#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2av9 n ALA 4 N 0.00 -2.76 -1.54 1.79 0.00 -1.26 -4.91 120.51 111.83 2av9 n ALA 4 Ca 0.00 0.12 -0.57 0.00 0.00 0.00 0.00 53.44 52.99 2av9 n ALA 4 Cb 0.00 -0.68 -0.07 0.00 0.00 0.00 0.00 19.45 18.70 2av9 n ALA 4 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2av9 n PRO 5 N 0.47 0.44 -3.78 0.00 -0.04 -1.26 -4.88 135.00 125.95 2av9 n PRO 5 Ca 0.00 0.16 -0.37 0.00 -0.04 0.00 0.00 63.50 63.25 2av9 n PRO 5 Cb 0.00 -1.71 -0.13 0.00 -0.04 0.00 0.00 33.50 31.62 2av9 n PRO 5 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2av9 s ARG 6 N 0.27 2.80 0.58 0.54 0.52 -1.26 -5.06 118.95 117.34 2av9 s ARG 6 Ca 0.89 -1.04 -0.19 0.00 -0.52 0.00 0.00 55.73 54.86 2av9 s ARG 6 Cb -1.15 -3.37 -0.05 0.00 0.52 0.00 0.00 34.95 30.90 2av9 s ARG 6 CO 0.54 -0.55 1.00 -2.30 0.02 0.00 0.00 175.30 174.00 2av9 n PRO 7 N 4.81 0.99 -4.08 3.54 -0.02 -1.26 -4.51 135.00 134.48 2av9 n PRO 7 Ca -0.14 0.38 -0.22 0.00 -2.02 0.00 0.00 63.50 61.51 2av9 n PRO 7 Cb 0.46 -2.19 -0.04 0.00 -0.02 0.00 0.00 33.50 31.72 2av9 n PRO 7 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2av9 s LEU 8 N -2.00 3.94 0.26 2.45 1.43 -1.26 -0.55 118.68 122.95 2av9 s LEU 8 Ca 0.74 -0.17 -0.02 0.00 -1.03 0.00 0.00 54.13 53.65 2av9 s LEU 8 Cb -0.43 -2.48 0.53 0.00 0.03 0.00 0.00 46.19 43.84 2av9 s LEU 8 CO 0.48 -0.05 1.71 -0.09 0.23 0.00 0.00 176.35 178.63 2av9 h ARG 9 N 1.41 0.36 0.00 1.70 2.43 -1.82 -2.46 114.38 116.01 2av9 h ARG 9 Ca -0.49 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 2av9 h ARG 9 Cb 1.24 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 2av9 h ARG 9 CO 0.61 0.24 0.00 0.39 -1.51 0.00 0.00 179.97 179.70 2av9 n GLU 10 N -5.07 0.06 0.00 0.20 4.71 -1.26 -1.51 120.64 117.77 2av9 n GLU 10 Ca 0.16 0.42 0.14 0.00 -0.01 0.00 0.00 57.16 57.87 2av9 n GLU 10 Cb 0.49 -1.64 0.64 0.00 -1.01 0.00 0.00 31.44 29.92 2av9 n GLU 10 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 2av9 n GLN 11 N -1.75 0.43 -4.70 3.49 6.02 -0.92 -4.88 117.38 115.06 2av9 n GLN 11 Ca 0.01 -0.09 -0.31 0.00 -0.01 0.00 0.00 57.00 56.60 2av9 n GLN 11 Cb 0.11 -1.50 -0.13 0.00 1.02 0.00 0.00 30.24 29.74 2av9 n GLN 11 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 2av9 s TYR 12 N -2.63 2.59 -0.51 1.08 1.51 -0.57 -4.87 117.35 113.94 2av9 s TYR 12 Ca 0.25 -0.24 0.22 0.00 -1.01 0.00 0.00 57.07 56.29 2av9 s TYR 12 Cb 0.20 -1.50 -0.22 0.00 -0.11 0.00 0.00 41.96 40.34 2av9 s TYR 12 CO 0.50 0.24 0.75 1.28 -1.11 0.00 0.00 175.55 177.21 2av9 n LEU 13 N 1.68 0.51 -3.73 -1.29 7.99 -0.73 -4.88 117.00 116.55 2av9 n LEU 13 Ca -0.16 -0.19 -0.12 0.00 -0.01 0.00 0.00 56.01 55.53 2av9 n LEU 13 Cb 0.52 -0.02 -0.12 0.00 -0.11 0.00 0.00 43.42 43.70 2av9 n LEU 13 CO 0.27 0.10 -0.03 -2.28 -1.51 0.00 0.00 177.39 173.94 2av9 s HIS 14 N -3.26 -0.43 0.09 -1.77 5.65 -0.86 -4.98 115.29 109.74 2av9 s HIS 14 Ca 0.00 0.97 0.10 0.00 0.25 0.00 0.00 55.06 56.39 2av9 s HIS 14 Cb 0.15 0.14 -0.03 0.00 -1.18 0.00 0.00 32.58 31.66 2av9 s HIS 14 CO 0.87 -0.25 -0.26 -0.06 -0.65 0.00 0.00 174.74 174.39 2av9 s PHE 15 N 0.92 2.33 -0.09 3.88 0.40 -1.26 -0.02 117.98 124.14 2av9 s PHE 15 Ca -0.06 -0.39 -0.03 0.00 -0.60 0.00 0.00 56.93 55.85 2av9 s PHE 15 Cb -0.07 -1.32 0.05 0.00 0.51 0.00 0.00 43.02 42.19 2av9 s PHE 15 CO -0.07 0.24 0.15 -1.14 0.70 0.00 0.00 175.22 175.11 2av9 s GLN 16 N -1.68 0.03 0.40 0.44 0.74 -1.26 -5.01 119.66 113.33 2av9 s GLN 16 Ca 0.13 0.51 -0.25 0.00 0.05 0.00 0.00 55.36 55.80 2av9 s GLN 16 Cb -0.10 -0.39 -0.08 0.00 1.10 0.00 0.00 33.01 33.54 2av9 s GLN 16 CO 0.04 -0.34 1.19 -1.25 -0.55 0.00 0.00 175.29 174.38 2av9 s PRO 17 N 2.28 4.03 -0.05 1.67 0.04 -1.26 -4.48 135.00 137.22 2av9 s PRO 17 Ca 0.03 1.88 0.00 0.00 0.04 0.00 0.00 61.00 62.95 2av9 s PRO 17 Cb -0.12 -2.67 0.02 0.00 0.04 0.00 0.00 34.50 31.77 2av9 s PRO 17 CO -0.06 -0.35 -0.02 0.42 0.04 0.00 0.00 177.00 177.03 2av9 s ILE 18 N -1.40 0.39 0.24 0.56 1.01 -0.40 -4.98 121.20 116.62 2av9 s ILE 18 Ca 0.57 0.01 -0.30 0.00 0.00 0.00 0.00 60.65 60.93 2av9 s ILE 18 Cb -0.32 -0.47 -0.09 0.00 0.01 0.00 0.00 42.46 41.59 2av9 s ILE 18 CO 0.40 0.21 0.94 -0.94 0.00 0.00 0.00 174.94 175.55 2av9 s SER 19 N 1.25 7.64 0.48 3.58 1.04 -1.26 -3.63 113.70 122.81 2av9 s SER 19 Ca -0.06 1.95 -0.12 0.00 0.48 0.00 0.00 55.95 58.20 2av9 s SER 19 Cb -0.13 -2.61 -0.06 0.00 0.10 0.00 0.00 66.02 63.31 2av9 s SER 19 CO -0.02 0.16 0.89 0.42 0.98 0.00 0.00 173.24 175.67 2av9 s THR 20 N -1.17 4.69 0.26 2.02 -4.23 -1.26 -5.05 115.64 110.89 2av9 s THR 20 Ca 0.41 0.85 0.11 0.00 -1.18 0.00 0.00 61.69 61.88 2av9 s THR 20 Cb -0.26 -3.76 -0.05 0.00 1.34 0.00 0.00 72.50 69.78 2av9 s THR 20 CO 0.32 -0.70 -0.13 -0.13 -0.54 