#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dfz s TYR 2 N 0.00 2.43 -0.01 3.17 6.04 -1.26 -5.12 117.35 122.60 3dfz s TYR 2 Ca 0.00 -2.24 -0.28 0.00 0.04 0.00 0.00 57.07 54.59 3dfz s TYR 2 Cb 0.00 -2.15 -0.03 0.00 -1.04 0.00 0.00 41.96 38.74 3dfz s TYR 2 CO 0.00 -0.89 0.90 0.99 -1.54 0.00 0.00 175.55 175.01 3dfz s THR 3 N 1.24 4.89 0.09 4.34 2.01 -1.26 -5.06 115.64 121.89 3dfz s THR 3 Ca 0.11 1.89 -0.02 0.00 0.31 0.00 0.00 61.69 63.98 3dfz s THR 3 Cb -0.19 -4.24 -0.04 0.00 0.01 0.00 0.00 72.50 68.05 3dfz s THR 3 CO -0.17 0.20 0.04 0.68 -0.69 0.00 0.00 174.62 174.68 3dfz s VAL 4 N 0.86 0.15 -0.16 3.82 -7.23 -1.26 -5.14 120.40 111.45 3dfz s VAL 4 Ca 0.48 -1.80 -0.14 0.00 -1.81 0.00 0.00 61.98 58.71 3dfz s VAL 4 Cb -0.20 -1.76 -0.05 0.00 0.56 0.00 0.00 36.38 34.93 3dfz s VAL 4 CO 0.25 -0.70 0.30 -0.04 -0.31 0.00 0.00 175.10 174.60 3dfz s MET 5 N -3.98 4.26 -0.14 4.82 -1.94 -1.26 -5.08 119.30 115.98 3dfz s MET 5 Ca 0.15 0.10 0.02 0.00 -1.71 0.00 0.00 55.69 54.25 3dfz s MET 5 Cb 0.07 -3.43 0.00 0.00 2.01 0.00 0.00 34.83 33.49 3dfz s MET 5 CO -0.04 0.22 -0.20 -1.17 -0.01 0.00 0.00 175.02 173.82 3dfz s LEU 6 N 0.51 2.25 -0.53 -0.03 2.96 -1.26 -5.09 118.68 117.49 3dfz s LEU 6 Ca 0.17 -0.55 -0.29 0.00 -0.22 0.00 0.00 54.13 53.24 3dfz s LEU 6 Cb -0.13 -1.49 0.03 0.00 0.50 0.00 0.00 46.19 45.10 3dfz s LEU 6 CO 0.04 0.09 1.17 -0.62 -1.32 0.00 0.00 176.35 175.71 3dfz s ASP 7 N 0.77 6.53 0.00 3.68 -1.08 -1.26 -4.84 116.67 120.47 3dfz s ASP 7 Ca -0.07 0.26 0.16 0.00 -0.52 0.00 0.00 52.55 52.38 3dfz s ASP 7 Cb -0.16 -2.55 0.03 0.00 -1.46 0.00 0.00 42.92 38.78 3dfz s ASP 7 CO -0.00 -1.38 0.89 0.18 0.52 0.00 0.00 175.17 175.38 3dfz n LEU 8 N 8.17 1.79 -4.55 -1.34 4.77 -1.26 -4.90 117.00 119.68 3dfz n LEU 8 Ca 0.10 -0.82 -0.44 0.00 -0.03 0.00 0.00 56.01 54.82 3dfz n LEU 8 Cb 0.49 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.54 3dfz n LEU 8 CO 0.72 0.34 1.88 1.17 -1.33 0.00 0.00 177.39 180.16 3dfz n LYS 9 N 0.13 1.55 -0.79 3.23 4.81 -1.10 -0.68 118.16 125.30 3dfz n LYS 9 Ca 0.07 0.37 0.00 0.00 -0.87 0.00 0.00 58.31 57.89 3dfz n LYS 9 Cb 0.35 -3.04 0.00 0.00 0.02 0.00 0.00 35.03 32.36 3dfz n LYS 9 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3dfz n GLY 10 N 6.03 0.76 3.94 3.14 0.00 -0.20 -5.00 105.19 113.86 3dfz n GLY 10 Ca 0.35 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.12 3dfz n GLY 10 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dfz s ARG 11 N -0.21 3.50 -0.23 1.61 1.81 0.14 -4.92 118.95 120.65 3dfz s ARG 11 Ca 0.00 -0.38 -0.29 0.00 -1.72 0.00 0.00 55.73 53.34 3dfz s ARG 11 Cb 0.00 -2.76 0.00 0.00 -0.45 0.00 0.00 34.95 31.75 3dfz s ARG 11 CO 0.00 0.28 1.14 0.45 -0.68 0.00 0.00 175.30 176.49 3dfz s SER 12 N -3.68 6.98 -0.20 0.23 0.15 -1.26 -4.10 113.70 111.82 3dfz s SER 12 Ca 0.39 1.39 -0.00 0.00 0.70 0.00 0.00 55.95 58.43 3dfz s SER 12 Cb -0.10 -2.54 0.01 0.00 -1.71 0.00 0.00 66.02 61.68 3dfz s SER 12 CO 0.32 -0.77 -0.15 -0.69 1.20 0.00 0.00 173.24 173.15 3dfz s VAL 13 N 3.48 2.44 -0.20 4.45 1.01 -0.38 -2.14 120.40 129.06 3dfz s VAL 13 Ca 0.49 -0.86 -0.07 0.00 0.00 0.00 0.00 61.98 61.54 3dfz s VAL 13 Cb -0.17 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 3dfz s VAL 13 CO 0.12 0.47 0.05 -0.22 0.00 0.00 0.00 175.10 175.52 3dfz s LEU 14 N 1.33 3.63 -0.29 3.92 2.96 -0.71 -1.08 118.68 128.45 3dfz s LEU 14 Ca 0.04 -0.03 -0.08 0.00 -0.22 0.00 0.00 54.13 53.84 3dfz s LEU 14 Cb -0.14 -1.93 -0.00 0.00 0.50 0.00 0.00 46.19 44.62 3dfz s LEU 14 CO -0.10 0.11 0.10 -0.69 -1.32 0.00 0.00 176.35 174.45 3dfz s VAL 15 N 0.75 4.25 -0.56 1.68 1.01 0.94 0.38 120.40 128.85 3dfz s VAL 15 Ca 0.03 -0.51 -0.18 0.00 0.00 0.00 0.00 61.98 61.32 3dfz s VAL 15 Cb -0.14 -3.15 0.11 0.00 0.00 0.00 0.00 36.38 33.21 3dfz s VAL 15 CO 0.02 0.12 0.61 -0.69 0.00 0.00 0.00 175.10 175.15 3dfz s VAL 16 N 1.56 4.99 0.00 2.92 1.01 0.26 -1.10 120.40 130.04 3dfz s VAL 16 Ca 0.04 -1.16 0.00 0.00 0.00 0.00 0.00 61.98 60.86 3dfz s VAL 16 Cb -0.17 -4.40 0.00 0.00 0.00 0.00 0.00 36.38 31.81 3dfz s VAL 16 CO 0.04 -0.98 0.00 0.61 0.00 0.00 0.00 175.10 174.77 3dfz n GLY 17 N 5.26 3.29 0.00 4.51 0.00 -0.65 -1.25 105.19 116.35 3dfz n GLY 17 Ca -0.11 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.10 3dfz n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dfz n GLY 18 N -1.69 0.82 0.00 -0.02 0.00 -1.26 -4.53 105.19 98.51 3dfz n GLY 18 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3dfz n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dfz n GLY 19 N 0.00 1.07 0.19 -0.02 0.00 -1.26 -1.52 105.19 103.66 3dfz n GLY 19 Ca 0.00 -1.53 -0.20 0.00 0.00 0.00 0.00 46.02 44.29 3dfz n GLY 19 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3dfz h THR 20 N 0.00 1.28 -0.01 2.61 1.35 -1.99 -2.00 112.91 114.15 3dfz h THR 20 Ca 0.00 -2.23 0.01 0.00 -0.55 0.00 0.00 66.41 63.63 3dfz h THR 20 Cb 0.00 2.39 -0.01 0.00 -1.73 0.00 0.00 68.15 68.80 3dfz h THR 20 CO 0.00 0.69 -0.02 0.40 -0.25 0.00 0.00 175.52 176.34 3dfz h ILE 21 N 0.37 0.93 -0.57 6.82 2.04 -1.95 -1.94 117.51 123.21 3dfz h ILE 21 Ca -0.13 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.83 3dfz h ILE 21 Cb 1.68 0.93 -0.08 0.00 -0.74 0.00 0.00 36.82 38.61 3dfz h ILE 21 CO 0.20 0.00 0.13 0.00 0.00 0.00 0.00 178.15 178.48 3dfz h ALA 22 N 0.98 0.67 -0.63 1.87 0.00 -1.82 -0.05 119.26 120.27 3dfz h ALA 22 Ca 0.02 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3dfz h ALA 22 Cb 0.06 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3dfz h ALA 22 CO -0.04 -0.29 0.37 1.15 0.00 0.00 0.00 179.25 180.44 3dfz h THR 23 N 0.27 1.19 -0.03 0.00 2.02 -1.26 -2.28 112.91 112.82 3dfz h THR 23 Ca 0.30 -0.45 -0.00 0.00 0.77 0.00 0.00 66.41 67.03 3dfz h THR 23 Cb 0.42 0.34 -0.00 0.00 -1.74 0.00 0.00 68.15 67.17 3dfz h THR 23 CO -0.37 0.20 0.02 0.03 0.37 0.00 0.00 175.52 175.77 3dfz h ARG 24 N 0.86 0.04 -0.21 6.66 3.08 -0.58 -1.77 114.38 122.46 3dfz h ARG 24 Ca 0.23 -0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.32 3dfz h ARG 24 Cb 0.00 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 29.99 3dfz h ARG 24 CO -0.04 0.07 -0.10 0.00 -1.07 0.00 0.00 179.97 178.82 3dfz h ARG 25 N -0.00 -0.08 -0.48 0.04 2.47 -0.87 -1.61 114.38 113.85 3dfz h ARG 25 Ca 0.01 0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 58.73 3dfz h ARG 25 Cb 0.04 0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 28.35 3dfz h ARG 25 CO -0.00 -0.05 0.28 0.82 0.56 0.00 0.00 179.97 181.57 3dfz h ILE 26 N -0.08 1.16 -0.60 2.04 2.04 -1.39 -2.10 117.51 118.58 3dfz h ILE 26 Ca 0.12 -0.38 0.11 0.00 1.00 0.00 0.00 64.86 65.71 3dfz h ILE 26 Cb 0.25 0.54 -0.08 0.00 -0.74 0.00 0.00 36.82 36.79 3dfz h ILE 26 CO -0.27 0.16 0.15 0.50 0.00 0.00 0.00 178.15 178.70 3dfz h LYS 27 N 0.64 0.28 -0.24 2.37 