#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x0g h GLU 7 N 0.00 0.16 -0.46 3.49 5.08 -2.07 -3.33 114.58 117.45 2x0g h GLU 7 Ca 0.00 -0.27 -0.10 0.00 -1.00 0.00 0.00 59.36 57.99 2x0g h GLU 7 Cb 0.00 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2x0g h GLU 7 CO 0.00 1.05 -0.13 1.96 -1.00 0.00 0.00 179.01 180.89 2x0g h GLN 8 N 0.04 0.85 -0.55 2.33 7.50 -2.05 -2.62 115.11 120.60 2x0g h GLN 8 Ca -0.14 -0.30 0.11 0.00 0.50 0.00 0.00 58.65 58.81 2x0g h GLN 8 Cb 1.93 -0.06 -0.11 0.00 0.05 0.00 0.00 27.48 29.29 2x0g h GLN 8 CO 0.16 0.93 -0.17 0.82 -1.50 0.00 0.00 178.83 179.07 2x0g h ILE 9 N 0.76 0.39 -1.01 2.54 2.04 -1.99 0.33 117.51 120.57 2x0g h ILE 9 Ca 0.12 0.00 0.27 0.00 1.00 0.00 0.00 64.86 66.25 2x0g h ILE 9 Cb 0.64 0.39 -0.13 0.00 -0.74 0.00 0.00 36.82 36.99 2x0g h ILE 9 CO 0.04 0.00 0.60 0.00 0.00 0.00 0.00 178.15 178.79 2x0g h ALA 10 N 1.47 1.88 0.07 1.87 0.00 -1.59 0.15 119.26 123.11 2x0g h ALA 10 Ca 0.26 0.14 -0.13 0.00 0.00 0.00 0.00 54.91 55.18 2x0g h ALA 10 Cb 0.44 0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.31 2x0g h ALA 10 CO -0.59 -0.40 -0.56 0.93 0.00 0.00 0.00 179.25 178.64 2x0g h GLU 11 N 0.48 0.25 0.00 0.00 5.08 -1.02 -3.10 114.58 116.27 2x0g h GLU 11 Ca 0.67 -0.36 -0.04 0.00 -1.00 0.00 0.00 59.36 58.63 2x0g h GLU 11 Cb 1.40 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.77 2x0g h GLU 11 CO -0.51 1.13 -0.21 0.74 -1.00 0.00 0.00 179.01 179.16 2x0g h PHE 12 N -0.45 0.00 -0.42 4.33 0.04 -0.60 -2.46 116.94 117.38 2x0g h PHE 12 Ca -0.09 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.55 2x0g h PHE 12 Cb 1.38 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.52 2x0g h PHE 12 CO 0.20 0.21 -0.25 0.87 -0.60 0.00 0.00 178.31 178.74 2x0g h LYS 13 N 0.00 0.91 -0.06 1.51 1.57 -0.77 -2.62 116.57 117.11 2x0g h LYS 13 Ca -0.00 -0.42 -0.19 0.00 -1.87 0.00 0.00 60.65 58.17 2x0g h LYS 13 Cb 0.40 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 2x0g h LYS 13 CO 0.03 1.07 -0.75 1.05 -0.57 0.00 0.00 179.45 180.28 2x0g h GLU 14 N 0.74 0.38 0.74 3.15 4.11 -1.42 -3.07 114.58 119.21 2x0g h GLU 14 Ca 0.09 -0.32 -0.04 0.00 0.07 0.00 0.00 59.36 59.16 2x0g h GLU 14 Cb 0.82 0.07 0.01 0.00 0.50 0.00 0.00 28.75 30.15 2x0g h GLU 14 CO 0.07 0.97 -0.36 0.00 0.07 0.00 0.00 179.01 179.76 2x0g h ALA 15 N 0.94 -0.99 -0.92 1.06 0.00 -1.50 -3.00 119.26 114.84 2x0g h ALA 15 Ca -0.03 -0.23 0.31 0.00 0.00 0.00 0.00 54.91 54.96 2x0g h ALA 15 Cb 1.33 0.38 -0.17 0.00 0.00 0.00 0.00 17.79 19.34 2x0g h ALA 15 CO 0.13 -0.96 0.23 0.34 0.00 0.00 0.00 179.25 178.99 2x0g n PHE 16 N -5.45 0.80 -0.10 0.00 -0.00 -0.99 -1.00 117.46 110.72 2x0g n PHE 16 Ca -0.13 1.10 -0.08 0.00 -0.00 0.00 0.00 57.45 58.35 2x0g n PHE 16 Cb 0.40 -1.33 0.00 0.00 -0.00 0.00 0.00 39.48 38.56 2x0g n PHE 16 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.76 177.53 2x0g h SER 17 N 0.00 0.28 0.71 -2.13 0.02 -1.42 0.13 113.55 111.13 2x0g h SER 17 Ca 0.66 0.01 -0.19 0.00 -0.84 0.00 0.00 61.79 61.43 2x0g h SER 17 Cb 1.56 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 64.04 2x0g h SER 17 CO -0.80 0.20 -0.88 0.25 -1.14 0.00 0.00 176.83 174.47 2x0g h LEU 18 N 0.37 0.14 -0.61 5.07 5.85 -1.06 -3.02 115.31 122.05 2x0g h LEU 18 Ca 0.14 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2x0g h LEU 18 Cb 0.04 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 2x0g h LEU 18 CO -0.09 0.94 0.34 -0.26 -0.34 0.00 0.00 178.44 179.04 2x0g h PHE 19 N 0.06 0.83 -0.41 1.25 0.04 -1.24 -3.30 116.94 114.17 2x0g h PHE 19 Ca -0.03 -0.02 -0.71 0.00 2.80 0.00 0.00 57.97 60.01 2x0g h PHE 19 Cb 1.52 -0.27 -0.06 0.00 2.20 0.00 0.00 35.95 39.35 2x0g h PHE 19 CO 0.02 0.59 3.01 -3.47 -0.60 0.00 0.00 178.31 177.86 2x0g n ASP 20 N -4.58 5.73 -0.29 2.17 4.64 0.44 -4.60 116.55 120.07 2x0g n ASP 20 Ca 0.04 -2.86 0.11 0.00 -1.38 0.00 0.00 54.79 50.69 2x0g n ASP 20 Cb 0.08 -1.57 0.27 0.00 -1.04 0.00 0.00 41.12 38.86 2x0g n ASP 20 CO 0.00 0.00 0.00 0.50 -0.82 0.00 0.00 177.20 176.88 2x0g h LYS 21 N 5.56 0.37 0.00 -0.67 3.64 -1.69 0.30 116.57 124.08 2x0g h LYS 21 Ca 0.62 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.98 2x0g h LYS 21 Cb 0.52 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 2x0g h LYS 21 CO 1.77 0.24 -0.52 -0.40 -2.27 0.00 0.00 179.45 178.27 2x0g n ASP 22 N -5.07 0.59 -1.56 4.20 3.85 -1.26 -4.96 116.55 112.34 2x0g n ASP 22 Ca 0.20 0.05 -0.13 0.00 -0.71 0.00 0.00 54.79 54.19 2x0g n ASP 22 Cb 0.59 0.11 -0.00 0.00 -1.35 0.00 0.00 41.12 40.46 2x0g n ASP 22 