0.00 0.00 174.62 173.44 2av9 s ARG 21 N -4.19 1.90 0.19 3.99 0.52 -1.26 -4.96 118.95 115.14 2av9 s ARG 21 Ca 0.54 -1.58 -0.15 0.00 -0.52 0.00 0.00 55.73 54.02 2av9 s ARG 21 Cb -0.10 -1.94 0.18 0.00 0.52 0.00 0.00 34.95 33.60 2av9 s ARG 21 CO 0.35 0.36 1.64 2.35 0.02 0.00 0.00 175.30 180.02 2av9 h TRP 22 N 2.32 -0.32 -0.14 -0.53 2.91 -1.98 -1.29 115.95 116.93 2av9 h TRP 22 Ca -0.43 0.05 0.00 0.00 1.13 0.00 0.00 58.89 59.64 2av9 h TRP 22 Cb 1.25 0.22 0.00 0.00 -0.51 0.00 0.00 29.16 30.12 2av9 h TRP 22 CO 0.74 -0.24 0.00 1.58 -1.03 0.00 0.00 178.44 179.49 2av9 n HIS 23 N -5.38 0.17 0.07 2.65 -0.00 -1.26 -2.95 115.22 108.52 2av9 n HIS 23 Ca 0.05 -0.09 0.06 0.00 0.46 0.00 0.00 57.72 58.21 2av9 n HIS 23 Cb 0.29 0.00 0.50 0.00 -0.12 0.00 0.00 29.99 30.66 2av9 n HIS 23 CO 0.00 0.00 0.00 -0.44 0.46 0.00 0.00 176.34 176.36 2av9 h ASP 24 N 1.43 0.31 -3.54 0.26 3.32 -1.63 -3.42 116.42 113.14 2av9 h ASP 24 Ca 0.00 -0.01 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 2av9 h ASP 24 Cb 0.32 -0.07 0.02 0.00 0.22 0.00 0.00 39.33 39.81 2av9 h ASP 24 CO 0.00 0.22 0.53 0.20 -1.72 0.00 0.00 179.24 178.47 2av9 s ASN 25 N -6.75 7.14 0.60 6.45 0.01 -1.15 -0.74 114.94 120.50 2av9 s ASN 25 Ca -0.07 2.21 -0.01 0.00 -0.71 0.00 0.00 52.86 54.28 2av9 s ASN 25 Cb 0.18 -2.61 0.07 0.00 0.41 0.00 0.00 41.25 39.29 2av9 s ASN 25 CO 0.71 -0.32 0.45 -0.90 -1.51 0.00 0.00 177.10 175.54 2av9 n ASP 26 N 2.31 0.50 0.17 -1.22 5.68 -0.30 -4.83 116.55 118.86 2av9 n ASP 26 Ca 0.03 -1.45 0.13 0.00 -0.50 0.00 0.00 54.79 53.00 2av9 n ASP 26 Cb 0.45 -0.30 0.59 0.00 -1.14 0.00 0.00 41.12 40.72 2av9 n ASP 26 CO 0.00 0.00 0.00 0.16 -1.33 0.00 0.00 177.20 176.03 2av9 h ILE 27 N -0.60 0.00 -0.13 2.12 3.07 -1.97 0.22 117.51 120.21 2av9 h ILE 27 Ca -0.15 -0.14 0.00 0.00 1.55 0.00 0.00 64.86 66.12 2av9 h ILE 27 Cb 0.52 0.80 0.00 0.00 -0.27 0.00 0.00 36.82 37.87 2av9 h ILE 27 CO 0.15 0.00 0.00 -1.22 -1.05 0.00 0.00 178.15 176.03 2av9 n TYR 28 N -2.35 0.15 -0.39 0.16 4.01 -1.26 -4.94 117.16 112.53 2av9 n TYR 28 Ca 0.00 -0.08 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 2av9 n TYR 28 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 2av9 n TYR 28 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2av9 n GLY 29 N 1.26 0.72 3.57 2.72 0.00 0.76 -5.04 105.19 109.18 2av9 n GLY 29 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 2av9 n GLY 29 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2av9 s HIS 30 N -2.62 1.95 0.08 1.61 -3.43 -1.26 -4.80 115.29 106.82 2av9 s HIS 30 Ca 0.00 -1.03 -0.31 0.00 -0.80 0.00 0.00 55.06 52.92 2av9 s HIS 30 Cb 0.00 -1.38 -0.10 0.00 -1.43 0.00 0.00 32.58 29.67 2av9 s HIS 30 CO 0.00 0.01 1.85 0.08 -2.00 0.00 0.00 174.74 174.68 2av9 s VAL 31 N -3.09 2.77 0.67 -5.38 1.01 0.15 -1.15 120.40 115.38 2av9 s VAL 31 Ca 0.24 0.11 -0.17 0.00 0.00 0.00 0.00 61.98 62.16 2av9 s VAL 31 Cb 0.05 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.36 2av9 s VAL 31 CO 0.12 -0.00 1.27 0.21 0.00 0.00 0.00 175.10 176.70 2av9 s ASN 32 N 3.23 4.53 0.40 3.32 3.84 0.08 -4.81 114.94 125.53 2av9 s ASN 32 Ca 0.82 2.54 0.16 0.00 0.21 0.00 0.00 52.86 56.59 2av9 s ASN 32 Cb -0.44 -2.61 0.86 0.00 -0.55 0.00 0.00 41.25 38.51 2av9 s ASN 32 CO 0.37 -2.05 1.87 -0.55 -2.79 0.00 0.00 177.10 173.95 2av9 h ASN 33 N 0.35 0.00 -0.35 -4.21 -1.07 -1.91 -2.63 115.58 105.76 2av9 h ASN 33 Ca -0.50 0.00 -0.07 0.00 0.07 0.00 0.00 56.30 55.80 2av9 h ASN 33 Cb 1.32 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 37.55 2av9 h ASN 33 CO 0.52 0.31 -0.03 0.58 0.07 0.00 0.00 177.43 178.89 2av9 h VAL 34 N 0.00 1.24 -0.03 6.14 2.07 -1.98 -3.22 116.25 120.46 2av9 h VAL 34 Ca -0.00 -1.01 -0.03 0.00 0.82 0.00 0.00 66.70 66.48 2av9 h VAL 34 Cb 0.60 0.93 -0.00 0.00 -1.52 0.00 0.00 31.29 31.30 2av9 h VAL 34 CO 0.04 0.35 -0.10 0.74 0.02 0.00 0.00 177.57 178.62 2av9 h THR 35 N 0.69 1.09 -0.83 2.57 2.02 -1.84 -2.19 112.91 114.42 2av9 h THR 35 Ca 0.13 -0.42 0.19 0.00 0.77 0.00 0.00 66.41 67.08 2av9 h THR 35 Cb 0.46 1.18 -0.06 0.00 -1.74 0.00 0.00 68.15 68.00 2av9 h THR 35 CO 0.02 0.13 0.56 1.88 0.37 0.00 0.00 175.52 178.47 2av9 h TYR 36 N 0.05 0.44 0.00 3.16 -1.99 -1.67 -0.69 116.97 116.26 2av9 h TYR 36 Ca 0.01 0.01 -0.15 0.00 2.00 0.00 0.00 58.73 60.60 2av9 h TYR 36 Cb 0.21 -0.14 -0.02 0.00 2.00 0.00 0.00 36.73 38.78 2av9 h TYR 36 CO 0.00 0.13 -0.72 1.88 -0.00 0.00 0.00 178.16 179.46 2av9 h TYR 37 N 0.35 0.00 -0.75 4.88 -1.99 -1.59 -0.90 116.97 116.97 2av9 h TYR 37 Ca 0.42 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 61.09 2av9 h TYR 37 Cb 1.10 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.80 2av9 h TYR 37 CO -0.00 0.72 0.23 0.00 -0.00 0.00 0.00 178.16 179.11 2av9 