3.64 -0.99 -1.12 116.57 121.16 3dfz h LYS 27 Ca 0.17 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.59 3dfz h LYS 27 Cb 0.02 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 31.71 3dfz h LYS 27 CO -0.03 0.19 -0.25 0.78 -2.27 0.00 0.00 179.45 177.87 3dfz h GLY 28 N 0.29 -0.19 -2.33 5.01 0.00 -0.63 -3.22 103.07 102.00 3dfz h GLY 28 Ca 0.31 0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.95 3dfz h GLY 28 CO -0.38 -0.20 0.00 1.97 0.00 0.00 0.00 176.54 177.93 3dfz n PHE 29 N -5.38 1.18 -0.20 5.60 1.16 -0.97 -4.61 117.46 114.24 3dfz n PHE 29 Ca -0.01 -0.67 0.00 0.00 -1.87 0.00 0.00 57.45 54.90 3dfz n PHE 29 Cb 0.29 -0.24 0.11 0.00 -1.61 0.00 0.00 39.48 38.03 3dfz n PHE 29 CO 0.00 0.00 0.00 -0.07 -1.87 0.00 0.00 176.76 174.82 3dfz h LEU 30 N 3.03 0.16 0.00 5.98 3.38 -1.23 -2.53 115.31 124.10 3dfz h LEU 30 Ca 0.00 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3dfz h LEU 30 Cb 1.35 0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.18 3dfz h LEU 30 CO 0.20 0.09 0.00 0.00 0.09 0.00 0.00 178.44 178.83 3dfz n GLN 31 N -5.04 0.08 -0.11 1.13 6.02 -1.26 -4.29 117.38 113.91 3dfz n GLN 31 Ca 0.09 0.26 0.08 0.00 -0.01 0.00 0.00 57.00 57.42 3dfz n GLN 31 Cb 0.29 -1.50 0.29 0.00 1.02 0.00 0.00 30.24 30.34 3dfz n GLN 31 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 3dfz n GLU 32 N -1.35 1.70 0.00 -1.09 -0.58 -0.96 -4.85 120.64 113.52 3dfz n GLU 32 Ca 0.03 -1.07 0.00 0.00 -0.42 0.00 0.00 57.16 55.70 3dfz n GLU 32 Cb 0.07 -1.33 0.00 0.00 -0.57 0.00 0.00 31.44 29.61 3dfz n GLU 32 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3dfz n GLY 33 N 1.07 0.54 7.00 0.62 0.00 -1.26 -2.73 105.19 110.43 3dfz n GLY 33 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3dfz n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dfz n ALA 34 N -1.93 0.00 -2.21 4.61 0.00 -1.26 -1.03 120.51 118.69 3dfz n ALA 34 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 3dfz n ALA 34 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 3dfz n ALA 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dfz n ALA 35 N 6.81 -1.07 -2.70 0.00 0.00 -1.26 -3.83 120.51 118.47 3dfz n ALA 35 Ca 0.00 0.03 -0.37 0.00 0.00 0.00 0.00 53.44 53.10 3dfz n ALA 35 Cb 0.00 -2.05 -0.07 0.00 0.00 0.00 0.00 19.45 17.33 3dfz n ALA 35 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3dfz s ILE 36 N -3.13 5.23 -0.06 0.00 1.01 -1.26 -1.25 121.20 121.74 3dfz s ILE 36 Ca 0.12 0.69 0.04 0.00 0.00 0.00 0.00 60.65 61.50 3dfz s ILE 36 Cb -0.02 -3.71 -0.00 0.00 0.01 0.00 0.00 42.46 38.74 3dfz s ILE 36 CO 0.26 0.31 -0.19 -0.89 0.00 0.00 0.00 174.94 174.42 3dfz s THR 37 N 0.94 1.63 -0.14 2.92 2.01 -0.24 -1.57 115.64 121.18 3dfz s THR 37 Ca 0.19 -0.81 -0.01 0.00 0.31 0.00 0.00 61.69 61.37 3dfz s THR 37 Cb -0.14 -1.41 -0.01 0.00 0.01 0.00 0.00 72.50 70.94 3dfz s THR 37 CO 0.07 0.46 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.66 3dfz s VAL 38 N 0.14 3.16 -0.27 3.82 1.01 0.68 -0.04 120.40 128.90 3dfz s VAL 38 Ca -0.08 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.30 3dfz s VAL 38 Cb -0.14 -2.35 0.06 0.00 0.00 0.00 0.00 36.38 33.95 3dfz s VAL 38 CO 0.04 0.51 -0.08 -0.69 0.00 0.00 0.00 175.10 174.88 3dfz s VAL 39 N 0.50 2.36 0.08 2.92 1.01 -0.26 -0.10 120.40 126.91 3dfz s VAL 39 Ca -0.08 -1.59 -0.23 0.00 0.00 0.00 0.00 61.98 60.08 3dfz s VAL 39 Cb -0.15 -2.38 0.06 0.00 0.00 0.00 0.00 36.38 33.90 3dfz s VAL 39 CO 0.04 -0.06 0.54 0.00 0.00 0.00 0.00 175.10 175.63 3dfz s ALA 40 N 1.13 -1.40 0.12 5.51 0.00 -0.92 -1.64 121.76 124.56 3dfz s ALA 40 Ca -0.08 0.55 -0.24 0.00 0.00 0.00 0.00 51.96 52.20 3dfz s ALA 40 Cb -0.20 0.54 -0.07 0.00 0.00 0.00 0.00 23.12 23.39 3dfz s ALA 40 CO -0.04 -0.59 1.68 -1.35 0.00 0.00 0.00 175.76 175.46 3dfz h PRO 41 N 2.51 -0.23 -6.88 0.00 0.11 -1.78 -2.87 132.00 122.86 3dfz h PRO 41 Ca -0.32 0.02 -0.69 0.00 0.11 0.00 0.00 66.00 65.12 3dfz h PRO 41 Cb 1.24 0.05 -0.23 0.00 0.11 0.00 0.00 31.00 32.18 3dfz h PRO 41 CO 0.41 -0.15 -0.87 0.99 -0.21 0.00 0.00 178.00 178.17 3dfz s THR 42 N -6.14 2.26 0.50 -1.15 2.01 -1.26 -4.63 115.64 107.25 3dfz s THR 42 Ca -0.14 -1.70 0.02 0.00 0.31 0.00 0.00 61.69 60.17 3dfz s THR 42 Cb 0.09 -1.99 -0.02 0.00 0.01 0.00 0.00 72.50 70.59 3dfz s THR 42 CO 0.67 0.13 0.02 0.68 -0.69 0.00 0.00 174.62 175.43 3dfz s VAL 43 N -1.03 1.25 0.54 3.82 -7.23 -1.26 -4.36 120.40 112.14 3dfz s VAL 43 Ca 0.14 -1.98 -0.02 0.00 -1.81 0.00 0.00 61.98 58.31 3dfz s VAL 43 Cb -0.10 -2.22 0.01 0.00 0.56 0.00 0.00 36.38 34.63 3dfz s VAL 43 CO 0.06 0.00 0.80 -0.94 -0.31 0.00 0.00 175.10 174.71 3dfz s SER 44 N -3.88 5.53 0.24 4.85 1.04 -0.57 -4.90 113.70 116.00 3dfz s SER 44 Ca 0.09 0.38 -0.04 0.00 0.48 0.00 0.00 55.95 56.86 3dfz s SER 44 Cb 0.02 -1.41 0.43 0.00 0.10 0.00 0.00 66.02 65.16 3dfz s SER 44 CO 0.05 -1.00 1.76 0.00 0.98 0.00 0.00 173.24 175.03 3dfz h ALA 45 N 0.04 1.10 -0.51 5.32 0.00 -1.98 0.44 119.26 123.66 3dfz h ALA 45 Ca -0.45 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.49 3dfz h ALA 45 Cb 1.27 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 3dfz h ALA 45 CO 0.58 -0.09 0.13 0.93 0.00 0.00 0.00 179.25 180.80 3dfz h GLU 46 N 0.58 0.81 -0.58 0.00 3.07 -1.97 0.23 114.58 116.72 3dfz h GLU 46 Ca 0.40 -0.19 -0.07 0.00 -0.50 0.00 0.00 59.36 59.00 3dfz h GLU 46 Cb 0.51 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.29 3dfz h GLU 46 CO -0.33 0.77 0.07 0.82 -1.40 0.00 0.00 179.01 178.94 3dfz h ILE 47 N 0.70 1.26 -0.33 3.13 2.04 -1.80 -1.39 117.51 121.13 3dfz h ILE 47 Ca 0.16 -1.03 0.04 0.00 1.00 0.00 0.00 64.86 65.04 3dfz h ILE 47 Cb 0.32 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 37.15 3dfz h ILE 47 CO -0.00 0.37 0.08 0.78 0.00 0.00 0.00 178.15 179.38 3dfz h ASN 48 N 0.87 0.04 -0.74 1.72 2.35 -0.61 0.26 115.58 119.48 3dfz h ASN 48 Ca 0.17 0.05 0.01 0.00 -0.55 0.00 0.00 56.30 55.98 3dfz h ASN 48 Cb 0.45 0.06 -0.04 0.00 0.05 0.00 0.00 38.32 38.84 3dfz h ASN 48 CO 0.02 0.06 0.48 -0.08 -1.65 0.00 0.00 177.43 176.26 3dfz h GLU 49 N 0.20 0.94 -0.55 0.81 4.57 -0.31 -0.47 114.58 119.77 3dfz h GLU 49 Ca 0.15 -0.06 -0.05 0.00 -1.18 0.00 0.00 59.36 58.23 3dfz h GLU 49 Cb 0.16 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 28.51 3dfz h GLU 49 CO -0.19 0.62 0.17 -1.49 -1.18 0.00 0.00 179.01 176.94 3dfz h TRP 50 N 0.97 0.90 -0.36 0.92 6.55 -0.80 -2.13 115.95 122.01 3dfz h TRP 50 Ca 0.28 -0.09 0.05 0.00 0.95 0.00 0.00 58.89 60.08 3dfz h TRP 50 Cb -0.08 -0.26 -0.05 0.00 -0.86 0.00 0.00 29.16 27.91 3dfz h TRP 50 CO -0.03 0.76 0.07 1.49 -1.05 0.00 0.00 178.44 179.68 3dfz h GLU 51 N 0.77 0.18 0.00 0.49 4.81 -0.11 -1.32 114.58 119.40 3dfz h GLU 51 Ca 0.18 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.36 3dfz h GLU 51 Cb 0.29 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.63 