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2x0g n GLY 23 N 1.40 -0.17 0.05 6.12 0.00 0.09 -4.90 105.19 107.79 2x0g n GLY 23 Ca 0.04 -0.32 0.13 0.00 0.00 0.00 0.00 46.02 45.88 2x0g n GLY 23 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2x0g n ASP 24 N -0.58 0.39 0.00 1.61 5.68 -1.26 -4.93 116.55 117.46 2x0g n ASP 24 Ca -0.15 -0.19 0.00 0.00 -0.50 0.00 0.00 54.79 53.95 2x0g n ASP 24 Cb 0.62 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.52 2x0g n ASP 24 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2x0g n GLY 25 N 1.42 0.95 2.92 6.12 0.00 -1.26 -5.10 105.19 110.24 2x0g n GLY 25 Ca 0.09 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.00 2x0g n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2x0g s THR 26 N -2.00 0.02 -0.30 2.61 -4.23 -1.26 -4.36 115.64 106.12 2x0g s THR 26 Ca 0.00 -0.13 -0.21 0.00 -1.18 0.00 0.00 61.69 60.17 2x0g s THR 26 Cb 0.00 -0.10 -0.01 0.00 1.34 0.00 0.00 72.50 73.74 2x0g s THR 26 CO 0.00 -0.07 0.66 -0.63 -0.54 0.00 0.00 174.62 174.04 2x0g s ILE 27 N -0.20 4.92 0.59 2.99 1.01 0.16 -4.83 121.20 125.84 2x0g s ILE 27 Ca -0.02 0.96 -0.05 0.00 0.00 0.00 0.00 60.65 61.54 2x0g s ILE 27 Cb -0.02 -4.01 0.01 0.00 0.01 0.00 0.00 42.46 38.45 2x0g s ILE 27 CO -0.00 -0.13 0.89 0.42 0.00 0.00 0.00 174.94 176.12 2x0g s THR 28 N 2.65 3.57 0.16 2.92 -4.23 -1.26 -1.12 115.64 118.32 2x0g s THR 28 Ca 0.27 -0.06 0.23 0.00 -1.18 0.00 0.00 61.69 60.95 2x0g s THR 28 Cb -0.15 -3.42 0.21 0.00 1.34 0.00 0.00 72.50 70.49 2x0g s THR 28 CO 0.11 -0.42 1.82 0.71 -0.54 0.00 0.00 174.62 176.30 2x0g h THR 29 N -0.16 0.64 -0.19 3.99 1.35 -1.93 0.12 112.91 116.73 2x0g h THR 29 Ca -0.45 -1.18 -0.14 0.00 -0.55 0.00 0.00 66.41 64.08 2x0g h THR 29 Cb 1.26 1.78 -0.01 0.00 -1.73 0.00 0.00 68.15 69.45 2x0g h THR 29 CO 0.60 0.25 -0.48 0.50 -0.25 0.00 0.00 175.52 176.14 2x0g h LYS 30 N 0.00 0.50 -0.03 4.72 3.11 -1.98 -1.86 116.57 121.03 2x0g h LYS 30 Ca -0.00 -0.28 -0.22 0.00 -2.81 0.00 0.00 60.65 57.34 2x0g h LYS 30 Cb 0.76 0.02 0.02 0.00 -1.00 0.00 0.00 32.23 32.02 2x0g h LYS 30 CO 0.03 0.87 -0.83 0.93 -2.81 0.00 0.00 179.45 177.64 2x0g h GLU 31 N 0.40 0.62 -0.42 1.90 5.08 -1.82 -3.11 114.58 117.23 2x0g h GLU 31 Ca 0.02 -0.62 -0.02 0.00 -1.00 0.00 0.00 59.36 57.74 2x0g h GLU 31 Cb 0.99 0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.38 2x0g h GLU 31 CO 0.09 1.23 0.19 1.25 -1.00 0.00 0.00 179.01 180.77 2x0g h LEU 32 N 0.25 0.53 -0.23 1.33 5.85 -0.95 -2.08 115.31 120.00 2x0g h LEU 32 Ca -0.09 -0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.53 2x0g h LEU 32 Cb 1.50 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.39 2x0g h LEU 32 CO 0.17 0.46 -0.04 1.23 -0.34 0.00 0.00 178.44 179.92 2x0g h GLY 33 N 0.72 0.48 1.87 3.75 0.00 -1.39 -2.71 103.07 105.79 2x0g h GLY 33 Ca 0.15 -0.38 -0.13 0.00 0.00 0.00 0.00 47.33 46.96 2x0g h GLY 33 CO -0.02 0.35 -0.59 -0.91 0.00 0.00 0.00 176.54 175.37 2x0g h THR 34 N 0.18 1.40 -0.94 4.70 1.35 -1.44 0.83 112.91 118.98 2x0g h THR 34 Ca 0.06 -1.98 0.10 0.00 -0.55 0.00 0.00 66.41 64.04 2x0g h THR 34 Cb 0.49 2.03 -0.08 0.00 -1.73 0.00 0.00 68.15 68.86 2x0g h THR 34 CO 0.02 0.58 0.58 0.58 -0.25 0.00 0.00 175.52 177.03 2x0g h VAL 35 N 0.10 0.96 0.00 6.82 2.07 -1.42 -2.47 116.25 122.30 2x0g h VAL 35 Ca -0.00 -0.33 -0.15 0.00 0.82 0.00 0.00 66.70 67.03 2x0g h VAL 35 Cb 1.07 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 2x0g h VAL 35 CO 0.08 0.18 -1.03 0.24 0.02 0.00 0.00 177.57 177.07 2x0g h MET 36 N 0.98 0.00 -0.61 1.57 2.86 -1.05 -2.94 114.93 115.74 2x0g h MET 36 Ca 0.45 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 58.14 2x0g h MET 36 Cb 0.36 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.97 2x0g h MET 36 CO -0.23 0.44 0.33 -0.09 1.06 0.00 0.00 176.91 178.41 2x0g h ARG 37 N 0.00 0.59 0.00 1.72 1.12 -0.75 -0.62 114.38 116.44 2x0g h ARG 37 Ca -0.09 -0.04 0.00 0.00 -1.11 0.00 0.00 59.98 58.74 2x0g h ARG 37 Cb 1.53 -0.13 0.00 0.00 -0.01 0.00 0.00 29.97 31.36 2x0g h ARG 37 CO 0.06 0.39 0.00 0.66 -3.11 0.00 0.00 179.97 177.97 2x0g h SER 38 N 0.61 0.00 -0.17 -3.80 4.64 -1.41 -1.92 113.55 111.50 2x0g h SER 38 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 2x0g h SER 38 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2x0g h SER 38 CO -0.18 0.00 0.00 -0.11 -0.87 0.00 0.00 176.83 175.67 2x0g n LEU 39 N -2.56 1.16 0.00 5.97 0.00 -1.12 -4.90 117.00 115.55 2x0g n LEU 39 Ca 0.04 -0.53 0.00 0.00 0.00 0.00 0.00 56.01 55.52 2x0g n LEU 39 Cb 0.41 -0.11 0.00 0.00 0.00 0.00 0.00 43.42 43.72 2x0g n LEU 