h ALA 38 N 1.28 1.00 -0.41 3.88 0.00 -1.24 -1.12 119.26 122.65 2av9 h ALA 38 Ca -0.01 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 2av9 h ALA 38 Cb 1.31 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2av9 h ALA 38 CO 0.09 0.67 0.16 0.74 0.00 0.00 0.00 179.25 180.92 2av9 h PHE 39 N 1.11 0.62 -0.11 0.00 0.04 -0.72 -0.47 116.94 117.41 2av9 h PHE 39 Ca 0.24 -0.05 0.03 0.00 2.80 0.00 0.00 57.97 61.00 2av9 h PHE 39 Cb 0.31 -0.18 -0.03 0.00 2.20 0.00 0.00 35.95 38.24 2av9 h PHE 39 CO 0.03 0.54 -0.10 0.74 -0.60 0.00 0.00 178.31 178.92 2av9 h PHE 40 N 0.51 -0.25 -1.01 -0.55 -1.00 -0.96 0.87 116.94 114.56 2av9 h PHE 40 Ca 0.14 0.02 0.02 0.00 2.81 0.00 0.00 57.97 60.95 2av9 h PHE 40 Cb 0.19 0.13 -0.05 0.00 3.61 0.00 0.00 35.95 39.82 2av9 h PHE 40 CO -0.00 -0.15 0.67 0.22 -1.61 0.00 0.00 178.31 177.43 2av9 h ASP 41 N -0.12 1.15 -0.05 2.17 1.82 -1.09 -1.49 116.42 118.81 2av9 h ASP 41 Ca 0.08 -0.03 -0.03 0.00 -0.39 0.00 0.00 57.03 56.66 2av9 h ASP 41 Cb 0.23 -0.28 0.00 0.00 0.68 0.00 0.00 39.33 39.96 2av9 h ASP 41 CO -0.18 0.82 -0.09 0.74 -1.61 0.00 0.00 179.24 178.92 2av9 h THR 42 N 1.35 1.42 -0.47 2.25 2.02 -0.41 -2.19 112.91 116.88 2av9 h THR 42 Ca 0.38 -1.38 0.04 0.00 0.77 0.00 0.00 66.41 66.21 2av9 h THR 42 Cb -0.13 2.21 -0.04 0.00 -1.74 0.00 0.00 68.15 68.45 2av9 h THR 42 CO -0.09 0.38 0.24 0.00 0.37 0.00 0.00 175.52 176.42 2av9 h ALA 43 N 0.49 0.59 0.01 6.16 0.00 -0.78 -1.55 119.26 124.18 2av9 h ALA 43 Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2av9 h ALA 43 Cb 0.66 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2av9 h ALA 43 CO 0.02 -0.10 -0.00 0.28 0.00 0.00 0.00 179.25 179.44 2av9 h VAL 44 N 0.48 1.37 0.00 0.00 2.07 -1.27 -2.86 116.25 116.03 2av9 h VAL 44 Ca 0.20 -1.13 -0.10 0.00 0.82 0.00 0.00 66.70 66.49 2av9 h VAL 44 Cb 0.10 2.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.99 2av9 h VAL 44 CO -0.14 0.29 -0.48 0.78 0.02 0.00 0.00 177.57 178.05 2av9 h ASN 45 N -0.50 0.00 -0.22 0.57 2.35 -1.41 -1.12 115.58 115.25 2av9 h ASN 45 Ca -0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 2av9 h ASN 45 Cb 0.49 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 2av9 h ASN 45 CO 0.00 0.48 0.12 0.74 -1.65 0.00 0.00 177.43 177.12 2av9 h THR 46 N 0.00 1.11 -0.12 2.81 2.02 -1.31 0.53 112.91 117.96 2av9 h THR 46 Ca -0.00 -0.30 0.02 0.00 0.77 0.00 0.00 66.41 66.90 2av9 h THR 46 Cb 0.88 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 2av9 h THR 46 CO 0.06 0.11 -0.01 0.22 0.37 0.00 0.00 175.52 176.27 2av9 h TYR 47 N 0.25 -0.03 -0.97 3.16 3.20 -1.23 -0.81 116.97 120.54 2av9 h TYR 47 Ca 0.08 0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.98 2av9 h TYR 47 Cb 0.07 0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.31 2av9 h TYR 47 CO -0.04 -0.03 0.64 -0.07 -1.64 0.00 0.00 178.16 177.02 2av9 h LEU 48 N 0.02 1.08 -0.32 2.82 4.07 -0.95 0.38 115.31 122.41 2av9 h LEU 48 Ca 0.06 -0.02 -0.03 0.00 0.08 0.00 0.00 57.88 57.97 2av9 h LEU 48 Cb 0.07 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.54 2av9 h LEU 48 CO -0.10 0.75 0.08 0.40 -1.08 0.00 0.00 178.44 178.49 2av9 h ILE 49 N 1.26 1.22 0.20 1.22 2.04 -0.70 -0.46 117.51 122.28 2av9 h ILE 49 Ca 0.37 -0.72 -0.29 0.00 1.00 0.00 0.00 64.86 65.23 2av9 h ILE 49 Cb -0.05 1.08 0.03 0.00 -0.74 0.00 0.00 36.82 37.13 2av9 h ILE 49 CO -0.10 0.24 -1.30 -0.33 0.00 0.00 0.00 178.15 176.66 2av9 h GLU 50 N 0.36 0.42 0.00 2.37 5.08 -0.40 -3.23 114.58 119.18 2av9 h GLU 50 Ca 0.10 -0.72 -0.03 0.00 -1.00 0.00 0.00 59.36 57.72 2av9 h GLU 50 Cb 0.28 0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 2av9 h GLU 50 CO 0.00 1.34 -1.60 0.54 -1.00 0.00 0.00 179.01 178.30 2av9 n ARG 51 N -3.86 0.59 0.00 2.33 5.12 0.13 -4.57 116.66 116.40 2av9 n ARG 51 Ca -0.18 -0.10 0.10 0.00 -1.93 0.00 0.00 57.85 55.75 2av9 n ARG 51 Cb 0.99 -1.30 0.05 0.00 -1.16 0.00 0.00 32.46 31.04 2av9 n ARG 51 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2av9 n GLY 52 N 1.85 0.40 2.51 -0.13 0.00 -0.56 -4.63 105.19 104.64 2av9 n GLY 52 Ca -0.04 -0.60 -0.19 0.00 0.00 0.00 0.00 46.02 45.18 2av9 n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2av9 n GLY 53 N 1.26 1.84 3.61 -0.02 0.00 -0.73 -3.79 105.19 107.36 2av9 n GLY 53 Ca 0.11 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.59 2av9 n GLY 53 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2av9 n LEU 54 N -2.26 1.75 -4.10 0.99 -0.00 -0.29 -4.95 117.00 108.13 2av9 n LEU 54 Ca -0.19 1.11 -0.35 0.00 -0.00 0.00 0.00 56.01 56.57 2av9 n LEU 54 Cb 0.64 -1.18 -0.12 0.00 -0.00 0.00 0.00 43.42 42.77 2av9 n LEU 54 CO 0.29 -0.95 -0.16 -0.62 -0.00 0.00 0.00 177.39 175.96 2av9 s ASP 55 N 1.01 5.17 0.40 1.45 3.68 -1.26 -4.36 116.67 122.77 2av9 s ASP 55 Ca 0.87 -2.19 0.22 0.00 2.13 0.00 0.00 52.55 53.58 2av9 s ASP 55 Cb -0.98 -1.81 0.28 0.00 -1.45 0.00 0.00 42.92 38.97 2av9 s ASP 55 CO 0.50 -0.49 1.56 0.16 0.13 0.00 0.00 175.17 177.03 2av9 h ILE 56 N 6.21 0.13 0.05 4.11 3.07 -1.93 0.19 117.51 129.36 2av9 h ILE 56 Ca -0.10 -1.19 -0.16 0.00 1.55 0.00 0.00 64.86 64.96 2av9 h ILE 56 Cb 1.03 2.04 0.02 0.00 -0.27 0.00 0.00 36.82 39.64 2av9 h ILE 56 CO 0.68 0.08 -0.66 1.56 -1.05 0.00 0.00 178.15 178.75 2av9 h GLN 57 N 0.00 0.36 0.00 0.16 1.08 -2.01 -3.42 115.11 111.27 2av9 h GLN 57 Ca -0.00 -0.45 0.00 0.00 -1.45 0.00 0.00 58.65 56.74 2av9 h GLN 57 Cb 1.06 0.15 0.00 0.00 -0.05 0.00 0.00 27.48 28.64 2av9 h GLN 57 CO 0.01 1.15 0.00 0.41 -0.95 0.00 0.00 178.83 179.45 2av9 n GLY 58 N 1.30 -1.59 3.77 3.46 0.00 -1.23 -5.09 105.19 105.81 2av9 n GLY 58 Ca -0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 2av9 n GLY 58 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2av9 s GLY 59 N -0.01 2.90 0.32 -0.02 0.00 0.68 -4.93 107.32 106.26 2av9 s GLY 59 Ca 0.00 1.23 0.22 0.00 0.00 0.00 0.00 44.72 46.17 2av9 s GLY 59 CO 0.00 1.79 1.34 0.83 0.00 0.00 0.00 173.10 177.06 2av9 h GLU 60 N 2.38 0.00 -5.58 2.90 4.39 -1.95 -3.45 114.58 113.27 2av9 h GLU 60 Ca -0.50 0.00 -0.68 0.00 0.34 0.00 0.00 59.36 58.53 2av9 h GLU 60 Cb 1.26 0.00 -0.30 0.00 -0.10 0.00 0.00 28.75 29.61 2av9 h GLU 60 CO 0.61 0.03 -0.83 0.08 -1.16 0.00 0.00 179.01 177.74 2av9 s VAL 61 N -3.25 2.49 0.12 3.13 1.01 -1.26 0.44 120.40 123.08 2av9 s VAL 61 Ca 0.03 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.14 2av9 s VAL 61 Cb 0.07 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 2av9 s VAL 61 CO 0.73 0.55 -0.01 0.27 0.00 0.00 0.00 175.10 176.64 2av9 s ILE 62 N 0.13 0.47 -0.10 2.22 -4.36 -0.60 -4.76 121.20 114.20 2av9 s ILE 62 Ca -0.10 -1.92 -0.00 0.00 -0.26 0.00 0.00 60.65 58.37 2av9 s ILE 62 Cb -0.16 -1.88 -0.03 0.00 1.25 0.00 0.00 42.46 41.65 2av9 s ILE 62 CO 0.06 -0.67 -0.07 -0.83 0.24 0.00 0.00 174.94 173.66 2av9 s GLY 63 N -3.07 1.67 -0.05 6.27 0.00 -1.26 -0.83 107.32 110.05 2av9 s GLY 63 Ca 0.18 -0.88 0.05 0.00 0.00 0.00 0.00 44.72 44.07 2av9 s GLY 63 CO -0.01 -0.47 -0.20 1.08 0.00 0.00 0.00 173.10 173.50 2av9 s LEU 64 N -0.37 2.39 0.04 0.66 1.43 0.42 -4.90 118.68 118.35 2av9 s LEU 64 Ca 0.05 -0.35 -0.30 0.00 -1.03 0.00 0.00 54.13 52.49 2av9 s LEU 64 Cb -0.12 -1.46 -0.05 0.00 0.03 0.00 0.00 46.19 44.59 2av9 s LEU 64 CO 0.02 0.31 1.24 -0.69 0.23 0.00 0.00 176.35 177.46 2av9 s VAL 65 N -0.50 3.97 -0.03 -1.59 1.01 -1.26 -0.47 120.40 121.52 2av9 s VAL 65 Ca 0.06 1.39 0.01 0.00 0.00 0.00 0.00 61.98 63.44 2av9 s VAL 65 Cb -0.11 -3.89 -0.01 0.00 0.00 0.00 0.00 36.38 32.36 2av9 s VAL 65 CO 0.01 0.07 0.04 0.55 0.00 0.00 0.00 175.10 175.77 2av9 n VAL 66 N 4.15 0.00 -3.54 2.92 3.14 -0.65 -4.94 118.33 119.41 2av9 n VAL 66 Ca 0.10 -0.32 -0.11 0.00 -2.96 0.00 0.00 64.34 61.05 2av9 n VAL 66 Cb 0.46 0.82 -0.04 0.00 -1.06 0.00 0.00 33.84 34.01 2av9 n VAL 66 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 2av9 s SER 67 N -1.44 -0.43 0.02 6.55 1.04 -1.26 -5.00 113.70 113.18 2av9 s SER 67 Ca 0.00 0.34 -0.23 0.00 0.48 0.00 0.00 55.95 56.55 2av9 s SER 67 Cb 0.01 0.38 0.05 0.00 0.10 0.00 0.00 66.02 66.55 2av9 s SER 67 CO 0.04 -0.48 0.52 -0.94 0.98 0.00 0.00 173.24 173.36 2av9 s SER 68 N -1.53 -0.44 0.24 7.02 1.04 -1.26 -1.56 113.70 117.22 2av9 s SER 68 Ca -0.02 0.26 -0.09 0.00 0.48 0.00 0.00 55.95 56.58 2av9 s SER 68 Cb -0.01 0.47 -0.01 0.00 0.10 0.00 0.00 66.02 66.58 2av9 s SER 68 CO -0.00 -0.66 0.40 -0.94 0.98 0.00 0.00 173.24 173.02 2av9 s SER 69 N -1.75 0.03 -0.27 7.02 1.04 -0.43 -4.99 113.70 114.35 2av9 s SER 69 Ca -0.07 -1.07 -0.25 0.00 0.48 0.00 0.00 55.95 55.03 2av9 s SER 69 Cb -0.01 0.55 0.08 0.00 0.10 0.00 0.00 66.02 66.73 2av9 s SER 69 CO 0.01 -1.09 0.76 0.00 0.98 0.00 0.00 173.24 173.90 2av9 s ASP 71 N 0.32 3.37 -0.19 0.00 1.01 0.42 -4.98 116.67 116.62 2av9 s ASP 71 Ca 0.00 -0.40 -0.02 0.00 0.71 0.00 0.00 52.55 52.85 2av9 s ASP 71 Cb -0.05 -0.67 -0.00 0.00 1.01 0.00 0.00 42.92 43.22 2av9 s ASP 71 CO 0.00 0.30 -0.10 -0.31 0.21 0.00 0.00 175.17 175.27 2av9 s TYR 72 N -0.48 2.88 -0.17 4.23 1.51 -1.26 -1.39 117.35 122.67 2av9 s TYR 72 Ca 0.06 -1.11 0.01 0.00 -1.01 0.00 0.00 57.07 55.03 2av9 s TYR 72 Cb -0.11 -2.01 -0.11 0.00 -0.11 0.00 0.00 41.96 39.62 2av9 s TYR 72 CO 0.01 -0.58 -0.15 1.19 -1.11 0.00 0.00 175.55 174.92 2av9 n PHE 73 N 4.54 0.00 -3.78 2.71 3.72 0.31 -4.97 117.46 119.99 2av9 n PHE 73 Ca -0.19 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.08 2av9 n PHE 73 Cb 0.51 -0.64 -0.10 0.00 -0.94 0.00 0.00 39.48 38.31 2av9 n PHE 73 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2av9 