#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wc9 s LYS 13 N 0.00 1.63 0.08 -1.58 -0.14 -1.26 -5.06 119.74 113.41 1wc9 s LYS 13 Ca 0.00 1.61 -0.10 0.00 -1.36 0.00 0.00 55.97 56.12 1wc9 s LYS 13 Cb 0.00 -1.79 0.01 0.00 -1.68 0.00 0.00 37.83 34.37 1wc9 s LYS 13 CO 0.00 -2.19 0.22 0.00 -0.76 0.00 0.00 175.35 172.62 1wc9 s MET 14 N -4.35 0.83 0.93 1.68 0.23 -1.26 -5.16 119.30 112.21 1wc9 s MET 14 Ca 0.70 -0.83 -0.12 0.00 -1.03 0.00 0.00 55.69 54.41 1wc9 s MET 14 Cb -0.25 0.35 0.15 0.00 -1.53 0.00 0.00 34.83 33.54 1wc9 s MET 14 CO 0.52 -0.27 1.09 -1.12 -2.03 0.00 0.00 175.02 173.22 1wc9 s SER 15 N -2.63 3.20 0.11 -1.18 0.01 -1.26 -4.99 113.70 106.97 1wc9 s SER 15 Ca 0.02 1.38 0.24 0.00 1.31 0.00 0.00 55.95 58.89 1wc9 s SER 15 Cb 0.03 -2.06 0.22 0.00 0.21 0.00 0.00 66.02 64.42 1wc9 s SER 15 CO -0.09 -2.79 1.20 -1.54 0.41 0.00 0.00 173.24 170.43 1wc9 n SER 16 N -3.97 0.69 -0.20 2.44 3.41 -1.26 -4.57 113.62 110.16 1wc9 n SER 16 Ca 0.06 0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 1wc9 n SER 16 Cb 0.56 0.37 0.09 0.00 -0.26 0.00 0.00 64.21 64.97 1wc9 n SER 16 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1wc9 h GLU 17 N 0.00 0.07 -0.48 4.33 3.07 -1.95 0.16 114.58 119.79 1wc9 h GLU 17 Ca 0.00 -0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.75 1wc9 h GLU 17 Cb 0.78 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.65 1wc9 h GLU 17 CO 0.00 0.05 -0.12 1.25 -1.40 0.00 0.00 179.01 178.79 1wc9 h LEU 18 N 0.08 0.88 -0.09 1.33 5.85 -2.00 -1.43 115.31 119.93 1wc9 h LEU 18 Ca 0.31 -0.28 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 1wc9 h LEU 18 Cb 0.50 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.29 1wc9 h LEU 18 CO -0.56 1.01 0.04 0.15 -0.34 0.00 0.00 178.44 178.74 1wc9 h PHE 19 N 0.79 0.13 -0.68 1.25 3.57 -1.60 -0.56 116.94 119.84 1wc9 h PHE 19 Ca 0.13 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 1wc9 h PHE 19 Cb 0.64 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.31 1wc9 h PHE 19 CO 0.04 0.19 0.42 1.79 -2.23 0.00 0.00 178.31 178.52 1wc9 h THR 20 N 0.02 1.19 -0.18 4.41 1.35 -0.60 0.09 112.91 119.19 1wc9 h THR 20 Ca 0.03 -0.40 -0.09 0.00 -0.55 0.00 0.00 66.41 65.40 1wc9 h THR 20 Cb 0.11 0.24 -0.01 0.00 -1.73 0.00 0.00 68.15 66.76 1wc9 h THR 20 CO -0.00 0.19 -0.29 -0.07 -0.25 0.00 0.00 175.52 175.10 1wc9 h LEU 21 N 0.92 0.35 -0.42 3.87 3.38 -1.18 -0.95 115.31 121.28 1wc9 h LEU 21 Ca 0.24 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 1wc9 h LEU 21 Cb -0.05 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1wc9 h LEU 21 CO -0.05 0.63 -0.15 0.74 0.09 0.00 0.00 178.44 179.70 1wc9 h THR 22 N 0.31 1.28 -0.46 0.22 2.02 -0.57 -1.11 112.91 114.60 1wc9 h THR 22 Ca 0.04 -1.28 -0.01 0.00 0.77 0.00 0.00 66.41 65.93 1wc9 h THR 22 Cb 0.67 1.22 -0.02 0.00 -1.74 0.00 0.00 68.15 68.27 1wc9 h THR 22 CO 0.05 0.43 0.23 0.22 0.37 0.00 0.00 175.52 176.82 1wc9 h TYR 23 N 0.67 0.63 -0.63 3.16 3.20 -0.72 -1.78 116.97 121.50 1wc9 h TYR 23 Ca 0.10 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.93 1wc9 h TYR 23 Cb 0.70 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.74 1wc9 h TYR 23 CO 0.05 0.47 0.27 0.78 -1.64 0.00 0.00 178.16 178.08 1wc9 h GLY 24 N 0.75 1.00 1.39 1.82 0.00 -0.68 -1.16 103.07 106.19 1wc9 h GLY 24 Ca 0.16 -0.53 -0.01 0.00 0.00 0.00 0.00 47.33 46.95 1wc9 h GLY 24 CO -0.02 0.50 0.30 0.00 0.00 0.00 0.00 176.54 177.32 1wc9 h ALA 25 N 1.11 1.45 -0.02 3.60 0.00 -0.40 -0.38 119.26 124.62 1wc9 h ALA 25 Ca 0.21 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1wc9 h ALA 25 Cb 0.18 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1wc9 h ALA 25 CO -0.02 0.45 0.00 1.25 0.00 0.00 0.00 179.25 180.94 1wc9 h LEU 26 N 0.80 0.02 -0.64 0.00 5.85 -0.76 -0.95 115.31 119.64 1wc9 h LEU 26 Ca 0.20 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.72 1wc9 h LEU 26 Cb 0.05 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1wc9 h LEU 26 CO -0.03 0.24 0.42 0.58 -0.34 0.00 0.00 178.44 179.30 1wc9 h VAL 27 N -0.19 1.14 -0.60 1.05 2.07 -0.94 -1.28 116.25 117.50 1wc9 h VAL 27 Ca 0.01 -0.29 0.03 0.00 0.82 0.00 0.00 66.70 67.26 1wc9 h VAL 27 Cb 0.22 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.18 1wc9 h VAL 27 CO -0.00 0.15 0.37 0.74 0.02 0.00 0.00 177.57 178.85 1wc9 h THR 28 N 0.84 1.08 -0.68 2.57 2.02 -0.97 -0.91 112.91 116.86 1wc9 h THR 28 Ca 0.24 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 67.15 1wc9 h THR 28 Cb -0.06 0.28 -0.03 0.00 -1.74 0.00 0.00 68.15 66.60 1wc9 h THR 28 CO -0.07 0.13 0.33 -0.61 0.37 0.00 0.00 175.52 175.67 1wc9 h GLN 29 N 0.73 0.97 -0.48 6.66 5.75 -0.76 -2.07 115.11 125.92 1wc9 h GLN 29 Ca 0.24 -0.14 -0.06 0.00 -0.15 0.00 0.00 58.65 58.54 1wc9 h GLN 29 Cb 0.01 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.37 1wc9 h GLN 29 CO -0.10 0.77 0.04 -0.07 -2.65 0.00 0.00 178.83 176.82 1wc9 h LEU 30 N 0.94 0.73 -1.20 -2.39 3.38 -0.80 0.29 115.31 116.26 1wc9 h LEU 30 Ca 0.23 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 1wc9 h LEU 30 Cb 0.12 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1wc9 h LEU 30 CO -0.03 0.77 0.04 0.00 0.09 0.00 0.00 178.44 179.31 1wc9 h LYS 32 N 0.56 0.86 -0.12 0.00 3.64 -0.76 0.17 116.57 120.92 1wc9 h LYS 32 Ca 0.12 -0.57 -0.10 0.00 -1.27 0.00 0.00 60.65 58.83 1wc9 h LYS 32 Cb 0.31 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 1wc9 h LYS 32 CO 0.01 1.20 -0.38 -0.44 -2.27 0.00 0.00 179.45 177.57 1wc9 h ASP 33 N 0.64 