39 CO 0.29 0.27 0.00 0.61 0.00 0.00 0.00 177.39 178.56 2x0g n GLY 40 N 0.94 1.21 3.88 -3.96 0.00 -0.72 -4.70 105.19 101.85 2x0g n GLY 40 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 2x0g n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2x0g s GLN 41 N -0.54 1.68 -0.36 1.61 1.11 -0.25 -4.98 119.66 117.92 2x0g s GLN 41 Ca 0.00 0.09 0.13 0.00 0.01 0.00 0.00 55.36 55.59 2x0g s GLN 41 Cb 0.00 -1.92 0.42 0.00 -1.01 0.00 0.00 33.01 30.50 2x0g s GLN 41 CO 0.00 -1.79 1.11 -1.71 0.01 0.00 0.00 175.29 172.91 2x0g n ASN 42 N -3.44 -0.17 -4.84 5.90 2.85 -1.26 -3.93 115.26 110.36 2x0g n ASN 42 Ca 0.08 -2.69 -0.29 0.00 -0.11 0.00 0.00 54.58 51.57 2x0g n ASN 42 Cb 0.61 0.23 0.11 0.00 1.24 0.00 0.00 39.78 41.96 2x0g n ASN 42 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 2x0g s PRO 43 N -1.54 1.70 0.31 1.20 0.04 -1.26 -5.06 135.00 130.39 2x0g s PRO 43 Ca 0.26 0.25 0.07 0.00 0.04 0.00 0.00 61.00 61.62 2x0g s PRO 43 Cb 0.42 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 33.03 2x0g s PRO 43 CO -0.03 -1.81 0.31 0.95 0.04 0.00 0.00 177.00 176.47 2x0g s THR 44 N -3.41 3.95 0.36 1.26 -4.23 -1.26 -4.96 115.64 107.35 2x0g s THR 44 Ca 0.62 -1.27 0.09 0.00 -1.18 0.00 0.00 61.69 59.95 2x0g s THR 44 Cb -0.13 -3.32 0.32 0.00 1.34 0.00 0.00 72.50 70.71 2x0g s THR 44 CO 0.51 -0.22 1.88 -0.08 -0.54 0.00 0.00 174.62 176.18 2x0g h GLU 45 N 1.22 0.65 -0.37 3.99 4.57 -1.98 0.23 114.58 122.89 2x0g h GLU 45 Ca -0.46 -0.04 -0.06 0.00 -1.18 0.00 0.00 59.36 57.62 2x0g h GLU 45 Cb 1.25 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.67 2x0g h GLU 45 CO 0.58 0.43 -0.02 0.00 -1.18 0.00 0.00 179.01 178.81 2x0g h ALA 46 N 1.60 1.27 0.17 2.92 0.00 -2.00 -0.17 119.26 123.05 2x0g h ALA 46 Ca 0.42 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2x0g h ALA 46 Cb 0.68 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2x0g h ALA 46 CO -0.18 0.49 -0.08 0.93 0.00 0.00 0.00 179.25 180.40 2x0g h GLU 47 N 0.56 -0.22 -0.89 0.00 4.39 -1.40 -3.14 114.58 113.88 2x0g h GLU 47 Ca 0.11 0.01 0.21 0.00 0.34 0.00 0.00 59.36 60.04 2x0g h GLU 47 Cb 0.39 0.05 -0.12 0.00 -0.10 0.00 0.00 28.75 28.97 2x0g h GLU 47 CO 0.02 0.18 0.40 -0.07 -1.16 0.00 0.00 179.01 178.38 2x0g h LEU 48 N -0.72 0.35 -0.51 1.33 3.38 -0.97 -2.36 115.31 115.81 2x0g h LEU 48 Ca -0.02 0.15 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 2x0g h LEU 48 Cb 0.50 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2x0g h LEU 48 CO 0.04 0.03 -0.19 -0.61 0.09 0.00 0.00 178.44 177.79 2x0g h GLN 49 N 0.43 1.01 -0.32 1.13 5.75 -1.08 -2.39 115.11 119.64 2x0g h GLN 49 Ca 0.54 -0.42 -0.00 0.00 -0.15 0.00 0.00 58.65 58.62 2x0g h GLN 49 Cb 1.00 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.50 2x0g h GLN 49 CO -0.51 1.10 0.18 -0.44 -2.65 0.00 0.00 178.83 176.52 2x0g h ASP 50 N 0.87 0.39 -0.22 -0.69 3.32 -1.39 0.25 116.42 118.96 2x0g h ASP 50 Ca 0.12 -0.07 0.03 0.00 0.02 0.00 0.00 57.03 57.12 2x0g h ASP 50 Cb 0.77 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.20 2x0g h ASP 50 CO 0.06 0.35 0.06 0.24 -1.72 0.00 0.00 179.24 178.22 2x0g h MET 51 N 0.40 0.15 -0.76 3.56 2.86 -1.34 -0.24 114.93 119.56 2x0g h MET 51 Ca 0.11 -0.01 0.06 0.00 -2.06 0.00 0.00 59.70 57.80 2x0g h MET 51 Cb 0.04 -0.03 -0.06 0.00 0.06 0.00 0.00 31.60 31.61 2x0g h MET 51 CO -0.02 0.10 0.45 0.82 1.06 0.00 0.00 176.91 179.32 2x0g h ILE 52 N 0.15 1.02 0.00 -1.22 1.08 -1.25 -3.20 117.51 114.09 2x0g h ILE 52 Ca 0.10 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 64.28 2x0g h ILE 52 Cb 0.09 0.11 0.00 0.00 -3.07 0.00 0.00 36.82 33.95 2x0g h ILE 52 CO -0.12 0.15 0.00 0.78 -0.69 0.00 0.00 178.15 178.27 2x0g h ASN 53 N 0.84 0.00 -0.00 1.72 4.21 0.14 0.87 115.58 123.36 2x0g h ASN 53 Ca 0.33 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.84 2x0g h ASN 53 Cb 0.16 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.36 2x0g h ASN 53 CO -0.17 0.00 -0.15 -1.84 -1.29 0.00 0.00 177.43 173.98 2x0g n GLU 54 N -2.41 4.28 0.12 0.81 0.28 -1.10 -4.28 120.64 118.34 2x0g n GLU 54 Ca -0.00 -0.18 0.00 0.00 -0.16 0.00 0.00 57.16 56.82 2x0g n GLU 54 Cb 0.13 -0.78 -0.01 0.00 1.43 0.00 0.00 31.44 32.20 2x0g n GLU 54 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 2x0g h VAL 55 N 0.21 1.06 -0.56 3.84 2.07 -1.48 -3.42 116.25 117.96 2x0g h VAL 55 Ca 0.00 -2.50 -0.52 0.00 0.82 0.00 0.00 66.70 64.50 2x0g h VAL 55 Cb 0.12 2.52 -0.05 0.00 -1.52 0.00 0.00 31.29 32.36 2x0g h VAL 55 CO 0.00 0.60 1.75 -0.67 0.02 0.00 0.00 177.57 179.27 2x0g n ASP 56 N -3.25 