3dfz h GLU 51 CO -0.00 0.12 -0.15 0.00 -0.73 0.00 0.00 179.01 178.25 3dfz h ALA 52 N 1.27 1.37 -0.10 2.92 0.00 -0.87 -2.53 119.26 121.32 3dfz h ALA 52 Ca 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3dfz h ALA 52 Cb 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3dfz h ALA 52 CO -0.23 0.19 0.00 1.63 0.00 0.00 0.00 179.25 180.84 3dfz n LYS 53 N -3.81 1.65 -1.03 0.00 4.76 -0.82 -4.93 118.16 113.99 3dfz n LYS 53 Ca -0.02 -0.97 -0.00 0.00 -2.87 0.00 0.00 58.31 54.45 3dfz n LYS 53 Cb 0.25 -1.42 -0.00 0.00 -1.84 0.00 0.00 35.03 32.02 3dfz n LYS 53 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3dfz n GLY 54 N 1.13 0.42 0.09 0.72 0.00 -0.95 -4.95 105.19 101.64 3dfz n GLY 54 Ca 0.17 -1.07 -0.02 0.00 0.00 0.00 0.00 46.02 45.10 3dfz n GLY 54 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3dfz n GLN 55 N -2.96 0.63 -3.99 1.61 6.02 -0.53 -4.97 117.38 113.20 3dfz n GLN 55 Ca -0.00 0.20 -0.09 0.00 -0.01 0.00 0.00 57.00 57.10 3dfz n GLN 55 Cb 0.02 -1.76 -0.10 0.00 1.02 0.00 0.00 30.24 29.42 3dfz n GLN 55 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3dfz s LEU 56 N -5.76 2.12 -0.10 1.08 1.02 -1.22 -4.67 118.68 111.15 3dfz s LEU 56 Ca -0.04 -0.65 -0.03 0.00 0.02 0.00 0.00 54.13 53.43 3dfz s LEU 56 Cb 0.08 0.35 -0.03 0.00 0.02 0.00 0.00 46.19 46.61 3dfz s LEU 56 CO 0.82 -0.47 0.03 -0.13 0.02 0.00 0.00 176.35 176.62 3dfz s ARG 57 N -2.64 3.15 0.11 1.70 0.52 -0.61 -4.41 118.95 116.77 3dfz s ARG 57 Ca -0.05 -0.36 0.08 0.00 -0.52 0.00 0.00 55.73 54.88 3dfz s ARG 57 Cb -0.01 -2.90 -0.04 0.00 0.52 0.00 0.00 34.95 32.52 3dfz s ARG 57 CO -0.05 0.67 -0.12 0.08 0.02 0.00 0.00 175.30 175.90 3dfz s VAL 58 N -0.78 3.22 -0.25 3.52 1.01 -1.26 -0.23 120.40 125.63 3dfz s VAL 58 Ca 0.12 -1.33 -0.01 0.00 0.00 0.00 0.00 61.98 60.76 3dfz s VAL 58 Cb -0.12 -2.50 0.08 0.00 0.00 0.00 0.00 36.38 33.84 3dfz s VAL 58 CO 0.02 0.11 0.03 -0.54 0.00 0.00 0.00 175.10 174.73 3dfz s LYS 59 N -2.18 0.97 -1.21 2.72 1.02 0.86 -4.91 119.74 117.01 3dfz s LYS 59 Ca 0.20 -0.86 -0.20 0.00 0.02 0.00 0.00 55.97 55.14 3dfz s LYS 59 Cb -0.11 -2.25 0.06 0.00 -0.52 0.00 0.00 37.83 35.02 3dfz s LYS 59 CO 0.13 -0.76 1.65 1.03 -0.92 0.00 0.00 175.35 176.47 3dfz s ARG 60 N 1.61 3.86 0.21 1.68 0.52 -1.24 -2.16 118.95 123.42 3dfz s ARG 60 Ca 0.02 -1.73 -0.07 0.00 -0.52 0.00 0.00 55.73 53.43 3dfz s ARG 60 Cb -0.18 -5.48 -0.02 0.00 0.52 0.00 0.00 34.95 29.79 3dfz s ARG 60 CO -0.13 -2.24 0.28 -1.59 0.02 0.00 0.00 175.30 171.64 3dfz s LYS 61 N 4.46 1.30 -0.04 3.54 -2.85 -1.08 -4.80 119.74 120.26 3dfz s LYS 61 Ca 0.51 -1.40 -0.30 0.00 -1.00 0.00 0.00 55.97 53.79 3dfz s LYS 61 Cb 0.03 0.36 -0.03 0.00 -2.06 0.00 0.00 37.83 36.12 3dfz s LYS 61 CO 0.02 -0.48 1.20 0.15 0.10 0.00 0.00 175.35 176.34 3dfz s LYS 62 N -4.07 4.36 0.27 1.78 1.02 -1.26 -2.71 119.74 119.13 3dfz s LYS 62 Ca 0.28 1.68 -0.30 0.00 0.02 0.00 0.00 55.97 57.65 3dfz s LYS 62 Cb 0.04 -3.54 -0.13 0.00 -0.52 0.00 0.00 37.83 33.68 3dfz s LYS 62 CO 0.08 -0.43 1.39 1.55 -0.92 0.00 0.00 175.35 177.03 3dfz n VAL 63 N 4.54 1.19 -4.44 3.17 3.14 -1.26 -5.03 118.33 119.64 3dfz n VAL 63 Ca 0.11 -0.30 -0.22 0.00 -2.96 0.00 0.00 64.34 60.96 3dfz n VAL 63 Cb 0.46 -1.52 -0.09 0.00 -1.06 0.00 0.00 33.84 31.63 3dfz n VAL 63 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 3dfz s GLY 64 N 0.17 2.30 0.66 7.55 0.00 -1.26 -5.02 107.32 111.71 3dfz s GLY 64 Ca 0.65 -1.59 0.36 0.00 0.00 0.00 0.00 44.72 44.14 3dfz s GLY 64 CO 0.52 -1.75 2.13 1.05 0.00 0.00 0.00 173.10 175.05 3dfz h GLU 65 N 2.00 0.00 0.00 2.90 4.11 -1.96 0.12 114.58 121.75 3dfz h GLU 65 Ca -0.36 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.06 3dfz h GLU 65 Cb 1.26 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.51 3dfz h GLU 65 CO 0.59 0.00 -0.03 1.05 0.07 0.00 0.00 179.01 180.68 3dfz h GLU 66 N 0.00 0.00 0.00 1.06 9.09 -2.00 -2.91 114.58 119.82 3dfz h GLU 66 Ca 0.01 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.42 3dfz h GLU 66 Cb 0.38 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.48 3dfz h GLU 66 CO -0.00 0.03 -0.30 -0.44 0.05 0.00 0.00 179.01 178.35 3dfz h ASP 67 N 0.00 0.00 -0.56 3.06 3.32 -1.16 -3.37 116.42 117.71 3dfz h ASP 67 Ca -0.00 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3dfz h ASP 67 Cb 0.69 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.24 3dfz h ASP 67 CO 0.00 0.01 0.00 0.18 -1.72 0.00 0.00 179.24 177.72 3dfz n LEU 68 N -2.75 5.65 -4.73 1.55 4.77 -1.10 -4.90 117.00 115.48 3dfz n LEU 68 Ca 0.03 -2.93 -0.38 0.00 -0.03 0.00 0.00 56.01 52.71 3dfz n LEU 68 Cb 0.51 -0.68 -0.06 0.00 -2.33 0.00 0.00 43.42 40.86 3dfz n LEU 68 CO 0.35 0.64 0.16 -0.76 -1.33 0.00 0.00 177.39 176.45 3dfz s LEU 69 N -2.75 4.30 -1.59 2.23 1.43 -1.26 -4.40 118.68 116.64 3dfz s LEU 69 Ca 0.54 0.83 -0.18 0.00 -1.03 0.00 0.00 54.13 54.30 3dfz s LEU 69 Cb 0.41 -2.69 0.16 0.00 0.03 0.00 0.00 46.19 44.11 3dfz s LEU 69 CO 0.16 0.04 0.64 0.59 0.23 0.00 0.00 176.35 178.00 3dfz n ASN 70 N 3.46 -2.76 -4.67 2.29 3.02 -1.26 -4.94 115.26 110.41 3dfz n ASN 70 Ca -0.08 -0.89 -0.39 0.00 -0.03 0.00 0.00 54.58 53.19 3dfz n ASN 70 Cb 0.52 -2.31 -0.07 0.00 -0.61 0.00 0.00 39.78 37.31 3dfz n ASN 70 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3dfz s VAL 71 N -3.13 5.13 0.07 2.41 1.01 -1.26 -4.88 120.40 119.75 3dfz s VAL 71 Ca 0.68 0.90 -0.20 0.00 0.00 0.00 0.00 61.98 63.36 3dfz s VAL 71 Cb -0.38 -3.82 -0.10 0.00 0.00 0.00 0.00 36.38 32.08 3dfz s VAL 71 CO 0.83 0.20 1.54 0.15 0.00 0.00 0.00 175.10 177.83 3dfz h PHE 72 N 7.40 0.32 -3.35 5.22 3.57 -1.80 -3.43 116.94 124.86 3dfz h PHE 72 Ca -0.35 -0.05 -0.38 0.00 3.53 0.00 0.00 57.97 60.73 3dfz h PHE 72 Cb 1.16 -0.09 -0.37 0.00 2.79 0.00 0.00 35.95 39.44 3dfz h PHE 72 CO 0.69 0.46 -0.75 0.12 -2.23 0.00 0.00 178.31 176.60 3dfz s PHE 73 N -5.17 0.31 -0.15 0.41 5.36 -0.91 -4.04 117.98 113.79 3dfz s PHE 73 Ca -0.14 0.05 -0.03 0.00 -0.96 0.00 0.00 56.93 55.86 3dfz s PHE 73 Cb 0.07 -0.55 -0.02 0.00 -0.34 0.00 0.00 43.02 42.18 3dfz s PHE 73 CO 0.72 -0.21 -0.07 0.42 -1.46 0.00 0.00 175.22 174.62 3dfz s ILE 74 N 1.74 3.57 -0.31 3.12 1.01 -0.55 -1.73 121.20 128.05 3dfz s ILE 74 Ca 0.00 -0.47 -0.06 0.00 0.00 0.00 0.00 60.65 60.13 3dfz s ILE 74 Cb -0.13 -2.55 0.03 0.00 0.01 0.00 0.00 42.46 39.82 3dfz s ILE 74 CO -0.03 0.50 0.07 -0.69 0.00 0.00 0.00 174.94 174.78 3dfz s VAL 75 N 0.47 3.67 -0.96 2.92 1.01 0.16 -1.28 120.40 126.39 3dfz s VAL 75 Ca -0.05 -1.01 -0.15 0.00 0.00 0.00 0.00 61.98 60.76 3dfz s VAL 75 Cb -0.15 -3.00 0.18 0.00 0.00 0.00 0.00 36.38 33.41 3dfz s VAL 75 CO 0.03 -0.05 1.06 -0.69 0.00 0.00 0.00 175.10 175.45 3dfz s VAL 76 N 1.41 5.19 0.14 2.92 1.01 -0.15 0.92 120.40 131.84 3dfz s VAL 76 Ca -0.01 -2.22 -0.05 0.00 0.00 0.00 0.00 61.98 59.70 3dfz s VAL 