.00 0.00 176.55 176.36 2afp n HIS 46 N -0.68 -2.38 -1.32 4.28 -0.00 -1.26 -5.07 115.22 108.79 2afp n HIS 46 Ca 0.00 0.53 -0.30 0.00 0.46 0.00 0.00 57.72 58.42 2afp n HIS 46 Cb 0.04 1.30 0.21 0.00 -0.12 0.00 0.00 29.99 31.41 2afp n HIS 46 CO 0.00 0.00 0.00 -1.12 0.46 0.00 0.00 176.34 175.68 2afp s SER 47 N -3.98 1.91 -0.06 0.26 0.01 -1.26 -4.99 113.70 105.59 2afp s SER 47 Ca 0.00 0.68 0.13 0.00 1.31 0.00 0.00 55.95 58.06 2afp s SER 47 Cb 0.00 -0.98 -0.23 0.00 0.21 0.00 0.00 66.02 65.02 2afp s SER 47 CO 0.00 -3.52 0.60 0.00 0.41 0.00 0.00 173.24 170.73 2afp n GLN 48 N -4.36 0.64 0.12 12.44 6.02 -1.26 -3.94 117.38 127.04 2afp n GLN 48 Ca 0.12 0.27 0.14 0.00 -0.01 0.00 0.00 57.00 57.51 2afp n GLN 48 Cb 0.59 -1.77 0.65 0.00 1.02 0.00 0.00 30.24 30.74 2afp n GLN 48 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.06 177.10 2afp h GLU 49 N 0.00 0.03 -0.22 -1.09 -0.00 -2.00 0.49 114.58 111.79 2afp h GLU 49 Ca -0.31 -0.00 -0.06 0.00 -0.00 0.00 0.00 59.36 58.98 2afp h GLU 49 Cb 2.04 -0.01 -0.01 0.00 -0.00 0.00 0.00 28.75 30.77 2afp h GLU 49 CO 0.07 0.02 -0.14 0.93 -0.00 0.00 0.00 179.01 179.89 2afp h GLU 50 N 0.03 0.37 -0.54 1.06 5.08 -1.97 -1.55 114.58 117.07 2afp h GLU 50 Ca 0.13 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2afp h GLU 50 Cb 0.49 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 2afp h GLU 50 CO -0.01 0.51 0.29 1.25 -1.00 0.00 0.00 179.01 180.06 2afp h HIS 51 N 0.34 0.74 -0.88 4.33 2.76 -0.21 -1.42 115.15 120.81 2afp h HIS 51 Ca 0.07 -0.02 0.10 0.00 -2.20 0.00 0.00 60.37 58.31 2afp h HIS 51 Cb 0.46 -0.24 -0.06 0.00 1.55 0.00 0.00 27.41 29.12 2afp h HIS 51 CO 0.01 0.54 0.57 0.77 -1.30 0.00 0.00 177.93 178.52 2afp h SER 52 N 0.72 0.79 -0.21 3.26 0.02 -0.89 0.51 113.55 117.74 2afp h SER 52 Ca 0.19 0.02 0.04 0.00 -0.84 0.00 0.00 61.79 61.20 2afp h SER 52 Cb 0.05 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 2afp h SER 52 CO -0.03 0.46 0.15 0.15 -1.14 0.00 0.00 176.83 176.42 2afp h PHE 53 N 0.87 0.12 -0.01 3.45 3.57 -0.53 -0.34 116.94 124.08 2afp h PHE 53 Ca 0.41 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.82 2afp h PHE 53 Cb 0.41 -0.04 0.01 0.00 2.79 0.00 0.00 35.95 39.12 2afp h PHE 53 CO -0.00 0.07 -0.35 0.82 -2.23 0.00 0.00 178.31 176.62 2afp h ILE 54 N 0.12 1.50 -0.28 1.41 2.04 -0.70 -3.09 117.51 118.51 2afp h ILE 54 Ca 0.09 -1.95 -0.02 0.00 1.00 0.00 0.00 64.86 63.98 2afp h ILE 54 Cb 0.22 2.68 -0.01 0.00 -0.74 0.00 0.00 36.82 38.96 2afp h ILE 54 CO -0.01 0.55 0.10 1.56 0.00 0.00 0.00 178.15 180.35 2afp h GLN 55 N -0.36 0.39 -0.10 2.37 7.50 -0.97 0.16 115.11 124.10 