3.83 0.11 0.57 2.03 0.27 -4.79 116.55 115.32 2x0g n ASP 56 Ca 0.01 -2.79 -0.13 0.00 0.52 0.00 0.00 54.79 52.40 2x0g n ASP 56 Cb 0.79 -1.69 -0.07 0.00 -0.72 0.00 0.00 41.12 39.43 2x0g n ASP 56 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2x0g h ALA 57 N 8.49 -0.21 -0.35 -1.67 0.00 -1.89 -2.87 119.26 120.76 2x0g h ALA 57 Ca 0.35 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.11 2x0g h ALA 57 Cb 0.87 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2x0g h ALA 57 CO 1.42 -0.63 -0.23 0.38 0.00 0.00 0.00 179.25 180.19 2x0g h ASP 58 N -0.23 0.70 0.00 0.00 3.04 -1.94 -3.48 116.42 114.52 2x0g h ASP 58 Ca -0.01 -0.25 0.00 0.00 -3.24 0.00 0.00 57.03 53.53 2x0g h ASP 58 Cb 0.20 -0.19 0.00 0.00 -1.04 0.00 0.00 39.33 38.30 2x0g h ASP 58 CO -0.00 0.92 0.00 0.61 -2.04 0.00 0.00 179.24 178.73 2x0g n GLY 59 N -0.27 1.61 1.40 7.15 0.00 -1.08 -5.02 105.19 108.97 2x0g n GLY 59 Ca -0.00 -0.19 0.10 0.00 0.00 0.00 0.00 46.02 45.93 2x0g n GLY 59 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2x0g n ASN 60 N 0.42 4.10 0.00 1.61 0.23 -1.26 -4.96 115.26 115.40 2x0g n ASN 60 Ca 0.00 -2.21 0.00 0.00 -0.53 0.00 0.00 54.58 51.84 2x0g n ASN 60 Cb 0.10 -0.51 0.00 0.00 -2.08 0.00 0.00 39.78 37.29 2x0g n ASN 60 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2x0g n GLY 61 N 1.35 0.73 3.22 4.83 0.00 -1.26 -5.02 105.19 109.04 2x0g n GLY 61 Ca 0.24 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.16 2x0g n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2x0g s THR 62 N -2.88 0.11 -0.26 2.61 -4.23 -1.26 -4.62 115.64 105.11 2x0g s THR 62 Ca 0.00 -1.63 -0.09 0.00 -1.18 0.00 0.00 61.69 58.79 2x0g s THR 62 Cb 0.00 -1.84 -0.04 0.00 1.34 0.00 0.00 72.50 71.96 2x0g s THR 62 CO 0.00 -0.48 0.13 -0.63 -0.54 0.00 0.00 174.62 173.10 2x0g s ILE 63 N -3.98 4.87 0.62 2.99 -1.09 -0.28 -4.75 121.20 119.58 2x0g s ILE 63 Ca 0.18 0.02 0.07 0.00 -2.23 0.00 0.00 60.65 58.68 2x0g s ILE 63 Cb 0.06 -3.29 0.10 0.00 -1.58 0.00 0.00 42.46 37.75 2x0g s ILE 63 CO -0.02 0.31 0.85 1.51 -1.23 0.00 0.00 174.94 176.37 2x0g s ASP 64 N 1.53 4.87 0.01 3.58 1.47 -1.26 0.38 116.67 127.24 2x0g s ASP 64 Ca 0.06 -0.73 -0.25 0.00 1.18 0.00 0.00 52.55 52.82 2x0g s ASP 64 Cb -0.15 0.24 -0.18 0.00 -0.34 0.00 0.00 42.92 42.48 2x0g s ASP 64 CO 0.07 -1.50 1.36 0.15 0.68 0.00 0.00 175.17 175.92 2x0g h PHE 65 N -0.03 -0.09 -0.88 2.11 3.04 -1.99 0.11 116.94 119.21 2x0g h PHE 65 Ca -0.31 -0.00 0.24 0.00 3.98 0.00 0.00 57.97 61.87 2x0g h PHE 65 Cb 1.28 0.03 -0.14 0.00 2.56 0.00 0.00 35.95 39.68 2x0g h PHE 65 CO 0.25 0.26 0.24 -1.35 -2.02 0.00 0.00 178.31 175.69 2x0g h PRO 66 N -0.45 0.20 -0.23 6.41 0.11 -1.97 0.69 132.00 136.77 2x0g h PRO 66 Ca -0.01 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.99 2x0g h PRO 66 Cb 0.39 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.45 2x0g h PRO 66 CO 0.02 0.13 -0.23 0.93 -0.21 0.00 0.00 178.00 178.63 2x0g h GLU 67 N 0.20 0.56 -0.66 1.05 5.08 -1.82 -2.05 114.58 116.94 2x0g h GLU 67 Ca 0.56 -0.30 0.04 0.00 -1.00 0.00 0.00 59.36 58.66 2x0g h GLU 67 Cb 1.13 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.35 2x0g h GLU 67 CO -0.66 0.89 0.40 0.35 -1.00 0.00 0.00 179.01 178.98 2x0g h PHE 68 N 0.25 0.74 -0.06 4.33 3.57 0.48 -2.82 116.94 123.43 2x0g h PHE 68 Ca 0.04 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.46 2x0g h PHE 68 Cb 0.79 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.28 2x0g h PHE 68 CO 0.08 0.40 -0.42 1.25 -2.23 0.00 0.00 178.31 177.38 2x0g h LEU 69 N 0.76 0.13 -0.59 0.59 6.46 0.37 -2.92 115.31 120.11 2x0g h LEU 69 Ca 0.27 -0.06 -0.03 0.00 -0.12 0.00 0.00 57.88 57.95 2x0g h LEU 69 Cb 0.07 -0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 39.96 2x0g h LEU 69 CO -0.13 0.55 -0.15 0.71 -0.62 0.00 0.00 178.44 178.80 2x0g h THR 70 N 0.11 0.30 -1.43 1.05 1.35 -1.13 -3.36 112.91 109.79 2x0g h THR 70 Ca 0.01 -1.15 -0.61 0.00 -0.55 0.00 0.00 66.41 64.10 2x0g h THR 70 Cb 0.80 1.92 -0.11 0.00 -1.73 0.00 0.00 68.15 69.02 2x0g h THR 70 CO 0.06 0.15 1.35 -0.32 -0.25 0.00 0.00 175.52 176.50 2x0g s MET 71 N -3.37 3.56 -0.03 4.72 -2.45 -1.10 -4.80 119.30 115.82 2x0g s MET 71 Ca 0.04 -1.16 -0.03 0.00 -1.25 0.00 0.00 55.69 53.28 2x0g s MET 71 Cb 0.08 -5.19 -0.01 0.00 1.25 0.00 0.00 34.83 30.96 2x0g s MET 71 CO 0.65 -2.13 -0.07 0.00 1.05 0.00 0.00 175.02 174.52 2x0g n MET 72 N 8.53 0.10 -3.63 4.11 0.00 -1.26 -4.97 117.12 120.00 2x0g n MET 72 Ca 0.29 0.04 -0.37 0.00 0.00 0.00 0.00 57.70 57.65 2x0g n MET 72 Cb 0.50 -0.63 -0.06 0.00 0.00 0.00 0.00 