76 Cb -0.18 -4.69 -0.15 0.00 0.00 0.00 0.00 36.38 31.36 3dfz s VAL 76 CO 0.02 -1.34 1.34 0.00 0.00 0.00 0.00 175.10 175.12 3dfz h ALA 77 N 8.01 0.42 -2.59 5.51 0.00 -1.45 -3.42 119.26 125.74 3dfz h ALA 77 Ca 0.17 -0.65 -0.53 0.00 0.00 0.00 0.00 54.91 53.89 3dfz h ALA 77 Cb 0.99 -0.03 0.18 0.00 0.00 0.00 0.00 17.79 18.93 3dfz h ALA 77 CO 1.01 0.76 0.34 -0.08 0.00 0.00 0.00 179.25 181.28 3dfz s THR 78 N -3.49 2.05 -2.36 0.00 -1.32 -0.77 -4.69 115.64 105.05 3dfz s THR 78 Ca -0.07 0.02 0.25 0.00 -1.21 0.00 0.00 61.69 60.68 3dfz s THR 78 Cb 0.09 -2.42 0.19 0.00 -1.51 0.00 0.00 72.50 68.86 3dfz s THR 78 CO 0.87 -0.02 1.33 0.59 -2.21 0.00 0.00 174.62 175.18 3dfz n ASN 79 N -3.33 2.07 -0.89 8.08 3.02 -1.26 -4.83 115.26 118.13 3dfz n ASN 79 Ca 0.13 -1.55 0.00 0.00 -0.03 0.00 0.00 54.58 53.13 3dfz n ASN 79 Cb 0.51 0.20 0.00 0.00 -0.61 0.00 0.00 39.78 39.87 3dfz n ASN 79 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3dfz n ASP 80 N 0.32 1.19 0.00 6.41 -0.08 -1.26 -4.83 116.55 118.31 3dfz n ASP 80 Ca 0.13 -0.94 0.00 0.00 -1.51 0.00 0.00 54.79 52.47 3dfz n ASP 80 Cb 0.47 -0.23 0.00 0.00 2.34 0.00 0.00 41.12 43.70 3dfz n ASP 80 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3dfz n GLN 81 N 0.65 0.00 0.04 -0.67 6.02 -1.26 -2.24 117.38 119.92 3dfz n GLN 81 Ca 0.00 0.00 -0.20 0.00 -0.01 0.00 0.00 57.00 56.79 3dfz n GLN 81 Cb 0.21 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.36 3dfz n GLN 81 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3dfz h ALA 82 N 0.00 0.14 -0.05 -1.58 0.00 -1.99 -1.70 119.26 114.08 3dfz h ALA 82 Ca 0.00 -0.69 -0.00 0.00 0.00 0.00 0.00 54.91 54.22 3dfz h ALA 82 Cb 0.00 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 3dfz h ALA 82 CO 0.00 0.68 0.02 0.28 0.00 0.00 0.00 179.25 180.23 3dfz h VAL 83 N 0.41 1.15 -0.61 0.00 2.07 -1.84 0.05 116.25 117.47 3dfz h VAL 83 Ca -0.12 -0.44 0.09 0.00 0.82 0.00 0.00 66.70 67.05 3dfz h VAL 83 Cb 1.68 1.35 -0.07 0.00 -1.52 0.00 0.00 31.29 32.73 3dfz h VAL 83 CO 0.20 0.12 0.25 0.78 0.02 0.00 0.00 177.57 178.94 3dfz h ASN 84 N -0.09 0.27 0.18 0.57 2.35 -1.79 -0.99 115.58 116.08 3dfz h ASN 84 Ca 0.02 0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 3dfz h ASN 84 Cb 0.18 0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.59 3dfz h ASN 84 CO -0.00 0.16 -0.09 0.50 -1.65 0.00 0.00 177.43 176.35 3dfz h LYS 85 N 0.44 -0.23 -0.33 0.81 1.63 -1.22 -2.48 116.57 115.19 3dfz h LYS 85 Ca 0.31 0.02 0.07 0.00 -0.85 0.00 0.00 60.65 60.19 3dfz h LYS 85 Cb 0.36 0.05 -0.07 0.00 -0.60 0.00 0.00 32.23 31.96 3dfz h LYS 85 CO -0.29 -0.10 -0.16 0.35 -3.45 0.00 0.00 179.45 175.80 3dfz h PHE 86 N -0.31 -0.40 0.17 1.91 3.57 -0.61 -0.16 116.94 121.11 3dfz h PHE 86 Ca -0.02 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 3dfz h PHE 86 Cb 0.24 0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.21 3dfz h PHE 86 CO -0.05 -0.24 -0.09 0.28 -2.23 0.00 0.00 178.31 175.99 3dfz h VAL 87 N -0.11 0.82 -0.97 1.41 2.07 -1.17 -1.82 116.25 116.47 3dfz h VAL 87 Ca 0.17 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.85 3dfz h VAL 87 Cb 0.37 0.82 -0.09 0.00 -1.52 0.00 0.00 31.29 30.87 3dfz h VAL 87 CO -0.40 0.00 0.61 0.50 0.02 0.00 0.00 177.57 178.30 3dfz h LYS 88 N -0.24 0.78 0.00 1.57 3.11 -1.20 -1.28 116.57 119.32 3dfz h LYS 88 Ca -0.02 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.77 3dfz h LYS 88 Cb 0.18 -0.18 0.00 0.00 -1.00 0.00 0.00 32.23 31.24 3dfz h LYS 88 CO 0.03 0.51 0.00 1.96 -2.81 0.00 0.00 179.45 179.15 3dfz h GLN 89 N 0.80 0.00 -0.09 1.90 4.20 -0.49 -3.36 115.11 118.08 3dfz h GLN 89 Ca 0.51 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.22 3dfz h GLN 89 Cb 0.74 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.52 3dfz h GLN 89 CO -0.28 0.00 0.00 0.72 -0.67 0.00 0.00 178.83 178.60 3dfz n HIS 90 N -2.65 0.11 -3.75 2.96 8.25 -0.54 -5.00 115.22 114.60 3dfz n HIS 90 Ca 0.04 -0.29 -0.26 0.00 -0.26 0.00 0.00 57.72 56.95 3dfz n HIS 90 Cb 0.43 -0.02 -0.03 0.00 1.12 0.00 0.00 29.99 31.48 3dfz n HIS 90 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 3dfz s ILE 91 N -0.74 5.23 1.01 1.59 -4.36 -0.84 -5.00 121.20 118.09 3dfz s ILE 91 Ca 0.08 -0.48 -0.12 0.00 -0.26 0.00 0.00 60.65 59.86 3dfz s ILE 91 Cb 0.05 -3.75 0.20 0.00 1.25 0.00 0.00 42.46 40.20 3dfz s ILE 91 CO 0.06 -0.19 1.08 -0.54 0.24 0.00 0.00 174.94 175.60 3dfz s LYS 92 N -3.40 0.31 0.24 0.37 1.02 -1.26 -4.98 119.74 112.04 3dfz s LYS 92 Ca 0.37 0.61 -0.07 0.00 0.02 0.00 0.00 55.97 56.91 3dfz s LYS 92 Cb -0.11 -1.72 0.27 0.00 -0.52 0.00 0.00 37.83 35.76 3dfz s LYS 92 CO 0.29 -2.84 1.88 -0.91 -0.92 0.00 0.00 175.35 172.86 3dfz h ASN 93 N -1.97 0.95 -0.71 2.83 2.35 -1.99 -3.13 115.58 113.91 3dfz h ASN 93 Ca -0.55 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.19 3dfz h ASN 93 Cb 1.32 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 39.48 3dfz h ASN 93 CO 0.56 0.65 0.00 0.47 -1.65 0.00 0.00 177.43 177.46 3dfz n ASP 94 N -4.53 4.02 -4.66 5.81 8.00 -1.26 -4.93 116.55 119.00 3dfz n ASP 94 Ca 0.11 -2.06 -0.46 0.00 0.71 0.00 0.00 54.79 53.09 3dfz n ASP 94 Cb 0.09 -0.49 -0.04 0.00 -0.02 0.00 0.00 41.12 40.66 3dfz n ASP 94 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 3dfz n GLN 95 N 1.54 2.36 -2.06 -1.24 -0.06 -1.18 -4.96 117.38 111.77 3dfz n GLN 95 Ca 0.24 0.85 -0.42 0.00 -2.00 0.00 0.00 57.00 55.67 3dfz n GLN 95 Cb 0.65 -2.80 -0.03 0.00 -4.06 0.00 0.00 30.24 24.01 3dfz n GLN 95 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 3dfz s LEU 96 N 4.57 4.31 -0.10 1.69 1.43 -1.26 -4.87 118.68 124.45 3dfz s LEU 96 Ca 0.93 2.20 -0.04 0.00 -1.03 0.00 0.00 54.13 56.18 3dfz s LEU 96 Cb -0.59 -3.54 0.05 0.00 0.03 0.00 0.00 46.19 42.14 3dfz s LEU 96 CO 0.48 -0.88 0.22 0.68 0.23 0.00 0.00 176.35 177.07 3dfz s VAL 97 N 3.65 -0.16 -0.27 -1.59 -7.23 -1.26 -1.48 120.40 112.06 3dfz s VAL 97 Ca 0.71 0.21 -0.15 0.00 -1.81 0.00 0.00 61.98 60.94 3dfz s VAL 97 Cb -0.33 -0.36 -0.04 0.00 0.56 0.00 0.00 36.38 36.22 3dfz s VAL 97 CO 0.28 0.09 0.36 0.21 -0.31 0.00 0.00 175.10 175.73 3dfz s ASN 98 N 1.65 6.23 0.00 4.85 3.84 -0.41 -0.94 114.94 130.17 3dfz s ASN 98 Ca -0.05 0.27 0.00 0.00 0.21 0.00 0.00 52.86 53.28 3dfz s ASN 98 Cb -0.11 -2.20 0.00 0.00 -0.55 0.00 0.00 41.25 38.39 3dfz s ASN 98 CO -0.08 -0.17 0.00 0.23 -2.79 0.00 0.00 177.10 174.29 3dfz n MET 99 N 5.30 0.00 0.00 0.43 2.81 -1.26 -0.97 117.12 123.43 3dfz n MET 99 Ca -0.09 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.80 3dfz n MET 99 Cb 0.51 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.02 3dfz n MET 99 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3dfz n ASP 105 N 0.00 0.00 -0.11 7.83 9.92 -1.26 -4.92 116.55 128.01 3dfz n ASP 105 Ca 0.00 0.00 0.01 0.00 -0.53 0.00 0.00 54.79 54.27 3dfz n