2afp h GLN 55 Ca -0.04 -0.05 -0.07 0.00 0.50 0.00 0.00 58.65 58.99 2afp h GLN 55 Cb 1.08 -0.08 -0.01 0.00 0.05 0.00 0.00 27.48 28.52 2afp h GLN 55 CO 0.07 0.34 -0.27 1.79 -1.50 0.00 0.00 178.83 179.26 2afp h THR 56 N 0.40 1.23 0.14 -0.54 1.35 -1.11 -2.94 112.91 111.44 2afp h THR 56 Ca 0.10 -1.09 -0.31 0.00 -0.55 0.00 0.00 66.41 64.56 2afp h THR 56 Cb 0.10 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 67.98 2afp h THR 56 CO -0.01 0.33 -1.51 -0.07 -0.25 0.00 0.00 175.52 174.01 2afp h LEU 57 N 0.15 0.47 -3.02 3.87 -0.00 -1.18 -3.50 115.31 112.11 2afp h LEU 57 Ca 0.02 -0.61 0.00 0.00 -0.00 0.00 0.00 57.88 57.29 2afp h LEU 57 Cb 0.56 -0.15 0.00 0.00 -0.00 0.00 0.00 40.66 41.07 2afp h LEU 57 CO 0.04 1.50 -0.41 -0.46 -0.00 0.00 0.00 178.44 179.11 2afp n ASN 58 N -3.51 -6.65 -0.76 -0.43 0.23 -0.06 -4.96 115.26 99.12 2afp n ASN 58 Ca -0.16 0.66 -0.01 0.00 -0.53 0.00 0.00 54.58 54.54 2afp n ASN 58 Cb 1.05 -1.44 -0.01 0.00 -2.08 0.00 0.00 39.78 37.30 2afp n ASN 58 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2afp n ALA 59 N 1.89 2.41 0.00 -2.53 0.00 -1.26 -5.12 120.51 115.90 2afp n ALA 59 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.65 2afp n ALA 59 Cb 0.21 -0.32 0.00 0.00 0.00 0.00 0.00 19.45 19.33 2afp n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2afp n GLY 60 N 0.08 0.54 0.00 0.00 0.00 -1.26 -2.08 105.19 102.47 2afp n GLY 60 Ca -0.05 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 43.97 2afp n GLY 60 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2afp n VAL 61 N 3.10 0.00 -3.83 1.61 0.31 -1.26 -4.86 118.33 113.39 2afp n VAL 61 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.03 2afp n VAL 61 Cb 0.00 -1.11 -0.15 0.00 -0.91 0.00 0.00 33.84 31.66 2afp n VAL 61 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2afp s VAL 62 N 0.87 1.20 -0.56 2.52 -7.23 -1.26 -4.42 120.40 111.53 2afp s VAL 62 Ca 0.00 -1.33 -0.26 0.00 -1.81 0.00 0.00 61.98 58.57 2afp s VAL 62 Cb 0.00 -1.74 -0.04 0.00 0.56 0.00 0.00 36.38 35.17 2afp s VAL 62 CO 0.00 -0.42 2.03 0.26 -0.31 0.00 0.00 175.10 176.67 2afp s TRP 63 N 1.50 1.48 -0.44 2.82 0.23 -1.26 -3.59 118.94 119.67 2afp s TRP 63 Ca 0.03 1.02 0.03 0.00 -2.03 0.00 0.00 56.10 55.15 2afp s TRP 63 Cb -0.18 -3.93 0.15 0.00 0.03 0.00 0.00 33.47 29.54 2afp s TRP 63 CO -0.14 -2.43 0.30 0.42 0.96 0.00 0.00 176.95 176.06 2afp s ILE 64 N 9.95 0.88 0.00 2.03 -1.09 -0.98 -4.39 121.20 127.59 2afp s ILE 64 Ca 0.78 -2.60 0.00 0.00 -2.23 0.00 0.00 60.65 56.59 2afp s ILE 64 Cb -0.15 -1.61 0.00 0.00 -1.58 0.00 0.00 42.46 39.12 2afp s ILE 64 CO 0.23 -1.06 0.00 