#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fdh s ALA 16 N 0.00 -0.85 -0.15 1.47 0.00 -1.26 -5.10 121.76 115.87 2fdh s ALA 16 Ca 0.00 1.16 -0.29 0.00 0.00 0.00 0.00 51.96 52.82 2fdh s ALA 16 Cb 0.00 -1.22 -0.02 0.00 0.00 0.00 0.00 23.12 21.88 2fdh s ALA 16 CO 0.00 -0.77 1.27 0.00 0.00 0.00 0.00 175.76 176.26 2fdh s ALA 17 N 2.51 3.64 0.00 0.00 0.00 -1.26 -3.14 121.76 123.52 2fdh s ALA 17 Ca 0.01 0.49 0.00 0.00 0.00 0.00 0.00 51.96 52.47 2fdh s ALA 17 Cb -0.12 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.38 2fdh s ALA 17 CO -0.11 -1.13 0.00 0.41 0.00 0.00 0.00 175.76 174.93 2fdh n GLY 18 N 3.60 1.17 3.69 0.00 0.00 -1.26 -1.07 105.19 111.32 2fdh n GLY 18 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 2fdh n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fdh s ALA 19 N -2.35 3.45 -0.35 4.61 0.00 -1.19 -2.68 121.76 123.26 2fdh s ALA 19 Ca 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 51.96 51.85 2fdh s ALA 19 Cb 0.00 -2.94 0.07 0.00 0.00 0.00 0.00 23.12 20.25 2fdh s ALA 19 CO 0.00 -0.30 0.10 0.08 0.00 0.00 0.00 175.76 175.64 2fdh s VAL 20 N 1.30 3.30 -0.29 0.00 1.01 -0.83 -4.93 120.40 119.97 2fdh s VAL 20 Ca 0.33 -1.55 -0.17 0.00 0.00 0.00 0.00 61.98 60.58 2fdh s VAL 20 Cb -0.16 -3.02 -0.02 0.00 0.00 0.00 0.00 36.38 33.18 2fdh s VAL 20 CO 0.13 -0.33 0.48 -0.63 0.00 0.00 0.00 175.10 174.76 2fdh s ILE 21 N 1.26 5.07 -0.64 2.22 1.01 -1.26 -1.52 121.20 127.33 2fdh s ILE 21 Ca 0.00 0.64 0.01 0.00 0.00 0.00 0.00 60.65 61.29 2fdh s ILE 21 Cb -0.21 -3.84 0.16 0.00 0.01 0.00 0.00 42.46 38.58 2fdh s ILE 21 CO -0.01 0.00 0.44 -0.76 0.00 0.00 0.00 174.94 174.61 2fdh s LEU 22 N 2.28 4.93 0.13 2.97 1.43 0.11 -5.02 118.68 125.52 2fdh s LEU 22 Ca 0.19 -3.19 -0.31 0.00 -1.03 0.00 0.00 54.13 49.79 2fdh s LEU 22 Cb -0.16 -1.76 -0.08 0.00 0.03 0.00 0.00 46.19 44.22 2fdh s LEU 22 CO 0.11 -0.25 1.35 -0.13 0.23 0.00 0.00 176.35 177.65 2fdh s ARG 23 N -0.54 4.35 -0.72 1.70 0.52 -1.26 -1.10 118.95 121.89 2fdh s ARG 23 Ca 0.20 2.04 0.00 0.00 -0.52 0.00 0.00 55.73 57.45 2fdh s ARG 23 Cb -0.18 -3.24 0.00 0.00 0.52 0.00 0.00 34.95 32.05 2fdh s ARG 23 CO -0.06 -0.37 0.00 0.54 0.02 0.00 0.00 175.30 175.44 2fdh n ARG 24 N 3.58 -1.12 -0.14 3.54 3.00 -1.24 -4.90 116.66 119.38 2fdh n ARG 24 Ca 0.10 0.65 0.02 0.00 -0.01 0.00 0.00 57.85 58.61 2fdh n ARG 24 Cb 0.43 -4.67 0.31 0.00 0.00 0.00 0.00 32.46 28.52 2fdh n ARG 24 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.63 177.98 2fdh h PHE 25 N 0.00 0.79 -0.53 -1.55 3.57 -1.37 -2.62 116.94 115.23 2fdh h PHE 25 Ca -0.14 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.38 2fdh h PHE 25 Cb 0.77 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.24 2fdh h PHE 25 CO 0.39 0.50 0.00 0.00 -2.23 0.00 0.00 178.31 176.97 2fdh n ALA 26 N -2.44 3.29 -0.08 2.41 0.00 0.86 -4.54 120.51 120.01 2fdh n ALA 26 Ca 0.06 -1.46 -0.08 0.00 0.00 0.00 0.00 53.44 51.96 2fdh n ALA 26 Cb 0.04 -1.06 -0.01 0.00 0.00 0.00 0.00 19.45 18.42 2fdh n ALA 26 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2fdh h PHE 27 N 3.47 0.23 -0.15 0.00 3.57 -1.63 0.72 116.94 123.16 2fdh h PHE 27 Ca 0.00 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.42 2fdh h PHE 27 Cb 1.48 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 40.14 2fdh h PHE 27 CO 0.78 0.12 -0.33 -0.91 -2.23 0.00 0.00 178.31 175.74 2fdh h ASN 28 N 0.27 0.30 1.02 0.41 -0.26 -1.83 -3.14 115.58 112.35 2fdh h ASN 28 Ca 0.12 -0.11 0.00 0.00 -0.56 0.00 0.00 56.30 55.75 2fdh h ASN 28 Cb 0.06 -0.08 0.00 0.00 -1.06 0.00 0.00 38.32 37.24 2fdh h ASN 28 CO -0.10 0.62 -0.74 0.00 -1.06 0.00 0.00 177.43 176.15 2fdh h ALA 29 N 1.40 0.58 -0.91 -0.83 0.00 -1.83 -3.41 119.26 114.26 2fdh h ALA 29 Ca 0.03 0.00 0.20 0.00 0.00 0.00 0.00 54.91 55.14 2fdh h ALA 29 Cb 0.71 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.33 2fdh h ALA 29 CO 0.05 0.00 -0.14 0.00 0.00 0.00 0.00 179.25 179.16 2fdh h ALA 30 N 2.24 0.74 -0.63 0.00 0.00 -0.80 -1.21 119.26 119.60 2fdh h ALA 30 Ca 0.00 0.34 -0.07 0.00 0.00 0.00 0.00 54.91 55.18 2fdh h ALA 30 Cb 0.88 0.64 -0.03 0.00 0.00 0.00 0.00 17.79 19.28 2fdh h ALA 30 CO 0.00 -0.43 0.12 1.49 0.00 0.00 0.00 179.25 180.43 2fdh h GLU 31 N 0.01 1.00 -0.00 0.00 4.81 -1.80 -1.81 114.58 116.80 2fdh h GLU 31 Ca 0.47 -0.24 -0.17 0.00 -0.13 0.00 0.00 59.36 59.28 2fdh h GLU 31 Cb 0.79 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.02 2fdh h GLU 31 CO -0.90 0.91 -0.81 0.37 -0.73 0.00 0.00 179.01 177.85 2fdh h GLN 32 N 0.95 0.06 -0.32 1.92 5.75 -1.66 -2.57 115.11 119.24 2fdh h GLN 32 Ca 0.20 -0.06 -0.12 0.00 -0.15 0.00 0.00 58.65 58.51 2fdh h GLN 32 Cb 0.38 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.94 2fdh h GLN 32 CO 0.01 0.83 -0.31 -0.07 -2.65 0.00 0.00 178.83 176.64 2fdh h LEU 33 N 0.03 0.71 -0.53 -2.39 3.38 -0.96 -1.11 115.31 114.45 2fdh h LEU 33 Ca -0.02 -0.28 -0.16 0.00 0.09 0.00 0.00 57.88 57.51 2fdh h LEU 33 Cb 1.42 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 2fdh h LEU 33 CO 0.11 0.97 -0.61 0.40 0.09 0.00 0.00 178.44 179.40 2fdh h ILE 34 N 0.59 1.35 -0.48 1.22 2.04 -1.29 -0.19 117.51 120.75 2fdh h ILE 34 Ca 0.07 -1.94 -0.11 0.00 1.00 0.00 0.00 64.86 63.88 2fdh h ILE 34 Cb 0.82 1.93 -0.02 0.00 -0.74 0.00 0.00 36.82 38.81 2fdh h ILE 34 CO 0.07 0.59 -0.15 0.03 0.00 0.00 0.00 178.15 178.69 2fdh h ARG 35 N 0.31 0.91 0.00 2.37 3.08 -1.26 -2.18 114.38 117.61 2fdh h ARG 35 Ca -0.01 -0.34 -0.09 0.00 0.07 0.00 0.00 59.98 59.61 2fdh h ARG 35 Cb 1.15 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 2fdh h ARG 35 CO 0.11 0.99 -0.44 -0.44 -1.07 0.00 0.00 179.97 179.12 2fdh h ASP 36 N 0.80 0.00 -0.25 7.04 3.32 -0.94 -2.15 116.42 124.24 2fdh h ASP 36 Ca 0.12 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.05 2fdh h ASP 36 Cb 0.68 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.23 2fdh h ASP 36 CO 0.05 0.44 -0.30 0.40 -1.72 0.00 0.00 179.24 178.11 2fdh h ILE 37 N 0.00 1.31 -0.52 0.35 2.04 -0.83 -0.64 117.51 119.23 2fdh h ILE 37 Ca -0.00 -1.49 -0.03 0.00 1.00 0.00 0.00 64.86 64.34 2fdh h ILE 37 Cb 1.11 1.69 -0.02 0.00 -0.74 0.00 0.00 36.82 38.85 2fdh h ILE 37 CO 0.06 0.47 0.18 0.78 0.00 0.00 0.00 178.15 179.64 2fdh h ASN 38 N 0.36 0.69 -0.17 1.72 2.35 -1.28 0.53 115.58 119.78 2fdh h ASN 38 Ca 0.03 -0.09 -0.09 0.00 -0.55 0.00 0.00 56.30 55.60 2fdh h ASN 38 Cb 0.88 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 39.07 2fdh h ASN 38 CO 0.07 0.64 -0.27 -0.78 -1.65 0.00 0.00 177.43 175.45 2fdh h ASP 39 N 0.74 0.53 -0.55 5.81 -0.00 -1.23 -2.41 116.42 119.31 2fdh h ASP 39 Ca 0.18 -0.53 0.00 0.00 -0.00 0.00 0.00 57.03 56.68 2fdh h ASP 39 Cb 0.19 -0.15 -0.03 0.00 -0.00 0.00 0.00 