33.22 33.03 2x0g n MET 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2x0g s ALA 73 N -2.87 3.74 0.00 3.17 0.00 -1.26 -5.19 121.76 119.35 2x0g s ALA 73 Ca -0.05 -0.38 -0.30 0.00 0.00 0.00 0.00 51.96 51.22 2x0g s ALA 73 Cb 0.01 -2.25 -0.03 0.00 0.00 0.00 0.00 23.12 20.84 2x0g s ALA 73 CO 0.08 0.48 1.02 -1.21 0.00 0.00 0.00 175.76 176.12 2x0g s GLU 82 N -0.87 4.53 0.14 0.00 0.41 -1.26 -5.20 118.70 116.45 2x0g s GLU 82 Ca 0.20 1.47 -0.06 0.00 -0.41 0.00 0.00 54.97 56.18 2x0g s GLU 82 Cb -0.15 -3.45 -0.05 0.00 -1.78 0.00 0.00 34.13 28.70 2x0g s GLU 82 CO 0.09 -0.10 1.35 0.93 -0.49 0.00 0.00 175.26 177.04 2x0g h GLU 83 N 6.83 0.51 0.00 1.61 4.39 -2.06 -3.20 114.58 122.66 2x0g h GLU 83 Ca -0.40 -0.46 0.00 0.00 0.34 0.00 0.00 59.36 58.83 2x0g h GLU 83 Cb 1.21 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.98 2x0g h GLU 83 CO 0.77 1.10 0.00 -0.85 -1.16 0.00 0.00 179.01 178.87 2x0g n GLU 84 N -3.83 0.05 0.02 2.33 0.28 -1.26 -1.75 120.64 116.48 2x0g n GLU 84 Ca -0.06 0.30 -0.22 0.00 -0.16 0.00 0.00 57.16 57.02 2x0g n GLU 84 Cb 0.77 -1.50 -0.14 0.00 1.43 0.00 0.00 31.44 32.00 2x0g n GLU 84 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 2x0g h ILE 85 N 0.00 0.68 0.50 3.84 2.04 -1.97 -2.85 117.51 119.74 2x0g h ILE 85 Ca 0.00 -2.37 -0.01 0.00 1.00 0.00 0.00 64.86 63.48 2x0g h ILE 85 Cb 0.09 2.55 -0.01 0.00 -0.74 0.00 0.00 36.82 38.71 2x0g h ILE 85 CO 0.00 0.90 -0.38 -0.09 0.00 0.00 0.00 178.15 178.57 2x0g h ARG 86 N 0.07 -0.83 -0.40 2.37 2.43 -1.47 -1.21 114.38 115.34 2x0g h ARG 86 Ca -0.41 0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 58.80 2x0g h ARG 86 Cb 2.04 0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 31.76 2x0g h ARG 86 CO 0.10 -0.56 0.17 0.93 -1.51 0.00 0.00 179.97 179.11 2x0g h GLU 87 N -0.87 0.57 -0.49 0.20 5.08 -1.72 -2.14 114.58 115.21 2x0g h GLU 87 Ca -0.05 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.15 2x0g h GLU 87 Cb 0.74 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.86 2x0g h GLU 87 CO 0.00 0.46 -0.06 0.00 -1.00 0.00 0.00 179.01 178.41 2x0g h ALA 88 N 1.63 0.97 -0.62 3.43 0.00 -1.23 -2.64 119.26 120.79 2x0g h ALA 88 Ca 0.14 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.77 2x0g h ALA 88 Cb 0.10 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 2x0g h ALA 88 CO -0.02 0.62 0.38 0.35 0.00 0.00 0.00 179.25 180.58 2x0g h PHE 89 N 0.79 0.71 -0.17 0.00 3.57 -0.55 -2.38 116.94 118.92 2x0g h PHE 89 Ca 0.14 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.68 2x0g h PHE 89 Cb 0.56 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 2x0g h PHE 89 CO 0.03 0.41 0.12 0.00 -2.23 0.00 0.00 178.31 176.64 2x0g h ARG 90 N 0.75 0.13 -0.05 1.11 -0.00 -1.30 -1.36 114.38 113.66 2x0g h ARG 90 Ca 0.25 -0.01 -0.04 0.00 -0.50 0.00 0.00 59.98 59.68 2x0g h ARG 90 Cb 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 29.97 29.96 2x0g h ARG 90 CO -0.10 0.08 -0.13 0.28 0.00 0.00 0.00 179.97 180.11 2x0g h VAL 91 N 0.13 1.44 -0.21 2.04 2.07 -1.24 -3.32 116.25 117.17 2x0g h VAL 91 Ca 0.07 -1.49 0.02 0.00 0.82 0.00 0.00 66.70 66.12 2x0g h VAL 91 Cb 0.14 2.30 -0.02 0.00 -1.52 0.00 0.00 31.29 32.19 2x0g h VAL 91 CO -0.01 0.41 0.07 -0.26 0.02 0.00 0.00 177.57 177.80 2x0g h PHE 92 N -0.35 0.12 -0.64 1.57 0.04 -1.04 -3.30 116.94 113.34 2x0g h PHE 92 Ca -0.00 0.01 -0.57 0.00 2.80 0.00 0.00 57.97 60.21 2x0g h PHE 92 Cb 0.73 -0.02 -0.06 0.00 2.20 0.00 0.00 35.95 38.80 2x0g h PHE 92 CO 0.12 0.06 1.93 -3.47 -0.60 0.00 0.00 178.31 176.35 2x0g n ASP 93 N -5.05 4.18 -0.20 2.17 4.64 -0.56 -4.60 116.55 117.14 2x0g n ASP 93 Ca -0.03 -2.84 0.06 0.00 -1.38 0.00 0.00 54.79 50.61 2x0g n ASP 93 Cb 0.08 -1.71 0.33 0.00 -1.04 0.00 0.00 41.12 38.77 2x0g n ASP 93 CO 0.00 0.00 0.00 0.50 -0.82 0.00 0.00 177.20 176.88 2x0g h LYS 94 N 8.12 0.79 -0.65 -0.67 1.63 -1.78 -2.51 116.57 121.50 2x0g h LYS 94 Ca 0.39 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 60.14 2x0g h LYS 94 Cb 0.87 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 32.32 2x0g h LYS 94 CO 1.44 0.52 0.00 -0.40 -3.45 0.00 0.00 179.45 177.56 2x0g n ASP 95 N -4.48 3.83 -0.67 4.20 5.75 -1.26 -4.97 116.55 118.95 2x0g n ASP 95 Ca 0.11 -2.00 -0.09 0.00 -0.01 0.00 0.00 54.79 52.80 2x0g n ASP 95 Cb 0.21 -0.43 -0.04 0.00 -1.03 0.00 0.00 41.12 39.83 2x0g n ASP 95 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2x0g n GLY 96 N 1.60 0.95 0.09 6.12 0.00 -0.95 -4.86 105.19 108.14 2x0g n GLY 96 Ca 0.23 -0.18 0.14 0.00 0.00 0.00 0.00 46.02 46.22 2x0g n GLY 96 