s ALA 74 N -2.33 -0.69 0.57 4.37 0.00 0.05 -5.02 121.76 118.72 2av9 s ALA 74 Ca -0.22 0.55 -0.17 0.00 0.00 0.00 0.00 51.96 52.11 2av9 s ALA 74 Cb 0.06 -0.23 -0.04 0.00 0.00 0.00 0.00 23.12 22.90 2av9 s ALA 74 CO 0.38 -0.18 1.08 -1.25 0.00 0.00 0.00 175.76 175.79 2av9 s PRO 75 N -0.49 3.32 0.30 0.00 0.04 -1.26 -4.61 135.00 132.29 2av9 s PRO 75 Ca -0.06 1.36 0.06 0.00 0.04 0.00 0.00 61.00 62.41 2av9 s PRO 75 Cb -0.04 -2.02 -0.06 0.00 0.04 0.00 0.00 34.50 32.42 2av9 s PRO 75 CO 0.02 -0.83 -0.04 0.14 0.04 0.00 0.00 177.00 176.33 2av9 s VAL 76 N -2.19 1.64 -0.10 -0.36 -7.23 -1.26 -5.02 120.40 105.88 2av9 s VAL 76 Ca 0.67 -2.10 -0.08 0.00 -1.81 0.00 0.00 61.98 58.66 2av9 s VAL 76 Cb -0.19 -2.56 0.03 0.00 0.56 0.00 0.00 36.38 34.22 2av9 s VAL 76 CO 0.32 -0.22 0.26 0.00 -0.31 0.00 0.00 175.10 175.15 2av9 s ALA 77 N -3.00 -0.63 0.38 1.32 0.00 -1.26 0.31 121.76 118.87 2av9 s ALA 77 Ca 0.31 0.82 -0.27 0.00 0.00 0.00 0.00 51.96 52.82 2av9 s ALA 77 Cb 0.05 -0.49 -0.11 0.00 0.00 0.00 0.00 23.12 22.57 2av9 s ALA 77 CO 0.13 -0.14 1.21 0.34 0.00 0.00 0.00 175.76 177.30 2av9 n PHE 78 N 3.28 1.97 -0.81 0.00 7.35 -1.26 -0.04 117.46 127.95 2av9 n PHE 78 Ca -0.16 0.55 -0.06 0.00 -0.76 0.00 0.00 57.45 57.02 2av9 n PHE 78 Cb 0.57 -2.36 0.27 0.00 0.35 0.00 0.00 39.48 38.31 2av9 n PHE 78 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 2av9 n PRO 79 N 0.33 3.38 -1.48 -7.13 -0.04 -1.26 -4.99 135.00 123.81 2av9 n PRO 79 Ca 0.06 -2.72 -0.37 0.00 -0.04 0.00 0.00 63.50 60.43 2av9 n PRO 79 Cb 0.37 -2.12 0.05 0.00 -0.04 0.00 0.00 33.50 31.77 2av9 n PRO 79 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2av9 n GLN 80 N -0.13 0.60 -3.21 0.54 6.02 0.94 -4.80 117.38 117.33 2av9 n GLN 80 Ca 0.37 0.24 -0.39 0.00 -0.01 0.00 0.00 57.00 57.22 2av9 n GLN 80 Cb 1.30 -1.93 -0.05 0.00 1.02 0.00 0.00 30.24 30.57 2av9 n GLN 80 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2av9 s ARG 81 N -2.55 4.37 0.10 -1.09 0.52 -1.26 -4.21 118.95 114.83 2av9 s ARG 81 Ca 0.71 0.63 0.07 0.00 -0.52 0.00 0.00 55.73 56.63 2av9 s ARG 81 Cb -0.41 -3.43 -0.03 0.00 0.52 0.00 0.00 34.95 31.60 2av9 s ARG 81 CO 0.52 0.15 -0.18 0.96 0.02 0.00 0.00 175.30 176.76 2av9 s ILE 82 N 0.60 1.51 0.00 1.52 -4.36 -1.24 -3.10 121.20 116.13 2av9 s ILE 82 Ca 0.31 -1.50 0.00 0.00 -0.26 0.00 0.00 60.65 59.19 2av9 s ILE 82 Cb -0.16 -1.42 0.00 0.00 1.25 0.00 0.00 42.46 42.12 2av9 s ILE 82 CO 0.14 -0.15 0.00 -1.84 0.24 0.00 0.00 174.94 173.33 2av9 n GLU 83 N 1.06 2.39 -3.60 0.37 0.28 -0.00 -1.27 120.64 119.87 2av9 n GLU 83 Ca -0.19 0.00 -0.15 0.00 -0.16 0.00 0.00 57.16 56.65 2av9 n GLU 83 Cb 0.54 0.00 -0.07 0.00 1.43 0.00 0.00 31.44 33.34 2av9 n GLU 83 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 2av9 s GLY 85 N 0.00 -0.53 -0.01 -1.84 0.00 -0.18 -0.81 107.32 103.96 2av9 s GLY 85 Ca 0.00 1.65 0.00 0.00 0.00 0.00 0.00 44.72 46.37 2av9 s GLY 85 CO 0.00 1.35 0.02 -2.27 0.00 0.00 0.00 173.10 172.20 2av9 s LEU 86 N -0.29 1.45 0.07 0.66 2.96 0.97 -2.30 118.68 122.20 2av9 s LEU 86 Ca -0.05 0.02 -0.01 0.00 -0.22 0.00 0.00 54.13 53.87 2av9 s LEU 86 Cb -0.03 -0.05 -0.04 0.00 0.50 0.00 0.00 46.19 46.58 2av9 s LEU 86 CO 0.05 -0.08 -0.00 0.00 -1.32 0.00 0.00 176.35 175.00 2av9 s ARG 87 N 0.63 0.68 -0.20 1.98 1.70 -0.39 -1.76 118.95 121.59 2av9 s ARG 87 Ca -0.05 -1.25 -0.07 0.00 -0.47 0.00 0.00 55.73 53.89 2av9 s ARG 87 Cb -0.08 0.22 -0.04 0.00 -0.57 0.00 0.00 34.95 34.49 2av9 s ARG 87 CO -0.02 -0.15 0.05 0.54 -1.08 0.00 0.00 175.30 174.65 2av9 s VAL 88 N -3.94 4.52 0.00 4.99 0.11 0.02 -0.94 120.40 125.15 2av9 s VAL 88 Ca 0.10 -0.12 0.00 0.00 -2.93 0.00 0.00 61.98 59.03 2av9 s VAL 88 Cb 0.08 -3.06 0.00 0.00 -1.53 0.00 0.00 36.38 31.87 2av9 s VAL 88 CO -0.08 0.42 0.00 0.00 -3.33 0.00 0.00 175.10 172.11 2av9 n ALA 89 N 4.02 0.00 -2.37 1.54 0.00 0.15 -4.16 120.51 119.69 2av9 n ALA 89 Ca -0.16 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.89 2av9 n ALA 89 Cb 0.52 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.91 2av9 n ALA 89 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2av9 s ARG 90 N 0.03 4.09 -0.27 0.00 1.81 -1.24 -4.92 118.95 118.45 2av9 s ARG 90 Ca 0.00 0.61 0.03 0.00 -1.72 0.00 0.00 55.73 54.65 2av9 s ARG 90 Cb 0.00 -3.23 0.07 0.00 -0.45 0.00 0.00 34.95 31.33 2av9 s ARG 90 CO 0.00 0.66 -0.07 -1.17 -0.68 0.00 0.00 175.30 174.03 2av9 s LEU 91 N -1.08 3.56 0.00 2.53 0.20 -1.26 -0.10 118.68 122.53 2av9 s LEU 91 Ca 0.27 -1.51 0.00 0.00 0.69 0.00 0.00 54.13 53.58 2av9 s LEU 91 Cb -0.18 -1.51 0.00 0.00 -0.43 0.00 0.00 46.19 44.07 2av9 s LEU 91 CO 0.17 -0.23 0.00 0.61 -0.29 0.00 0.00 176.35 176.60 2av9 n GLY 92 N 4.43 1.28 0.12 7.98 0.00 0.13 -5.01 105.19 