39.33 39.34 2fdh h ASP 39 CO -0.01 0.95 0.35 0.58 -0.00 0.00 0.00 179.24 181.10 2fdh h VAL 40 N 0.11 1.16 0.00 2.25 2.07 -0.81 -2.47 116.25 118.56 2fdh h VAL 40 Ca 0.01 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.21 2fdh h VAL 40 Cb 0.84 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2fdh h VAL 40 CO 0.06 0.16 -0.01 0.00 0.02 0.00 0.00 177.57 177.80 2fdh h ALA 41 N 1.18 1.02 0.00 1.67 0.00 -0.84 -0.37 119.26 121.92 2fdh h ALA 41 Ca 0.20 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2fdh h ALA 41 Cb -0.05 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2fdh h ALA 41 CO -0.04 0.01 -0.09 0.66 0.00 0.00 0.00 179.25 179.79 2fdh h SER 42 N 0.00 0.00 0.00 0.00 4.64 -0.94 -2.86 113.55 114.40 2fdh h SER 42 Ca -0.00 0.00 -0.45 0.00 -0.47 0.00 0.00 61.79 60.87 2fdh h SER 42 Cb 0.24 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.27 2fdh h SER 42 CO 0.00 0.09 -2.49 1.67 -0.87 0.00 0.00 176.83 175.23 2fdh n GLN 43 N -3.13 0.60 -3.95 4.77 7.27 -0.78 -4.80 117.38 117.36 2fdh n GLN 43 Ca 0.03 0.25 -0.30 0.00 0.07 0.00 0.00 57.00 57.05 2fdh n GLN 43 Cb 0.52 -1.51 -0.14 0.00 2.41 0.00 0.00 30.24 31.52 2fdh n GLN 43 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 2fdh s SER 44 N -7.32 4.41 0.78 1.69 0.01 -0.22 -4.99 113.70 108.07 2fdh s SER 44 Ca -0.38 -2.66 -0.13 0.00 1.31 0.00 0.00 55.95 54.09 2fdh s SER 44 Cb 0.14 -1.57 0.07 0.00 0.21 0.00 0.00 66.02 64.86 2fdh s SER 44 CO 0.51 -0.29 1.18 -2.16 0.41 0.00 0.00 173.24 172.89 2fdh s PRO 45 N 0.21 1.90 0.17 12.44 0.04 -1.08 -3.99 135.00 144.70 2fdh s PRO 45 Ca 0.15 1.65 -0.31 0.00 0.04 0.00 0.00 61.00 62.53 2fdh s PRO 45 Cb -0.23 -1.82 -0.09 0.00 0.04 0.00 0.00 34.50 32.40 2fdh s PRO 45 CO -0.03 -1.99 1.38 -0.06 0.04 0.00 0.00 177.00 176.34 2fdh s PHE 46 N -2.23 3.19 0.01 0.56 0.40 -1.26 -4.69 117.98 113.96 2fdh s PHE 46 Ca 0.71 1.03 -0.02 0.00 -0.60 0.00 0.00 56.93 58.05 2fdh s PHE 46 Cb -0.26 -3.70 -0.01 0.00 0.51 0.00 0.00 43.02 39.56 2fdh s PHE 46 CO 0.49 -2.34 0.03 -0.98 0.70 0.00 0.00 175.22 173.12 2fdh s ARG 47 N 0.41 0.34 -0.54 0.44 3.03 -0.67 -4.89 118.95 117.08 2fdh s ARG 47 Ca 0.61 -0.48 -0.21 0.00 2.03 0.00 0.00 55.73 57.69 2fdh s ARG 47 Cb -0.38 0.13 0.06 0.00 -1.03 0.00 0.00 34.95 33.73 2fdh s ARG 47 CO 0.35 -0.07 0.75 -0.65 -1.13 0.00 0.00 175.30 174.56 2fdh s GLN 48 N -1.29 3.18 0.44 3.89 -0.21 -1.26 -0.40 119.66 124.00 2fdh s GLN 48 Ca -0.14 -0.72 -0.25 0.00 0.02 0.00 0.00 55.36 54.27 2fdh s GLN 48 Cb -0.08 -4.10 -0.08 0.00 1.00 0.00 0.00 33.01 29.75 2fdh s GLN 48 CO -0.00 -1.36 1.28 -1.64 -2.12 0.00 0.00 175.29 171.45 2fdh s MET 49 N 3.13 3.80 -0.28 2.91 -1.94 -1.26 -4.62 119.30 121.03 2fdh s MET 49 Ca 0.20 2.09 -0.17 0.00 -1.71 0.00 0.00 55.69 56.10 2fdh s MET 49 Cb -0.17 -2.61 -0.03 0.00 2.01 0.00 0.00 34.83 34.03 2fdh s MET 49 CO 0.14 -0.61 0.46 0.08 -0.01 0.00 0.00 175.02 175.08 2fdh s VAL 50 N -1.33 5.10 0.56 -6.03 1.01 -1.26 -1.17 120.40 117.28 2fdh s VAL 50 Ca 0.60 0.64 -0.19 0.00 0.00 0.00 0.00 61.98 63.03 2fdh s VAL 50 Cb -0.36 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.15 2fdh s VAL 50 CO 0.46 0.04 1.15 0.28 0.00 0.00 0.00 175.10 177.03 2fdh s THR 51 N 2.24 3.01 0.59 3.92 -1.32 -0.01 -4.60 115.64 119.45 2fdh s THR 51 Ca 0.18 0.62 0.37 0.00 -1.21 0.00 0.00 61.69 61.65 2fdh s THR 51 Cb -0.16 -3.25 0.54 0.00 -1.51 0.00 0.00 72.50 68.13 2fdh s THR 51 CO 0.10 -0.14 1.44 1.55 -2.21 0.00 0.00 174.62 175.36 2fdh h PRO 52 N 1.08 0.00 -0.01 7.08 0.13 -1.86 0.22 132.00 138.65 2fdh h PRO 52 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2fdh h PRO 52 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2fdh h PRO 52 CO 0.56 0.00 -0.07 0.41 -0.23 0.00 0.00 178.00 178.67 2fdh n GLY 53 N -1.80 -0.71 0.13 1.56 0.00 -1.26 -4.92 105.19 98.19 2fdh n GLY 53 Ca 0.32 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2fdh n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fdh n GLY 54 N 1.21 0.96 3.56 -0.02 0.00 0.78 -5.09 105.19 106.59 2fdh n GLY 54 Ca 0.17 -0.03 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 2fdh n GLY 54 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2fdh s TYR 55 N -2.00 3.09 0.00 1.61 1.51 -1.24 -4.87 117.35 115.46 2fdh s TYR 55 Ca 0.00 -0.12 -0.30 0.00 -1.01 0.00 0.00 57.07 55.64 2fdh s TYR 55 Cb 0.00 -1.94 -0.04 0.00 -0.11 0.00 0.00 41.96 39.88 2fdh s TYR 55 CO 0.00 0.11 1.07 0.99 -1.11 0.00 0.00 175.55 176.61 2fdh s THR 56 N 0.07 4.54 0.46 -0.71 2.01 -1.26 -0.83 115.64 119.92 2fdh s THR 56 Ca 0.01 1.83 -0.22 0.00 0.31 0.00 0.00 61.69 63.62 2fdh s THR 56 Cb -0.13 -4.17 -0.08 0.00 0.01 0.00 0.00 72.50 68.13 2fdh s THR 56 CO 0.02 0.12 1.09 -0.04 -0.69 0.00 0.00 174.62 175.12 2fdh s MET 57 N 1.23 3.85 0.30 4.92 -1.94 -0.32 -4.96 119.30 122.39 2fdh s MET 57 Ca 0.54 1.56 0.16 0.00 -1.71 0.00 0.00 55.69 56.24 2fdh s MET 57 Cb -0.24 -2.31 0.25 0.00 2.01 0.00 0.00 34.83 34.54 2fdh s MET 57 CO 0.27 -0.43 1.53 0.66 -0.01 0.00 0.00 175.02 177.04 2fdh h SER 58 N 1.95 0.00 -3.42 3.03 4.64 -1.91 -3.42 113.55 114.42 2fdh h SER 58 Ca -0.49 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.29 2fdh h SER 58 Cb 1.23 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.29 2fdh h SER 58 CO 0.60 0.48 0.24 -0.69 -0.87 0.00 0.00 176.83 176.60 2fdh s VAL 59 N -3.14 4.85 -0.07 0.95 1.01 -1.26 -4.74 120.40 117.99 2fdh s VAL 59 Ca 0.03 1.80 -0.18 0.00 0.00 0.00 0.00 61.98 63.62 2fdh s VAL 59 Cb 0.09 -4.20 -0.05 0.00 0.00 0.00 0.00 36.38 32.22 2fdh s VAL 59 CO 0.73 0.25 0.49 0.00 0.00 0.00 0.00 175.10 176.56 2fdh s ALA 60 N 0.60 3.52 0.17 5.51 0.00 -0.74 -4.42 121.76 126.39 2fdh s ALA 60 Ca 0.44 -0.15 0.06 0.00 0.00 0.00 0.00 51.96 52.31 2fdh s ALA 60 Cb -0.20 -2.62 -0.04 0.00 0.00 0.00 0.00 23.12 20.25 2fdh s ALA 60 CO 0.24 0.12 -0.12 -1.64 0.00 0.00 0.00 175.76 174.36 2fdh s MET 61 N 0.16 1.17 0.31 0.00 -1.94 0.47 0.20 119.30 119.67 2fdh s MET 61 Ca 0.27 -1.49 -0.19 0.00 -1.71 0.00 0.00 55.69 52.56 2fdh s MET 61 Cb -0.16 -0.86 0.03 0.00 2.01 0.00 0.00 34.83 35.85 2fdh s MET 61 CO 0.12 0.13 0.74 -0.08 -0.01 0.00 0.00 175.02 175.92 2fdh s THR 62 N -3.05 0.00 0.11 2.05 -1.32 -0.73 -1.66 115.64 111.04 2fdh s THR 62 Ca 0.18 -1.00 -0.03 0.00 -1.21 0.00 0.00 61.69 59.63 2fdh s THR 62 Cb 0.00 -2.27 -0.03 0.00 -1.51 0.00 0.00 72.50 68.69 2fdh s THR 62 CO 0.03 0.00 0.09 0.20 -2.21 0.00 0.00 174.62 172.74 2fdh s ASN 63 N -2.97 0.28 -0.00 8.08 0.01 -1.26 -0.49 114.94 118.59 2fdh s ASN 63 Ca 0.12 -1.04 -0.05 0.00 -0.71 0.00 0.00 52.86 51.19 2fdh s ASN 63 Cb -0.06 0.30 -0.00 0.00 0.41 0.00 0.00 41.25 41.90 2fdh s ASN 63 CO 0.08 -0.73 0.10 0.00 -1.51 0.00 0.00 177.10 175.04 2fdh n GLY 65 N 1.72 0.37 