0.27 0.00 4.20 3.32 -0.52 -3.37 116.42 120.96 1wc9 h ASP 33 Ca 0.00 -0.11 -0.04 0.00 0.02 0.00 0.00 57.03 56.90 1wc9 h ASP 33 Cb 1.20 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.66 1wc9 h ASP 33 CO 0.13 0.64 -1.25 -1.22 -1.72 0.00 0.00 179.24 175.81 1wc9 n TYR 34 N -4.05 0.00 -4.11 4.55 4.02 -0.30 -5.02 117.16 112.24 1wc9 n TYR 34 Ca -0.01 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.55 1wc9 n TYR 34 Cb 0.46 -0.16 -0.02 0.00 -0.02 0.00 0.00 39.34 39.60 1wc9 n TYR 34 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1wc9 n GLU 35 N -1.92 -3.50 -3.16 -0.72 1.02 0.59 -4.92 120.64 108.02 1wc9 n GLU 35 Ca -0.04 0.41 0.04 0.00 -0.02 0.00 0.00 57.16 57.55 1wc9 n GLU 35 Cb 0.39 -4.99 -0.01 0.00 -0.02 0.00 0.00 31.44 26.81 1wc9 n GLU 35 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1wc9 s ASN 36 N -3.58 -1.21 0.27 1.62 2.47 -1.26 -5.06 114.94 108.18 1wc9 s ASN 36 Ca 0.53 0.79 -0.00 0.00 0.42 0.00 0.00 52.86 54.60 1wc9 s ASN 36 Cb -0.29 2.02 0.60 0.00 -1.45 0.00 0.00 41.25 42.13 1wc9 s ASN 36 CO 0.91 -0.23 1.71 0.44 -3.72 0.00 0.00 177.10 176.21 1wc9 h ASP 37 N 8.00 0.28 -0.93 -4.21 3.45 -1.95 -0.90 116.42 120.16 1wc9 h ASP 37 Ca -0.21 0.14 0.00 0.00 0.43 0.00 0.00 57.03 57.39 1wc9 h ASP 37 Cb 1.16 0.12 -0.05 0.00 -0.56 0.00 0.00 39.33 40.01 1wc9 h ASP 37 CO 0.19 0.04 0.59 -0.33 -1.57 0.00 0.00 179.24 178.17 1wc9 h GLU 38 N 0.41 1.23 -0.55 3.56 3.07 -1.97 0.01 114.58 120.34 1wc9 h GLU 38 Ca 0.49 -0.09 -0.04 0.00 -0.50 0.00 0.00 59.36 59.23 1wc9 h GLU 38 Cb 0.85 -0.27 -0.02 0.00 -0.84 0.00 0.00 28.75 28.46 1wc9 h GLU 38 CO -0.48 0.83 0.21 -0.44 -1.40 0.00 0.00 179.01 177.73 1wc9 h ASP 39 N 1.26 0.77 -0.46 1.42 3.32 -1.58 -1.79 116.42 119.37 1wc9 h ASP 39 Ca 0.34 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1wc9 h ASP 39 Cb -0.11 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.21 1wc9 h ASP 39 CO -0.07 0.75 0.29 0.58 -1.72 0.00 0.00 179.24 179.06 1wc9 h VAL 40 N 0.76 1.13 -0.58 -1.35 2.07 -0.78 -0.54 116.25 116.96 1wc9 h VAL 40 Ca 0.18 -0.29 0.06 0.00 0.82 0.00 0.00 66.70 67.48 1wc9 h VAL 40 Cb 0.22 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 30.44 1wc9 h VAL 40 CO -0.01 0.13 0.27 0.78 0.02 0.00 0.00 177.57 178.76 1wc9 h ASN 41 N 0.61 0.36 -0.29 0.57 2.35 -0.79 -0.10 115.58 118.29 1wc9 h ASN 41 Ca 0.17 0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.95 1wc9 h ASN 41 Cb -0.03 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 1wc9 h ASN 41 CO -0.03 0.23 0.13 0.11 -1.65 0.00 0.00 177.43 176.22 1wc9 h LYS 42 N 0.51 0.42 -0.69 0.81 1.57 -0.89 -2.23 116.57 116.06 1wc9 h LYS 42 Ca 0.27 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 58.92 1wc9 h LYS 42 Cb 0.23 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.44 1wc9 h LYS 42 CO -0.21 0.41 0.19 1.96 -0.57 0.00 0.00 179.45 181.23 1wc9 h GLN 43 N 0.33 1.10 -0.69 3.15 1.08 -0.76 -1.19 115.11 118.11 1wc9 h GLN 43 Ca 0.10 -0.25 0.00 0.00 -1.45 0.00 0.00 58.65 57.05 1wc9 h GLN 43 Cb 0.14 -0.15 -0.03 0.00 -0.05 0.00 0.00 27.48 27.38 1wc9 h GLN 43 CO -0.01 0.96 0.45 -0.07 -0.95 0.00 0.00 178.83 179.21 1wc9 h LEU 44 N 1.03 0.81 -0.59 1.46 3.38 -0.92 -0.23 115.31 120.25 1wc9 h LEU 44 Ca 0.22 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.09 1wc9 h LEU 44 Cb 0.34 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1wc9 h LEU 44 CO -0.00 0.60 0.09 -0.78 0.09 0.00 0.00 178.44 178.44 1wc9 h ASP 45 N 0.94 0.95 -0.26 -0.43 1.82 -1.18 -0.29 116.42 117.97 1wc9 h ASP 45 Ca 0.25 -0.26 -0.00 0.00 -0.39 0.00 0.00 57.03 56.63 1wc9 h ASP 45 Cb -0.09 -0.25 -0.01 0.00 0.68 0.00 0.00 39.33 39.66 1wc9 h ASP 45 CO -0.05 0.97 0.15 -0.09 -1.61 0.00 0.00 179.24 178.61 1wc9 h ARG 46 N 0.89 0.37 -0.93 0.28 2.43 -0.81 0.39 114.38 117.00 1wc9 h ARG 46 Ca 0.18 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 1wc9 h ARG 46 Cb 0.43 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.86 1wc9 h ARG 46 CO 0.01 0.32 0.59 0.52 -1.51 0.00 0.00 179.97 179.89 1wc9 h MET 47 N 0.32 1.24 -0.63 0.20 2.86 -0.91 -1.76 114.93 116.24 1wc9 h MET 47 Ca 0.09 -0.10 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1wc9 h MET 47 Cb 0.05 -0.27 -0.03 0.00 0.06 0.00 0.00 31.60 31.41 1wc9 h MET 47 CO -0.02 0.85 0.37 0.78 1.06 0.00 0.00 176.91 179.95 1wc9 h GLY 48 N 1.27 0.93 0.65 8.32 0.00 -0.58 -0.63 103.07 113.03 1wc9 h GLY 48 Ca 0.34 -0.40 0.03 0.00 0.00 0.00 0.00 47.33 47.30 1wc9 h GLY 48 CO -0.07 0.38 -0.06 -1.82 0.00 0.00 0.00 176.54 174.98 1wc9 h TYR 49 N 0.86 -0.12 -0.69 5.60 3.20 -0.20 0.13 116.97 125.75 1wc9 h TYR 49 Ca 0.23 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.12 1wc9 h TYR 49 Cb -0.00 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.31 1wc9 h TYR 49 CO -0.01 -0.09 0.44 -0.91 -1.64 0.00 0.00 178.16 175.95 1wc9 h ASN 50 N -0.03 0.80 -0.44 -2.11 2.35 -1.02 -1.79 115.58 113.35 1wc9 h ASN 50 Ca 0.08 -0.03 -0.08 0.00 -0.55 0.00 0.00 56.30 55.73 1wc9 h ASN 50 Cb 0.15 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 1wc9 h ASN 50 CO -0.18 0.59 -0.02 0.40 -1.65 0.00 0.00 177.43 176.57 1wc9 h ILE 51 N 0.94 1.26 -0.77 2.81 2.04 -0.47 -3.16 117.51 120.17 1wc9 h ILE 51 Ca 0.25 -1.08 -0.03 0.00 1.00 0.00 0.00 64.86 65.00 1wc9 h ILE 51 Cb -0.09 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 1wc9 h ILE 51 CO -0.05 0.37 0.36 1.23 0.00 0.00 0.00 178.15 180.06 1wc9 h GLY 52 N 0.63 1.19 2.00 5.37 0.00 -0.19 0.22 103.07 112.29 1wc9 h GLY 52 Ca 0.12 -0.60 -0.00 0.00 0.00 0.00 0.00 47.33 46.85 1wc9 h GLY 52 CO 0.03 0.57 -0.00 -2.08 0.00 0.00 0.00 176.54 175.05 1wc9 h VAL 53 N 1.08 0.88 0.07 4.60 2.07 -1.32 -2.02 116.25 121.61 1wc9 h VAL 53 Ca 0.26 -0.01 -0.30 0.00 0.82 0.00 0.00 66.70 67.47 1wc9 h VAL 53 Cb 0.13 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 1wc9 h VAL 53 CO -0.03 0.00 -1.63 0.03 0.02 0.00 0.00 177.57 175.96 1wc9 h ARG 54 N 0.00 0.15 -0.67 1.57 2.47 -1.39 -3.39 114.38 113.11 1wc9 h ARG 54 Ca -0.00 -0.25 0.07 0.00 -1.26 0.00 0.00 59.98 58.54 1wc9 h ARG 54 Cb 0.01 0.09 -0.04 0.00 -1.65 0.00 0.00 29.97 28.38 1wc9 h ARG 54 CO 0.00 1.12 0.44 1.25 0.56 0.00 0.00 179.97 183.34 1wc9 h LEU 55 N -0.43 0.56 -1.38 3.04 5.85 -0.41 -2.43 115.31 120.10 1wc9 h LEU 55 Ca -0.38 0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.43 1wc9 h LEU 55 Cb 1.69 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 42.56 1wc9 h LEU 55 CO -0.05 0.35 0.50 -0.29 -0.34 0.00 0.00 178.44 178.61 1wc9 h ILE 56 N 0.63 0.95 -0.74 4.05 6.09 -1.56 -1.30 117.51 125.63 1wc9 h ILE 56 Ca 0.29 -0.24 -0.03 0.00 -1.37 0.00 0.00 64.86 63.51 1wc9 h ILE 56 Cb 0.34 0.19 -0.03 0.00 0.47 0.00 0.00 36.82 37.79 1wc9 h ILE 56 CO -0.09 0.13 0.34 1.05 -3.07 0.00 0.00 178.15 176.50 1wc9 h GLU 57 N 0.70 1.08 -0.36 2.19 4.11 -1.66 -0.40 114.58 120.25 1wc9 h GLU 57 Ca 0.35 -0.17 -0.04 0.00 0.07 0.00 0.00 59.36 59.56 1wc9 h GLU 57 Cb 0.43 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1wc9 h GLU 57 CO -0.13 0.86 0.05 0.22 0.07 0.00 0.00 179.01 180.08 1wc9 h ASP 58 N 1.05 0.58 -0.20 3.06 1.82 -1.42 -2.64 116.42 118.67 1wc9 h ASP 58 Ca 0.25 -0.27 -0.01 0.00 -0.39 0.00 0.00 57.03 56.62 1wc9 h ASP 58 Cb 0.15 -0.15 -0.01 0.00 0.68 0.00 0.00 39.33 39.99 1wc9 h ASP 58 CO -0.03 0.70 0.11 0.15 -1.61 0.00 0.00 179.24 178.56 1wc9 h PHE 59 N 0.43 0.28 -0.44 0.28 3.57 -0.97 -2.26 116.94 117.83 1wc9 h PHE 59 Ca 0.11 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 1wc9 h PHE 59 Cb 0.37 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 1wc9 h PHE 59 CO 0.03 0.27 0.23 -0.07 -2.23 0.00 0.00 178.31 176.54 1wc9 h LEU 60 N 0.21 0.54 -1.05 0.59 3.38 -1.09 -1.24 115.31 116.66 1wc9 h LEU 60 Ca 0.07 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 1wc9 h LEU 60 Cb 0.08 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1wc9 h LEU 60 CO -0.01 0.45 -0.42 0.00 0.09 0.00 0.00 178.44 178.55 1wc9 h ALA 61 N 1.64 1.11 -0.62 1.53 0.00 -1.22 -3.12 119.26 118.58 1wc9 h ALA 61 Ca 0.16 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1wc9 h ALA 61 Cb 0.04 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1wc9 h ALA 61 CO -0.02 0.52 0.00 0.54 0.00 0.00 0.00 179.25 180.29 1wc9 n ARG 62 N -3.75 2.85 -4.48 0.00 1.74 -0.82 -4.99 116.66 107.21 1wc9 n ARG 62 Ca -0.01 -2.52 -0.23 0.00 -0.77 0.00 0.00 57.85 54.32 1wc9 n ARG 62 Cb 0.49 -1.52 -0.10 0.00 -1.02 0.00 0.00 32.46 30.32 1wc9 n ARG 62 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1wc9 s SER 63 N -1.01 2.52 -0.21 0.55 1.04 -0.53 -5.04 113.70 111.02 1wc9 s SER 63 Ca 0.42 -1.48 0.15 0.00 0.48 0.00 0.00 55.95 55.52 1wc9 s SER 63 Cb 0.23 0.12 0.48 0.00 0.10 0.00 0.00 66.02 66.95 1wc9 s SER 63 CO 0.28 -0.72 1.39 0.59 0.98 0.00 0.00 173.24 175.75 1wc9 n ASN 64 N -0.88 3.14 0.18 7.02 3.02 -1.26 -4.64 115.26 121.83 1wc9 n ASN 64 Ca -0.04 -3.29 0.07 0.00 -0.03 0.00 0.00 54.58 51.29 1wc9 n ASN 64 Cb 0.66 -0.55 0.13 0.00 -0.61 0.00 0.00 39.78 39.41 1wc9 n ASN 64 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 1wc9 h VAL 65 N 1.23 0.52 0.00 2.41 -1.51 -1.95 -3.49 116.25 113.47 1wc9 h VAL 65 Ca 0.07 -1.66 0.00 0.00 -1.23 0.00 0.00 66.70 63.88 1wc9 h VAL 65 Cb 1.43 2.20 0.00 0.00 -2.13 0.00 0.00 31.29 32.78 1wc9 h VAL 65 CO 0.23 0.29 0.00 0.61 -1.23 0.00 0.00 177.57 177.47 1wc9 n GLY 66 N 1.05 1.49 3.40 5.19 0.00 -1.26 -4.19 105.19 110.87 1wc9 n GLY 66 Ca 0.02 -0.54 -0.44 0.00 0.00 0.00 0.00 46.02 45.06 1wc9 n GLY 66 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wc9 s ARG 67 N 0.00 3.22 0.39 1.61 0.52 -1.26 -5.02 118.95 118.40 1wc9 s ARG 67 Ca 0.00 -1.45 0.04 0.00 -0.52 0.00 0.00 55.73 53.80 1wc9 s ARG 67 Cb 0.00 -4.40 -0.04 0.00 0.52 0.00 0.00 34.95 31.03 1wc9 s ARG 67 CO 0.00 -1.61 0.09 0.00 0.02 0.00 0.00 175.30 173.80 1wc9 n HIS 69 N -0.86 0.00 -2.51 0.00 -0.00 -1.26 -4.95 115.22 105.65 1wc9 n HIS 69 Ca -0.06 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.24 1wc9 n HIS 69 Cb 0.66 0.07 -0.02 0.00 -0.00 0.00 0.00 29.99 30.70 1wc9 n HIS 69 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1wc9 s ASP 70 N -0.11 7.04 0.17 0.41 2.15 -1.26 -4.96 116.67 120.11 1wc9 s ASP 70 Ca 0.00 1.66 -0.14 0.00 0.43 0.00 0.00 52.55 54.50 1wc9 s ASP 70 Cb 0.00 -2.55 0.06 0.00 -0.30 0.00 0.00 42.92 40.13 1wc9 s ASP 70 CO 0.00 -0.65 1.80 0.15 -0.17 0.00 0.00 175.17 176.29 1wc9 h PHE 71 N 7.71 0.71 -0.53 -5.34 3.57 -1.98 0.06 116.94 121.14 1wc9 h PHE 71 Ca -0.28 -0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.10 1wc9 h PHE 71 Cb 1.12 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.61 1wc9 h PHE 71 CO 0.76 0.50 -0.10 -0.09 -2.23 0.00 0.00 178.31 177.14 1wc9 h ARG 72 N 0.71 0.98 -0.79 1.11 2.43 -1.93 -0.49 114.38 116.40 1wc9 h ARG 72 Ca 0.19 -0.35 -0.05 0.00 -0.81 0.00 0.00 59.98 58.96 1wc9 h ARG 72 Cb 0.01 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.45 1wc9 h ARG 72 CO -0.03 1.03 0.30 1.49 -1.51 0.00 0.00 179.97 181.25 1wc9 h GLU 73 N 0.88 1.19 -0.80 0.20 4.81 -1.94 -2.09 