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2x0g n ASN 97 N -0.56 0.41 0.00 1.61 6.94 -1.26 -4.89 115.26 117.50 2x0g n ASN 97 Ca -0.09 -0.45 0.00 0.00 -0.02 0.00 0.00 54.58 54.02 2x0g n ASN 97 Cb 0.44 -0.10 0.00 0.00 -2.36 0.00 0.00 39.78 37.76 2x0g n ASN 97 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2x0g n GLY 98 N 1.31 0.60 2.90 4.83 0.00 -1.26 -5.08 105.19 108.49 2x0g n GLY 98 Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 2x0g n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2x0g s TYR 99 N -2.00 0.25 -0.26 1.61 2.02 -1.26 -4.00 117.35 113.70 2x0g s TYR 99 Ca 0.00 -0.04 -0.16 0.00 -0.37 0.00 0.00 57.07 56.50 2x0g s TYR 99 Cb 0.00 -0.18 -0.03 0.00 -0.40 0.00 0.00 41.96 41.34 2x0g s TYR 99 CO 0.00 -0.02 0.42 0.42 -1.57 0.00 0.00 175.55 174.80 2x0g s ILE 100 N 0.06 5.15 0.53 2.71 1.01 0.74 -4.74 121.20 126.66 2x0g s ILE 100 Ca -0.00 0.68 -0.02 0.00 0.00 0.00 0.00 60.65 61.30 2x0g s ILE 100 Cb -0.03 -3.74 0.01 0.00 0.01 0.00 0.00 42.46 38.72 2x0g s ILE 100 CO -0.00 0.15 0.79 -0.94 0.00 0.00 0.00 174.94 174.93 2x0g s SER 101 N 1.55 5.59 0.22 3.58 1.04 -1.26 -1.16 113.70 123.26 2x0g s SER 101 Ca 0.17 0.38 -0.08 0.00 0.48 0.00 0.00 55.95 56.90 2x0g s SER 101 Cb -0.16 -1.45 0.34 0.00 0.10 0.00 0.00 66.02 64.86 2x0g s SER 101 CO 0.09 -0.95 1.71 0.00 0.98 0.00 0.00 173.24 175.07 2x0g h ALA 102 N 0.09 0.80 -0.68 5.32 0.00 -1.96 -1.82 119.26 121.00 2x0g h ALA 102 Ca -0.45 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 2x0g h ALA 102 Cb 1.27 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 19.19 2x0g h ALA 102 CO 0.58 -0.29 0.42 0.00 0.00 0.00 0.00 179.25 179.96 2x0g h ALA 103 N 1.51 0.87 -0.51 0.00 0.00 -1.97 -1.61 119.26 117.55 2x0g h ALA 103 Ca 0.34 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 2x0g h ALA 103 Cb 0.52 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2x0g h ALA 103 CO -0.42 0.34 0.05 0.93 0.00 0.00 0.00 179.25 180.15 2x0g h GLU 104 N 0.93 0.87 0.12 0.00 5.08 -1.81 -0.70 114.58 119.08 2x0g h GLU 104 Ca 0.25 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2x0g h GLU 104 Cb -0.05 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 2x0g h GLU 104 CO -0.05 0.87 -0.07 1.25 -1.00 0.00 0.00 179.01 180.01 2x0g h LEU 105 N 0.74 -0.17 -0.18 1.33 6.46 -0.95 0.66 115.31 123.20 2x0g h LEU 105 Ca 0.15 0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.90 2x0g h LEU 105 Cb 0.45 0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.42 2x0g h LEU 105 CO 0.02 -0.12 0.05 -0.09 -0.62 0.00 0.00 178.44 177.68 2x0g h ARG 106 N -0.19 0.29 -0.38 1.25 2.43 -1.28 -2.37 114.38 114.13 2x0g h ARG 106 Ca -0.01 -0.07 -0.08 0.00 -0.81 0.00 0.00 59.98 59.01 2x0g h ARG 106 Cb 0.15 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 2x0g h ARG 106 CO 0.02 0.42 -0.06 1.25 -1.51 0.00 0.00 179.97 180.08 2x0g h HIS 107 N 0.11 0.80 -0.15 2.20 2.76 -1.03 -1.82 115.15 118.03 2x0g h HIS 107 Ca 0.06 -0.16 -0.12 0.00 -2.20 0.00 0.00 60.37 57.95 2x0g h HIS 107 Cb 0.25 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 29.00 2x0g h HIS 107 CO 0.01 0.84 -0.42 0.28 -1.30 0.00 0.00 177.93 177.34 2x0g h VAL 108 N 0.53 1.31 0.02 5.26 2.07 -0.91 -2.61 116.25 121.92 2x0g h VAL 108 Ca 0.10 -1.56 -0.24 0.00 0.82 0.00 0.00 66.70 65.82 2x0g h VAL 108 Cb 0.57 1.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.96 2x0g h VAL 108 CO 0.03 0.47 -1.26 0.24 0.02 0.00 0.00 177.57 177.08 2x0g h MET 109 N 0.28 0.03 -0.44 1.57 2.86 -1.38 -2.94 114.93 114.91 2x0g h MET 109 Ca 0.02 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 2x0g h MET 109 Cb 0.86 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.52 2x0g h MET 109 CO 0.07 0.88 0.22 1.15 1.06 0.00 0.00 176.91 180.29 2x0g h THR 110 N 0.01 1.18 0.00 2.22 2.02 -1.23 -0.25 112.91 116.85 2x0g h THR 110 Ca -0.11 -0.50 0.00 0.00 0.77 0.00 0.00 66.41 66.57 2x0g h THR 110 Cb 1.87 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 68.97 2x0g h THR 110 CO 0.12 0.19 0.00 0.78 0.37 0.00 0.00 175.52 176.98 2x0g h ASN 111 N 0.58 0.00 -0.61 4.18 4.21 -1.51 -0.19 115.58 122.23 2x0g h ASN 111 Ca 0.15 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.66 2x0g h ASN 111 Cb 0.11 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.31 2x0g h ASN 111 CO -0.02 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 176.30 2x0g n LEU 112 N -2.48 5.44 0.00 1.61 4.32 -0.84 -4.95 117.00 120.10 2x0g n LEU 112 Ca -0.00 -2.75 0.00 0.00 -0.02 0.00 0.00 56.01 53.23 2x0g n LEU 112 Cb 0.14 -0.65 0.00 0.00 -1.62 0.00 0.00 