0.61 -1.23 0.00 0.00 174.94 173.49 2afp n GLY 65 N 3.20 3.22 0.00 6.18 0.00 -1.25 -4.34 105.19 112.20 2afp n GLY 65 Ca 0.19 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2afp n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2afp n GLY 66 N -0.75 -2.27 3.64 -0.02 0.00 -1.20 -4.39 105.19 100.20 2afp n GLY 66 Ca 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 46.02 45.94 2afp n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2afp s SER 67 N -1.94 -0.06 -0.43 1.61 1.04 -1.14 -4.55 113.70 108.23 2afp s SER 67 Ca 0.00 0.05 0.07 0.00 0.48 0.00 0.00 55.95 56.55 2afp s SER 67 Cb 0.00 0.05 0.18 0.00 0.10 0.00 0.00 66.02 66.35 2afp s SER 67 CO 0.00 -0.07 0.63 0.00 0.98 0.00 0.00 173.24 174.79 2afp s ALA 68 N -1.32 -2.17 0.00 5.32 0.00 -1.12 -3.83 121.76 118.63 2afp s ALA 68 Ca 0.09 -0.00 0.02 0.00 0.00 0.00 0.00 51.96 52.07 2afp s ALA 68 Cb -0.01 -2.68 0.03 0.00 0.00 0.00 0.00 23.12 20.46 2afp s ALA 68 CO -0.06 -2.22 0.92 0.00 0.00 0.00 0.00 175.76 174.41 2afp n LEU 70 N 0.04 -0.34 0.00 0.00 4.77 -1.26 -5.08 117.00 115.12 2afp n LEU 70 Ca -0.20 -2.29 -0.10 0.00 -0.03 0.00 0.00 56.01 53.39 2afp n LEU 70 Cb 0.70 0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.81 2afp n LEU 70 CO -0.11 1.24 0.03 0.00 -1.33 0.00 0.00 177.39 177.22 2afp n GLN 71 N -0.18 0.34 -1.22 3.23 6.02 -1.26 -5.04 117.38 119.27 2afp n GLN 71 Ca -0.15 -1.82 -0.27 0.00 -0.01 0.00 0.00 57.00 54.75 2afp n GLN 71 Cb 0.85 1.62 0.13 0.00 1.02 0.00 0.00 30.24 33.86 2afp n GLN 71 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2afp n ALA 72 N -1.63 5.80 -0.25 -1.58 0.00 -1.26 -4.91 120.51 116.68 2afp n ALA 72 Ca -0.08 -2.99 0.00 0.00 0.00 0.00 0.00 53.44 50.38 2afp n ALA 72 Cb 0.36 -1.57 0.00 0.00 0.00 0.00 0.00 19.45 18.24 2afp n ALA 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2afp n GLY 73 N -0.93 -0.13 2.12 0.00 0.00 -1.26 -5.10 105.19 99.89 2afp n GLY 73 Ca 0.58 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.73 2afp n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2afp n ALA 74 N 1.90 1.02 -2.44 4.61 0.00 -1.26 -5.14 120.51 119.20 2afp n ALA 74 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 2afp n ALA 74 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2afp n ALA 74 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2afp n TRP 75 N -3.23 -4.73 -4.35 0.00 7.02 -1.26 -5.05 117.44 105.85 2afp n TRP 75 Ca 0.00 2.80 -0.24 0.00 -1.02 0.00 0.00 57.50 59.04 2afp n TRP 75 Cb 0.00 -3.86 -0.12 0.00 -2.42 0.00 0.00 31.31 24.91 2afp n TRP 75 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 2afp s