114.58 116.84 1wc9 h GLU 73 Ca 0.14 -0.22 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1wc9 h GLU 73 Cb 0.65 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.81 1wc9 h GLU 73 CO 0.05 0.97 0.49 1.15 -0.73 0.00 0.00 179.01 180.94 1wc9 h THR 74 N 1.16 1.22 -0.25 0.32 2.02 -0.61 -0.33 112.91 116.44 1wc9 h THR 74 Ca 0.26 -0.46 0.01 0.00 0.77 0.00 0.00 66.41 66.99 1wc9 h THR 74 Cb 0.23 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.72 1wc9 h THR 74 CO -0.02 0.22 0.16 0.00 0.37 0.00 0.00 175.52 176.25 1wc9 h ALA 75 N 1.27 0.31 -0.60 6.16 0.00 -0.71 0.40 119.26 126.09 1wc9 h ALA 75 Ca 0.29 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.19 1wc9 h ALA 75 Cb -0.06 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1wc9 h ALA 75 CO -0.06 -0.22 0.39 -0.44 0.00 0.00 0.00 179.25 178.92 1wc9 h ASP 76 N 0.32 0.68 -0.45 0.00 3.32 -0.96 -1.42 116.42 117.92 1wc9 h ASP 76 Ca 0.09 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.06 1wc9 h ASP 76 Cb -0.03 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 1wc9 h ASP 76 CO -0.03 0.49 0.01 0.58 -1.72 0.00 0.00 179.24 178.57 1wc9 h VAL 77 N 0.80 1.26 0.15 -1.35 2.07 -0.82 -0.11 116.25 118.25 1wc9 h VAL 77 Ca 0.22 -1.03 -0.00 0.00 0.82 0.00 0.00 66.70 66.71 1wc9 h VAL 77 Cb -0.08 1.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1wc9 h VAL 77 CO -0.05 0.35 -0.10 0.40 0.02 0.00 0.00 177.57 178.19 1wc9 h ILE 78 N 0.63 0.79 -0.11 4.57 2.04 -0.68 -0.42 117.51 124.34 1wc9 h ILE 78 Ca 0.13 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.93 1wc9 h ILE 78 Cb 0.48 0.79 -0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1wc9 h ILE 78 CO 0.02 0.00 -0.14 0.00 0.00 0.00 0.00 178.15 178.03 1wc9 h ALA 79 N 0.60 0.16 0.00 1.87 0.00 -1.25 -0.42 119.26 120.22 1wc9 h ALA 79 Ca -0.01 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1wc9 h ALA 79 Cb 0.21 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1wc9 h ALA 79 CO 0.01 0.04 -0.72 0.87 0.00 0.00 0.00 179.25 179.45 1wc9 h LYS 80 N -0.14 0.00 0.00 0.00 1.57 -1.08 -3.35 116.57 113.57 1wc9 h LYS 80 Ca 0.01 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1wc9 h LYS 80 Cb 0.69 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.00 1wc9 h LYS 80 CO 0.03 0.00 -0.23 0.28 -0.57 0.00 0.00 179.45 178.97 1wc9 n VAL 81 N -2.53 1.09 -0.03 0.50 0.31 -0.29 -4.67 118.33 112.71 1wc9 n VAL 81 Ca 0.02 0.33 -0.11 0.00 -0.01 0.00 0.00 64.34 64.56 1wc9 n VAL 81 Cb 0.51 -1.63 -0.05 0.00 -0.91 0.00 0.00 33.84 31.76 1wc9 n VAL 81 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1wc9 h ALA 82 N -0.07 0.18 -0.70 3.52 0.00 -1.12 -0.36 119.26 120.71 1wc9 h ALA 82 Ca -0.01 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1wc9 h ALA 82 Cb 0.22 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1wc9 h ALA 82 CO -0.00 -0.24 0.28 0.74 0.00 0.00 0.00 179.25 180.03 1wc9 h PHE 83 N 0.07 1.05 -0.32 0.00 -1.00 -1.26 -1.03 116.94 114.45 1wc9 h PHE 83 Ca 0.05 -0.07 -0.06 0.00 2.81 0.00 0.00 57.97 60.69 1wc9 h PHE 83 Cb 0.16 -0.32 -0.01 0.00 3.61 0.00 0.00 35.95 39.39 1wc9 h PHE 83 CO -0.02 0.80 -0.04 -0.22 -1.61 0.00 0.00 178.31 177.22 1wc9 h LYS 84 N 1.02 0.60 -0.50 1.51 3.64 -1.14 1.00 116.57 122.70 1wc9 h LYS 84 Ca 0.24 -0.21 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 1wc9 h LYS 84 Cb 0.20 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 1wc9 h LYS 84 CO -0.02 0.76 0.21 1.98 -2.27 0.00 0.00 179.45 180.11 1wc9 h MET 85 N 0.39 0.74 0.00 1.90 4.05 -0.86 -1.60 114.93 119.55 1wc9 h MET 85 Ca 0.09 -0.13 0.00 0.00 -0.28 0.00 0.00 59.70 59.38 1wc9 h MET 85 Cb 0.52 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 31.19 1wc9 h MET 85 CO 0.03 0.65 -1.52 0.66 0.23 0.00 0.00 176.91 176.96 1wc9 n TYR 86 N -4.57 0.00 -0.35 1.39 0.53 -0.41 -4.62 117.16 109.14 1wc9 n TYR 86 Ca 0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.90 1wc9 n TYR 86 Cb 0.15 -0.26 0.00 0.00 -1.03 0.00 0.00 39.34 38.19 1wc9 n TYR 86 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 1wc9 n LEU 87 N -1.89 0.26 -0.11 7.72 4.77 0.30 -5.03 117.00 123.01 1wc9 n LEU 87 Ca -0.00 -0.35 -0.01 0.00 -0.03 0.00 0.00 56.01 55.61 1wc9 n LEU 87 Cb 0.45 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.53 1wc9 n LEU 87 CO 0.44 0.07 -0.01 0.61 -1.33 0.00 0.00 177.39 177.16 1wc9 n GLY 88 N 0.17 0.46 3.26 -0.72 0.00 -0.60 -4.88 105.19 102.87 1wc9 n GLY 88 Ca 0.00 -0.16 -0.17 0.00 0.00 0.00 0.00 46.02 45.69 1wc9 n GLY 88 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1wc9 s ILE 89 N -1.80 1.36 -0.42 -0.61 -4.36 -1.19 -4.91 121.20 109.27 1wc9 s ILE 89 Ca 0.00 -1.86 0.03 0.00 -0.26 0.00 0.00 60.65 58.56 1wc9 s ILE 89 Cb 0.00 -1.67 0.12 0.00 1.25 0.00 0.00 42.46 42.15 1wc9 s ILE 89 CO 0.00 -0.51 0.16 -0.89 0.24 0.00 0.00 174.94 173.93 1wc9 s THR 90 N -2.51 2.15 0.74 8.37 2.01 -1.26 -1.46 115.64 123.67 1wc9 s THR 90 Ca 0.13 -2.65 -0.11 0.00 0.31 0.00 0.00 61.69 59.36 1wc9 s THR 90 Cb -0.03 -2.54 0.04 0.00 0.01 0.00 0.00 72.50 69.98 1wc9 s THR 90 CO 0.03 -0.72 1.09 -2.16 -0.69 0.00 0.00 174.62 172.17 1wc9 s PRO 91 N 0.45 2.49 0.28 4.92 0.04 -1.26 -4.99 135.00 136.94 1wc9 s PRO 91 Ca 0.14 1.17 -0.06 0.00 0.04 0.00 0.00 61.00 62.29 1wc9 s PRO 91 Cb -0.22 -1.92 -0.06 0.00 0.04 0.00 0.00 34.50 32.34 1wc9 s PRO 91 CO -0.06 -1.47 0.56 -1.54 0.04 0.00 0.00 177.00 174.54 1wc9 s SER 92 N -3.32 6.48 -0.27 6.66 1.04 -0.53 -4.72 113.70 119.04 1wc9 s SER 92 Ca 0.62 0.76 -0.10 0.00 0.48 0.00 