43.42 41.29 2x0g n LEU 112 CO 0.17 0.70 0.00 0.61 -1.22 0.00 0.00 177.39 177.65 2x0g n GLY 113 N 0.83 2.99 3.59 -0.72 0.00 -0.08 -5.02 105.19 106.78 2x0g n GLY 113 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.87 2x0g n GLY 113 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2x0g s GLU 114 N -0.20 3.82 -0.72 1.61 2.12 -0.17 -4.91 118.70 120.25 2x0g s GLU 114 Ca 0.00 0.37 -0.20 0.00 0.36 0.00 0.00 54.97 55.50 2x0g s GLU 114 Cb 0.00 -3.78 0.11 0.00 0.26 0.00 0.00 34.13 30.72 2x0g s GLU 114 CO 0.00 -0.77 0.90 0.21 -0.54 0.00 0.00 175.26 175.06 2x0g s LYS 115 N 2.99 3.26 0.11 4.30 2.20 -1.26 -3.00 119.74 128.33 2x0g s LYS 115 Ca 0.31 -1.38 -0.26 0.00 -0.36 0.00 0.00 55.97 54.28 2x0g s LYS 115 Cb -0.14 -4.45 -0.07 0.00 -1.51 0.00 0.00 37.83 31.67 2x0g s LYS 115 CO 0.15 -1.67 0.79 -0.51 -0.36 0.00 0.00 175.35 173.75 2x0g s LEU 116 N 2.92 4.52 0.75 5.43 1.43 -1.26 -5.07 118.68 127.40 2x0g s LEU 116 Ca 0.21 1.58 -0.11 0.00 -1.03 0.00 0.00 54.13 54.78 2x0g s LEU 116 Cb -0.16 -3.30 0.04 0.00 0.03 0.00 0.00 46.19 42.80 2x0g s LEU 116 CO 0.02 0.10 1.08 0.42 0.23 0.00 0.00 176.35 178.20 2x0g s THR 117 N -0.57 3.56 0.38 5.49 -4.23 -1.26 -4.83 115.64 114.18 2x0g s THR 117 Ca 0.38 0.51 0.13 0.00 -1.18 0.00 0.00 61.69 61.52 2x0g s THR 117 Cb -0.22 -3.08 0.35 0.00 1.34 0.00 0.00 72.50 70.89 2x0g s THR 117 CO 0.25 -0.66 1.86 0.44 -0.54 0.00 0.00 174.62 175.97 2x0g h ASP 118 N -0.99 0.54 -0.27 3.99 3.45 -1.99 -0.85 116.42 120.29 2x0g h ASP 118 Ca -0.44 0.04 -0.09 0.00 0.43 0.00 0.00 57.03 56.98 2x0g h ASP 118 Cb 1.22 -0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 39.93 2x0g h ASP 118 CO 0.53 0.25 -0.18 -0.33 -1.57 0.00 0.00 179.24 177.93 2x0g h GLU 119 N 0.56 0.61 0.09 3.56 4.39 -1.99 -0.45 114.58 121.35 2x0g h GLU 119 Ca 0.46 -0.29 0.00 0.00 0.34 0.00 0.00 59.36 59.87 2x0g h GLU 119 Cb 0.92 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.55 2x0g h GLU 119 CO -0.20 0.87 -0.09 0.93 -1.16 0.00 0.00 179.01 179.37 2x0g h GLU 120 N 0.34 -0.19 -0.02 2.33 5.08 -1.74 -0.36 114.58 120.02 2x0g h GLU 120 Ca 0.05 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.46 2x0g h GLU 120 Cb 0.72 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.96 2x0g h GLU 120 CO 0.05 -0.13 -0.42 0.28 -1.00 0.00 0.00 179.01 177.80 2x0g h VAL 121 N -0.19 0.15 -0.43 3.13 2.07 -1.10 -1.07 116.25 118.80 2x0g h VAL 121 Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 2x0g h VAL 121 Cb 0.19 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.09 2x0g h VAL 121 CO -0.02 0.00 0.19 0.44 0.02 0.00 0.00 177.57 178.20 2x0g h ASP 122 N -0.56 0.54 -0.64 0.57 3.45 -0.94 -0.96 116.42 117.89 2x0g h ASP 122 Ca 0.05 -0.05 -0.07 0.00 0.43 0.00 0.00 57.03 57.40 2x0g h ASP 122 Cb 0.65 -0.14 -0.03 0.00 -0.56 0.00 0.00 39.33 39.25 2x0g h ASP 122 CO -0.33 0.48 0.14 -0.33 -1.57 0.00 0.00 179.24 177.63 2x0g h GLU 123 N 0.61 1.03 0.04 3.56 5.08 -0.70 -1.81 114.58 122.39 2x0g h GLU 123 Ca 0.15 -0.26 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2x0g h GLU 123 Cb 0.09 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.21 2x0g h GLU 123 CO -0.02 0.94 -0.02 0.52 -1.00 0.00 0.00 179.01 179.43 2x0g h MET 124 N 0.95 -0.05 -0.08 2.33 2.86 0.11 -1.19 114.93 119.85 2x0g h MET 124 Ca 0.20 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.83 2x0g h MET 124 Cb 0.38 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.05 2x0g h MET 124 CO 0.00 0.14 0.02 0.82 1.06 0.00 0.00 176.91 178.95 2x0g h ILE 125 N -0.23 1.21 -0.83 -1.22 1.08 -1.41 -2.74 117.51 113.37 2x0g h ILE 125 Ca -0.01 -0.64 0.05 0.00 -0.39 0.00 0.00 64.86 63.88 2x0g h ILE 125 Cb 0.21 1.47 -0.06 0.00 -3.07 0.00 0.00 36.82 35.38 2x0g h ILE 125 CO 0.01 0.18 0.52 -0.09 -0.69 0.00 0.00 178.15 178.08 2x0g h ARG 126 N -0.09 0.94 0.00 2.37 2.43 -1.24 0.14 114.38 118.93 2x0g h ARG 126 Ca 0.03 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.07 2x0g h ARG 126 Cb 0.27 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2x0g h ARG 126 CO 0.00 0.62 -0.34 0.93 -1.51 0.00 0.00 179.97 179.67 2x0g h GLU 127 N 0.96 0.00 0.00 0.20 4.39 -1.21 -3.11 114.58 115.81 2x0g h GLU 127 Ca 0.35 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.90 2x0g h GLU 127 Cb 0.12 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.75 2x0g h GLU 127 CO -0.16 0.34 -1.25 0.00 -1.16 0.00 0.00 179.01 176.78 2x0g h ALA 128 N 1.66 0.65 -1.31 3.43 0.00 -1.09 -3.45 119.26 119.15 2x0g h ALA 128 Ca -0.00 -0.76 -0.54 0.00 0.00 0.00 0.00 54.91 53.60 2x0g h ALA 128 Cb 