ASP 105 Cb 0.00 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 40.47 3dfz n ASP 105 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3dfz n GLY 106 N 0.00 -2.52 0.00 0.44 0.00 -1.26 -4.90 105.19 96.95 3dfz n GLY 106 Ca 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.59 3dfz n GLY 106 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3dfz n ASN 107 N -2.28 1.04 -3.87 1.61 0.23 -0.11 -5.00 115.26 106.87 3dfz n ASN 107 Ca -0.01 -1.53 -0.26 0.00 -0.53 0.00 0.00 54.58 52.25 3dfz n ASN 107 Cb 0.05 -0.00 -0.17 0.00 -2.08 0.00 0.00 39.78 37.58 3dfz n ASN 107 CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 3dfz s ILE 108 N -0.53 0.84 -0.03 1.53 -1.09 -1.00 -4.91 121.20 116.01 3dfz s ILE 108 Ca 0.00 -0.17 -0.02 0.00 -2.23 0.00 0.00 60.65 58.23 3dfz s ILE 108 Cb 0.00 -0.89 -0.04 0.00 -1.58 0.00 0.00 42.46 39.95 3dfz s ILE 108 CO 0.00 0.34 0.09 -1.10 -1.23 0.00 0.00 174.94 173.04 3dfz s GLN 109 N 1.75 3.14 -0.32 2.79 -0.21 -1.26 -4.23 119.66 121.32 3dfz s GLN 109 Ca 0.04 -0.42 -0.06 0.00 0.02 0.00 0.00 55.36 54.95 3dfz s GLN 109 Cb -0.13 -2.92 0.03 0.00 1.00 0.00 0.00 33.01 31.00 3dfz s GLN 109 CO -0.07 0.67 0.09 0.42 -2.12 0.00 0.00 175.29 174.28 3dfz s ILE 110 N -1.15 3.79 0.57 1.08 1.01 -1.26 -5.10 121.20 120.14 3dfz s ILE 110 Ca 0.21 -0.99 -0.15 0.00 0.00 0.00 0.00 60.65 59.72 3dfz s ILE 110 Cb -0.12 -3.08 -0.05 0.00 0.01 0.00 0.00 42.46 39.22 3dfz s ILE 110 CO 0.12 -0.08 1.03 -2.16 0.00 0.00 0.00 174.94 173.84 3dfz s PRO 111 N 1.43 3.56 0.22 2.79 0.04 -1.26 -5.01 135.00 136.76 3dfz s PRO 111 Ca -0.00 1.06 -0.32 0.00 0.04 0.00 0.00 61.00 61.78 3dfz s PRO 111 Cb -0.19 -2.07 -0.14 0.00 0.04 0.00 0.00 34.50 32.14 3dfz s PRO 111 CO 0.02 -0.60 1.37 0.00 0.04 0.00 0.00 177.00 177.83 3dfz n ALA 112 N -1.97 0.70 -3.79 8.56 0.00 -1.24 -4.86 120.51 117.91 3dfz n ALA 112 Ca 0.08 0.43 -0.08 0.00 0.00 0.00 0.00 53.44 53.87 3dfz n ALA 112 Cb 0.53 -2.22 -0.02 0.00 0.00 0.00 0.00 19.45 17.74 3dfz n ALA 112 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 3dfz s GLN 113 N -0.29 1.71 0.16 0.00 -2.07 -1.26 -0.31 119.66 117.60 3dfz s GLN 113 Ca 0.70 -0.91 -0.11 0.00 -1.82 0.00 0.00 55.36 53.22 3dfz s GLN 113 Cb -0.70 0.61 0.00 0.00 -1.09 0.00 0.00 33.01 31.83 3dfz s GLN 113 CO 0.49 -0.78 0.32 -0.59 -1.32 0.00 0.00 175.29 173.41 3dfz s PHE 114 N -3.89 0.24 0.14 9.60 -0.12 0.14 -4.97 117.98 119.12 3dfz s PHE 114 Ca 0.10 -0.61 0.04 0.00 -0.05 0.00 0.00 56.93 56.41 3dfz s PHE 114 Cb -0.05 0.04 -0.04 0.00 -0.63 0.00 0.00 43.02 42.33 3dfz s PHE 114 CO 0.04 -0.73 -0.10 -1.54 -0.05 0.00 0.00 175.22 172.84 3dfz s SER 115 N -2.93 1.73 -0.50 1.98 1.04 -1.26 -1.15 113.70 112.61 3dfz s SER 115 Ca 0.13 -0.99 0.03 0.00 0.48 0.00 0.00 55.95 55.61 3dfz s SER 115 Cb 0.03 -0.00 0.16 0.00 0.10 0.00 0.00 66.02 66.30 3dfz s SER 115 CO -0.03 -0.33 0.34 -0.13 0.98 0.00 0.00 173.24 174.07 3dfz s ARG 116 N -3.64 1.44 7.88 4.02 1.81 0.91 -4.99 118.95 126.38 3dfz s ARG 116 Ca 0.15 -2.36 0.00 0.00 -1.72 0.00 0.00 55.73 51.80 3dfz s ARG 116 Cb 0.02 -2.28 0.00 0.00 -0.45 0.00 0.00 34.95 32.24 3dfz s ARG 116 CO 0.00 -1.27 0.00 0.41 -0.68 0.00 0.00 175.30 173.76 3dfz n GLY 117 N 2.93 3.70 0.26 -3.53 0.00 -1.26 -2.23 105.19 105.06 3dfz n GLY 117 Ca 0.18 -0.04 0.14 0.00 0.00 0.00 0.00 46.02 46.31 3dfz n GLY 117 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3dfz h ARG 118 N 0.00 0.00 -6.54 1.61 3.08 -1.87 -3.43 114.38 107.22 3dfz h ARG 118 Ca 0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.52 3dfz h ARG 118 Cb 0.00 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.06 3dfz h ARG 118 CO 0.00 0.11 0.57 -1.17 -1.07 0.00 0.00 179.97 178.40 3dfz s LEU 119 N -6.55 4.40 0.00 3.04 2.96 -0.95 -5.05 118.68 116.54 3dfz s LEU 119 Ca 0.00 2.09 0.01 0.00 -0.22 0.00 0.00 54.13 56.02 3dfz s LEU 119 Cb 0.10 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 43.20 3dfz s LEU 119 CO 0.58 -0.44 -0.03 -0.94 -1.32 0.00 0.00 176.35 174.20 3dfz s SER 120 N 0.77 0.36 -0.08 3.68 1.04 -1.26 -0.06 113.70 118.15 3dfz s SER 120 Ca 0.57 -0.15 0.02 0.00 0.48 0.00 0.00 55.95 56.87 3dfz s SER 120 Cb -0.31 -0.01 0.01 0.00 0.10 0.00 0.00 66.02 65.81 3dfz s SER 120 CO 0.31 -0.03 -0.14 -0.76 0.98 0.00 0.00 173.24 173.61 3dfz s LEU 121 N -0.37 1.67 0.05 2.42 1.43 -0.30 -5.00 118.68 118.58 3dfz s LEU 121 Ca -0.02 -0.34 0.09 0.00 -1.03 0.00 0.00 54.13 52.83 3dfz s LEU 121 Cb -0.03 -0.93 -0.03 0.00 0.03 0.00 0.00 46.19 45.24 3dfz s LEU 121 CO -0.00 0.03 -0.25 0.00 0.23 0.00 0.00 176.35 176.36 3dfz s ALA 122 N 0.75 2.18 -0.05 4.21 0.00 -1.26 -0.68 121.76 126.91 3dfz s ALA 122 Ca -0.13 -1.24 0.03 0.00 0.00 0.00 0.00 51.96 50.62 3dfz s ALA 122 Cb -0.16 -0.45 0.01 0.00 0.00 0.00 0.00 23.12 22.52 3dfz s ALA 122 CO 0.03 0.51 -0.12 0.42 0.00 0.00 0.00 175.76 176.60 3dfz s ILE 123 N -0.82 1.04 0.11 0.00 1.09 0.58 -4.97 121.20 118.23 3dfz s ILE 123 Ca 0.11 -0.47 -0.06 0.00 -1.10 0.00 0.00 60.65 59.13 3dfz s ILE 123 Cb -0.10 -0.94 -0.02 0.00 -1.06 0.00 0.00 42.46 40.35 3dfz s ILE 123 CO 0.02 0.32 0.14 -0.94 -0.10 0.00 0.00 174.94 174.39 3dfz s SER 124 N 0.38 0.21 -0.10 3.58 1.04 -1.26 -3.60 113.70 113.94 3dfz s SER 124 Ca -0.08 -0.87 0.14 0.00 0.48 0.00 0.00 55.95 55.61 3dfz s SER 124 Cb -0.12 0.32 0.26 0.00 0.10 0.00 0.00 66.02 66.58 3dfz s SER 124 CO 0.02 -0.74 1.13 0.35 0.98 0.00 0.00 173.24 174.98 3dfz n THR 125 N -0.07 1.39 -4.01 2.02 -2.24 -1.26 -4.99 114.28 105.13 3dfz n THR 125 Ca -0.11 -1.83 -0.28 0.00 -2.27 0.00 0.00 64.05 59.56 3dfz n THR 125 Cb 0.62 0.01 -0.02 0.00 -2.10 0.00 0.00 70.33 68.85 3dfz n THR 125 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3dfz n ASP 126 N -0.93 -1.10 0.00 3.42 2.03 -1.26 -1.96 116.55 116.75 3dfz n ASP 126 Ca 0.12 -1.00 0.00 0.00 0.52 0.00 0.00 54.79 54.43 3dfz n ASP 126 Cb 0.70 -3.03 0.00 0.00 -0.72 0.00 0.00 41.12 38.06 3dfz n ASP 126 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3dfz n GLY 127 N -1.86 0.42 0.23 0.27 0.00 -1.26 -4.88 105.19 98.11 3dfz n GLY 127 Ca -0.22 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.71 3dfz n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dfz h ALA 128 N 0.00 0.61 -1.96 4.61 0.00 -1.82 -3.40 119.26 117.29 3dfz h ALA 128 Ca 0.00 -0.23 -0.42 0.00 0.00 0.00 0.00 54.91 54.25 3dfz h ALA 128 Cb 0.12 -0.17 -0.31 0.00 0.00 0.00 0.00 17.79 17.43 3dfz h ALA 128 CO 0.00 0.34 -0.77 0.45 0.00 0.00 0.00 179.25 179.26 3dfz s SER 129 N -6.17 0.84 0.55 0.00 0.15 -1.26 -4.94 113.70 102.86 3dfz s SER 129 Ca -0.13 -2.24 0.24 0.00 0.70 0.00 0.00 55.95 54.52 3dfz s SER 129 Cb 0.11 0.38 1.55 0.00 -1.71 0.00 0.00 66.02 66.36 3dfz s SER 129 CO 0.79 -0.18 2.19 1.55 1.20 0.00 0.00 173.24 178.79 3dfz h PRO 130 N 6.07 0.00 -0.28 5.44 0.13 -1.95 -1.73 132.00 139.68 3dfz h PRO 130 Ca 0.14 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.13 3dfz h PRO 130 Cb 1.