THR 76 N -0.62 1.94 0.35 -0.99 -4.23 -1.25 -5.06 115.64 105.78 2afp s THR 76 Ca -0.09 -1.86 -0.05 0.00 -1.18 0.00 0.00 61.69 58.51 2afp s THR 76 Cb 0.01 -1.86 0.08 0.00 1.34 0.00 0.00 72.50 72.07 2afp s THR 76 CO 0.25 -0.20 0.47 0.79 -0.54 0.00 0.00 174.62 175.39 2afp n TRP 77 N 0.47 -3.82 -0.18 3.99 7.02 -1.26 -2.88 117.44 120.78 2afp n TRP 77 Ca -0.14 -0.50 0.08 0.00 -1.02 0.00 0.00 57.50 55.92 2afp n TRP 77 Cb 0.56 -0.36 0.38 0.00 -2.42 0.00 0.00 31.31 29.46 2afp n TRP 77 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 2afp h SER 78 N -0.56 0.62 0.00 -0.99 4.64 -1.90 -3.33 113.55 112.02 2afp h SER 78 Ca -0.15 0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 61.05 2afp h SER 78 Cb 0.45 -0.12 -0.15 0.00 -0.31 0.00 0.00 62.40 62.27 2afp h SER 78 CO 0.12 0.38 -0.35 -0.67 -0.87 0.00 0.00 176.83 175.44 2afp n ASP 79 N -4.49 -0.65 -2.03 4.97 2.03 -1.26 -4.88 116.55 110.24 2afp n ASP 79 Ca 0.12 -1.90 -0.17 0.00 0.52 0.00 0.00 54.79 53.35 2afp n ASP 79 Cb 0.29 0.19 -0.04 0.00 -0.72 0.00 0.00 41.12 40.85 2afp n ASP 79 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2afp n GLY 80 N 0.06 0.40 0.26 0.27 0.00 -1.25 -4.86 105.19 100.08 2afp n GLY 80 Ca -0.21 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.67 2afp n GLY 80 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2afp n THR 81 N -3.06 1.39 -2.98 2.61 -2.24 -1.26 -5.00 114.28 103.74 2afp n THR 81 Ca -0.19 -0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.22 2afp n THR 81 Cb 0.62 -2.08 -0.06 0.00 -2.10 0.00 0.00 70.33 66.71 2afp n THR 81 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2afp s PRO 82 N -2.64 4.39 -0.23 -0.78 0.04 -1.26 -4.97 135.00 129.55 2afp s PRO 82 Ca -0.27 1.05 0.11 0.00 0.04 0.00 0.00 61.00 61.93 2afp s PRO 82 Cb 0.07 -2.87 0.31 0.00 0.04 0.00 0.00 34.50 32.06 2afp s PRO 82 CO 0.38 0.36 1.36 0.00 0.04 0.00 0.00 177.00 179.13 2afp n MET 83 N 0.70 1.00 -3.61 4.56 0.00 -1.26 -4.87 117.12 113.63 2afp n MET 83 Ca -0.01 -1.38 -0.14 0.00 0.00 0.00 0.00 57.70 56.17 2afp n MET 83 Cb 0.51 0.26 -0.05 0.00 0.00 0.00 0.00 33.22 33.93 2afp n MET 83 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 175.97 176.24 2afp n ASN 84 N -1.01 -0.60 -1.30 3.17 2.04 -1.26 -4.91 115.26 111.40 2afp n ASN 84 Ca -0.18 -2.59 -0.10 0.00 -0.44 0.00 0.00 54.58 51.27 2afp n ASN 84 Cb 0.84 1.34 0.00 0.00 -2.53 0.00 0.00 39.78 39.42 2afp n ASN 84 CO 0.00 0.00 0.00 0.33 -0.44 0.00 0.00 177.26 177.15 2afp n PHE 85 N -0.46 -0.64 -3.72 -2.53 -0.00 -1.26 -4.99 117.46 103.86 2afp n PHE 85 Ca 0.05 0.08 -0.37 0.00 -0.00 0.00 0.00 57.45 57.22 2afp