0.31 0.00 0.00 0.79 -1.27 105.19 107.11 2fdh n GLY 65 Ca -0.21 -2.31 -0.09 0.00 0.00 0.00 0.00 46.02 43.41 2fdh n GLY 65 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2fdh h HIS 66 N 0.00 1.17 -2.85 1.61 3.86 -1.45 -3.42 115.15 114.07 2fdh h HIS 66 Ca 0.00 -0.20 -0.61 0.00 -1.16 0.00 0.00 60.37 58.40 2fdh h HIS 66 Cb 0.00 -0.31 -0.17 0.00 1.06 0.00 0.00 27.41 28.00 2fdh h HIS 66 CO 0.00 1.03 -0.79 -0.51 0.86 0.00 0.00 177.93 178.52 2fdh s LEU 67 N -9.35 2.49 -0.08 2.43 1.43 -0.52 -4.33 118.68 110.75 2fdh s LEU 67 Ca -0.12 -0.93 -0.06 0.00 -1.03 0.00 0.00 54.13 51.99 2fdh s LEU 67 Cb 0.14 -1.08 0.03 0.00 0.03 0.00 0.00 46.19 45.30 2fdh s LEU 67 CO 0.86 0.06 0.20 -0.83 0.23 0.00 0.00 176.35 176.86 2fdh s GLY 68 N -2.99 -0.13 0.17 -3.19 0.00 -0.30 -4.26 107.32 96.63 2fdh s GLY 68 Ca 0.23 0.66 -0.30 0.00 0.00 0.00 0.00 44.72 45.31 2fdh s GLY 68 CO 0.11 0.71 1.29 0.86 0.00 0.00 0.00 173.10 176.06 2fdh s TRP 69 N 0.50 3.31 0.13 1.90 -0.00 -1.26 -1.47 118.94 122.05 2fdh s TRP 69 Ca -0.03 1.23 -0.16 0.00 -0.00 0.00 0.00 56.10 57.13 2fdh s TRP 69 Cb -0.05 -3.56 0.04 0.00 -0.00 0.00 0.00 33.47 29.90 2fdh s TRP 69 CO -0.02 -1.75 0.42 -0.08 -0.00 0.00 0.00 176.95 175.52 2fdh s THR 70 N 0.34 0.06 0.27 5.86 -1.32 -0.68 -4.89 115.64 115.27 2fdh s THR 70 Ca 0.57 -0.59 -0.05 0.00 -1.21 0.00 0.00 61.69 60.42 2fdh s THR 70 Cb -0.35 -1.21 -0.05 0.00 -1.51 0.00 0.00 72.50 69.37 2fdh s THR 70 CO 0.36 -0.28 0.53 0.42 -2.21 0.00 0.00 174.62 173.44 2fdh s THR 71 N -3.81 5.03 0.25 5.08 -4.23 -1.26 -1.92 115.64 114.78 2fdh s THR 71 Ca 0.04 0.08 -0.10 0.00 -1.18 0.00 0.00 61.69 60.53 2fdh s THR 71 Cb 0.01 -3.71 -0.01 0.00 1.34 0.00 0.00 72.50 70.13 2fdh s THR 71 CO -0.11 -0.26 0.42 -2.28 -0.54 0.00 0.00 174.62 171.85 2fdh s HIS 72 N -2.01 0.57 0.27 3.99 5.04 0.69 -4.90 115.29 118.93 2fdh s HIS 72 Ca 0.44 -0.90 -0.03 0.00 -1.54 0.00 0.00 55.06 53.03 2fdh s HIS 72 Cb -0.11 0.04 0.36 0.00 0.04 0.00 0.00 32.58 32.91 2fdh s HIS 72 CO 0.28 -0.95 1.86 0.00 -2.34 0.00 0.00 174.74 173.59 2fdh h ARG 73 N 2.30 0.99 -0.00 2.88 3.08 -1.93 -2.78 114.38 118.92 2fdh h ARG 73 Ca -0.28 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.62 2fdh h ARG 73 Cb 1.25 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.12 2fdh h ARG 73 CO 0.39 0.79 -0.19 1.04 -1.07 0.00 0.00 179.97 180.93 2fdh n GLN 74 N -4.31 0.16 0.00 0.04 1.13 -1.26 -4.82 117.38 108.32 2fdh n GLN 74 Ca 0.06 -0.05 0.00 0.00 -1.94 0.00 0.00 57.00 55.07 2fdh n GLN 74 Cb 0.16 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.01 2fdh n GLN 74 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2fdh n GLY 75 N 1.45 0.27 3.38 1.08 0.00 -1.05 -5.09 105.19 105.23 2fdh n GLY 75 Ca 0.08 -1.07 -0.32 0.00 0.00 0.00 0.00 46.02 44.71 2fdh n GLY 75 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2fdh s TYR 76 N -3.59 2.65 0.16 1.61 2.02 -1.26 -0.22 117.35 118.71 2fdh s TYR 76 Ca 0.00 -0.46 -0.13 0.00 -0.37 0.00 0.00 57.07 56.11 2fdh s TYR 76 Cb 0.00 -1.68 0.01 0.00 -0.40 0.00 0.00 41.96 39.90 2fdh s TYR 76 CO 0.00 -0.04 0.38 -0.48 -1.57 0.00 0.00 175.55 173.84 2fdh s LEU 77 N -0.27 0.60 -0.16 -1.29 0.05 -0.81 -4.98 118.68 111.81 2fdh s LEU 77 Ca 0.01 -0.59 -0.13 0.00 0.05 0.00 0.00 54.13 53.47 2fdh s LEU 77 Cb -0.13 1.63 -0.05 0.00 -2.05 0.00 0.00 46.19 45.60 2fdh s LEU 77 CO 0.03 -0.92 0.26 -0.31 -0.55 0.00 0.00 176.35 174.85 2fdh s TYR 78 N -3.89 3.46 -0.00 3.48 1.51 -1.26 -1.69 117.35 118.96 2fdh s TYR 78 Ca 0.10 0.55 0.04 0.00 -1.01 0.00 0.00 57.07 56.74 2fdh s TYR 78 Cb 0.02 -2.29 -0.01 0.00 -0.11 0.00 0.00 41.96 39.57 2fdh s TYR 78 CO -0.05 0.28 -0.12 0.45 -1.11 0.00 0.00 175.55 175.00 2fdh s SER 79 N 0.35 1.37 0.00 2.29 0.15 -0.54 -4.87 113.70 112.44 2fdh s SER 79 Ca 0.15 -0.25 0.29 0.00 0.70 0.00 0.00 55.95 56.83 2fdh s SER 79 Cb -0.13 -0.14 1.29 0.00 -1.71 0.00 0.00 66.02 65.33 2fdh s SER 79 CO 0.03 0.11 1.94 -0.81 1.20 0.00 0.00 173.24 175.72 2fdh n PRO 80 N 2.63 0.11 -4.98 5.44 -0.04 -1.26 -1.14 135.00 135.75 2fdh n PRO 80 Ca -0.15 0.01 -0.32 0.00 -0.04 0.00 0.00 63.50 63.00 2fdh n PRO 80 Cb 0.56 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.37 2fdh n PRO 80 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2fdh s ILE 81 N -2.89 2.76 -0.30 0.52 -1.09 -1.26 -3.57 121.20 115.37 2fdh s ILE 81 Ca 0.17 -0.81 -0.29 0.00 -2.23 0.00 0.00 60.65 57.49 2fdh s ILE 81 Cb 0.19 -2.08 0.00 0.00 -1.58 0.00 0.00 42.46 39.00 2fdh s ILE 81 CO 0.50 0.57 1.23 -0.62 -1.23 0.00 0.00 174.94 175.40 2fdh s ASP 82 N -0.33 6.77 0.64 3.58 -1.08 0.14 -4.89 116.67 121.49 2fdh s ASP 82 Ca 0.03 1.20 0.40 0.00 -0.52 0.00 0.00 52.55 53.65 2fdh s ASP 82 Cb -0.13 -2.54 2.23 0.00 -1.46 0.00 0.00 42.92 41.02 2fdh s ASP 82 CO 0.02 -1.00 2.33 -0.65 0.52 0.00 0.00 175.17 176.39 2fdh h PRO 83 N 8.86 0.00 0.00 4.34 0.11 -1.96 0.34 132.00 143.70 2fdh h PRO 83 Ca -0.25 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.75 2fdh h PRO 83 Cb 1.09 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2fdh h PRO 83 CO 1.03 0.00 -0.70 0.37 -0.21 0.00 0.00 178.00 178.49 2fdh h GLN 84 N 0.00 0.00 0.00 1.05 4.15 -1.95 -3.39 115.11 114.98 2fdh h GLN 84 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2fdh h GLN 84 Cb 0.02 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.71 2fdh h GLN 84 CO 0.00 0.81 -0.42 1.79 -1.93 0.00 0.00 178.83 179.08 2fdh h THR 85 N -1.00 0.00 -0.23 2.39 1.35 -1.93 -3.47 112.91 110.02 2fdh h THR 85 Ca -0.18 -0.87 -0.10 0.00 -0.55 0.00 0.00 66.41 64.71 2fdh h THR 85 Cb 1.02 1.65 -0.04 0.00 -1.73 0.00 0.00 68.15 69.06 2fdh h THR 85 CO -0.11 0.00 -0.09 0.59 -0.25 0.00 0.00 175.52 175.66 2fdh n ASN 86 N -2.74 -5.24 -4.83 5.36 5.03 0.12 -4.98 115.26 107.98 2fdh n ASN 86 Ca 0.03 0.12 -0.22 0.00 0.87 0.00 0.00 54.58 55.38 2fdh n ASN 86 Cb 0.51 -3.17 -0.04 0.00 -1.02 0.00 0.00 39.78 36.06 2fdh n ASN 86 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2fdh s LYS 87 N -2.11 2.61 0.81 3.52 1.02 -1.25 -4.81 119.74 119.54 2fdh s LYS 87 Ca 0.00 -1.39 -0.11 0.00 0.02 0.00 0.00 55.97 54.49 2fdh s LYS 87 Cb 0.00 -2.39 0.08 0.00 -0.52 0.00 0.00 37.83 35.00 2fdh s LYS 87 CO 0.00 0.05 1.09 -2.14 -0.92 0.00 0.00 175.35 173.43 2fdh s PRO 88 N -3.98 2.00 0.63 -1.68 0.02 -1.26 -0.68 135.00 130.05 2fdh s PRO 88 Ca 0.41 0.97 -0.16 0.00 0.02 0.00 0.00 61.00 62.24 2fdh s PRO 88 Cb -0.04 -1.88 -0.01 0.00 0.02 0.00 0.00 34.50 32.58 2fdh s PRO 88 CO 0.26 -1.77 1.12 -1.58 -0.33 0.00 0.00 177.00 174.70 2fdh s TRP 89 N -2.96 2.60 0.81 6.54 0.52 -1.23 -4.69 118.94 120.54 2fdh s TRP 89 Ca 0.61 1.55 -0.12 0.00 0.02 0.00 0.00 56.10 58.16 2fdh s TRP 89 Cb -0.17 -3.21 0.09 0.00 -1.15 0.00 0.00 33.47 29.02 2fdh s