114.11 2av9 n GLY 92 Ca -0.10 -1.98 -0.12 0.00 0.00 0.00 0.00 46.02 43.82 2av9 n GLY 92 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2av9 h ASN 93 N 0.00 0.30 0.00 1.61 2.35 -2.00 -3.38 115.58 114.47 2av9 h ASN 93 Ca 0.00 -0.35 0.00 0.00 -0.55 0.00 0.00 56.30 55.40 2av9 h ASN 93 Cb 0.00 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.29 2av9 h ASN 93 CO 0.00 0.58 0.00 -1.54 -1.65 0.00 0.00 177.43 174.82 2av9 n SER 94 N -4.70 0.73 -4.35 5.81 3.41 -1.26 -1.27 113.62 111.98 2av9 n SER 94 Ca -0.05 -0.87 -0.19 0.00 -0.26 0.00 0.00 58.87 57.50 2av9 n SER 94 Cb 0.25 0.24 -0.10 0.00 -0.26 0.00 0.00 64.21 64.34 2av9 n SER 94 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2av9 s SER 95 N -0.24 2.60 -0.12 4.04 1.04 -1.26 -0.57 113.70 119.19 2av9 s SER 95 Ca 0.00 -1.03 -0.10 0.00 0.48 0.00 0.00 55.95 55.29 2av9 s SER 95 Cb 0.00 -0.14 0.03 0.00 0.10 0.00 0.00 66.02 66.01 2av9 s SER 95 CO 0.00 -0.18 0.31 0.54 0.98 0.00 0.00 173.24 174.88 2av9 s VAL 96 N -2.97 -0.00 -0.32 5.02 0.11 -0.23 -0.70 120.40 121.31 2av9 s VAL 96 Ca 0.23 0.01 -0.07 0.00 -2.93 0.00 0.00 61.98 59.22 2av9 s VAL 96 Cb -0.00 -0.44 0.02 0.00 -1.53 0.00 0.00 36.38 34.43 2av9 s VAL 96 CO 0.07 0.01 0.11 -1.58 -3.33 0.00 0.00 175.10 170.37 2av9 s GLN 97 N 0.29 2.97 0.11 1.54 2.00 0.86 -1.72 119.66 125.70 2av9 s GLN 97 Ca -0.01 -0.95 -0.12 0.00 -2.00 0.00 0.00 55.36 52.28 2av9 s GLN 97 Cb -0.03 -3.45 -0.06 0.00 0.80 0.00 0.00 33.01 30.27 2av9 s GLN 97 CO -0.01 -0.52 0.47 0.71 -0.50 0.00 0.00 175.29 175.44 2av9 s TYR 98 N 1.49 3.60 -0.08 1.67 2.02 0.16 0.30 117.35 126.51 2av9 s TYR 98 Ca 0.02 0.92 0.04 0.00 -0.37 0.00 0.00 57.07 57.68 2av9 s TYR 98 Cb -0.18 -2.26 -0.01 0.00 -0.40 0.00 0.00 41.96 39.12 2av9 s TYR 98 CO 0.03 0.48 -0.22 -1.21 -1.57 0.00 0.00 175.55 173.06 2av9 s GLU 99 N -1.90 2.81 0.10 -0.62 2.02 -0.12 -1.68 118.70 119.31 2av9 s GLU 99 Ca 0.35 -0.85 0.05 0.00 0.02 0.00 0.00 54.97 54.54 2av9 s GLU 99 Cb -0.14 -2.28 -0.03 0.00 0.10 0.00 0.00 34.13 31.77 2av9 s GLU 99 CO 0.18 0.32 -0.14 -0.51 0.02 0.00 0.00 175.26 175.13 2av9 s LEU 100 N 0.02 2.36 -0.02 1.80 1.02 0.56 -1.26 118.68 123.16 2av9 s LEU 100 Ca -0.08 -0.74 -0.08 0.00 0.02 0.00 0.00 54.13 53.24 2av9 s LEU 100 Cb -0.15 -0.51 0.01 0.00 0.02 0.00 0.00 46.19 45.56 2av9 s LEU 100 CO 0.05 -0.14 0.18 0.00 0.02 0.00 0.00 176.35 176.47 2av9 s ALA 101 N -1.87 -0.44 -0.18 4.21 0.00 -0.97 -0.40 121.76 122.12 2av9 s ALA 101 Ca 0.05 0.10 -0.07 0.00 0.00 0.00 0.00 51.96 52.04 2av9 s ALA 101 Cb -0.06 -0.00 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 2av9 s ALA 101 CO 0.02 -0.19 0.04 -1.17 0.00 0.00 0.00 175.76 174.46 2av9 s LEU 102 N -1.02 3.68 -0.03 0.00 0.20 -0.38 -1.01 118.68 120.12 2av9 s LEU 102 Ca -0.11 0.03 0.07 0.00 0.69 0.00 0.00 54.13 54.81 2av9 s LEU 102 Cb -0.06 -1.92 -0.02 0.00 -0.43 0.00 0.00 46.19 43.76 2av9 s LEU 102 CO 0.02 0.17 -0.23 -0.36 -0.29 0.00 0.00 176.35 175.66 2av9 s PHE 103 N 0.37 2.44 0.05 5.38 0.40 0.01 -0.87 117.98 125.75 2av9 s PHE 103 Ca 0.01 -0.42 -0.31 0.00 -0.60 0.00 0.00 56.93 55.61 2av9 s PHE 103 Cb -0.13 -1.55 -0.06 0.00 0.51 0.00 0.00 43.02 41.80 2av9 s PHE 103 CO 0.01 -0.02 1.24 -0.51 0.70 0.00 0.00 175.22 176.64 2av9 s LEU 104 N -0.55 4.35 0.59 -0.37 1.43 -1.26 -0.82 118.68 122.05 2av9 s LEU 104 Ca 0.08 2.03 -0.20 0.00 -1.03 0.00 0.00 54.13 55.01 2av9 s LEU 104 Cb -0.11 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.50 2av9 s LEU 104 CO 0.00 -0.53 1.29 -0.62 0.23 0.00 0.00 176.35 176.72 2av9 n GLU 105 N 4.23 1.38 -0.26 1.70 1.02 -1.18 -1.02 120.64 126.52 2av9 n GLU 105 Ca 0.10 0.52 0.00 0.00 -0.02 0.00 0.00 57.16 57.76 2av9 n GLU 105 Cb 0.46 -2.51 0.00 0.00 -0.02 0.00 0.00 31.44 29.37 2av9 n GLU 105 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2av9 n GLY 106 N 0.88 0.80 3.88 0.62 0.00 -1.26 -4.96 105.19 105.16 2av9 n GLY 106 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 2av9 n GLY 106 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2av9 s GLN 107 N -0.24 3.23 -0.10 1.61 -0.21 -0.19 -5.07 119.66 118.69 2av9 s GLN 107 Ca 0.00 -0.67 -0.05 0.00 0.02 0.00 0.00 55.36 54.66 2av9 s GLN 107 Cb 0.00 -2.86 -0.04 0.00 1.00 0.00 0.00 33.01 31.11 2av9 s GLN 107 CO 0.00 0.52 0.14 0.07 -2.12 0.00 0.00 175.29 173.91 2av9 h ARG 108 N 2.43 -0.02 -6.04 2.91 -0.00 -1.93 -3.44 114.38 108.30 2av9 h ARG 108 Ca -0.48 0.00 -0.57 0.00 -0.00 0.00 0.00 59.98 58.93 2av9 h ARG 108 Cb 1.19 0.00 -0.06 0.00 -0.00 0.00 0.00 29.97 31.11 2av9 h ARG 108 CO 0.68 0.13 -0.05 -1.21 -0.00 0.00 0.00 179.97 179.52 2av9 s GLU 109 N -1.73 4.27 0.46 0.08 2.02 -1.26 -2.64 118.70 119.90 2av9 s GLU 109 Ca -0.03 0.66 -0.24 0.00 0.02 0.00 0.00 54.97 55.38 2av9 