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.13 3dfz h PRO 130 CO 0.23 0.02 -0.41 -0.07 -0.23 0.00 0.00 178.00 177.54 3dfz h LEU 131 N 0.00 0.71 -0.52 1.56 3.38 -1.97 -0.57 115.31 117.91 3dfz h LEU 131 Ca -0.00 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.64 3dfz h LEU 131 Cb 0.05 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3dfz h LEU 131 CO 0.00 1.04 0.32 0.25 0.09 0.00 0.00 178.44 180.14 3dfz h LEU 132 N 0.55 0.61 -0.80 1.67 5.85 -1.81 -2.39 115.31 118.99 3dfz h LEU 132 Ca 0.04 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.76 3dfz h LEU 132 Cb 0.94 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.76 3dfz h LEU 132 CO 0.09 0.48 0.50 0.74 -0.34 0.00 0.00 178.44 179.90 3dfz h THR 133 N 0.70 1.07 -0.62 1.05 2.02 -1.04 0.65 112.91 116.74 3dfz h THR 133 Ca 0.19 -0.32 0.02 0.00 0.77 0.00 0.00 66.41 67.06 3dfz h THR 133 Cb -0.03 0.05 -0.03 0.00 -1.74 0.00 0.00 68.15 66.39 3dfz h THR 133 CO -0.04 0.17 0.40 0.50 0.37 0.00 0.00 175.52 176.92 3dfz h LYS 134 N 0.94 0.78 -0.33 6.66 3.64 -1.04 0.04 116.57 127.27 3dfz h LYS 134 Ca 0.33 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.60 3dfz h LYS 134 Cb 0.09 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 3dfz h LYS 134 CO -0.14 0.52 -0.04 -0.09 -2.27 0.00 0.00 179.45 177.42 3dfz h ARG 135 N 0.80 0.60 -0.69 1.90 9.65 -0.82 -2.22 114.38 123.61 3dfz h ARG 135 Ca 0.24 -0.21 -0.04 0.00 -1.10 0.00 0.00 59.98 58.87 3dfz h ARG 135 Cb -0.05 -0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 28.46 3dfz h ARG 135 CO -0.07 0.76 0.28 0.82 2.80 0.00 0.00 179.97 184.56 3dfz h ILE 136 N 0.39 1.24 -0.37 1.20 2.04 -0.83 -0.42 117.51 120.76 3dfz h ILE 136 Ca 0.09 -0.75 0.06 0.00 1.00 0.00 0.00 64.86 65.26 3dfz h ILE 136 Cb 0.51 0.44 -0.05 0.00 -0.74 0.00 0.00 36.82 36.99 3dfz h ILE 136 CO 0.02 0.30 0.06 0.50 0.00 0.00 0.00 178.15 179.03 3dfz h LYS 137 N 0.98 0.17 0.14 2.37 3.64 -0.91 0.71 116.57 123.67 3dfz h LYS 137 Ca 0.23 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.61 3dfz h LYS 137 Cb 0.20 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 3dfz h LYS 137 CO -0.02 0.11 -0.20 0.93 -2.27 0.00 0.00 179.45 178.00 3dfz h GLU 138 N 0.18 -0.39 -0.82 1.90 5.08 -1.12 -0.83 114.58 118.58 3dfz h GLU 138 Ca 0.18 0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.60 3dfz h GLU 138 Cb 0.22 0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.50 3dfz h GLU 138 CO -0.25 -0.26 0.52 -0.44 -1.00 0.00 0.00 179.01 177.58 3dfz h ASP 139 N -0.40 0.85 0.53 1.42 3.32 -0.74 -1.88 116.42 119.52 3dfz h ASP 139 Ca 0.02 -0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.93 3dfz h ASP 139 Cb 0.41 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 3dfz h ASP 139 CO -0.09 0.58 -0.61 -0.07 -1.72 0.00 0.00 179.24 177.33 3dfz h LEU 140 N 1.00 0.09 -0.74 1.55 3.38 -0.68 -2.30 115.31 117.60 3dfz h LEU 140 Ca 0.33 -0.05 -0.11 0.00 0.09 0.00 0.00 57.88 58.14 3dfz h LEU 140 Cb 0.04 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 3dfz h LEU 140 CO -0.12 0.68 -0.26 0.28 0.09 0.00 0.00 178.44 179.10 3dfz h SER 141 N 0.06 0.69 -0.08 -0.43 0.02 -0.73 0.20 113.55 113.27 3dfz h SER 141 Ca -0.01 -0.25 -0.00 0.00 -0.84 0.00 0.00 61.79 60.69 3dfz h SER 141 Cb 1.09 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.44 3dfz h SER 141 CO 0.08 0.92 0.04 -1.28 -1.14 0.00 0.00 176.83 175.45 3dfz h SER 142 N 0.58 0.11 1.20 3.07 0.87 -1.18 -3.27 113.55 114.92 3dfz h SER 142 Ca 0.08 -0.14 -0.07 0.00 -1.23 0.00 0.00 61.79 60.43 3dfz h SER 142 Cb 0.75 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.68 3dfz h SER 142 CO 0.06 0.21 -0.32 0.78 -0.53 0.00 0.00 176.83 177.03 3dfz h ASN 143 N -0.01 0.00 -3.68 6.23 4.21 -1.16 -3.38 115.58 117.79 3dfz h ASN 143 Ca 0.03 0.00 -0.66 0.00 1.21 0.00 0.00 56.30 56.87 3dfz h ASN 143 Cb 0.14 0.00 -0.40 0.00 -1.12 0.00 0.00 38.32 36.94 3dfz h ASN 143 CO -0.00 0.32 -0.71 -0.31 -1.29 0.00 0.00 177.43 175.44 3dfz s TYR 144 N -3.37 3.76 0.00 1.19 1.51 0.04 -5.09 117.35 115.38 3dfz s TYR 144 Ca 0.02 -2.97 0.00 0.00 -1.01 0.00 0.00 57.07 53.11 3dfz s TYR 144 Cb 0.09 -2.94 0.00 0.00 -0.11 0.00 0.00 41.96 39.00 3dfz s TYR 144 CO 0.68 -0.95 0.00 -0.40 -1.11 0.00 0.00 175.55 173.77 3dfz n ASP 145 N 4.27 0.00 0.15 2.29 5.75 -1.26 -4.63 116.55 123.12 3dfz n ASP 145 Ca 0.03 -0.84 0.12 0.00 -0.01 0.00 0.00 54.79 54.10 3dfz n ASP 145 Cb 0.42 0.00 0.53 0.00 -1.03 0.00 0.00 41.12 41.04 3dfz n ASP 145 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 3dfz h GLU 146 N 0.00 0.00 0.00 0.11 3.07 -1.97 -2.74 114.58 113.05 3dfz h GLU 146 Ca 0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3dfz h GLU 146 Cb 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3dfz h GLU 146 CO 0.00 0.00 -0.01 0.66 -1.40 0.00 0.00 179.01 178.26 3dfz h SER 147 N 0.00 0.00 1.12 1.42 4.64 -1.95 -1.60 113.55 117.17 3dfz h SER 147 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dfz h SER 147 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3dfz h SER 147 CO 0.00 0.01 0.00 1.88 -0.87 0.00 0.00 176.83 177.85 3dfz h TYR 148 N 0.00 0.00 0.32 4.77 -1.99 -1.83 -2.55 116.97 115.69 3dfz h TYR 148 Ca -0.00 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 3dfz h TYR 148 Cb 0.01 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.74 3dfz h TYR 148 CO 0.00 0.00 -0.15 1.15 -0.00 0.00 0.00 178.16 179.16 3dfz h THR 149 N 0.00 0.65 0.00 -2.88 2.02 -1.36 -2.02 112.91 109.32 3dfz h THR 149 Ca 0.00 -0.64 0.00 0.00 0.77 0.00 0.00 66.41 66.54 3dfz h THR 149 Cb 0.56 0.95 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 3dfz h THR 149 CO 0.00 0.12 0.00 0.06 0.37 0.00 0.00 175.52 176.07 3dfz h GLN 150 N -0.81 0.00 -0.11 6.66 -0.00 -1.67 -2.82 115.11 116.36 3dfz h GLN 150 Ca -0.04 0.00 -0.05 0.00 -0.00 0.00 0.00 58.65 58.56 3dfz h GLN 150 Cb 0.52 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.00 3dfz h GLN 150 CO 0.07 0.00 -0.11 -0.92 -0.00 0.00 0.00 178.83 177.87 3dfz h TYR 151 N 0.00 0.33 0.00 0.06 -0.00 -1.50 -1.79 116.97 114.07 3dfz h TYR 151 Ca 0.00 -0.10 -0.09 0.00 -0.00 0.00 0.00 58.73 58.54 3dfz h TYR 151 Cb 0.93 -0.07 -0.01 0.00 -0.00 0.00 0.00 36.73 37.58 3dfz h TYR 151 CO 0.00 0.69 -0.43 1.79 -0.00 0.00 0.00 178.16 180.21 3dfz h THR 152 N -0.13 1.15 -0.29 1.81 1.35 -1.40 0.71 112.91 116.11 3dfz h THR 152 Ca 0.02 -1.55 -0.01 0.00 -0.55 0.00 0.00 66.41 64.31 3dfz h THR 152 Cb 0.64 1.87 -0.01 0.00 -1.73 0.00 0.00 68.15 68.92 3dfz h THR 152 CO 0.03 0.42 0.13 -0.61 -0.25 0.00 0.00 175.52 175.24 3dfz h GLN 153 N 0.00 0.43 -0.60 4.72 4.15 -1.54 -1.26 115.11 121.00 3dfz h GLN 153 Ca -0.00 -0.07 0.06 0.00 0.77 0.00 0.00 58.65 59.41 3dfz h GLN 153 Cb 0.84 -0.07 -0.06 