TRP 89 CO 0.56 -1.71 1.16 -2.14 0.02 0.00 0.00 176.95 174.84 2fdh s PRO 90 N -3.89 1.69 0.65 4.98 0.02 -1.26 -4.66 135.00 132.54 2fdh s PRO 90 Ca 0.69 1.58 -0.16 0.00 0.02 0.00 0.00 61.00 63.12 2fdh s PRO 90 Cb -0.22 -1.80 -0.00 0.00 0.02 0.00 0.00 34.50 32.50 2fdh s PRO 90 CO 0.38 -2.13 1.16 0.00 -0.33 0.00 0.00 177.00 176.08 2fdh s ALA 91 N -2.41 2.40 -0.10 -1.55 0.00 -1.26 -0.15 121.76 118.68 2fdh s ALA 91 Ca 0.69 0.77 -0.29 0.00 0.00 0.00 0.00 51.96 53.13 2fdh s ALA 91 Cb -0.24 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.44 2fdh s ALA 91 CO 0.52 -1.38 1.59 1.41 0.00 0.00 0.00 175.76 177.91 2fdh s MET 92 N -3.79 4.10 0.71 0.00 1.75 -1.26 -4.30 119.30 116.51 2fdh s MET 92 Ca 0.72 2.01 -0.16 0.00 -1.25 0.00 0.00 55.69 57.01 2fdh s MET 92 Cb -0.25 -3.97 0.03 0.00 2.84 0.00 0.00 34.83 33.48 2fdh s MET 92 CO 0.39 -0.92 1.23 -2.14 -0.65 0.00 0.00 175.02 172.93 2fdh s PRO 93 N 4.10 2.24 0.30 4.11 0.02 -1.26 -4.83 135.00 139.68 2fdh s PRO 93 Ca 0.71 1.86 -0.00 0.00 0.02 0.00 0.00 61.00 63.58 2fdh s PRO 93 Cb -0.30 -1.83 0.48 0.00 0.02 0.00 0.00 34.50 32.87 2fdh s PRO 93 CO 0.27 -1.78 1.90 0.37 -0.33 0.00 0.00 177.00 177.43 2fdh h GLN 94 N -0.06 0.86 -0.55 5.54 5.75 -1.99 -1.70 115.11 122.97 2fdh h GLN 94 Ca -0.49 -0.12 -0.05 0.00 -0.15 0.00 0.00 58.65 57.85 2fdh h GLN 94 Cb 1.31 -0.16 -0.03 0.00 1.07 0.00 0.00 27.48 29.67 2fdh h GLN 94 CO 0.50 0.68 0.16 0.66 -2.65 0.00 0.00 178.83 178.18 2fdh h SER 95 N 0.86 0.77 0.12 -0.69 4.64 -1.95 0.62 113.55 117.92 2fdh h SER 95 Ca 0.21 -0.13 -0.01 0.00 -0.47 0.00 0.00 61.79 61.40 2fdh h SER 95 Cb 0.11 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 2fdh h SER 95 CO -0.03 0.74 -0.06 -0.26 -0.87 0.00 0.00 176.83 176.35 2fdh h PHE 96 N 0.80 -0.15 -0.52 4.77 -1.00 -1.80 -1.79 116.94 117.25 2fdh h PHE 96 Ca 0.18 -0.00 0.03 0.00 2.81 0.00 0.00 57.97 60.99 2fdh h PHE 96 Cb 0.26 0.05 -0.04 0.00 3.61 0.00 0.00 35.95 39.83 2fdh h PHE 96 CO 0.02 0.17 0.29 0.45 -1.61 0.00 0.00 178.31 177.63 2fdh h HIS 97 N -0.49 0.54 -0.50 -0.55 3.86 -0.98 -1.63 115.15 115.40 2fdh h HIS 97 Ca -0.02 0.02 -0.11 0.00 -1.16 0.00 0.00 60.37 59.10 2fdh h HIS 97 Cb 0.39 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 28.68 2fdh h HIS 97 CO 0.03 0.29 -0.12 -0.91 0.86 0.00 0.00 177.93 178.08 2fdh h ASN 98 N 0.57 0.97 -0.27 2.45 2.35 -0.90 -1.84 115.58 118.92 2fdh h ASN 98 Ca 0.22 -0.36 -0.15 0.00 -0.55 0.00 0.00 56.30 55.46 2fdh h ASN 98 Cb 0.08 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.18 2fdh h ASN 98 CO -0.12 1.11 -0.41 0.25 -1.65 0.00 0.00 177.43 176.60 2fdh h LEU 99 N 0.82 0.82 -0.54 1.61 7.12 -1.18 -2.56 115.31 121.40 2fdh h LEU 99 Ca 0.13 -0.52 -0.05 0.00 0.13 0.00 0.00 57.88 57.57 2fdh h LEU 99 Cb 0.68 -0.23 -0.02 0.00 -0.53 0.00 0.00 40.66 40.56 2fdh h LEU 99 CO 0.05 1.18 0.14 0.00 -0.13 0.00 0.00 178.44 179.68 2fdh h GLN 101 N 0.76 -0.10 -0.33 0.00 4.15 -1.34 0.46 115.11 118.71 2fdh h GLN 101 Ca 0.17 0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.54 2fdh h GLN 101 Cb 0.33 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.03 2fdh h GLN 101 CO 0.00 -0.07 -0.06 0.00 -1.93 0.00 0.00 178.83 176.77 2fdh h ARG 102 N -0.10 0.54 -0.20 1.69 3.08 -1.40 -1.48 114.38 116.50 2fdh h ARG 102 Ca 0.00 -0.14 -0.07 0.00 0.07 0.00 0.00 59.98 59.84 2fdh h ARG 102 Cb 0.10 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.08 2fdh h ARG 102 CO -0.01 0.61 -0.17 0.00 -1.07 0.00 0.00 179.97 179.34 2fdh h ALA 103 N 1.43 0.29 -0.36 0.04 0.00 -0.95 -2.07 119.26 117.64 2fdh h ALA 103 Ca 0.10 -0.33 -0.12 0.00 0.00 0.00 0.00 54.91 54.56 2fdh h ALA 103 Cb 0.42 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2fdh h ALA 103 CO 0.02 0.19 -0.24 0.00 0.00 0.00 0.00 179.25 179.21 2fdh h ALA 104 N 0.66 0.89 -0.46 0.00 0.00 -0.74 -2.72 119.26 116.88 2fdh h ALA 104 Ca 0.04 -0.38 -0.12 0.00 0.00 0.00 0.00 54.91 54.45 2fdh h ALA 104 Cb 0.69 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2fdh h ALA 104 CO 0.04 0.63 -0.20 1.15 0.00 0.00 0.00 179.25 180.87 2fdh h THR 105 N 0.63 1.27 0.00 0.00 2.02 -1.28 0.24 112.91 115.80 2fdh h THR 105 Ca 0.09 -1.35 0.00 0.00 0.77 0.00 0.00 66.41 65.91 2fdh h THR 105 Cb 0.75 1.16 0.00 0.00 -1.74 0.00 0.00 68.15 68.31 2fdh h THR 105 CO 0.06 0.46 0.00 0.00 0.37 0.00 0.00 175.52 176.41 2fdh h ALA 106 N 0.86 1.00 -0.02 6.16 0.00 -1.28 -2.01 119.26 123.96 2fdh h ALA 106 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2fdh h ALA 106 Cb 0.77 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2fdh h ALA 106 CO 0.06 0.00 -0.20 0.00 0.00 0.00 0.00 179.25 179.11 2fdh n ALA 107 N -1.95 2.94 -0.33 0.00 0.00 -0.98 -4.97 120.51 115.23 2fdh n ALA 107 Ca 0.01 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.80 2fdh n ALA 107 Cb 0.24 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 18.85 2fdh n ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fdh n GLY 108 N 1.37 0.81 2.75 0.00 0.00 -0.76 -5.00 105.19 104.35 2fdh n GLY 108 Ca 0.12 -0.28 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 2fdh n GLY 108 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2fdh n TYR 109 N -2.33 2.37 0.59 1.61 4.02 0.82 -4.94 117.16 119.30 2fdh n TYR 109 Ca 0.00 -4.08 0.13 0.00 -0.01 0.00 0.00 57.90 53.93 2fdh n TYR 109 Cb 0.00 -0.43 0.40 0.00 -0.02 0.00 0.00 39.34 39.28 2fdh n TYR 109 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 2fdh h PRO 110 N 5.31 0.00 -0.01 -0.72 0.11 -1.85 -3.23 132.00 131.62 2fdh h PRO 110 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 2fdh h PRO 110 Cb 0.78 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.89 2fdh h PRO 110 CO 0.65 0.00 -0.24 -0.25 -0.21 0.00 0.00 178.00 177.95 2fdh n ASP 111 N -2.32 1.25 -4.64 -2.05 8.00 -1.26 -4.91 116.55 110.62 2fdh n ASP 111 Ca 0.05 -1.07 -0.43 0.00 0.71 0.00 0.00 54.79 54.06 2fdh n ASP 111 Cb 0.43 0.15 -0.03 0.00 -0.02 0.00 0.00 41.12 41.66 2fdh n ASP 111 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2fdh s PHE 112 N -2.42 1.97 -0.37 1.24 5.36 -1.23 -4.98 117.98 117.55 2fdh s PHE 112 Ca 0.26 0.41 0.02 0.00 -0.96 0.00 0.00 56.93 56.66 2fdh s PHE 112 Cb 0.19 -3.97 0.11 0.00 -0.34 0.00 0.00 43.02 39.01 2fdh s PHE 112 CO 0.50 -3.37 0.11 -0.65 -1.46 0.00 0.00 175.22 170.35 2fdh s GLN 113 N 4.60 1.32 0.33 10.12 -0.21 -1.26 -4.91 119.66 129.65 2fdh s GLN 113 Ca 0.75 -1.77 -0.27 0.00 0.02 0.00 0.00 55.36 54.08 2fdh s GLN 113 Cb -0.28 -2.80 -0.09 0.00 1.00 0.00 0.00 33.01 30.84 2fdh s GLN 113 CO 0.30 -1.00 1.09 -1.25 -2.12 0.00 0.00 175.29 172.31 2fdh s PRO 114 N 0.88 4.43 0.00 2.91 0.04 -1.26 -4.75 135.00 137.24 2fdh s PRO 114 Ca 0.12 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.87 