n PHE 85 Cb 0.45 -2.54 -0.10 0.00 -0.00 0.00 0.00 39.48 37.29 2afp n PHE 85 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 2afp s ARG 86 N -4.70 2.43 -0.09 -4.13 1.81 -1.26 -4.85 118.95 108.17 2afp s ARG 86 Ca 0.05 -2.32 0.13 0.00 -1.72 0.00 0.00 55.73 51.87 2afp s ARG 86 Cb -0.02 -3.71 0.20 0.00 -0.45 0.00 0.00 34.95 30.97 2afp s ARG 86 CO 0.06 -1.15 1.09 0.43 -0.68 0.00 0.00 175.30 175.05 2afp n SER 87 N 3.83 2.11 -3.86 0.23 7.64 -1.26 -5.07 113.62 117.23 2afp n SER 87 Ca 0.05 -2.74 -0.27 0.00 1.01 0.00 0.00 58.87 56.92 2afp n SER 87 Cb 0.39 -0.31 0.22 0.00 -1.01 0.00 0.00 64.21 63.50 2afp n SER 87 CO 0.00 0.00 0.00 -2.67 -3.01 0.00 0.00 175.04 169.36 2afp n TRP 88 N -1.12 -2.31 -1.65 1.43 4.27 -1.26 -4.79 117.44 112.01 2afp n TRP 88 Ca 0.11 -0.24 -0.43 0.00 -3.89 0.00 0.00 57.50 53.06 2afp n TRP 88 Cb 0.55 -1.48 -0.03 0.00 -1.36 0.00 0.00 31.31 28.98 2afp n TRP 88 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2afp n SER 90 N 8.02 3.28 -0.37 0.00 2.88 -1.26 -4.37 113.62 121.81 2afp n SER 90 Ca 0.22 -3.68 0.08 0.00 -1.33 0.00 0.00 58.87 54.15 2afp n SER 90 Cb 0.40 -0.77 0.18 0.00 -0.75 0.00 0.00 64.21 63.27 2afp n SER 90 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2afp n THR 91 N -1.14 2.07 -3.65 2.46 -2.24 -1.26 -5.00 114.28 105.52 2afp n THR 91 Ca 0.50 -2.78 0.03 0.00 -2.27 0.00 0.00 64.05 59.53 2afp n THR 91 Cb 1.44 -0.24 -0.06 0.00 -2.10 0.00 0.00 70.33 69.37 2afp n THR 91 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2afp s LYS 92 N -3.07 0.01 0.75 -0.78 2.20 -1.26 -5.18 119.74 112.40 2afp s LYS 92 Ca 0.35 0.02 -0.09 0.00 -0.36 0.00 0.00 55.97 55.89 2afp s LYS 92 Cb 0.33 0.00 0.07 0.00 -1.51 0.00 0.00 37.83 36.72 2afp s LYS 92 CO -0.02 -0.00 1.08 -1.25 -0.36 0.00 0.00 175.35 174.80 2afp s PRO 93 N 0.97 2.06 -0.04 4.03 0.04 -1.26 -4.99 135.00 135.80 2afp s PRO 93 Ca -0.07 -0.14 0.07 0.00 0.04 0.00 0.00 61.00 60.90 2afp s PRO 93 Cb -0.02 -2.08 0.14 0.00 0.04 0.00 0.00 34.50 32.57 2afp s PRO 93 CO -0.09 -1.41 1.09 -0.25 0.04 0.00 0.00 177.00 176.37 2afp n ASP 94 N -3.09 2.28 -1.93 6.66 9.92 -1.26 -5.09 116.55 124.04 2afp n ASP 94 Ca 0.08 -2.35 0.00 0.00 -0.53 0.00 0.00 54.79 52.00 2afp n ASP 94 Cb 0.61 -0.17 0.00 0.00 -0.64 0.00 0.00 41.12 40.92 2afp n ASP 94 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2afp n ASP 95 N -0.65 -8.76 -0.33 -2.24 8.00 -1.26 -3.47 116.55 107.84 2afp n ASP 95 Ca 0.07 1.30 0.01 0.00 0.71 0.00 0.00 54.79 56.87 2afp n ASP 95 Cb 0.41 -4.84 0.18 0.00 -0.02 0.00 0.00 41.12 36.84 2afp n ASP 95 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 