0.00 0.21 0.00 0.00 27.48 28.40 3dfz h GLN 153 CO 0.06 0.43 0.30 0.35 -1.93 0.00 0.00 178.83 178.03 3dfz h PHE 154 N 0.33 0.55 -0.54 3.99 3.57 -0.65 -1.98 116.94 122.21 3dfz h PHE 154 Ca 0.10 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 3dfz h PHE 154 Cb 0.15 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 3dfz h PHE 154 CO -0.01 0.24 0.31 -0.07 -2.23 0.00 0.00 178.31 176.55 3dfz h LEU 155 N 0.56 0.66 -0.49 0.59 3.38 -0.73 -1.66 115.31 117.61 3dfz h LEU 155 Ca 0.28 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3dfz h LEU 155 Cb 0.22 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3dfz h LEU 155 CO -0.20 0.54 0.32 0.22 0.09 0.00 0.00 178.44 179.40 3dfz h TYR 156 N 0.72 0.63 -0.85 1.13 3.20 -1.07 0.67 116.97 121.40 3dfz h TYR 156 Ca 0.19 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.06 3dfz h TYR 156 Cb 0.01 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.03 3dfz h TYR 156 CO -0.02 0.41 0.50 0.93 -1.64 0.00 0.00 178.16 178.34 3dfz h GLU 157 N 0.66 1.16 -0.54 1.82 5.08 -1.17 -2.22 114.58 119.36 3dfz h GLU 157 Ca 0.18 -0.11 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 3dfz h GLU 157 Cb -0.05 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 28.94 3dfz h GLU 157 CO -0.04 0.82 0.16 0.00 -1.00 0.00 0.00 179.01 178.96 3dfz h ARG 159 N 0.75 0.34 0.03 0.00 2.43 -0.67 0.17 114.38 117.43 3dfz h ARG 159 Ca 0.17 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 3dfz h ARG 159 Cb 0.29 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 3dfz h ARG 159 CO -0.00 0.23 -0.02 0.28 -1.51 0.00 0.00 179.97 178.95 3dfz h VAL 160 N 0.34 1.05 -0.54 0.20 2.07 -1.31 -0.69 116.25 117.37 3dfz h VAL 160 Ca 0.09 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.39 3dfz h VAL 160 Cb -0.03 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 3dfz h VAL 160 CO -0.02 0.06 0.32 -0.07 0.02 0.00 0.00 177.57 177.88 3dfz h LEU 161 N -0.15 0.51 -0.18 2.57 3.38 -0.99 -1.96 115.31 118.48 3dfz h LEU 161 Ca -0.00 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3dfz h LEU 161 Cb 0.14 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 3dfz h LEU 161 CO 0.01 0.35 -0.01 0.40 0.09 0.00 0.00 178.44 179.28 3dfz h ILE 162 N 0.63 1.27 -0.85 1.22 2.04 -0.62 -2.45 117.51 118.74 3dfz h ILE 162 Ca 0.22 -0.91 0.21 0.00 1.00 0.00 0.00 64.86 65.38 3dfz h ILE 162 Cb 0.04 1.51 -0.13 0.00 -0.74 0.00 0.00 36.82 37.50 3dfz h ILE 162 CO -0.11 0.27 0.24 -0.74 0.00 0.00 0.00 178.15 177.82 3dfz h HIS 163 N 0.07 0.38 0.00 1.37 2.76 -0.93 -0.74 115.15 118.06 3dfz h HIS 163 Ca 0.05 0.05 -0.00 0.00 -2.20 0.00 0.00 60.37 58.26 3dfz h HIS 163 Cb 0.42 -0.03 -0.00 0.00 1.55 0.00 0.00 27.41 29.35 3dfz h HIS 163 CO 0.04 -0.16 -0.01 0.00 -1.30 0.00 0.00 177.93 176.50 3dfz h ARG 164 N 0.25 0.00 -6.83 5.26 3.08 -1.09 -3.46 114.38 111.59 3dfz h ARG 164 Ca 0.52 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 60.01 3dfz h ARG 164 Cb 1.01 0.00 0.12 0.00 0.08 0.00 0.00 29.97 31.18 3dfz h ARG 164 CO -0.60 0.01 0.49 1.28 -1.07 0.00 0.00 179.97 180.07 3dfz n LEU 165 N -3.10 4.03 -3.86 3.04 4.32 -0.29 -4.93 117.00 116.21 3dfz n LEU 165 Ca 0.02 1.11 -0.39 0.00 -0.02 0.00 0.00 56.01 56.73 3dfz n LEU 165 Cb 0.40 -1.50 -0.01 0.00 -1.62 0.00 0.00 43.42 40.69 3dfz n LEU 165 CO 0.30 -0.66 0.84 0.59 -1.22 0.00 0.00 177.39 177.24 3dfz n ASN 166 N 0.19 5.70 -3.93 -1.43 3.02 -1.26 -4.95 115.26 112.60 3dfz n ASN 166 Ca 0.07 -3.42 -0.10 0.00 -0.03 0.00 0.00 54.58 51.10 3dfz n ASN 166 Cb 0.40 -1.11 -0.10 0.00 -0.61 0.00 0.00 39.78 38.35 3dfz n ASN 166 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3dfz s VAL 167 N -2.68 0.11 0.77 2.41 1.01 -1.26 -5.14 120.40 115.61 3dfz s VAL 167 Ca 0.33 -0.93 -0.14 0.00 0.00 0.00 0.00 61.98 61.24 3dfz s VAL 167 Cb 0.07 -0.57 0.06 0.00 0.00 0.00 0.00 36.38 35.94 3dfz s VAL 167 CO 0.07 -0.51 1.20 -0.94 0.00 0.00 0.00 175.10 174.92 3dfz s SER 168 N -1.70 3.95 0.30 3.32 1.04 -1.26 -4.75 113.70 114.59 3dfz s SER 168 Ca -0.11 2.32 0.04 0.00 0.48 0.00 0.00 55.95 58.68 3dfz s SER 168 Cb -0.06 -2.58 0.69 0.00 0.10 0.00 0.00 66.02 64.17 3dfz s SER 168 CO -0.02 -2.43 1.78 0.50 0.98 0.00 0.00 173.24 174.05 3dfz h LYS 169 N -0.62 0.74 -0.33 4.02 3.64 -1.99 -0.68 116.57 121.35 3dfz h LYS 169 Ca -0.47 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 3dfz h LYS 169 Cb 1.29 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.93 3dfz h LYS 169 CO 0.48 0.49 0.21 1.03 -2.27 0.00 0.00 179.45 179.39 3dfz h SER 170 N 0.76 0.38 -0.28 4.20 0.87 -2.00 -2.00 113.55 115.49 3dfz h SER 170 Ca 0.56 -0.02 -0.16 0.00 -1.23 0.00 0.00 61.79 60.93 3dfz h SER 170 Cb 0.83 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.70 3dfz h SER 170 CO -0.37 0.29 -0.46 0.03 -0.53 0.00 0.00 176.83 175.79 3dfz h ARG 171 N 0.44 0.80 -0.61 2.24 3.08 -1.77 -2.75 114.38 115.81 3dfz h ARG 171 Ca 0.12 -0.49 0.06 0.00 0.07 0.00 0.00 59.98 59.73 3dfz h ARG 171 Cb -0.03 0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.02 3dfz h ARG 171 CO -0.02 1.12 0.32 0.87 -1.07 0.00 0.00 179.97 181.19 3dfz h LYS 172 N 0.56 0.59 -0.30 0.04 1.57 -0.96 -0.38 116.57 117.69 3dfz h LYS 172 Ca 0.02 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.67 3dfz h LYS 172 Cb 1.06 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.23 3dfz h LYS 172 CO 0.10 0.39 -0.21 1.25 -0.57 0.00 0.00 179.45 180.42 3dfz h HIS 173 N 0.61 0.63 -0.14 -1.35 2.76 -1.37 -0.53 115.15 115.75 3dfz h HIS 173 Ca 0.27 -0.13 -0.00 0.00 -2.20 0.00 0.00 60.37 58.31 3dfz h HIS 173 Cb 0.18 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 28.98 3dfz h HIS 173 CO -0.09 0.74 0.08 1.49 -1.30 0.00 0.00 177.93 178.85 3dfz h GLU 174 N 0.51 0.20 -0.39 5.26 4.57 -1.07 -1.55 114.58 122.11 3dfz h GLU 174 Ca 0.08 -0.02 -0.10 0.00 -1.18 0.00 0.00 59.36 58.14 3dfz h GLU 174 Cb 0.64 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.18 3dfz h GLU 174 CO 0.05 0.21 -0.15 -0.07 -1.18 0.00 0.00 179.01 177.87 3dfz h LEU 175 N 0.13 0.72 -0.53 1.64 3.38 -0.68 -2.18 115.31 117.79 3dfz h LEU 175 Ca 0.05 -0.22 -0.15 0.00 0.09 0.00 0.00 57.88 57.65 3dfz h LEU 175 Cb 0.07 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3dfz h LEU 175 CO -0.01 0.88 -0.45 -0.07 0.09 0.00 0.00 178.44 178.87 3dfz h LEU 176 N 0.65 0.74 -0.44 1.67 3.38 -1.04 -3.19 115.31 117.07 3dfz h LEU 176 Ca 0.11 -0.36 -0.14 0.00 0.09 0.00 0.00 57.88 57.58 3dfz h LEU 176 Cb 0.62 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3dfz h LEU 176 CO 0.04 1.08 -0.26 0.74 0.09 0.00 0.00 178.44 180.14 3dfz h THR 177 N 0.55 1.27 -0.80 0.22 2.02 -1.23 -3.35 112.91 111.60 3dfz h THR 177 Ca 0.03 -1.42 0.10 0.00 0.77 0.00 0.00 66.41 65.89 3dfz h THR 177 Cb 1.00 1.22 -0.07 0.00 -1.74 0.00 0.00 68.15 68.56 3dfz h THR 177 CO 0.09 0.49 