2fdh s PRO 114 Cb -0.20 -2.93 0.00 0.00 0.04 0.00 0.00 34.50 31.41 2fdh s PRO 114 CO -0.11 0.05 0.73 -0.40 0.04 0.00 0.00 177.00 177.31 2fdh n ASP 115 N 0.67 1.43 -3.75 6.66 5.68 -0.86 -4.99 116.55 121.39 2fdh n ASP 115 Ca 0.01 -1.48 -0.12 0.00 -0.50 0.00 0.00 54.79 52.70 2fdh n ASP 115 Cb 0.46 0.00 -0.12 0.00 -1.14 0.00 0.00 41.12 40.33 2fdh n ASP 115 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2fdh s ALA 116 N -0.48 -0.69 -0.22 2.12 0.00 -1.03 -1.21 121.76 120.25 2fdh s ALA 116 Ca 0.00 0.95 -0.03 0.00 0.00 0.00 0.00 51.96 52.88 2fdh s ALA 116 Cb 0.00 -0.57 0.07 0.00 0.00 0.00 0.00 23.12 22.62 2fdh s ALA 116 CO 0.00 -0.17 0.06 0.00 0.00 0.00 0.00 175.76 175.65 2fdh s LEU 118 N 1.87 4.15 -0.30 0.00 2.96 -0.35 -2.02 118.68 125.00 2fdh s LEU 118 Ca 0.02 1.17 -0.09 0.00 -0.22 0.00 0.00 54.13 55.01 2fdh s LEU 118 Cb -0.17 -3.26 -0.01 0.00 0.50 0.00 0.00 46.19 43.26 2fdh s LEU 118 CO -0.13 -0.44 0.13 -0.63 -1.32 0.00 0.00 176.35 173.95 2fdh s ILE 119 N 2.36 4.46 -0.14 6.68 1.01 0.35 -0.92 121.20 135.01 2fdh s ILE 119 Ca 0.38 -0.41 -0.05 0.00 0.00 0.00 0.00 60.65 60.57 2fdh s ILE 119 Cb -0.16 -3.24 -0.04 0.00 0.01 0.00 0.00 42.46 39.03 2fdh s ILE 119 CO 0.11 0.12 0.03 0.20 0.00 0.00 0.00 174.94 175.40 2fdh s ASN 120 N 1.60 5.42 -0.17 3.58 0.02 0.54 -1.77 114.94 124.16 2fdh s ASN 120 Ca 0.05 0.10 0.00 0.00 -1.02 0.00 0.00 52.86 51.99 2fdh s ASN 120 Cb -0.17 -1.78 0.00 0.00 0.02 0.00 0.00 41.25 39.32 2fdh s ASN 120 CO 0.05 0.26 -0.15 -0.60 0.02 0.00 0.00 177.10 176.68 2fdh s ARG 121 N -0.17 3.16 -0.36 -0.60 3.52 0.13 -0.98 118.95 123.65 2fdh s ARG 121 Ca 0.06 -0.76 -0.09 0.00 -0.13 0.00 0.00 55.73 54.81 2fdh s ARG 121 Cb -0.12 -2.65 0.03 0.00 -1.56 0.00 0.00 34.95 30.65 2fdh s ARG 121 CO 0.02 -0.09 0.16 0.71 -0.81 0.00 0.00 175.30 175.29 2fdh s TYR 122 N 1.06 3.25 0.66 5.12 1.51 0.59 -1.80 117.35 127.73 2fdh s TYR 122 Ca -0.01 -1.20 -0.10 0.00 -1.01 0.00 0.00 57.07 54.76 2fdh s TYR 122 Cb -0.14 -2.36 0.00 0.00 -0.11 0.00 0.00 41.96 39.35 2fdh s TYR 122 CO -0.04 -0.69 1.02 0.00 -1.11 0.00 0.00 175.55 174.73 2fdh s ALA 123 N 1.48 3.05 0.08 3.71 0.00 -1.26 -1.81 121.76 127.00 2fdh s ALA 123 Ca 0.00 -0.41 -0.34 0.00 0.00 0.00 0.00 51.96 51.21 2fdh s ALA 123 Cb -0.19 -2.90 -0.13 0.00 0.00 0.00 0.00 23.12 19.89 2fdh s ALA 123 CO 0.05 -0.96 1.66 -2.30 0.00 0.00 0.00 175.76 174.21 2fdh n PRO 124 N -2.83 2.12 -0.02 0.00 -0.02 -1.26 -1.34 135.00 131.64 2fdh n PRO 124 Ca 0.06 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 2fdh n PRO 124 Cb 0.57 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 2fdh n PRO 124 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fdh n GLY 125 N 3.68 1.57 3.77 -1.23 0.00 0.17 -4.91 105.19 108.24 2fdh n GLY 125 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 2fdh n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fdh s ALA 126 N -2.56 3.41 0.23 4.61 0.00 -0.45 -4.25 121.76 122.74 2fdh s ALA 126 Ca 0.00 1.20 0.00 0.00 0.00 0.00 0.00 51.96 53.17 2fdh s ALA 126 Cb 0.00 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.62 2fdh s ALA 126 CO 0.00 -0.63 0.14 -1.59 0.00 0.00 0.00 175.76 173.68 2fdh s LYS 127 N -1.91 1.31 -0.23 0.00 -2.85 -1.26 -1.50 119.74 113.30 2fdh s LYS 127 Ca 0.51 -1.70 -0.03 0.00 -1.00 0.00 0.00 55.97 53.74 2fdh s LYS 127 Cb -0.38 0.18 0.11 0.00 -2.06 0.00 0.00 37.83 35.68 2fdh s LYS 127 CO 0.50 -0.41 0.25 -1.17 0.10 0.00 0.00 175.35 174.63 2fdh s LEU 128 N -3.22 -0.18 0.93 2.77 2.96 -0.51 -4.22 118.68 117.21 2fdh s LEU 128 Ca 0.39 -0.31 -0.12 0.00 -0.22 0.00 0.00 54.13 53.87 2fdh s LEU 128 Cb 0.07 0.48 0.15 0.00 0.50 0.00 0.00 46.19 47.38 2fdh s LEU 128 CO 0.14 -0.34 1.09 -0.94 -1.32 0.00 0.00 176.35 174.98 2fdh s SER 129 N 2.35 3.08 0.02 3.68 1.04 -1.26 -0.39 113.70 122.22 2fdh s SER 129 Ca 0.08 1.54 -0.37 0.00 0.48 0.00 0.00 55.95 57.69 2fdh s SER 129 Cb -0.15 -2.21 -0.16 0.00 0.10 0.00 0.00 66.02 63.60 2fdh s SER 129 CO -0.18 -2.89 1.50 0.18 0.98 0.00 0.00 173.24 172.83 2fdh n LEU 130 N -4.06 2.16 -3.83 2.42 4.77 -1.26 -4.59 117.00 112.62 2fdh n LEU 130 Ca 0.07 1.09 -0.09 0.00 -0.03 0.00 0.00 56.01 57.05 2fdh n LEU 130 Cb 0.55 -1.23 -0.04 0.00 -2.33 0.00 0.00 43.42 40.37 2fdh n LEU 130 CO 0.55 -0.73 0.30 -1.38 -1.33 0.00 0.00 177.39 174.81 2fdh s HIS 131 N 1.40 -0.03 0.09 -1.77 -3.43 0.03 -4.88 115.29 106.71 2fdh s HIS 131 Ca 0.87 -0.35 0.09 0.00 -0.80 0.00 0.00 55.06 54.87 2fdh s HIS 131 Cb -0.91 0.42 -0.04 0.00 -1.43 0.00 0.00 32.58 30.63 2fdh s HIS 131 CO 0.49 -1.01 -0.23 -0.65 -2.00 0.00 0.00 174.74 171.33 2fdh s GLN 132 N -3.92 1.70 -0.66 -0.38 -0.21 -1.26 -0.25 119.66 114.69 2fdh s GLN 132 Ca 0.13 -1.19 -0.16 0.00 0.02 0.00 0.00 55.36 54.16 2fdh s GLN 132 Cb -0.02 -2.02 0.16 0.00 1.00 0.00 0.00 33.01 32.13 2fdh s GLN 132 CO 0.02 0.49 0.64 -0.51 -2.12 0.00 0.00 175.29 173.81 2fdh s ASP 133 N -1.75 6.40 -0.11 5.90 1.11 -1.26 -4.87 116.67 122.08 2fdh s ASP 133 Ca 0.14 -2.06 0.18 0.00 0.18 0.00 0.00 52.55 51.00 2fdh s ASP 133 Cb -0.10 -2.23 0.43 0.00 1.07 0.00 0.00 42.92 42.09 2fdh s ASP 133 CO 0.06 -0.80 1.19 2.29 1.18 0.00 0.00 175.17 179.09 2fdh n LYS 134 N 5.00 0.90 -0.03 8.23 2.85 -1.26 -4.76 118.16 129.08 2fdh n LYS 134 Ca -0.03 -2.72 0.12 0.00 -1.05 0.00 0.00 58.31 54.63 2fdh n LYS 134 Cb 0.43 -0.87 0.13 0.00 -0.65 0.00 0.00 35.03 34.07 2fdh n LYS 134 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2fdh n ASP 135 N -0.33 3.03 -4.84 -5.58 10.43 -1.26 -4.95 116.55 113.06 2fdh n ASP 135 Ca 0.13 -1.98 -0.37 0.00 2.57 0.00 0.00 54.79 55.14 2fdh n ASP 135 Cb 0.92 -0.04 -0.06 0.00 1.84 0.00 0.00 41.12 43.77 2fdh n ASP 135 CO 0.00 0.00 0.00 -1.61 -1.07 0.00 0.00 177.20 174.52 2fdh s GLU 136 N -1.91 3.97 0.15 -1.24 8.01 -1.26 -4.82 118.70 121.60 2fdh s GLU 136 Ca 0.30 0.47 -0.16 0.00 0.01 0.00 0.00 54.97 55.59 2fdh s GLU 136 Cb 0.21 -3.14 0.01 0.00 -4.31 0.00 0.00 34.13 26.90 2fdh s GLU 136 CO 0.30 0.62 1.78 -1.35 0.01 0.00 0.00 175.26 176.62 2fdh h PRO 137 N 4.30 0.56 -4.73 0.39 0.11 -1.79 -3.40 132.00 127.45 2fdh h PRO 137 Ca -0.50 -0.05 -0.68 0.00 0.11 0.00 0.00 66.00 64.87 2fdh h PRO 137 Cb 1.21 -0.12 -0.34 0.00 0.11 0.00 0.00 31.00 31.86 2fdh h PRO 137 CO 0.63 0.42 -0.69 0.34 -0.21 0.00 0.00 178.00 178.50 2fdh s ASP 138 N -5.65 4.91 0.00 -2.05 2.15 -1.26 -4.97 116.67 109.79 2fdh s ASP 138 Ca -0.13 -1.45 0.26 0.00 0.43 0.00 0.00 52.55 51.66 2fdh s ASP 138 Cb 0.11 -1.71 1.47 0.00 -0.30 0.00 0.00 42.92 42.49 2fdh s ASP 138 CO 0.73 -0.30 1.90 0.18 -0.17 0.00 0.00 175.17 177.50 2fdh n LEU 139 N 4.58 0.00 0.17 -1.34 4.77 -1.26 -2.61 117.00 121.31 2fdh n LEU 139 Ca -0.11 0.09 0.08 0.00 -0.03 0.00 0.00 56.01 56.05 2fdh n