0.00 55.95 57.71 1wc9 s SER 92 Cb -0.17 -2.16 -0.04 0.00 0.10 0.00 0.00 66.02 63.74 1wc9 s SER 92 CO 0.53 -0.18 0.15 -0.63 0.98 0.00 0.00 173.24 174.09 1wc9 s ILE 93 N -2.05 4.99 0.32 -1.02 1.01 -1.26 -0.76 121.20 122.44 1wc9 s ILE 93 Ca 0.45 0.04 0.05 0.00 0.00 0.00 0.00 60.65 61.20 1wc9 s ILE 93 Cb -0.11 -3.38 -0.03 0.00 0.01 0.00 0.00 42.46 38.95 1wc9 s ILE 93 CO 0.28 0.27 0.23 0.42 0.00 0.00 0.00 174.94 176.14 1wc9 s THR 94 N 1.71 0.09 -1.16 2.92 -4.23 -0.31 -4.97 115.64 109.70 1wc9 s THR 94 Ca 0.07 -2.00 -0.28 0.00 -1.18 0.00 0.00 61.69 58.29 1wc9 s THR 94 Cb -0.16 -2.48 0.03 0.00 1.34 0.00 0.00 72.50 71.23 1wc9 s THR 94 CO 0.09 0.00 0.71 -3.20 -0.54 0.00 0.00 174.62 171.68 1wc9 n ASN 95 N -1.30 -4.58 -4.73 3.99 4.05 -1.26 -0.62 115.26 110.80 1wc9 n ASN 95 Ca 0.05 -1.19 -0.41 0.00 0.45 0.00 0.00 54.58 53.48 1wc9 n ASN 95 Cb 0.63 -2.18 -0.03 0.00 1.23 0.00 0.00 39.78 39.43 1wc9 n ASN 95 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 1wc9 s TRP 96 N -3.46 3.33 0.72 1.20 0.52 -1.26 -4.31 118.94 115.68 1wc9 s TRP 96 Ca 0.45 1.28 -0.13 0.00 0.02 0.00 0.00 56.10 57.72 1wc9 s TRP 96 Cb -0.22 -3.53 0.03 0.00 -1.15 0.00 0.00 33.47 28.59 1wc9 s TRP 96 CO 0.93 -1.63 1.11 -1.54 0.02 0.00 0.00 176.95 175.84 1wc9 s SER 97 N 0.37 4.77 0.25 2.95 1.04 -0.11 -4.89 113.70 118.07 1wc9 s SER 97 Ca 0.56 1.94 -0.04 0.00 0.48 0.00 0.00 55.95 58.89 1wc9 s SER 97 Cb -0.35 -2.54 0.47 0.00 0.10 0.00 0.00 66.02 63.70 1wc9 s SER 97 CO 0.36 -1.86 1.72 -0.65 0.98 0.00 0.00 173.24 173.80 1wc9 h PRO 98 N -0.52 0.41 0.00 4.02 0.11 -1.95 0.60 132.00 134.67 1wc9 h PRO 98 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1wc9 h PRO 98 Cb 1.24 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1wc9 h PRO 98 CO 0.52 0.27 0.00 0.00 -0.21 0.00 0.00 178.00 178.59 1wc9 h ALA 99 N 1.56 1.00 -0.27 -0.75 0.00 -1.97 -3.46 119.26 115.37 1wc9 h ALA 99 Ca 0.42 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.25 1wc9 h ALA 99 Cb 0.65 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1wc9 h ALA 99 CO -0.42 0.00 -0.08 0.41 0.00 0.00 0.00 179.25 179.17 1wc9 n GLY 100 N 0.24 0.55 0.75 0.00 0.00 0.20 -4.91 105.19 102.03 1wc9 n GLY 100 Ca 0.02 -0.86 0.07 0.00 0.00 0.00 0.00 46.02 45.26 1wc9 n GLY 100 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1wc9 n ASP 101 N 1.37 2.94 -3.78 1.61 5.75 -1.26 -4.79 116.55 118.39 1wc9 n ASP 101 Ca -0.04 -1.91 -0.13 0.00 -0.01 0.00 0.00 54.79 52.71 1wc9 n ASP 101 Cb 0.23 -0.23 -0.12 0.00 -1.03 0.00 0.00 41.12 39.98 1wc9 n ASP 101 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1wc9 s GLU 102 N -1.04 0.29 0.21 0.11 2.02 -1.26 0.02 118.70 119.04 1wc9 s GLU 102 Ca 0.26 0.37 -0.16 0.00 0.02 0.00 0.00 54.97 55.46 1wc9 s GLU 102 Cb 0.14 0.12 0.02 0.00 0.10 0.00 0.00 34.13 34.52 1wc9 s GLU 102 CO 0.19 -0.05 0.51 -0.59 0.02 0.00 0.00 175.26 175.35 1wc9 s PHE 103 N 0.23 -0.01 0.06 1.61 -0.12 -0.39 -0.93 117.98 118.43 1wc9 s PHE 103 Ca -0.01 -0.35 0.09 0.00 -0.05 0.00 0.00 56.93 56.62 1wc9 s PHE 103 Cb -0.02 0.35 -0.03 0.00 -0.63 0.00 0.00 43.02 42.68 1wc9 s PHE 103 CO -0.00 -0.94 -0.26 -1.12 -0.05 0.00 0.00 175.22 172.85 1wc9 s SER 104 N -2.91 3.24 -0.28 1.98 0.01 0.21 -0.29 113.70 115.66 1wc9 s SER 104 Ca 0.12 -0.61 -0.09 0.00 1.31 0.00 0.00 55.95 56.67 1wc9 s SER 104 Cb -0.01 -0.30 -0.02 0.00 0.21 0.00 0.00 66.02 65.90 1wc9 s SER 104 CO -0.00 0.24 0.14 -0.76 0.41 0.00 0.00 173.24 173.27 1wc9 s LEU 105 N -1.41 3.88 -0.30 2.44 1.43 0.12 -1.16 118.68 123.68 1wc9 s LEU 105 Ca 0.12 -0.30 -0.10 0.00 -1.03 0.00 0.00 54.13 52.83 1wc9 s LEU 105 Cb -0.10 -2.01 -0.01 0.00 0.03 0.00 0.00 46.19 44.10 1wc9 s LEU 105 CO 0.03 -0.11 0.15 -0.63 0.23 0.00 0.00 176.35 176.02 1wc9 s ILE 106 N 1.65 4.62 -0.28 -0.59 -1.09 0.06 -1.42 121.20 124.15 1wc9 s ILE 106 Ca 0.06 -0.37 -0.07 0.00 -2.23 0.00 0.00 60.65 58.03 1wc9 s ILE 106 Cb -0.16 -3.33 -0.01 0.00 -1.58 0.00 0.00 42.46 37.38 1wc9 s ILE 106 CO 0.07 0.10 0.09 -0.76 -1.23 0.00 0.00 174.94 173.20 1wc9 s LEU 107 N 1.62 3.72 0.17 2.97 1.02 0.44 -1.45 118.68 127.18 1wc9 s LEU 107 Ca 0.05 -0.49 -0.01 0.00 0.02 0.00 0.00 54.13 53.70 1wc9 s LEU 107 Cb -0.17 -1.91 0.04 0.00 0.02 0.00 0.00 46.19 44.16 1wc9 s LEU 107 CO 0.06 -0.13 1.41 -0.33 0.02 0.00 0.00 176.35 177.38 1wc9 h GLU 108 N 8.26 0.36 -4.20 1.70 5.08 -1.93 -0.42 114.58 123.42 1wc9 h GLU 108 Ca -0.34 -0.32 -0.44 0.00 -1.00 0.00 0.00 59.36 57.26 1wc9 h GLU 108 Cb 1.15 0.07 -0.33 0.00 0.50 0.00 0.00 28.75 30.14 1wc9 h GLU 108 CO 0.60 0.97 -0.78 -0.80 -1.00 0.00 0.00 179.01 178.00 1wc9 s ASN 109 N -6.98 1.17 -0.36 1.42 -0.87 -1.26 -4.75 114.94 103.31 1wc9 s ASN 109 Ca -0.05 -0.18 -0.01 0.00 -1.57 0.00 0.00 52.86 51.05 1wc9 s ASN 109 Cb 0.10 -0.54 0.09 0.00 -0.02 0.00 0.00 41.25 40.88 1wc9 s ASN 109 CO 0.84 -0.02 0.10 0.21 -2.57 0.00 0.00 177.10 175.66 1wc9 s ASN 110 N 0.78 5.03 0.31 -1.22 2.47 -1.26 -5.00 114.94 116.06 1wc9 s ASN 110 Ca -0.12 -1.80 0.08 0.00 0.42 0.00 0.00 52.86 51.44 1wc9 s ASN 110 Cb -0.14 -1.75 0.89 0.00 -1.45 0.00 0.00 41.25 38.80 1wc9 s ASN 110 CO 0.01 -0.42 1.67 -0.65 -3.72 0.00 0.00 177.10 174.00 1wc9 h PRO 111 N 7.95 0.33 -0.01 0.43 0.11 -2.00 -0.66 132.00 138.14 1wc9 h PRO 111 Ca -0.14 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.95 1wc9 h PRO 111 Cb 1.05 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.08 1wc9 h PRO 111 CO 0.61 0.22 0.07 -0.07 -0.21 0.00 0.00 178.00 178.61 1wc9 h LEU 112 N 0.34 0.00 -2.32 2.35 3.38 -1.94 -1.68 115.31 115.44 1wc9 h LEU 112 Ca 0.64 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.61 1wc9 h LEU 112 Cb 1.