2afp h VAL 96 N 3.78 1.18 0.07 2.53 -1.51 -1.94 0.72 116.25 121.09 2afp h VAL 96 Ca 0.00 -0.41 -0.24 0.00 -1.23 0.00 0.00 66.70 64.82 2afp h VAL 96 Cb 0.00 -0.12 0.02 0.00 -2.13 0.00 0.00 31.29 29.06 2afp h VAL 96 CO 0.00 0.22 -0.98 -0.07 -1.23 0.00 0.00 177.57 175.51 2afp h LEU 97 N 1.19 0.73 0.00 4.19 -0.00 -1.86 -3.18 115.31 116.38 2afp h LEU 97 Ca 0.36 -0.81 0.00 0.00 -0.00 0.00 0.00 57.88 57.43 2afp h LEU 97 Cb -0.03 -0.23 0.00 0.00 -0.00 0.00 0.00 40.66 40.41 2afp h LEU 97 CO -0.10 1.46 0.00 0.00 -0.00 0.00 0.00 178.44 179.80 2afp n ALA 98 N -2.65 1.66 -3.71 1.53 0.00 -1.00 -4.61 120.51 111.74 2afp n ALA 98 Ca -0.12 -0.05 -0.18 0.00 0.00 0.00 0.00 53.44 53.09 2afp n ALA 98 Cb 0.86 -1.23 -0.16 0.00 0.00 0.00 0.00 19.45 18.92 2afp n ALA 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2afp s ALA 99 N -2.97 0.33 0.07 0.00 0.00 0.21 -4.41 121.76 114.99 2afp s ALA 99 Ca 0.07 0.15 -0.00 0.00 0.00 0.00 0.00 51.96 52.18 2afp s ALA 99 Cb 0.09 -0.37 -0.00 0.00 0.00 0.00 0.00 23.12 22.84 2afp s ALA 99 CO 0.26 -0.13 -0.00 0.00 0.00 0.00 0.00 175.76 175.88 2afp s MET 102 N -5.40 0.60 0.00 0.00 -1.94 -1.26 0.11 119.30 111.40 2afp s MET 102 Ca 0.59 -0.78 0.00 0.00 -1.71 0.00 0.00 55.69 53.79 2afp s MET 102 Cb -0.11 -0.44 0.00 0.00 2.01 0.00 0.00 34.83 36.29 2afp s MET 102 CO 0.50 0.09 0.00 0.00 -0.01 0.00 0.00 175.02 175.60 2afp n GLN 103 N 1.49 0.00 -1.35 2.03 0.00 -1.26 -2.33 117.38 115.97 2afp n GLN 103 Ca -0.22 0.00 -0.01 0.00 0.00 0.00 0.00 57.00 56.78 2afp n GLN 103 Cb 0.55 0.00 0.01 0.00 0.00 0.00 0.00 30.24 30.80 2afp n GLN 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2afp n MET 104 N 0.00 0.15 -0.64 2.61 0.00 -1.24 -2.32 117.12 115.68 2afp n MET 104 Ca 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 57.70 57.51 2afp n MET 104 Cb 0.00 0.20 -0.00 0.00 0.00 0.00 0.00 33.22 33.42 2afp n MET 104 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 2afp n THR 105 N -0.18 0.00 0.00 3.17 -2.24 -1.26 -4.81 114.28 108.96 2afp n THR 105 Ca -0.03 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 2afp n THR 105 Cb 0.49 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 2afp n THR 105 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2afp n ALA 106 N 0.05 0.00 -1.00 6.98 0.00 -1.26 -4.67 120.51 120.61 2afp n ALA 106 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2afp n ALA 106 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.12 2afp n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2afp n ALA 107 N 0.00 0.00 0.00 0.00 0.00 -0.95 -4.99 120.51 114.57 2afp n ALA 107 