1.08 0.21 -0.08 0.00 0.00 0.00 0.00 17.79 19.00 2x0g h ALA 128 CO 0.04 0.85 1.16 0.34 0.00 0.00 0.00 179.25 181.64 2x0g s ASP 129 N -5.89 6.10 -0.06 0.00 2.15 0.45 -4.69 116.67 114.75 2x0g s ASP 129 Ca -0.02 -0.55 -0.26 0.00 0.43 0.00 0.00 52.55 52.15 2x0g s ASP 129 Cb 0.09 -2.56 -0.22 0.00 -0.30 0.00 0.00 42.92 39.93 2x0g s ASP 129 CO 0.80 -1.86 1.10 0.40 -0.17 0.00 0.00 175.17 175.44 2x0g h ILE 130 N 6.28 1.46 -0.00 4.11 2.04 -1.87 -3.33 117.51 126.21 2x0g h ILE 130 Ca -0.18 -1.47 0.00 0.00 1.00 0.00 0.00 64.86 64.21 2x0g h ILE 130 Cb 1.05 2.44 0.00 0.00 -0.74 0.00 0.00 36.82 39.58 2x0g h ILE 130 CO 1.30 0.38 -0.20 -0.90 0.00 0.00 0.00 178.15 178.73 2x0g n ASP 131 N -4.79 0.26 0.00 1.72 5.68 -1.26 -4.95 116.55 113.20 2x0g n ASP 131 Ca -0.09 0.05 0.00 0.00 -0.50 0.00 0.00 54.79 54.25 2x0g n ASP 131 Cb 0.31 -0.16 0.00 0.00 -1.14 0.00 0.00 41.12 40.13 2x0g n ASP 131 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2x0g n GLY 132 N 1.46 0.47 0.46 6.12 0.00 -1.25 -4.95 105.19 107.51 2x0g n GLY 132 Ca 0.08 -0.94 0.12 0.00 0.00 0.00 0.00 46.02 45.28 2x0g n GLY 132 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2x0g n ASP 133 N 1.79 1.41 0.00 1.61 5.75 -1.26 -4.92 116.55 120.93 2x0g n ASP 133 Ca 0.00 -1.57 0.00 0.00 -0.01 0.00 0.00 54.79 53.21 2x0g n ASP 133 Cb 0.12 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.15 2x0g n ASP 133 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2x0g n GLY 134 N 1.12 0.58 3.19 6.12 0.00 -1.26 -5.02 105.19 109.92 2x0g n GLY 134 Ca 0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.08 2x0g n GLY 134 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2x0g s GLN 135 N -0.06 0.93 -0.24 1.61 -0.21 -1.26 -4.45 119.66 115.98 2x0g s GLN 135 Ca 0.00 -1.40 -0.00 0.00 0.02 0.00 0.00 55.36 53.97 2x0g s GLN 135 Cb 0.00 -0.21 0.03 0.00 1.00 0.00 0.00 33.01 33.83 2x0g s GLN 135 CO 0.00 -0.06 -0.09 0.08 -2.12 0.00 0.00 175.29 173.10 2x0g s VAL 136 N -3.65 2.62 0.47 1.09 1.01 -0.31 -4.67 120.40 116.95 2x0g s VAL 136 Ca 0.16 -1.11 0.02 0.00 0.00 0.00 0.00 61.98 61.05 2x0g s VAL 136 Cb 0.06 -2.33 0.09 0.00 0.00 0.00 0.00 36.38 34.20 2x0g s VAL 136 CO -0.02 0.22 0.64 -0.46 0.00 0.00 0.00 175.10 175.48 2x0g n ASN 137 N 4.62 1.07 -0.01 3.32 0.23 -1.26 -0.19 115.26 123.05 2x0g n ASN 137 Ca -0.17 -1.86 -0.12 0.00 -0.53 0.00 0.00 54.58 51.90 2x0g n ASN 137 Cb 0.47 -0.40 -0.08 0.00 -2.08 0.00 0.00 39.78 37.70 2x0g n ASN 137 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 2x0g h TYR 138 N -0.35 0.11 -0.58 -2.53 -0.00 -2.00 0.01 116.97 111.62 2x0g h TYR 138 Ca -0.21 -0.02 -0.02 0.00 -0.00 0.00 0.00 58.73 58.48 2x0g h TYR 138 Cb 0.84 -0.03 -0.03 0.00 -0.00 0.00 0.00 36.73 37.51 2x0g h TYR 138 CO 0.00 0.34 0.28 1.49 -0.00 0.00 0.00 178.16 180.28 2x0g h GLU 139 N -0.16 0.83 -0.32 1.82 4.57 -1.95 0.21 114.58 119.58 2x0g h GLU 139 Ca 0.02 -0.12 0.04 0.00 -1.18 0.00 0.00 59.36 58.12 2x0g h GLU 139 Cb 0.30 -0.15 -0.04 0.00 -0.16 0.00 0.00 28.75 28.69 2x0g h GLU 139 CO 0.00 0.67 0.07 0.93 -1.18 0.00 0.00 179.01 179.50 2x0g h GLU 140 N 0.79 0.18 -0.67 1.92 5.08 -1.79 0.13 114.58 120.22 2x0g h GLU 140 Ca 0.20 -0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.67 2x0g h GLU 140 Cb 0.11 -0.04 -0.08 0.00 0.50 0.00 0.00 28.75 29.23 2x0g h GLU 140 CO -0.03 0.12 0.24 0.35 -1.00 0.00 0.00 179.01 178.69 2x0g h PHE 141 N 0.19 0.41 0.44 4.33 -0.00 -0.32 -1.88 116.94 120.11 2x0g h PHE 141 Ca 0.15 0.03 -0.02 0.00 -0.00 0.00 0.00 57.97 58.13 2x0g h PHE 141 Cb 0.15 -0.08 0.00 0.00 -0.00 0.00 0.00 35.95 36.03 2x0g h PHE 141 CO -0.17 0.06 -0.21 0.28 -0.00 0.00 0.00 178.31 178.27 2x0g h VAL 142 N 0.40 0.57 -0.79 1.41 2.07 0.11 -1.57 116.25 118.44 2x0g h VAL 142 Ca 0.35 -0.03 0.18 0.00 0.82 0.00 0.00 66.70 68.02 2x0g h VAL 142 Cb 0.49 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 30.79 2x0g h VAL 142 CO -0.36 0.01 0.54 1.56 0.02 0.00 0.00 177.57 179.33 2x0g h GLN 143 N -0.61 0.29 -0.08 1.57 1.08 -0.55 -1.06 115.11 115.75 2x0g h GLN 143 Ca -0.06 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.11 2x0g h GLN 143 Cb 0.47 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.83 2x0g h GLN 143 CO 0.10 0.19 -0.01 1.98 -0.95 0.00 0.00 178.83 180.14 2x0g h MET 144 N 0.30 0.15 0.00 1.46 4.05 -0.80 -3.52 114.93 116.57 2x0g h MET 144 Ca 0.40 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.76 2x0g h MET 144 Cb 1.10 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.89 2x0g h MET 144 CO -0.11 0.45 0.00 -1.33 0.23 0.00 0.00 176.91 176.16