LEU 139 Cb 0.43 -0.09 0.09 0.00 -2.33 0.00 0.00 43.42 41.52 2fdh n LEU 139 CO 0.27 -0.02 0.57 0.03 -1.33 0.00 0.00 177.39 176.91 2fdh h ARG 140 N 0.00 0.00 -6.56 3.23 -0.00 -1.95 -3.45 114.38 105.65 2fdh h ARG 140 Ca 0.00 0.00 -0.52 0.00 -0.50 0.00 0.00 59.98 58.96 2fdh h ARG 140 Cb 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.04 2fdh h ARG 140 CO 0.00 0.18 0.43 0.00 0.00 0.00 0.00 179.97 180.57 2fdh s ALA 141 N -3.13 3.29 0.99 0.04 0.00 -1.07 -4.73 121.76 117.16 2fdh s ALA 141 Ca 0.05 0.69 -0.16 0.00 0.00 0.00 0.00 51.96 52.54 2fdh s ALA 141 Cb 0.06 -3.33 0.20 0.00 0.00 0.00 0.00 23.12 20.05 2fdh s ALA 141 CO 0.71 -0.17 1.23 -1.25 0.00 0.00 0.00 175.76 176.28 2fdh s PRO 142 N 0.17 0.42 -0.09 0.00 0.04 -1.26 -4.97 135.00 129.30 2fdh s PRO 142 Ca 0.50 -0.17 0.02 0.00 0.04 0.00 0.00 61.00 61.39 2fdh s PRO 142 Cb -0.26 -1.80 0.01 0.00 0.04 0.00 0.00 34.50 32.50 2fdh s PRO 142 CO 0.31 -2.60 -0.14 0.42 0.04 0.00 0.00 177.00 175.03 2fdh s ILE 143 N -3.56 1.36 -0.28 0.56 1.01 -1.06 -4.54 121.20 114.69 2fdh s ILE 143 Ca 0.70 -0.58 -0.11 0.00 0.00 0.00 0.00 60.65 60.67 2fdh s ILE 143 Cb -0.08 -1.25 -0.05 0.00 0.01 0.00 0.00 42.46 41.10 2fdh s ILE 143 CO 0.53 0.41 0.18 -0.69 0.00 0.00 0.00 174.94 175.38 2fdh s VAL 144 N 0.91 5.25 -0.17 2.92 1.01 -0.96 -0.47 120.40 128.89 2fdh s VAL 144 Ca -0.09 0.13 -0.05 0.00 0.00 0.00 0.00 61.98 61.97 2fdh s VAL 144 Cb -0.15 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.69 2fdh s VAL 144 CO 0.00 0.24 -0.00 -0.55 0.00 0.00 0.00 175.10 174.79 2fdh s SER 145 N 1.75 5.08 -0.17 3.32 0.15 -0.07 -0.49 113.70 123.28 2fdh s SER 145 Ca 0.07 -0.06 0.01 0.00 0.70 0.00 0.00 55.95 56.67 2fdh s SER 145 Cb -0.16 -1.85 0.03 0.00 -1.71 0.00 0.00 66.02 62.33 2fdh s SER 145 CO 0.11 0.17 -0.14 -0.69 1.20 0.00 0.00 173.24 173.89 2fdh s VAL 146 N 0.38 1.64 -0.12 4.45 1.01 0.53 -1.12 120.40 127.17 2fdh s VAL 146 Ca -0.02 -0.76 -0.12 0.00 0.00 0.00 0.00 61.98 61.08 2fdh s VAL 146 Cb -0.14 -1.58 -0.05 0.00 0.00 0.00 0.00 36.38 34.62 2fdh s VAL 146 CO 0.02 0.39 0.26 -0.44 0.00 0.00 0.00 175.10 175.33 2fdh s SER 147 N 1.44 6.49 -0.01 3.32 0.01 0.02 -0.90 113.70 124.07 2fdh s SER 147 Ca 0.03 0.57 0.01 0.00 1.31 0.00 0.00 55.95 57.88 2fdh s SER 147 Cb -0.14 -2.16 0.00 0.00 0.21 0.00 0.00 66.02 63.94 2fdh s SER 147 CO -0.10 0.25 -0.04 -0.76 0.41 0.00 0.00 173.24 173.00 2fdh s LEU 148 N -0.33 1.87 0.00 2.44 1.43 0.32 0.04 118.68 124.44 2fdh s LEU 148 Ca 0.17 -0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.19 2fdh s LEU 148 Cb -0.13 -0.23 0.00 0.00 0.03 0.00 0.00 46.19 45.85 2fdh s LEU 148 CO 0.05 0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.27 2fdh n GLY 149 N 3.18 0.75 3.75 -3.19 0.00 -1.26 -0.04 105.19 108.38 2fdh n GLY 149 Ca -0.15 -1.29 -0.39 0.00 0.00 0.00 0.00 46.02 44.19 2fdh n GLY 149 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fdh n LEU 150 N 0.00 5.45 -4.78 0.99 4.77 -1.00 -3.61 117.00 118.82 2fdh n LEU 150 Ca 0.00 1.03 -0.37 0.00 -0.03 0.00 0.00 56.01 56.64 2fdh n LEU 150 Cb 0.00 -1.59 -0.02 0.00 -2.33 0.00 0.00 43.42 39.47 2fdh n LEU 150 CO 0.00 -0.40 0.79 -2.16 -1.33 0.00 0.00 177.39 174.29 2fdh s PRO 151 N -2.74 3.95 0.03 3.23 0.04 -1.26 -4.71 135.00 133.54 2fdh s PRO 151 Ca 0.68 1.66 0.02 0.00 0.04 0.00 0.00 61.00 63.40 2fdh s PRO 151 Cb -0.43 -2.47 -0.02 0.00 0.04 0.00 0.00 34.50 31.62 2fdh s PRO 151 CO 0.52 -0.36 -0.07 0.00 0.04 0.00 0.00 177.00 177.13 2fdh s ALA 152 N -1.59 0.51 -0.40 8.56 0.00 -0.61 -4.62 121.76 123.61 2fdh s ALA 152 Ca 0.61 -0.64 -0.20 0.00 0.00 0.00 0.00 51.96 51.73 2fdh s ALA 152 Cb -0.26 0.02 0.01 0.00 0.00 0.00 0.00 23.12 22.90 2fdh s ALA 152 CO 0.32 -0.00 0.59 0.42 0.00 0.00 0.00 175.76 177.08 2fdh s ILE 153 N -1.13 4.91 -0.06 0.00 1.01 -1.26 -0.77 121.20 123.89 2fdh s ILE 153 Ca -0.08 0.23 -0.18 0.00 0.00 0.00 0.00 60.65 60.62 2fdh s ILE 153 Cb -0.08 -4.10 -0.05 0.00 0.01 0.00 0.00 42.46 38.24 2fdh s ILE 153 CO 0.00 -0.43 0.48 0.12 0.00 0.00 0.00 174.94 175.12 2fdh s PHE 154 N 2.63 3.60 -0.06 3.97 5.36 0.71 -1.65 117.98 132.53 2fdh s PHE 154 Ca 0.21 0.98 0.05 0.00 -0.96 0.00 0.00 56.93 57.21 2fdh s PHE 154 Cb -0.15 -2.50 -0.00 0.00 -0.34 0.00 0.00 43.02 40.03 2fdh s PHE 154 CO 0.16 0.33 -0.22 1.14 -1.46 0.00 0.00 175.22 175.17 2fdh s GLN 155 N 0.02 2.40 0.03 10.12 -2.07 -0.38 -0.20 119.66 129.59 2fdh s GLN 155 Ca 0.26 -0.79 0.04 0.00 -1.82 0.00 0.00 55.36 53.05 2fdh s GLN 155 Cb -0.16 -1.98 -0.02 0.00 -1.09 0.00 0.00 33.01 29.76 2fdh s GLN 155 CO 0.12 0.28 -0.12 -0.59 -1.32 0.00 0.00 175.29 173.66 2fdh s PHE 156 N 0.06 1.02 0.00 9.60 -0.12 -0.43 -1.31 117.98 126.80 2fdh s PHE 156 Ca -0.08 -0.34 0.00 0.00 -0.05 0.00 0.00 56.93 56.46 2fdh s PHE 156 Cb -0.14 -0.61 0.00 0.00 -0.63 0.00 0.00 43.02 41.64 2fdh s PHE 156 CO 0.04 0.01 0.00 0.41 -0.05 0.00 0.00 175.22 175.63 2fdh n GLY 157 N 2.00 1.66 0.00 1.99 0.00 0.09 -0.63 105.19 110.30 2fdh n GLY 157 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2fdh n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fdh n GLY 158 N 5.00 5.62 0.20 -0.02 0.00 -1.26 -4.67 105.19 110.07 2fdh n GLY 158 Ca 0.00 -0.99 -0.18 0.00 0.00 0.00 0.00 46.02 44.85 2fdh n GLY 158 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2fdh h LEU 159 N 0.00 0.85-10.34 0.99 3.38 -1.97 -2.09 115.31 106.13 2fdh h LEU 159 Ca 0.00 -0.66 -0.45 0.00 0.09 0.00 0.00 57.88 56.86 2fdh h LEU 159 Cb 0.00 -0.25 0.02 0.00 0.09 0.00 0.00 40.66 40.51 2fdh h LEU 159 CO 0.00 1.38 -0.23 -0.54 0.09 0.00 0.00 178.44 179.14 2fdh s LYS 160 N -3.61 3.09 0.25 1.13 1.02 -1.26 -4.87 119.74 115.48 2fdh s LYS 160 Ca -0.11 -0.78 0.26 0.00 0.02 0.00 0.00 55.97 55.36 2fdh s LYS 160 Cb 0.07 -2.70 0.82 0.00 -0.52 0.00 0.00 37.83 35.50 2fdh s LYS 160 CO 0.89 -0.09 1.76 -0.09 -0.92 0.00 0.00 175.35 176.89 2fdh h ARG 161 N 0.66 0.00 -0.63 1.68 2.43 -2.02 -3.21 114.38 113.29 2fdh h ARG 161 Ca -0.46 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 2fdh h ARG 161 Cb 1.26 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 2fdh h ARG 161 CO 0.55 0.00 0.00 0.09 -1.51 0.00 0.00 179.97 179.10 2fdh n ASN 162 N -2.35 4.64 -4.80 -3.80 3.02 -1.26 -4.99 115.26 105.72 2fdh n ASN 162 Ca 0.05 -2.42 -0.35 0.00 -0.03 0.00 0.00 54.58 51.83 2fdh n ASN 162 Cb 0.40 -0.56 -0.06 0.00 -0.61 0.00 0.00 39.78 38.95 2fdh n ASN 162 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2fdh s ASP 163 N -0.96 6.98 0.15 6.41 1.11 -1.22 -5.00 116.67 124.15 2fdh s ASP 163 Ca 0.50 1.80 -0.33 0.00 0.18 0.00 0.00 52.55 54.70 2fdh s ASP 163 Cb 0.32 -2.56 -0.12 0.00 1.07 0.00 0.00 42.92 41.63 2fdh s ASP 163 CO 0.24 -0.33 1.70 -2.65 1.18 0.00 0.00 175.17 175.32 2fdh n PRO 