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2afp n ALA 107 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2afp n ALA 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2afp n ALA 108 N -1.15 0.00 -2.03 0.00 0.00 -1.26 -4.93 120.51 111.13 2afp n ALA 108 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 2afp n ALA 108 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 2afp n ALA 108 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2afp n ASP 109 N 0.00 4.90 -2.62 0.00 9.92 -1.26 -4.85 116.55 122.64 2afp n ASP 109 Ca 0.00 -3.74 -0.19 0.00 -0.53 0.00 0.00 54.79 50.33 2afp n ASP 109 Cb 0.00 -0.34 0.03 0.00 -0.64 0.00 0.00 41.12 40.17 2afp n ASP 109 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2afp n GLN 110 N -0.71 -4.28 -3.40 -1.24 6.02 -1.26 -4.93 117.38 107.58 2afp n GLN 110 Ca 0.44 0.78 -0.21 0.00 -0.01 0.00 0.00 57.00 58.00 2afp n GLN 110 Cb 0.97 -5.38 0.01 0.00 1.02 0.00 0.00 30.24 26.85 2afp n GLN 110 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2afp n TRP 112 N -1.83 0.18 0.00 0.00 7.02 -1.26 -2.25 117.44 119.30 2afp n TRP 112 Ca 0.06 -3.59 0.00 0.00 -1.02 0.00 0.00 57.50 52.95 2afp n TRP 112 Cb 0.62 -0.14 0.00 0.00 -2.42 0.00 0.00 31.31 29.37 2afp n TRP 112 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 2afp n ASP 113 N 2.02 0.00 -0.95 -0.99 9.92 -0.98 -4.39 116.55 121.18 2afp n ASP 113 Ca 0.26 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.52 2afp n ASP 113 Cb 0.48 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.96 2afp n ASP 113 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2afp n ASP 114 N 0.00 -5.26 -3.83 -2.24 8.00 -1.26 -4.73 116.55 107.23 2afp n ASP 114 Ca 0.00 0.61 -0.06 0.00 0.71 0.00 0.00 54.79 56.04 2afp n ASP 114 Cb 0.00 -2.04 -0.02 0.00 -0.02 0.00 0.00 41.12 39.04 2afp n ASP 114 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2afp s LEU 115 N -1.07 -0.24 0.27 0.64 1.43 0.29 -4.67 118.68 115.33 2afp s LEU 115 Ca 0.00 -0.55 0.20 0.00 -1.03 0.00 0.00 54.13 52.75 2afp s LEU 115 Cb 0.00 2.58 0.09 0.00 0.03 0.00 0.00 46.19 48.90 2afp s LEU 115 CO 0.00 -1.23 1.26 1.55 0.23 0.00 0.00 176.35 178.16 2afp h PRO 116 N 2.00 0.00 0.00 1.29 0.13 -1.78 0.98 132.00 134.62 2afp h PRO 116 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 2afp h PRO 116 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2afp h PRO 116 CO 0.24 0.15 0.00 0.00 -0.23 0.00 0.00 178.00 178.16 2afp s PRO 118 N 0.00 3.74 -0.31 0.00 0.04 -1.26 -4.52 135.00 132.70 2afp s PRO 118 Ca 0.00 -1.66 0.18 0.00 0.04 0.00 0.00 61.00 59.56 2afp s PRO 118 Cb 0.00 -5.46 0.46 0.00 