s GLU 109 Cb -0.00 -3.34 -0.07 0.00 0.10 0.00 0.00 34.13 30.82 2av9 s GLU 109 CO 0.11 0.39 1.28 0.00 0.02 0.00 0.00 175.26 177.06 2av9 s ALA 110 N -0.23 3.07 -0.02 5.21 0.00 0.29 -4.75 121.76 125.32 2av9 s ALA 110 Ca 0.29 1.17 0.12 0.00 0.00 0.00 0.00 51.96 53.54 2av9 s ALA 110 Cb -0.18 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.43 2av9 s ALA 110 CO 0.16 -0.91 1.38 0.00 0.00 0.00 0.00 175.76 176.39 2av9 s ALA 112 N -2.88 -1.72 -0.09 0.00 0.00 -1.23 0.11 121.76 115.97 2av9 s ALA 112 Ca 0.03 1.12 -0.12 0.00 0.00 0.00 0.00 51.96 52.99 2av9 s ALA 112 Cb 0.09 0.20 0.03 0.00 0.00 0.00 0.00 23.12 23.43 2av9 s ALA 112 CO 0.78 -0.46 0.31 0.00 0.00 0.00 0.00 175.76 176.39 2av9 s ALA 113 N -1.76 -0.78 0.00 0.00 0.00 -0.49 -1.24 121.76 117.49 2av9 s ALA 113 Ca -0.08 0.72 0.00 0.00 0.00 0.00 0.00 51.96 52.60 2av9 s ALA 113 Cb -0.00 -0.35 0.00 0.00 0.00 0.00 0.00 23.12 22.77 2av9 s ALA 113 CO 0.05 -0.18 0.00 0.41 0.00 0.00 0.00 175.76 176.04 2av9 n GLY 114 N 2.43 3.29 3.34 0.00 0.00 0.47 -0.44 105.19 114.27 2av9 n GLY 114 Ca -0.16 -0.55 -0.14 0.00 0.00 0.00 0.00 46.02 45.17 2av9 n GLY 114 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2av9 s ARG 115 N 1.72 0.85 0.18 1.61 0.52 -0.95 -0.32 118.95 122.55 2av9 s ARG 115 Ca 0.00 -0.14 -0.24 0.00 -0.52 0.00 0.00 55.73 54.83 2av9 s ARG 115 Cb 0.00 0.39 0.05 0.00 0.52 0.00 0.00 34.95 35.91 2av9 s ARG 115 CO 0.00 -0.27 0.79 -0.59 0.02 0.00 0.00 175.30 175.25 2av9 s PHE 116 N -1.69 -0.27 -0.11 -0.53 -0.12 -0.68 -1.31 117.98 113.27 2av9 s PHE 116 Ca -0.10 -0.04 0.03 0.00 -0.05 0.00 0.00 56.93 56.77 2av9 s PHE 116 Cb -0.02 0.63 0.00 0.00 -0.63 0.00 0.00 43.02 43.00 2av9 s PHE 116 CO 0.03 -0.94 -0.22 0.08 -0.05 0.00 0.00 175.22 174.13 2av9 s VAL 117 N -3.59 1.93 -0.10 -2.49 1.01 -0.60 -0.66 120.40 115.91 2av9 s VAL 117 Ca 0.08 -0.93 -0.12 0.00 0.00 0.00 0.00 61.98 61.02 2av9 s VAL 117 Cb -0.03 -1.69 -0.05 0.00 0.00 0.00 0.00 36.38 34.61 2av9 s VAL 117 CO -0.01 0.53 0.27 -1.00 0.00 0.00 0.00 175.10 174.89 2av9 s HIS 118 N 0.54 3.59 -0.17 5.22 3.76 -0.70 -1.63 115.29 125.90 2av9 s HIS 118 Ca -0.15 0.69 -0.06 0.00 -0.15 0.00 0.00 55.06 55.40 2av9 s HIS 118 Cb -0.17 -2.18 -0.04 0.00 1.11 0.00 0.00 32.58 31.30 2av9 s HIS 118 CO 0.05 0.54 0.02 0.08 -0.85 0.00 0.00 174.74 174.58 2av9 s VAL 119 N -0.54 4.45 0.03 -0.90 1.01 0.38 -1.07 120.40 123.76 2av9 s VAL 119 Ca 0.18 -0.16 -0.26 0.00 0.00 0.00 0.00 61.98 61.74 2av9 s VAL 119 Cb -0.14 -2.98 -0.05 0.00 0.00 0.00 0.00 36.38 33.22 2av9 s VAL 119 CO 0.07 0.48 0.81 -0.36 0.00 0.00 0.00 175.10 176.10 2av9 s PHE 120 N 0.26 3.70 0.03 5.22 0.40 0.27 -0.43 117.98 127.43 2av9 s PHE 120 Ca 0.01 1.51 -0.04 0.00 -0.60 0.00 0.00 56.93 57.81 2av9 s PHE 120 Cb -0.13 -2.90 -0.01 0.00 0.51 0.00 0.00 43.02 40.49 2av9 s PHE 120 CO 0.01 0.18 0.06 0.14 0.70 0.00 0.00 175.22 176.31 2av9 s VAL 121 N 0.29 0.13 0.07 -0.44 -7.23 -0.01 -0.80 120.40 112.40 2av9 s VAL 121 Ca 0.42 -1.06 -0.31 0.00 -1.81 0.00 0.00 61.98 59.22 2av9 s VAL 121 Cb -0.20 -0.72 -0.08 0.00 0.56 0.00 0.00 36.38 35.93 2av9 s VAL 121 CO 0.24 -0.58 1.67 -1.83 -0.31 0.00 0.00 175.10 174.28 2av9 s GLU 122 N -2.25 4.19 0.30 4.82 1.03 -0.35 -1.56 118.70 124.89 2av9 s GLU 122 Ca -0.08 2.35 0.00 0.00 0.03 0.00 0.00 54.97 57.27 2av9 s GLU 122 Cb -0.04 -3.60 0.52 0.00 -0.80 0.00 0.00 34.13 30.21 2av9 s GLU 122 CO -0.03 -0.74 1.93 -0.09 -1.33 0.00 0.00 175.26 174.99 2av9 h ARG 123 N 8.36 1.01 -1.94 -4.83 9.65 -0.31 0.81 114.38 127.14 2av9 h ARG 123 Ca -0.43 -0.06 -0.68 0.00 -1.10 0.00 0.00 59.98 57.71 2av9 h ARG 123 Cb 1.20 -0.23 -0.35 0.00 -1.39 0.00 0.00 29.97 29.20 2av9 h ARG 123 CO 0.93 0.67 0.10 -2.13 2.80 0.00 0.00 179.97 182.33 2av9 n ARG 124 N -4.46 3.54 0.00 0.20 3.00 -1.26 -4.23 116.66 113.45 2av9 n ARG 124 Ca 0.12 -4.33 0.00 0.00 -0.00 0.00 0.00 57.85 53.64 2av9 n ARG 124 Cb 0.15 -2.29 0.00 0.00 0.00 0.00 0.00 32.46 30.32 2av9 n ARG 124 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2av9 n SER 125 N -0.38 0.00 -0.77 6.15 3.41 -1.17 -5.00 113.62 115.86 2av9 n SER 125 Ca 0.43 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.96 2av9 n SER 125 Cb 0.42 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.35 2av9 n SER 125 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2av9 n SER 126 N 0.00 -3.36 -4.70 4.04 7.64 0.28 -5.00 113.62 112.53 2av9 n SER 126 Ca 0.00 0.08 -0.40 0.00 1.01 0.00 0.00 58.87 59.56 2av9 n SER 126 Cb 0.00 -2.17 -0.05 0.00 -1.01 0.00 0.00 64.21 60.98 2av9 n SER 126 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2av9 s ARG 127 N -3.62 4.38 0.07 1.43 1.04 -1.26 -4.78 118.95 116.21 2av9 s ARG 127 Ca 0.00 0.91 -0.34 0.00 -1.04 0.00 0.00 55.73 55.26 2av9 