164 N -0.25 2.50 -3.01 8.23 -0.02 -1.26 -4.69 135.00 136.51 2fdh n PRO 164 Ca 0.05 0.90 -0.40 0.00 -2.02 0.00 0.00 63.50 62.04 2fdh n PRO 164 Cb 0.52 -2.73 -0.05 0.00 -0.02 0.00 0.00 33.50 31.22 2fdh n PRO 164 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2fdh s LEU 165 N 1.62 4.47 -0.04 2.45 2.01 -1.26 -4.45 118.68 123.48 2fdh s LEU 165 Ca 0.79 1.45 0.05 0.00 0.01 0.00 0.00 54.13 56.43 2fdh s LEU 165 Cb -0.58 -3.21 -0.03 0.00 0.01 0.00 0.00 46.19 42.39 2fdh s LEU 165 CO 0.37 0.06 -0.17 -0.54 1.01 0.00 0.00 176.35 177.08 2fdh s LYS 166 N -0.27 2.39 -0.03 1.70 1.02 0.20 -4.95 119.74 119.79 2fdh s LYS 166 Ca 0.37 -0.77 -0.01 0.00 0.02 0.00 0.00 55.97 55.58 2fdh s LYS 166 Cb -0.21 -2.29 -0.04 0.00 -0.52 0.00 0.00 37.83 34.77 2fdh s LYS 166 CO 0.23 0.60 0.08 1.03 -0.92 0.00 0.00 175.35 176.37 2fdh s ARG 167 N -0.76 3.11 -0.11 1.68 0.52 -1.26 -1.31 118.95 120.82 2fdh s ARG 167 Ca 0.11 -0.43 -0.04 0.00 -0.52 0.00 0.00 55.73 54.86 2fdh s ARG 167 Cb -0.10 -2.90 0.05 0.00 0.52 0.00 0.00 34.95 32.52 2fdh s ARG 167 CO 0.01 0.67 0.22 -1.17 0.02 0.00 0.00 175.30 175.04 2fdh s LEU 168 N -1.54 -0.06 -0.02 2.53 2.96 0.72 -5.00 118.68 118.27 2fdh s LEU 168 Ca 0.21 0.48 -0.28 0.00 -0.22 0.00 0.00 54.13 54.32 2fdh s LEU 168 Cb -0.12 0.54 -0.03 0.00 0.50 0.00 0.00 46.19 47.08 2fdh s LEU 168 CO 0.11 -0.23 0.90 -0.22 -1.32 0.00 0.00 176.35 175.59 2fdh s LEU 169 N 2.13 4.35 -0.24 -0.68 2.96 -1.26 -0.21 118.68 125.74 2fdh s LEU 169 Ca -0.00 1.52 -0.02 0.00 -0.22 0.00 0.00 54.13 55.40 2fdh s LEU 169 Cb -0.12 -3.42 0.02 0.00 0.50 0.00 0.00 46.19 43.16 2fdh s LEU 169 CO -0.07 -0.22 -0.06 -0.76 -1.32 0.00 0.00 176.35 173.92 2fdh s LEU 170 N 0.96 3.08 0.55 -0.68 1.43 0.05 -4.95 118.68 119.12 2fdh s LEU 170 Ca 0.48 -0.72 0.07 0.00 -1.03 0.00 0.00 54.13 52.92 2fdh s LEU 170 Cb -0.20 -1.68 0.05 0.00 0.03 0.00 0.00 46.19 44.39 2fdh s LEU 170 CO 0.25 -0.10 0.53 -1.61 0.23 0.00 0.00 176.35 175.65 2fdh s GLU 171 N 1.37 2.29 -0.04 1.70 2.02 -1.26 -1.58 118.70 123.20 2fdh s GLU 171 Ca 0.02 -1.87 -0.34 0.00 0.02 0.00 0.00 54.97 52.80 2fdh s GLU 171 Cb -0.16 -2.29 -0.12 0.00 0.10 0.00 0.00 34.13 31.66 2fdh s GLU 171 CO -0.04 -0.67 1.83 1.58 0.02 0.00 0.00 175.26 177.97 2fdh n HIS 172 N -1.91 2.32 0.00 1.61 -0.00 -1.24 -1.80 115.22 114.21 2fdh n HIS 172 Ca 0.04 0.04 0.00 0.00 -0.00 0.00 0.00 57.72 57.80 2fdh n HIS 172 Cb 0.63 -2.64 0.00 0.00 -0.00 0.00 0.00 29.99 27.98 2fdh n HIS 172 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2fdh n GLY 173 N 4.22 1.50 3.73 1.57 0.00 0.11 -4.56 105.19 111.76 2fdh n GLY 173 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 2fdh n GLY 173 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2fdh s ASP 174 N -2.57 6.73 -0.09 1.61 -0.00 -0.74 -0.10 116.67 121.51 2fdh s ASP 174 Ca 0.00 2.49 0.03 0.00 -0.00 0.00 0.00 52.55 55.08 2fdh s ASP 174 Cb 0.00 -2.60 0.00 0.00 -0.00 0.00 0.00 42.92 40.32 2fdh s ASP 174 CO 0.00 -0.69 -0.21 -0.69 -0.00 0.00 0.00 175.17 173.58 2fdh s VAL 175 N 0.70 1.81 -0.09 -1.27 1.01 -0.26 -0.80 120.40 121.49 2fdh s VAL 175 Ca 0.64 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.76 2fdh s VAL 175 Cb -0.40 -1.58 0.02 0.00 0.00 0.00 0.00 36.38 34.42 2fdh s VAL 175 CO 0.35 0.50 -0.11 -0.69 0.00 0.00 0.00 175.10 175.15 2fdh s VAL 176 N 0.44 1.15 -0.49 2.92 1.01 -0.27 0.08 120.40 125.24 2fdh s VAL 176 Ca -0.18 -0.44 -0.17 0.00 0.00 0.00 0.00 61.98 61.20 2fdh s VAL 176 Cb -0.17 -1.09 0.08 0.00 0.00 0.00 0.00 36.38 35.19 2fdh s VAL 176 CO 0.07 0.37 0.48 -0.69 0.00 0.00 0.00 175.10 175.33 2fdh s VAL 177 N 1.09 5.12 -0.99 2.92 1.01 -0.57 -0.89 120.40 128.09 2fdh s VAL 177 Ca -0.06 -0.95 -0.21 0.00 0.00 0.00 0.00 61.98 60.76 2fdh s VAL 177 Cb -0.14 -4.21 0.09 0.00 0.00 0.00 0.00 36.38 32.12 2fdh s VAL 177 CO -0.02 -0.69 1.31 0.26 0.00 0.00 0.00 175.10 175.97 2fdh s TRP 178 N 1.94 2.82 0.32 5.22 0.52 0.38 -1.96 118.94 128.18 2fdh s TRP 178 Ca 0.07 -1.13 0.01 0.00 0.02 0.00 0.00 56.10 55.07 2fdh s TRP 178 Cb -0.23 -4.50 0.01 0.00 -1.15 0.00 0.00 33.47 27.59 2fdh s TRP 178 CO 0.08 -1.72 0.11 0.41 0.02 0.00 0.00 176.95 175.84 2fdh n GLY 179 N 6.17 3.40 7.00 0.98 0.00 -1.09 -2.56 105.19 119.09 2fdh n GLY 179 Ca 0.29 -2.28 0.00 0.00 0.00 0.00 0.00 46.02 44.03 2fdh n GLY 179 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fdh n GLY 180 N 1.16 3.12 0.26 -0.02 0.00 -1.26 -2.91 105.19 105.53 2fdh n GLY 180 Ca -0.08 -0.20 -0.09 0.00 0.00 0.00 0.00 46.02 45.65 2fdh n GLY 180 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2fdh h GLU 181 N 0.00 0.78 0.00 1.61 4.81 -1.86 -3.15 114.58 116.77 2fdh h GLU 181 Ca 0.00 -0.37 0.00 0.00 -0.13 0.00 0.00 59.36 58.86 2fdh h GLU 181 Cb 0.00 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.37 2fdh h GLU 181 CO 0.00 0.99 0.01 0.66 -0.73 0.00 0.00 179.01 179.94 2fdh h SER 182 N 0.66 0.00 0.38 1.04 4.64 -0.97 -1.87 113.55 117.43 2fdh h SER 182 Ca 0.07 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.33 2fdh h SER 182 Cb 0.86 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.94 2fdh h SER 182 CO 0.08 0.00 -0.28 -0.09 -0.87 0.00 0.00 176.83 175.67 2fdh h ARG 183 N 0.00 0.00 -0.02 4.77 9.65 -1.54 -2.89 114.38 124.35 2fdh h ARG 183 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2fdh h ARG 183 Cb 0.01 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.59 2fdh h ARG 183 CO 0.00 0.28 -0.39 1.28 2.80 0.00 0.00 179.97 183.94 2fdh n LEU 184 N -3.99 2.11 -4.76 3.80 4.77 -0.70 -4.64 117.00 113.58 2fdh n LEU 184 Ca -0.02 -0.76 -0.38 0.00 -0.03 0.00 0.00 56.01 54.82 2fdh n LEU 184 Cb 0.35 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 41.44 2fdh n LEU 184 CO 0.36 0.38 0.89 -0.36 -1.33 0.00 0.00 177.39 177.34 2fdh s PHE 185 N -2.41 2.69 0.10 -1.77 2.99 -1.10 -4.75 117.98 113.73 2fdh s PHE 185 Ca 0.20 1.47 -0.30 0.00 0.00 0.00 0.00 56.93 58.30 2fdh s PHE 185 Cb 0.18 -3.54 -0.06 0.00 0.00 0.00 0.00 43.02 39.60 2fdh s PHE 185 CO 0.53 -1.99 1.20 0.71 -0.00 0.00 0.00 175.22 175.66 2fdh s TYR 186 N -1.44 3.44 0.18 0.36 2.02 -0.78 -4.64 117.35 116.49 2fdh s TYR 186 Ca 0.65 1.34 -0.07 0.00 -0.37 0.00 0.00 57.07 58.63 2fdh s TYR 186 Cb -0.33 -3.42 -0.02 0.00 -0.40 0.00 0.00 41.96 37.79 2fdh s TYR 186 CO 0.40 -1.24 0.25 -3.38 -1.57 0.00 0.00 175.55 170.01 2fdh s HIS 187 N 0.71 0.61 0.05 2.71 -3.43 0.66 -0.73 115.29 115.87 2fdh s HIS 187 Ca 0.57 -0.95 -0.23 0.00 -0.80 0.00 0.00 55.06 53.66 2fdh s HIS 187 Cb -0.30 -0.18 0.08 0.00 -1.43 0.00 0.00 32.58 30.75 2fdh s HIS 187 CO 0.31 -0.72 1.04 0.41 -2.00 0.00 0.00 174.74 173.78 2fdh n GLY 188 N -0.24 0.42 3.14 -1.38 0.00 -0.43 -0.79 105.19 105.91 2fdh n GLY 188 Ca -0.04 -1.06 -0.28 0.00 0.00 