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.10 1wc9 h LEU 112 CO -0.59 0.00 0.00 1.33 0.09 0.00 0.00 178.44 179.27 1wc9 n VAL 113 N -3.17 0.64 -2.01 1.22 0.24 -0.25 -4.90 118.33 110.09 1wc9 n VAL 113 Ca -0.03 -0.78 -0.37 0.00 -2.04 0.00 0.00 64.34 61.13 1wc9 n VAL 113 Cb 0.14 0.75 0.03 0.00 -1.47 0.00 0.00 33.84 33.29 1wc9 n VAL 113 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1wc9 s ASP 114 N -1.32 5.34 0.00 -1.34 -0.00 -0.63 -2.36 116.67 116.35 1wc9 s ASP 114 Ca 0.41 2.44 0.00 0.00 -0.00 0.00 0.00 52.55 55.40 1wc9 s ASP 114 Cb 0.23 -2.61 0.00 0.00 -0.00 0.00 0.00 42.92 40.54 1wc9 s ASP 114 CO 0.31 -1.50 0.00 0.49 -0.00 0.00 0.00 175.17 174.47 1wc9 n PHE 115 N -1.34 0.00 -4.28 4.23 3.01 -1.26 -4.92 117.46 112.90 1wc9 n PHE 115 Ca 0.12 0.00 -0.34 0.00 1.01 0.00 0.00 57.45 58.24 1wc9 n PHE 115 Cb 0.49 -1.75 -0.09 0.00 -0.01 0.00 0.00 39.48 38.12 1wc9 n PHE 115 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1wc9 s VAL 116 N -1.10 4.38 -0.37 -4.37 1.01 -1.00 -5.08 120.40 113.87 1wc9 s VAL 116 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.62 1wc9 s VAL 116 Cb 0.00 -2.90 0.13 0.00 0.00 0.00 0.00 36.38 33.60 1wc9 s VAL 116 CO 0.00 0.50 0.19 -1.83 0.00 0.00 0.00 175.10 173.95 1wc9 s GLU 117 N -1.23 0.78 -0.52 2.72 -1.05 -1.26 -5.06 118.70 113.08 1wc9 s GLU 117 Ca 0.17 -1.41 -0.29 0.00 -0.15 0.00 0.00 54.97 53.28 1wc9 s GLU 117 Cb -0.12 -1.76 -0.11 0.00 -0.44 0.00 0.00 34.13 31.71 1wc9 s GLU 117 CO 0.07 -1.13 2.39 -0.11 0.95 0.00 0.00 175.26 177.43 1wc9 n LEU 118 N 4.17 1.99 0.00 1.83 7.94 -1.26 -4.95 117.00 126.72 1wc9 n LEU 118 Ca 0.06 -0.07 0.00 0.00 -1.11 0.00 0.00 56.01 54.89 1wc9 n LEU 118 Cb 0.38 -1.38 0.00 0.00 0.53 0.00 0.00 43.42 42.95 1wc9 n LEU 118 CO 0.16 -1.10 0.00 -2.65 -1.11 0.00 0.00 177.39 172.69 1wc9 n PRO 119 N 8.68 -0.04 -2.54 1.96 -0.02 -1.26 -4.93 135.00 136.85 1wc9 n PRO 119 Ca 0.43 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.48 1wc9 n PRO 119 Cb 0.36 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.81 1wc9 n PRO 119 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 1wc9 s ASP 120 N -2.00 7.12 0.00 2.55 1.47 -1.26 -3.61 116.67 120.94 1wc9 s ASP 120 Ca 0.00 1.71 0.00 0.00 1.18 0.00 0.00 52.55 55.44 1wc9 s ASP 120 Cb 0.00 -2.56 0.00 0.00 -0.34 0.00 0.00 42.92 40.02 1wc9 s ASP 120 CO 0.00 -0.53 0.00 -0.46 0.68 0.00 0.00 175.17 174.86 1wc9 n ASN 121 N 5.11 -0.13 -1.26 2.11 0.23 -1.26 -4.85 115.26 115.22 1wc9 n ASN 121 Ca 0.10 0.00 0.05 0.00 -0.53 0.00 0.00 54.58 54.20 1wc9 n ASN 121 Cb 0.47 -0.73 0.24 0.00 -2.08 0.00 0.00 39.78 37.68 1wc9 n ASN 121 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1wc9 n HIS 122 N -2.02 1.15 -0.07 -2.53 -0.00 -1.24 -4.52 115.22 105.99 1wc9 n HIS 122 Ca 0.00 -0.42 0.14 0.00 -0.00 0.00 0.00 57.72 57.44 1wc9 n HIS 122 Cb 0.00 -0.28 0.54 0.00 -0.00 0.00 0.00 29.99 30.26 1wc9 n HIS 122 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1wc9 h SER 123 N 2.54 0.29 1.08 0.41 4.64 -1.89 -1.35 113.55 119.27 1wc9 h SER 123 Ca 0.00 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1wc9 h SER 123 Cb 1.25 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1wc9 h SER 123 CO 0.24 0.16 0.00 0.00 -0.87 0.00 0.00 176.83 176.36 1wc9 n ALA 124 N -2.55 2.00 -2.25 5.18 0.00 -1.26 -4.80 120.51 116.83 1wc9 n ALA 124 Ca 0.10 0.01 -0.42 0.00 0.00 0.00 0.00 53.44 53.14 1wc9 n ALA 124 Cb 0.44 -1.42 -0.03 0.00 0.00 0.00 0.00 19.45 18.44 1wc9 n ALA 124 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1wc9 s LEU 125 N -4.32 4.37 -0.94 0.00 2.96 -0.51 -4.79 118.68 115.45 1wc9 s LEU 125 Ca 0.08 2.23 -0.08 0.00 -0.22 0.00 0.00 54.13 56.14 1wc9 s LEU 125 Cb 0.11 -3.58 0.24 0.00 0.50 0.00 0.00 46.19 43.46 1wc9 s LEU 125 CO 0.49 -0.59 0.88 -0.63 -1.32 0.00 0.00 176.35 175.18 1wc9 s ILE 126 N 1.06 5.29 0.27 6.68 1.01 -1.26 -4.96 121.20 129.28 1wc9 s ILE 126 Ca 0.62 -3.25 -0.08 0.00 0.00 0.00 0.00 60.65 57.95 1wc9 s ILE 126 Cb -0.34 -4.24 0.40 0.00 0.01 0.00 0.00 42.46 38.29 1wc9 s ILE 126 CO 0.30 -1.09 1.58 0.22 0.00 0.00 0.00 174.94 175.95 1wc9 h TYR 127 N 6.82 -0.41 -0.60 3.97 3.20 -1.95 -0.94 116.97 127.06 1wc9 h TYR 127 Ca 0.14 0.08 -0.14 0.00 3.14 0.00 0.00 58.73 61.95 1wc9 h TYR 127 Cb 0.91 0.32 -0.08 0.00 1.54 0.00 0.00 36.73 39.42 1wc9 h TYR 127 CO 0.81 -0.39 0.18 0.43 -1.64 0.00 0.00 178.16 177.55 1wc9 n SER 128 N -5.56 4.61 0.16 -2.11 7.64 -1.26 -4.61 113.62 112.48 1wc9 n SER 128 Ca 0.15 -2.98 0.19 0.00 1.01 0.00 0.00 58.87 57.24 1wc9 n SER 128 Cb 0.50 -0.70 0.73 0.00 -1.01 0.00 0.00 64.21 63.73 1wc9 n SER 128 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 1wc9 h ASN 129 N 2.60 0.00 -1.01 6.43 -0.00 -1.53 -1.30 115.58 120.77 1wc9 h ASN 129 Ca 0.17 0.00 0.20 0.00 -0.00 0.00 0.00 56.30 56.67 1wc9 h ASN 129 Cb 2.03 0.00 -0.11 0.00 -0.00 0.00 0.00 38.32 40.24 1wc9 h ASN 129 CO 0.59 0.00 0.61 0.25 -0.00 0.00 0.00 177.43 178.88 1wc9 h LEU 130 N 0.00 0.78 -1.48 0.34 5.85 -1.82 -1.57 115.31 117.41 1wc9 h LEU 130 Ca 0.14 0.10 0.04 0.00 0.84 0.00 0.00 57.88 59.01 1wc9 h LEU 130 Cb 1.08 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.04 1wc9 h LEU 130 CO -0.00 0.26 0.40 -0.07 -0.34 0.00 0.00 178.44 178.69 1wc9 h LEU 131 N 0.75 0.58 -0.64 2.25 3.38 -1.55 -1.46 115.31 118.61 1wc9 h LEU 131 Ca 0.59 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.52 