s ARG 127 Cb 0.00 -3.50 -0.18 0.00 -2.04 0.00 0.00 34.95 29.23 2av9 s ARG 127 CO 0.00 -0.08 0.82 -2.30 -0.04 0.00 0.00 175.30 173.70 2av9 n PRO 128 N 4.33 0.00 -4.31 3.89 -0.02 -1.26 -1.21 135.00 136.43 2av9 n PRO 128 Ca 0.01 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.28 2av9 n PRO 128 Cb 0.50 -1.25 -0.11 0.00 -0.02 0.00 0.00 33.50 32.62 2av9 n PRO 128 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2av9 s VAL 129 N -0.36 1.69 0.36 -1.45 0.11 0.02 -4.80 120.40 115.97 2av9 s VAL 129 Ca 0.77 -1.89 -0.28 0.00 -2.93 0.00 0.00 61.98 57.65 2av9 s VAL 129 Cb -1.09 -1.78 -0.11 0.00 -1.53 0.00 0.00 36.38 31.87 2av9 s VAL 129 CO 0.54 -0.36 1.52 0.00 -3.33 0.00 0.00 175.10 173.46 2av9 s ALA 130 N -2.14 3.61 0.07 1.54 0.00 -1.26 -4.30 121.76 119.28 2av9 s ALA 130 Ca 0.14 1.59 -0.30 0.00 0.00 0.00 0.00 51.96 53.39 2av9 s ALA 130 Cb -0.05 -3.62 -0.10 0.00 0.00 0.00 0.00 23.12 19.35 2av9 s ALA 130 CO 0.06 -1.06 1.93 0.42 0.00 0.00 0.00 175.76 177.10 2av9 s ILE 131 N -0.89 2.82 0.36 0.00 1.01 -0.40 -4.94 121.20 119.16 2av9 s ILE 131 Ca 0.55 0.01 -0.26 0.00 0.00 0.00 0.00 60.65 60.96 2av9 s ILE 131 Cb -0.47 -3.01 -0.12 0.00 0.01 0.00 0.00 42.46 38.87 2av9 s ILE 131 CO 0.61 -0.00 0.98 -0.81 0.00 0.00 0.00 174.94 175.71 2av9 n PRO 132 N 6.86 1.31 -0.17 2.79 -0.04 -1.26 -4.69 135.00 139.80 2av9 n PRO 132 Ca 0.19 0.46 -0.02 0.00 -0.04 0.00 0.00 63.50 64.10 2av9 n PRO 132 Cb 0.40 -1.92 0.06 0.00 -0.04 0.00 0.00 33.50 32.01 2av9 n PRO 132 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 2av9 h GLN 133 N 1.70 0.10 -0.10 0.54 -0.00 -1.98 -0.36 115.11 115.01 2av9 h GLN 133 Ca -0.42 -0.01 -0.05 0.00 -0.00 0.00 0.00 58.65 58.17 2av9 h GLN 133 Cb 1.34 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.48 28.79 2av9 h GLN 133 CO 0.58 0.06 -0.17 1.49 -0.00 0.00 0.00 178.83 180.80 2av9 h GLU 134 N 0.10 0.15 -0.14 0.06 4.81 -1.90 0.13 114.58 117.79 2av9 h GLU 134 Ca 0.26 -0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 59.32 2av9 h GLU 134 Cb 0.40 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.76 2av9 h GLU 134 CO -0.45 0.33 -0.43 -0.07 -0.73 0.00 0.00 179.01 177.66 2av9 h LEU 135 N 0.15 0.62 -0.61 1.64 3.38 -1.52 -2.97 115.31 115.99 2av9 h LEU 135 Ca 0.03 -0.60 0.12 0.00 0.09 0.00 0.00 57.88 57.52 2av9 h LEU 135 Cb 0.39 -0.18 -0.09 0.00 0.09 0.00 0.00 40.66 40.87 2av9 h LEU 135 CO 0.03 1.11 0.12 0.08 0.09 0.00 0.00 178.44 179.87 2av9 h ARG 136 N 0.16 0.24 -0.18 1.13 -0.00 0.72 0.95 114.38 117.41 2av9 h ARG 136 Ca -0.01 -0.01 -0.14 0.00 -0.00 0.00 0.00 59.98 59.81 2av9 h ARG 136 Cb 1.05 -0.05 -0.01 0.00 -0.00 0.00 0.00 29.97 30.96 2av9 h ARG 136 CO 0.09 0.16 -0.48 0.38 -0.00 0.00 0.00 179.97 180.12 2av9 h ASP 137 N 0.25 0.50 -0.42 0.08 -0.00 -0.92 -0.09 116.42 115.82 2av9 h ASP 137 Ca 0.32 -0.24 -0.10 0.00 -0.00 0.00 0.00 57.03 57.01 2av9 h ASP 137 Cb 0.49 -0.14 -0.02 0.00 -0.00 0.00 0.00 39.33 39.66 2av9 h ASP 137 CO -0.42 0.90 -0.11 0.00 -0.00 0.00 0.00 179.24 179.61 2av9 h ALA 138 N 1.12 0.91 -0.33 4.15 0.00 -1.13 -2.26 119.26 121.72 2av9 h ALA 138 Ca 0.02 -0.33 -0.15 0.00 0.00 0.00 0.00 54.91 54.45 2av9 h ALA 138 Cb 0.98 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 2av9 h ALA 138 CO 0.09 0.63 -0.37 -0.07 0.00 0.00 0.00 179.25 179.52 2av9 h LEU 139 N 0.79 0.90 -1.47 0.00 3.38 -0.62 -3.01 115.31 115.27 2av9 h LEU 139 Ca 0.13 -0.48 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 2av9 h LEU 139 Cb 0.62 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 2av9 h LEU 139 CO 0.04 1.20 0.28 0.00 0.09 0.00 0.00 178.44 180.06 2av9 h ALA 140 N 0.73 1.61 0.00 1.53 0.00 -0.98 -1.63 119.26 120.51 2av9 h ALA 140 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2av9 h ALA 140 Cb 0.96 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2av9 h ALA 140 CO 0.09 0.34 0.00 0.00 0.00 0.00 0.00 179.25 179.68 2av9 n ALA 141 N -2.46 1.19 -0.06 0.00 0.00 -0.85 -0.75 120.51 117.57 2av9 n ALA 141 Ca 0.04 0.05 0.09 0.00 0.00 0.00 0.00 53.44 53.61 2av9 n ALA 141 Cb 0.08 -1.15 0.21 0.00 0.00 0.00 0.00 19.45 18.59 2av9 n ALA 141 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2av9 n LEU 142 N -1.74 3.28 -4.83 0.00 4.77 -0.61 -4.97 117.00 112.90 2av9 n LEU 142 Ca 0.00 -1.79 -0.38 0.00 -0.03 0.00 0.00 56.01 53.82 2av9 n LEU 142 Cb 0.06 -0.29 -0.06 0.00 -2.33 0.00 0.00 43.42 40.79 2av9 n LEU 142 CO 0.06 0.78 0.11 -1.10 -1.33 0.00 0.00 177.39 175.92 2av9 s GLN 143 N -1.11 3.95 0.00 3.23 -1.52 0.08 -0.80 119.66 123.49 2av9 s GLN 143 Ca 0.34 0.42 0.00 0.00 -1.95 0.00 0.00 55.36 54.17 2av9 s GLN 143 Cb 0.18 -3.23 0.00 0.00 -0.22 0.00 0.00 33.01 29.74 2av9 s GLN 143 CO 0.25 0.66 0.00 -1.13 -0.25 0.00 0.00 175.29 174.82