0.04 0.00 0.00 34.50 29.54 2afp s PRO 118 CO 0.00 -2.39 1.18 0.00 0.04 0.00 0.00 177.00 175.83 2afp n ALA 119 N 9.08 2.70 -0.73 8.56 0.00 -1.26 -5.08 120.51 133.79 2afp n ALA 119 Ca 0.44 -2.34 -0.10 0.00 0.00 0.00 0.00 53.44 51.44 2afp n ALA 119 Cb 0.47 -0.90 -0.10 0.00 0.00 0.00 0.00 19.45 18.92 2afp n ALA 119 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2afp n SER 120 N -0.62 -0.78 -3.89 0.00 3.41 -1.26 -4.79 113.62 105.69 2afp n SER 120 Ca 0.02 -0.33 -0.22 0.00 -0.26 0.00 0.00 58.87 58.08 2afp n SER 120 Cb 0.83 -0.27 -0.04 0.00 -0.26 0.00 0.00 64.21 64.47 2afp n SER 120 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2afp n HIS 121 N 2.72 0.49 -0.30 7.33 8.25 -1.26 -4.30 115.22 128.16 2afp n HIS 121 Ca 0.31 -1.72 -0.19 0.00 -0.26 0.00 0.00 57.72 55.86 2afp n HIS 121 Cb 0.09 -0.25 0.18 0.00 1.12 0.00 0.00 29.99 31.13 2afp n HIS 121 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 2afp n LYS 122 N -0.98 -2.73 -4.30 -0.41 2.85 -0.88 0.73 118.16 112.43 2afp n LYS 122 Ca -0.12 -0.89 -0.20 0.00 -1.05 0.00 0.00 58.31 56.05 2afp n LYS 122 Cb 0.45 -1.38 -0.13 0.00 -0.65 0.00 0.00 35.03 33.31 2afp n LYS 122 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2afp s SER 123 N -2.40 1.72 -0.13 -5.58 0.15 -1.26 -4.54 113.70 101.66 2afp s SER 123 Ca 0.41 -0.52 -0.00 0.00 0.70 0.00 0.00 55.95 56.54 2afp s SER 123 Cb -0.07 -0.09 0.03 0.00 -1.71 0.00 0.00 66.02 64.17 2afp s SER 123 CO 0.34 0.01 -0.09 -0.69 1.20 0.00 0.00 173.24 174.00 2afp s VAL 124 N -0.99 1.21 -0.05 4.45 1.01 -1.26 -2.51 120.40 122.26 2afp s VAL 124 Ca 0.01 -0.44 0.05 0.00 0.00 0.00 0.00 61.98 61.60 2afp s VAL 124 Cb -0.09 -1.21 -0.02 0.00 0.00 0.00 0.00 36.38 35.06 2afp s VAL 124 CO 0.02 0.37 -0.22 0.00 0.00 0.00 0.00 175.10 175.27 2afp s ALA 126 N -0.36 0.96 0.24 0.00 0.00 -0.68 0.89 121.76 122.81 2afp s ALA 126 Ca 0.03 -0.43 0.04 0.00 0.00 0.00 0.00 51.96 51.59 2afp s ALA 126 Cb -0.12 -0.30 -0.05 0.00 0.00 0.00 0.00 23.12 22.64 2afp s ALA 126 CO 0.02 0.19 0.00 -1.64 0.00 0.00 0.00 175.76 174.33 2afp s MET 127 N -0.02 1.38 0.29 0.00 -1.94 0.29 -4.10 119.30 115.19 2afp s MET 127 Ca 0.00 -1.70 -0.08 0.00 -1.71 0.00 0.00 55.69 52.20 2afp s MET 127 Cb -0.07 -0.66 -0.00 0.00 2.01 0.00 0.00 34.83 36.11 2afp s MET 127 CO 0.00 -0.10 0.46 -0.08 -0.01 0.00 0.00 175.02 175.29 2afp s THR 128 N -3.40 0.00 0.00 2.05 -1.32 -1.26 -0.39 115.64 111.32 2afp s THR 128 Ca 0.29 -1.52 0.00 0.00 -1.21 0.00 0.00 61.69 59.25 2afp s THR 128 Cb 0.06 -2.44 0.00 0.00 -1.51 0.00 0.00 72.50 68.61 2afp s THR 128 CO 0.10 0.00 0.00 2.22 -2.21 0.00 0.00 174.62 174.73