1wc9 h LEU 131 Cb 0.94 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.53 1wc9 h LEU 131 CO -0.39 0.39 0.28 0.00 0.09 0.00 0.00 178.44 178.81 1wc9 h GLY 133 N 0.90 0.81 0.61 0.00 0.00 -1.38 -1.79 103.07 102.22 1wc9 h GLY 133 Ca 0.22 -0.55 0.05 0.00 0.00 0.00 0.00 47.33 47.04 1wc9 h GLY 133 CO -0.02 0.51 0.04 -2.08 0.00 0.00 0.00 176.54 174.99 1wc9 h VAL 134 N 0.61 0.83 -0.39 4.60 2.07 -0.79 0.96 116.25 124.13 1wc9 h VAL 134 Ca 0.13 -0.05 0.01 0.00 0.82 0.00 0.00 66.70 67.62 1wc9 h VAL 134 Cb 0.41 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 1wc9 h VAL 134 CO 0.01 0.03 0.25 -0.07 0.02 0.00 0.00 177.57 177.81 1wc9 h LEU 135 N 0.14 0.42 -0.39 2.57 3.38 -1.19 -0.73 115.31 119.51 1wc9 h LEU 135 Ca 0.14 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 1wc9 h LEU 135 Cb 0.17 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1wc9 h LEU 135 CO -0.20 0.30 0.05 -0.09 0.09 0.00 0.00 178.44 178.59 1wc9 h ARG 136 N 0.51 0.66 -0.36 1.13 2.43 -0.98 -2.08 114.38 115.69 1wc9 h ARG 136 Ca 0.15 -0.18 -0.04 0.00 -0.81 0.00 0.00 59.98 59.10 1wc9 h ARG 136 Cb -0.03 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 1wc9 h ARG 136 CO -0.05 0.72 0.08 0.78 -1.51 0.00 0.00 179.97 179.99 1wc9 h GLY 137 N 0.50 0.63 0.98 2.80 0.00 -0.71 -1.54 103.07 105.73 1wc9 h GLY 137 Ca 0.12 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 47.04 1wc9 h GLY 137 CO 0.01 0.37 0.19 0.00 0.00 0.00 0.00 176.54 177.12 1wc9 h ALA 138 N 0.93 0.40 -0.05 3.60 0.00 -1.11 -2.88 119.26 120.15 1wc9 h ALA 138 Ca 0.11 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1wc9 h ALA 138 Cb 0.32 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1wc9 h ALA 138 CO 0.00 -0.10 -0.34 -0.07 0.00 0.00 0.00 179.25 178.74 1wc9 h LEU 139 N 0.41 0.09 -1.28 0.00 3.38 -1.31 -2.68 115.31 113.92 1wc9 h LEU 139 Ca 0.11 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1wc9 h LEU 139 Cb 0.00 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1wc9 h LEU 139 CO -0.02 0.44 0.31 -0.08 0.09 0.00 0.00 178.44 179.18 1wc9 h GLU 140 N 0.08 0.81 0.00 1.13 4.81 -1.06 -0.54 114.58 119.81 1wc9 h GLU 140 Ca 0.01 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1wc9 h GLU 140 Cb 0.65 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.87 1wc9 h GLU 140 CO 0.05 0.60 0.00 0.52 -0.73 0.00 0.00 179.01 179.45 1wc9 h MET 141 N 0.82 0.00 -0.58 1.92 2.86 -1.37 -2.04 114.93 116.54 1wc9 h MET 141 Ca 0.21 0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 57.59 1wc9 h MET 141 Cb 0.03 0.00 -0.15 0.00 0.06 0.00 0.00 31.60 31.54 1wc9 h MET 141 CO -0.03 0.00 0.18 1.33 1.06 0.00 0.00 176.91 179.45 1wc9 n VAL 142 N -2.78 2.76 -2.40 -2.22 0.24 -0.71 -4.93 118.33 108.28 1wc9 n VAL 142 Ca 0.00 -2.24 -0.16 0.00 -2.04 0.00 0.00 64.34 59.90 1wc9 n VAL 142 Cb 0.21 -0.36 -0.00 0.00 -1.47 0.00 0.00 33.84 32.22 1wc9 n VAL 142 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1wc9 n GLN 143 N -0.90 -1.73 -3.98 7.34 1.13 -0.77 -4.84 117.38 113.63 1wc9 n GLN 143 Ca 0.40 0.74 -0.31 0.00 -1.94 0.00 0.00 57.00 55.89 1wc9 n GLN 143 Cb 1.25 -5.10 -0.15 0.00 0.11 0.00 0.00 30.24 26.34 1wc9 n GLN 143 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 1wc9 s MET 144 N -4.90 1.79 -0.29 -1.09 -1.94 -0.29 -1.01 119.30 111.56 1wc9 s MET 144 Ca 0.05 -1.12 -0.26 0.00 -1.71 0.00 0.00 55.69 52.65 1wc9 s MET 144 Cb -0.02 -2.69 0.01 0.00 2.01 0.00 0.00 34.83 34.14 1wc9 s MET 144 CO 0.06 -0.60 0.90 0.00 -0.01 0.00 0.00 175.02 175.36 1wc9 s ALA 145 N 1.30 3.55 0.21 3.03 0.00 -0.32 -2.92 121.76 126.61 1wc9 s ALA 145 Ca -0.06 -0.22 0.02 0.00 0.00 0.00 0.00 51.96 51.69 1wc9 s ALA 145 Cb -0.19 -3.43 -0.05 0.00 0.00 0.00 0.00 23.12 19.45 1wc9 s ALA 145 CO -0.06 -1.23 0.04 0.14 0.00 0.00 0.00 175.76 174.65 1wc9 s VAL 146 N 3.17 0.62 -0.17 0.00 -7.23 -1.26 -0.73 120.40 114.80 1wc9 s VAL 146 Ca 0.38 -1.99 0.01 0.00 -1.81 0.00 0.00 61.98 58.57 1wc9 s VAL 146 Cb -0.14 -2.35 0.01 0.00 0.56 0.00 0.00 36.38 34.46 1wc9 s VAL 146 CO 0.12 -0.26 -0.19 -0.70 -0.31 0.00 0.00 175.10 173.76 1wc9 s GLU 147 N -3.97 3.07 -0.11 4.82 2.12 0.04 -4.88 118.70 119.79 1wc9 s GLU 147 Ca 0.30 -0.81 0.03 0.00 0.36 0.00 0.00 54.97 54.86 1wc9 s GLU 147 Cb 0.07 -2.57 0.00 0.00 0.26 0.00 0.00 34.13 31.89 1wc9 s GLU 147 CO 0.08 -0.10 -0.23 0.00 -0.54 0.00 0.00 175.26 174.47 1wc9 s ALA 148 N 1.06 2.22 -0.02 6.30 0.00 -1.26 -0.92 121.76 129.14 1wc9 s ALA 148 Ca -0.01 -0.98 -0.16 0.00 0.00 0.00 0.00 51.96 50.81 1wc9 s ALA 148 Cb -0.14 -0.87 0.03 0.00 0.00 0.00 0.00 23.12 22.13 1wc9 s ALA 148 CO -0.06 0.24 0.34 -1.59 0.00 0.00 0.00 175.76 174.68 1wc9 s LYS 149 N 0.41 0.69 0.01 0.00 -2.85 -0.80 -4.83 119.74 112.37 1wc9 s LYS 149 Ca -0.17 -0.15 -0.30 0.00 -1.00 0.00 0.00 55.97 54.36 1wc9 s LYS 149 Cb -0.17 0.31 -0.03 0.00 -2.06 0.00 0.00 37.83 35.87 1wc9 s LYS 149 CO 0.07 -0.19 0.98 -0.06 0.10 0.00 0.00 175.35 176.25 1wc9 s PHE 150 N -1.29 3.67 -0.10 1.78 0.40 -1.26 -0.42 117.98 120.76 1wc9 s PHE 150 Ca -0.13 1.70 0.04 0.00 -0.60 0.00 0.00 56.93 57.94 1wc9 s PHE 150 Cb -0.05 -3.12 -0.06 0.00 0.51 0.00 0.00 43.02 40.30 1wc9 s PHE 150 CO 0.05 -0.02 0.13 1.33 0.70 0.00 0.00 175.22 177.41 1wc9 n VAL 151 N 3.83 0.00 -3.84 -0.44 0.24 0.15 -4.93 118.33 113.34 1wc9 n VAL 151 Ca 0.06 -0.24 -0.12 0.00 -2.04 0.00 0.00 64.34 62.00 1wc9 n VAL 151 Cb 0.51 0.69 -0.10 0.00 -1.47 0.00 0.00 33.84 33.46 1wc9 n VAL 151 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1wc9 s GLN 