0.44 -0.08 0.37 0.00 0.00 175.52 176.83 3dfz h GLU 178 N 0.80 0.72 -0.04 6.66 4.57 -1.37 -2.84 114.58 123.07 3dfz h GLU 178 Ca 0.09 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 3dfz h GLU 178 Cb 0.84 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 29.27 3dfz h GLU 178 CO 0.07 0.47 0.00 0.44 -1.18 0.00 0.00 179.01 178.82 3dfz n ILE 179 N -4.78 0.06 -3.54 2.32 -5.35 -1.24 -4.39 119.36 102.44 3dfz n ILE 179 Ca 0.13 -0.07 -0.39 0.00 -0.27 0.00 0.00 62.75 62.15 3dfz n ILE 179 Cb 0.28 -0.08 -0.04 0.00 -1.74 0.00 0.00 39.64 38.06 3dfz n ILE 179 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3dfz s ILE 180 N -1.94 4.90 0.23 7.28 -1.09 -1.07 -4.75 121.20 124.76 3dfz s ILE 180 Ca 0.18 -3.70 -0.22 0.00 -2.23 0.00 0.00 60.65 54.67 3dfz s ILE 180 Cb 0.09 -4.00 0.04 0.00 -1.58 0.00 0.00 42.46 37.00 3dfz s ILE 180 CO 0.14 -1.12 0.81 1.51 -1.23 0.00 0.00 174.94 175.05 3dfz s ASP 181 N 0.36 -0.22 0.47 3.58 1.47 -1.26 -5.04 116.67 116.02 3dfz s ASP 181 Ca 0.28 -0.54 0.18 0.00 1.18 0.00 0.00 52.55 53.65 3dfz s ASP 181 Cb -0.08 0.64 1.17 0.00 -0.34 0.00 0.00 42.92 44.31 3dfz s ASP 181 CO -0.11 -1.18 1.98 0.44 0.68 0.00 0.00 175.17 176.97 3dfz h ASP 182 N 2.00 0.23 0.15 2.11 3.32 -1.98 -2.30 116.42 119.95 3dfz h ASP 182 Ca -0.21 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.73 3dfz h ASP 182 Cb 1.24 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.74 3dfz h ASP 182 CO 0.24 0.13 -0.41 -0.61 -1.72 0.00 0.00 179.24 176.88 3dfz h GLN 183 N 0.25 0.33 -0.06 3.56 4.15 -1.96 0.10 115.11 121.49 3dfz h GLN 183 Ca 0.28 -0.16 -0.14 0.00 0.77 0.00 0.00 58.65 59.40 3dfz h GLN 183 Cb 0.76 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.44 3dfz h GLN 183 CO -0.06 0.69 -0.59 1.88 -1.93 0.00 0.00 178.83 178.82 3dfz h TYR 184 N 0.28 0.24 -0.07 3.99 -1.99 -1.71 -1.45 116.97 116.26 3dfz h TYR 184 Ca 0.03 -0.09 -0.15 0.00 2.00 0.00 0.00 58.73 60.52 3dfz h TYR 184 Cb 0.84 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 39.51 3dfz h TYR 184 CO 0.02 0.73 -0.61 -0.09 -0.00 0.00 0.00 178.16 178.21 3dfz h ARG 185 N 0.14 0.23 0.00 4.88 2.43 -1.24 -3.37 114.38 117.46 3dfz h ARG 185 Ca -0.01 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 3dfz h ARG 185 Cb 1.08 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 3dfz h ARG 185 CO 0.09 0.77 -0.00 1.28 -1.51 0.00 0.00 179.97 180.60 3dfz n LEU 186 N -3.86 1.97 -3.83 3.80 4.77 0.29 -4.80 117.00 115.34 3dfz n LEU 186 Ca -0.02 -2.05 -0.27 0.00 -0.03 0.00 0.00 56.01 53.64 3dfz n LEU 186 Cb 0.62 -0.04 -0.17 0.00 -2.33 0.00 0.00 43.42 41.50 3dfz n LEU 186 CO 0.44 0.51 -0.40 -0.55 -1.33 0.00 0.00 177.39 176.06 3dfz s SER 187 N -1.16 2.60 0.17 -1.43 0.15 -0.55 -5.00 113.70 108.49 3dfz s SER 187 Ca 0.03 -0.59 -0.03 0.00 0.70 0.00 0.00 55.95 56.07 3dfz s SER 187 Cb 0.03 -0.74 0.05 0.00 -1.71 0.00 0.00 66.02 63.65 3dfz s SER 187 CO 0.00 -0.22 1.44 -0.07 1.20 0.00 0.00 173.24 175.59 3dfz h LEU 188 N 8.19 0.54 -0.29 3.45 3.38 -1.88 -2.62 115.31 126.07 3dfz h LEU 188 Ca -0.21 -0.34 0.05 0.00 0.09 0.00 0.00 57.88 57.47 3dfz h LEU 188 Cb 1.12 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.66 3dfz h LEU 188 CO 0.36 1.08 -0.01 0.58 0.09 0.00 0.00 178.44 180.54 3dfz h VAL 189 N 0.32 0.78 -0.26 1.22 2.07 -1.95 0.16 116.25 118.59 3dfz h VAL 189 Ca -0.03 -0.03 0.04 0.00 0.82 0.00 0.00 66.70 67.51 3dfz h VAL 189 Cb 1.28 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 31.70 3dfz h VAL 189 CO 0.12 0.01 0.01 0.50 0.02 0.00 0.00 177.57 178.23 3dfz h LYS 190 N 0.08 0.08 0.30 1.57 1.63 -1.84 0.12 116.57 118.52 3dfz h LYS 190 Ca 0.14 -0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.92 3dfz h LYS 190 Cb 0.19 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.80 3dfz h LYS 190 CO -0.24 0.06 -0.15 1.96 -3.45 0.00 0.00 179.45 177.63 3dfz h GLN 191 N 0.09 -0.39 -0.78 1.90 4.20 -1.24 -2.14 115.11 116.74 3dfz h GLN 191 Ca 0.12 0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.83 3dfz h GLN 191 Cb 0.16 0.09 -0.04 0.00 0.30 0.00 0.00 27.48 27.99 3dfz h GLN 191 CO -0.20 -0.20 0.37 0.00 -0.67 0.00 0.00 178.83 178.13 3dfz h ARG 192 N -0.50 1.13 -0.33 1.46 3.08 -0.42 -0.69 114.38 118.10 3dfz h ARG 192 Ca -0.04 -0.16 -0.11 0.00 0.07 0.00 0.00 59.98 59.73 3dfz h ARG 192 Cb 0.37 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 3dfz h ARG 192 CO 0.07 0.87 -0.25 0.93 -1.07 0.00 0.00 179.97 180.52 3dfz h GLU 193 N 1.12 0.67 -0.45 0.04 5.08 -1.00 -1.46 114.58 118.57 3dfz h GLU 193 Ca 0.27 -0.27 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 3dfz h GLU 193 Cb 0.12 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 3dfz h GLU 193 CO -0.03 0.86 0.12 0.35 -1.00 0.00 0.00 179.01 179.30 3dfz h PHE 194 N 0.58 0.75 -0.46 4.33 3.57 -0.85 -1.37 116.94 123.49 3dfz h PHE 194 Ca 0.08 -0.09 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 3dfz h PHE 194 Cb 0.73 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.24 3dfz h PHE 194 CO 0.03 0.69 0.19 -0.07 -2.23 0.00 0.00 178.31 176.92 3dfz h LEU 195 N 0.59 0.58 -0.30 0.59 3.38 -0.98 -1.96 115.31 117.21 3dfz h LEU 195 Ca 0.14 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 3dfz h LEU 195 Cb 0.31 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 3dfz h LEU 195 CO 0.00 0.53 0.09 1.56 0.09 0.00 0.00 178.44 180.71 3dfz h GLN 196 N 0.64 0.47 -0.15 1.13 4.20 -1.10 -2.68 115.11 117.63 3dfz h GLN 196 Ca 0.16 -0.10 0.05 0.00 0.06 0.00 0.00 58.65 58.81 3dfz h GLN 196 Cb 0.12 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 27.78 3dfz h GLN 196 CO -0.02 0.53 -0.18 0.37 -0.67 0.00 0.00 178.83 178.86 3dfz h GLN 197 N 0.33 -0.20 0.00 1.46 4.15 -0.80 -3.00 115.11 117.04 3dfz h GLN 197 Ca 0.10 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.53 3dfz h GLN 197 Cb 0.26 0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.99 3dfz h GLN 197 CO -0.00 -0.14 0.00 0.44 -1.93 0.00 0.00 178.83 177.20 3dfz n ILE 198 N -5.32 0.37 0.16 2.39 -5.35 -0.78 -2.63 119.36 108.21 3dfz n ILE 198 Ca -0.02 -0.11 0.04 0.00 -0.27 0.00 0.00 62.75 62.38 3dfz n ILE 198 Cb 0.24 -0.60 0.16 0.00 -1.74 0.00 0.00 39.64 37.70 3dfz n ILE 198 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 3dfz h GLU 199 N 0.00 0.00 0.00 6.28 4.22 -1.33 -3.10 114.58 120.65 3dfz h GLU 199 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 3dfz h GLU 199 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 3dfz h GLU 199 CO 0.00 0.46 -0.14 0.87 -2.18 0.00 0.00 179.01 178.02 3dfz h LYS 200 N 0.00 0.00 0.00 1.92 1.57 -1.50 -3.52 116.57 115.05 3dfz h LYS 200 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3dfz h LYS 200 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.50 3dfz h LYS 200 CO 0.06 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.60