0.00 0.00 46.02 44.65 2fdh n GLY 188 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fdh s ILE 189 N -2.07 1.55 0.57 -0.61 -1.09 0.48 -1.24 121.20 118.80 2fdh s ILE 189 Ca 0.24 -0.75 -0.14 0.00 -2.23 0.00 0.00 60.65 57.77 2fdh s ILE 189 Cb -0.01 -1.35 -0.05 0.00 -1.58 0.00 0.00 42.46 39.46 2fdh s ILE 189 CO 0.01 0.44 1.01 -1.10 -1.23 0.00 0.00 174.94 174.08 2fdh s GLN 190 N 0.25 3.68 -0.36 2.79 -0.21 -0.66 -1.43 119.66 123.71 2fdh s GLN 190 Ca -0.10 0.92 -0.43 0.00 0.02 0.00 0.00 55.36 55.77 2fdh s GLN 190 Cb -0.14 -2.09 -0.17 0.00 1.00 0.00 0.00 33.01 31.60 2fdh s GLN 190 CO 0.04 -0.50 1.68 -2.30 -2.12 0.00 0.00 175.29 172.09 2fdh n PRO 191 N -2.15 0.69 -1.71 2.91 -0.02 -1.26 -4.67 135.00 128.79 2fdh n PRO 191 Ca 0.07 0.25 -0.42 0.00 -2.02 0.00 0.00 63.50 61.38 2fdh n PRO 191 Cb 0.54 -1.86 -0.03 0.00 -0.02 0.00 0.00 33.50 32.13 2fdh n PRO 191 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2fdh s LEU 192 N 3.31 4.33 0.30 2.45 2.96 -0.56 -4.76 118.68 126.71 2fdh s LEU 192 Ca 1.01 2.54 -0.29 0.00 -0.22 0.00 0.00 54.13 57.17 2fdh s LEU 192 Cb -1.24 -3.53 -0.10 0.00 0.50 0.00 0.00 46.19 41.82 2fdh s LEU 192 CO 0.72 -1.13 1.27 -0.54 -1.32 0.00 0.00 176.35 175.35 2fdh s LYS 193 N 4.59 4.42 0.68 1.98 1.02 -1.26 0.46 119.74 131.63 2fdh s LYS 193 Ca 0.88 2.11 -0.16 0.00 0.02 0.00 0.00 55.97 58.82 2fdh s LYS 193 Cb -0.41 -3.11 0.01 0.00 -0.52 0.00 0.00 37.83 33.81 2fdh s LYS 193 CO 0.40 -0.12 1.21 0.00 -0.92 0.00 0.00 175.35 175.92 2fdh s ALA 194 N -0.96 2.27 0.00 5.17 0.00 -1.26 -4.83 121.76 122.15 2fdh s ALA 194 Ca 0.49 0.92 0.00 0.00 0.00 0.00 0.00 51.96 53.37 2fdh s ALA 194 Cb -0.38 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.28 2fdh s ALA 194 CO 0.48 -1.64 0.00 0.41 0.00 0.00 0.00 175.76 175.02 2fdh n GLY 195 N 0.40 -1.07 3.05 0.00 0.00 -1.26 -5.12 105.19 101.18 2fdh n GLY 195 Ca 0.13 -1.03 -0.19 0.00 0.00 0.00 0.00 46.02 44.94 2fdh n GLY 195 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2fdh s PHE 196 N -3.00 0.91 -0.03 1.61 5.36 -1.26 -4.53 117.98 117.03 2fdh s PHE 196 Ca 0.00 -0.22 0.01 0.00 -0.96 0.00 0.00 56.93 55.76 2fdh s PHE 196 Cb 0.00 -0.57 0.01 0.00 -0.34 0.00 0.00 43.02 42.12 2fdh s PHE 196 CO 0.00 -0.01 -0.04 -1.58 -1.46 0.00 0.00 175.22 172.13 2fdh s HIS 197 N -0.42 0.60 0.51 10.12 5.65 -0.86 -4.96 115.29 125.93 2fdh s HIS 197 Ca 0.02 -0.13 0.21 0.00 0.25 0.00 0.00 55.06 55.41 2fdh s HIS 197 Cb -0.05 -0.51 1.30 0.00 -1.18 0.00 0.00 32.58 32.14 2fdh s HIS 197 CO -0.00 -0.12 2.02 -1.35 -0.65 0.00 0.00 174.74 174.64 2fdh h PRO 198 N 6.78 0.09 0.00 2.88 0.11 -1.99 -0.87 132.00 139.00 2fdh h PRO 198 Ca -0.36 -0.01 -0.34 0.00 0.11 0.00 0.00 66.00 65.41 2fdh h PRO 198 Cb 1.16 -0.02 -0.06 0.00 0.11 0.00 0.00 31.00 32.19 2fdh h PRO 198 CO 0.49 0.06 -2.11 1.28 -0.21 0.00 0.00 178.00 177.51 2fdh n LEU 199 N -4.43 0.43 -0.19 2.35 4.77 -1.26 -4.55 117.00 114.12 2fdh n LEU 199 Ca 0.08 0.17 0.05 0.00 -0.03 0.00 0.00 56.01 56.28 2fdh n LEU 199 Cb 0.47 0.33 -0.01 0.00 -2.33 0.00 0.00 43.42 41.87 2fdh n LEU 199 CO 0.36 0.46 0.17 0.35 -1.33 0.00 0.00 177.39 177.40 2fdh n THR 200 N -2.89 0.00 0.00 -5.08 -2.24 -1.22 -5.05 114.28 97.80 2fdh n THR 200 Ca -0.27 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.15 2fdh n THR 200 Cb 1.11 1.10 0.00 0.00 -2.10 0.00 0.00 70.33 70.44 2fdh n THR 200 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2fdh n ILE 201 N -0.45 0.00 -1.48 2.28 2.08 -0.33 -3.46 119.36 118.00 2fdh n ILE 201 Ca 0.04 0.00 0.02 0.00 0.56 0.00 0.00 62.75 63.37 2fdh n ILE 201 Cb 0.21 0.00 0.02 0.00 -0.75 0.00 0.00 39.64 39.13 2fdh n ILE 201 CO 0.00 0.00 0.00 -0.90 0.56 0.00 0.00 176.55 176.21 2fdh n ASP 202 N 3.23 0.53 -3.98 4.38 5.75 -1.26 -2.02 116.55 123.18 2fdh n ASP 202 Ca 0.00 -1.96 -0.22 0.00 -0.01 0.00 0.00 54.79 52.60 2fdh n ASP 202 Cb 0.00 -0.18 -0.09 0.00 -1.03 0.00 0.00 41.12 39.82 2fdh n ASP 202 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2fdh s ARG 204 N -3.71 1.31 0.05 0.00 3.52 -0.75 -2.37 118.95 117.00 2fdh s ARG 204 Ca 0.30 -0.64 0.07 0.00 -0.13 0.00 0.00 55.73 55.33 2fdh s ARG 204 Cb 0.03 -1.28 -0.03 0.00 -1.56 0.00 0.00 34.95 32.11 2fdh s ARG 204 CO 0.17 0.35 -0.17 0.71 -0.81 0.00 0.00 175.30 175.55 2fdh s TYR 205 N -0.48 2.59 -0.02 5.12 1.51 0.94 -0.30 117.35 126.71 2fdh s TYR 205 Ca 0.06 -0.24 0.00 0.00 -1.01 0.00 0.00 57.07 55.89 2fdh s TYR 205 Cb -0.07 -1.45 0.03 0.00 -0.11 0.00 0.00 41.96 40.36 2fdh s TYR 205 CO -0.00 0.29 0.02 1.21 -1.11 0.00 0.00 175.55 175.96 2fdh s ASN 206 N -1.60 0.23 -0.18 2.29 3.84 -0.16 -0.52 114.94 118.84 2fdh s ASN 206 Ca 0.16 0.01 -0.03 0.00 0.21 0.00 0.00 52.86 53.20 2fdh s ASN 206 Cb -0.11 -0.14 -0.02 0.00 -0.55 0.00 0.00 41.25 40.44 2fdh s ASN 206 CO 0.07 -0.11 -0.05 -0.76 -2.79 0.00 0.00 177.10 173.45 2fdh s LEU 207 N 1.02 3.02 -0.26 3.21 1.43 -0.08 -0.34 118.68 126.68 2fdh s LEU 207 Ca -0.09 -0.27 0.03 0.00 -1.03 0.00 0.00 54.13 52.76 2fdh s LEU 207 Cb -0.13 -1.74 0.06 0.00 0.03 0.00 0.00 46.19 44.41 2fdh s LEU 207 CO -0.02 0.08 -0.11 0.42 0.23 0.00 0.00 176.35 176.95 2fdh s THR 208 N 0.85 2.20 -0.11 5.49 -4.23 -0.09 -0.35 115.64 119.40 2fdh s THR 208 Ca -0.01 -1.61 -0.23 0.00 -1.18 0.00 0.00 61.69 58.65 2fdh s THR 208 Cb -0.15 -2.29 -0.03 0.00 1.34 0.00 0.00 72.50 71.37 2fdh s THR 208 CO 0.01 -0.02 0.72 -0.36 -0.54 0.00 0.00 174.62 174.43 2fdh s PHE 209 N 1.11 3.50 0.09 3.99 0.40 0.35 -1.21 117.98 126.22 2fdh s PHE 209 Ca -0.09 1.20 0.05 0.00 -0.60 0.00 0.00 56.93 57.49 2fdh s PHE 209 Cb -0.20 -2.86 -0.03 0.00 0.51 0.00 0.00 43.02 40.44 2fdh s PHE 209 CO -0.05 -0.04 -0.13 1.03 0.70 0.00 0.00 175.22 176.73 2fdh s ARG 210 N 1.33 0.86 -0.77 0.44 3.00 0.54 -2.26 118.95 122.09 2fdh s ARG 210 Ca 0.36 -1.07 -0.13 0.00 0.00 0.00 0.00 55.73 54.89 2fdh s ARG 210 Cb -0.17 -0.74 0.20 0.00 0.00 0.00 0.00 34.95 34.24 2fdh s ARG 210 CO 0.15 0.15 0.70 -1.14 0.00 0.00 0.00 175.30 175.16 2fdh s GLN 211 N -2.25 3.43 -0.04 3.54 0.74 -1.26 -2.03 119.66 121.79 2fdh s GLN 211 Ca 0.02 -2.38 0.17 0.00 0.05 0.00 0.00 55.36 53.22 2fdh s GLN 211 Cb -0.07 -4.34 -0.21 0.00 1.10 0.00 0.00 33.01 29.49 2fdh s GLN 211 CO 0.02 -1.28 0.56 0.00 -0.55 0.00 0.00 175.29 174.04 2fdh n ALA 212 N 4.08 1.85 -1.97 1.58 0.00 -1.26 -4.49 120.51 120.29 2fdh n ALA 212 Ca 0.10 -0.78 -0.41 0.00 0.00 0.00 0.00 53.44 52.35 2fdh n ALA 212 Cb 0.45 -0.71 -0.04 0.00 0.00 0.00 0.00 19.45 19.15 2fdh n ALA 212 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2fdh s GLY 213 N -5.00 2.81 0.00 0.00 0.00 -1.26 -4.47 107.32 99.40 2fdh s GLY 213 Ca -0.06 0.94 0.00 0.00 0.00 0.00 0.00 44.72 45.60 2fdh s GLY 213 CO 0.83 1.75 0.00 0.58 0.00 0.00 0.00 173.10 176.26