152 N -1.87 0.43 -0.18 7.34 -0.21 -1.16 -4.92 119.66 119.09 1wc9 s GLN 152 Ca -0.00 -0.19 -0.06 0.00 0.02 0.00 0.00 55.36 55.13 1wc9 s GLN 152 Cb 0.03 0.19 0.08 0.00 1.00 0.00 0.00 33.01 34.31 1wc9 s GLN 152 CO 0.18 -0.10 0.37 0.34 -2.12 0.00 0.00 175.29 173.96 1wc9 s ASP 153 N -0.96 -0.08 0.57 5.90 -1.08 -1.20 -1.08 116.67 118.74 1wc9 s ASP 153 Ca -0.10 0.87 0.26 0.00 -0.52 0.00 0.00 52.55 53.06 1wc9 s ASP 153 Cb -0.06 1.13 1.60 0.00 -1.46 0.00 0.00 42.92 44.14 1wc9 s ASP 153 CO 0.01 -0.23 2.13 0.71 0.52 0.00 0.00 175.17 178.32 1wc9 h THR 154 N 6.18 0.60 0.00 1.71 1.35 -1.73 0.65 112.91 121.67 1wc9 h THR 154 Ca -0.16 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.68 1wc9 h THR 154 Cb 1.11 0.89 -0.00 0.00 -1.73 0.00 0.00 68.15 68.42 1wc9 h THR 154 CO 0.13 0.00 -0.07 -0.07 -0.25 0.00 0.00 175.52 175.26 1wc9 h LEU 155 N 0.00 0.00 -3.13 3.87 3.38 -1.93 -2.42 115.31 115.08 1wc9 h LEU 155 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1wc9 h LEU 155 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1wc9 h LEU 155 CO -0.00 0.07 0.00 0.29 0.09 0.00 0.00 178.44 178.89 1wc9 n LYS 156 N -3.35 3.71 -0.24 1.13 5.02 0.20 -4.70 118.16 119.93 1wc9 n LYS 156 Ca -0.01 -2.89 0.00 0.00 -2.02 0.00 0.00 58.31 53.39 1wc9 n LYS 156 Cb 0.23 -1.88 0.00 0.00 -0.02 0.00 0.00 35.03 33.36 1wc9 n LYS 156 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wc9 n GLY 157 N 1.13 0.75 3.78 0.72 0.00 -0.91 -4.99 105.19 105.68 1wc9 n GLY 157 Ca 0.26 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.95 1wc9 n GLY 157 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wc9 s ASP 158 N -2.91 5.20 0.49 1.61 1.01 -1.10 -4.94 116.67 116.04 1wc9 s ASP 158 Ca 0.00 1.88 0.28 0.00 0.71 0.00 0.00 52.55 55.42 1wc9 s ASP 158 Cb 0.00 -2.53 1.19 0.00 1.01 0.00 0.00 42.92 42.58 1wc9 s ASP 158 CO 0.00 -1.57 1.93 1.23 0.21 0.00 0.00 175.17 176.98 1wc9 h GLY 159 N -0.16 0.00 -2.19 0.21 0.00 -1.93 -3.38 103.07 95.62 1wc9 h GLY 159 Ca -0.46 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 46.76 1wc9 h GLY 159 CO 0.55 0.00 -0.19 -1.34 0.00 0.00 0.00 176.54 175.55 1wc9 s VAL 160 N -3.77 0.00 -0.18 4.60 -7.23 -1.26 -4.97 120.40 107.59 1wc9 s VAL 160 Ca -0.00 -1.51 -0.08 0.00 -1.81 0.00 0.00 61.98 58.58 1wc9 s VAL 160 Cb 0.10 -2.32 -0.04 0.00 0.56 0.00 0.00 36.38 34.68 1wc9 s VAL 160 CO 0.59 0.00 0.07 -0.89 -0.31 0.00 0.00 175.10 174.56 1wc9 s THR 161 N -3.87 4.83 -0.09 5.32 2.01 -0.17 -3.26 115.64 120.41 1wc9 s THR 161 Ca 0.26 -0.02 0.01 0.00 0.31 0.00 0.00 61.69 62.25 1wc9 s THR 161 Cb 0.00 -3.18 0.02 0.00 0.01 0.00 0.00 72.50 69.35 1wc9 s THR 161 CO 0.11 0.46 -0.12 -0.70 -0.69 0.00 0.00 174.62 173.68 1wc9 s GLU 162 N 0.36 1.81 -0.29 4.92 2.12 -0.24 -0.42 118.70 126.96 1wc9 s GLU 162 Ca 0.03 -0.42 -0.06 0.00 0.36 0.00 0.00 54.97 54.89 1wc9 s GLU 162 Cb -0.12 -1.60 0.01 0.00 0.26 0.00 0.00 34.13 32.69 1wc9 s GLU 162 CO -0.00 -0.07 0.05 0.42 -0.54 0.00 0.00 175.26 175.12 1wc9 s ILE 163 N 1.02 3.74 -0.14 -3.70 1.01 -0.51 -0.68 121.20 121.95 1wc9 s ILE 163 Ca -0.07 -0.79 -0.23 0.00 0.00 0.00 0.00 60.65 59.56 1wc9 s ILE 163 Cb -0.15 -2.94 -0.03 0.00 0.01 0.00 0.00 42.46 39.36 1wc9 s ILE 163 CO -0.01 0.08 0.69 -0.60 0.00 0.00 0.00 174.94 175.10 1wc9 s ARG 164 N 1.46 4.32 -0.15 2.79 6.06 0.44 -0.70 118.95 133.17 1wc9 s ARG 164 Ca 0.02 0.79 -0.02 0.00 -2.50 0.00 0.00 55.73 54.02 1wc9 s ARG 164 Cb -0.17 -3.52 -0.02 0.00 0.06 0.00 0.00 34.95 31.30 1wc9 s ARG 164 CO 0.01 -0.12 -0.09 -1.64 -2.50 0.00 0.00 175.30 170.97 1wc9 s MET 165 N 1.46 3.47 -0.09 5.12 -1.94 0.60 -1.90 119.30 126.03 1wc9 s MET 165 Ca 0.34 -0.62 0.02 0.00 -1.71 0.00 0.00 55.69 53.71 1wc9 s MET 165 Cb -0.17 -2.78 0.01 0.00 2.01 0.00 0.00 34.83 33.91 1wc9 s MET 165 CO 0.14 0.15 -0.14 0.50 -0.01 0.00 0.00 175.02 175.66 1wc9 s ARG 166 N 0.54 1.98 -0.32 2.03 3.52 -0.10 -1.26 118.95 125.35 1wc9 s ARG 166 Ca -0.06 -0.48 -0.28 0.00 -0.13 0.00 0.00 55.73 54.78 1wc9 s ARG 166 Cb -0.15 -1.69 0.01 0.00 -1.56 0.00 0.00 34.95 31.56 1wc9 s ARG 166 CO 0.03 -0.04 1.02 0.12 -0.81 0.00 0.00 175.30 175.62 1wc9 s PHE 167 N 0.92 3.16 -0.18 5.12 5.36 0.10 -0.78 117.98 131.69 1wc9 s PHE 167 Ca -0.09 1.13 -0.20 0.00 -0.96 0.00 0.00 56.93 56.81 1wc9 s PHE 167 Cb -0.15 -3.61 -0.17 0.00 -0.34 0.00 0.00 43.02 38.75 1wc9 s PHE 167 CO 0.00 -0.73 0.25 0.82 -1.46 0.00 0.00 175.22 174.10 1wc9 h ILE 168 N 5.71 0.90 -1.02 3.12 2.04 -1.24 -3.48 117.51 123.54 1wc9 h ILE 168 Ca -0.21 -1.98 0.36 0.00 1.00 0.00 0.00 64.86 64.02 1wc9 h ILE 168 Cb 1.07 2.01 -0.19 0.00 -0.74 0.00 0.00 36.82 38.97 1wc9 h ILE 168 CO 1.01 0.30 0.99 0.00 0.00 0.00 0.00 178.15 180.45 1wc9 s ARG 169 N -2.28 0.01 0.19 2.37 1.70 -1.14 -5.04 118.95 114.77 1wc9 s ARG 169 Ca -0.24 -0.01 -0.26 0.00 -0.47 0.00 0.00 55.73 54.76 1wc9 s ARG 169 Cb 0.03 0.01 -0.08 0.00 -0.57 0.00 0.00 34.95 34.34 1wc9 s ARG 169 CO 0.53 -0.01 0.81 -0.98 -1.08 0.00 0.00 175.30 174.58 1wc9 s ARG 170 N -2.02 4.63 0.46 3.89 1.70 -1.26 -1.17 118.95 125.18 1wc9 s ARG 170 Ca 0.13 1.23 0.06 0.00 -0.47 0.00 0.00 55.73 56.68 1wc9 s ARG 170 Cb 0.02 -3.25 0.02 0.00 -0.57 0.00 0.00 34.95 31.17 1wc9 s ARG 170 CO -0.04 0.55 0.64 0.42 -1.08 0.00 0.00 175.30 175.79 1wc9 s ILE 171 N -1.18 2.88 0.00 4.99 1.01 -0.18 -4.90 121.20 123.83 1wc9 s ILE 171 Ca 0.37 -0.90 0.00 0.00 0.00 0.00 0.00 60.65 60.13 1wc9 s ILE 171 Cb -0.24 -2.98 0.00 0.00 0.01 0.00 0.00 42.46 39.26 1wc9 s ILE 171 CO 0.27 0.00 0.00 1.21 0.00 0.00 0.00 174.94 176.42