#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uuz s VAL 2 N 0.00 3.47 0.53 3.15 1.01 -1.26 -0.49 120.40 126.81 1uuz s VAL 2 Ca 0.00 -1.19 -0.20 0.00 0.00 0.00 0.00 61.98 60.58 1uuz s VAL 2 Cb 0.00 -2.95 -0.06 0.00 0.00 0.00 0.00 36.38 33.37 1uuz s VAL 2 CO 0.00 -0.12 1.17 -0.36 0.00 0.00 0.00 175.10 175.79 1uuz s PHE 3 N 1.35 2.63 0.53 5.22 0.40 -0.57 -5.00 117.98 122.54 1uuz s PHE 3 Ca -0.03 1.52 -0.16 0.00 -0.60 0.00 0.00 56.93 57.67 1uuz s PHE 3 Cb -0.19 -3.39 -0.07 0.00 0.51 0.00 0.00 43.02 39.87 1uuz s PHE 3 CO 0.01 -1.80 1.00 0.20 0.70 0.00 0.00 175.22 175.33 1uuz s GLY 4 N -1.57 2.01 0.10 4.36 0.00 -1.26 -4.88 107.32 106.08 1uuz s GLY 4 Ca 0.72 0.16 -0.31 0.00 0.00 0.00 0.00 44.72 45.28 1uuz s GLY 4 CO 0.32 0.43 1.61 -0.09 0.00 0.00 0.00 173.10 175.36 1uuz h ARG 5 N 0.71 -0.67 -0.06 2.90 2.43 -1.96 -0.96 114.38 116.76 1uuz h ARG 5 Ca -0.46 0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 58.66 1uuz h ARG 5 Cb 1.19 0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.88 1uuz h ARG 5 CO 0.61 -0.45 -0.40 0.00 -1.51 0.00 0.00 179.97 178.23 1uuz h GLU 7 N 0.11 0.90 -0.25 0.00 4.81 -1.87 -0.95 114.58 117.32 1uuz h GLU 7 Ca 0.01 -0.13 -0.10 0.00 -0.13 0.00 0.00 59.36 59.01 1uuz h GLU 7 Cb 0.75 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.97 1uuz h GLU 7 CO 0.06 0.72 -0.22 1.25 -0.73 0.00 0.00 179.01 180.08 1uuz h LEU 8 N 0.85 0.63 -0.47 1.64 5.85 -0.94 -2.17 115.31 120.71 1uuz h LEU 8 Ca 0.21 -0.46 0.07 0.00 0.84 0.00 0.00 57.88 58.54 1uuz h LEU 8 Cb 0.12 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 40.91 1uuz h LEU 8 CO -0.03 0.96 0.14 0.00 -0.34 0.00 0.00 178.44 179.17 1uuz h ALA 9 N 0.69 0.56 -0.08 1.25 0.00 -1.12 0.11 119.26 120.66 1uuz h ALA 9 Ca 0.04 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1uuz h ALA 9 Cb 0.77 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1uuz h ALA 9 CO 0.06 -0.25 0.02 0.00 0.00 0.00 0.00 179.25 179.07 1uuz h ALA 10 N 1.33 0.08 -0.46 0.00 0.00 -1.11 -1.37 119.26 117.73 1uuz h ALA 10 Ca 0.23 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.17 1uuz h ALA 10 Cb 0.26 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1uuz h ALA 10 CO -0.25 -0.45 0.27 0.00 0.00 0.00 0.00 179.25 178.82 1uuz h ALA 11 N 1.06 0.58 -0.94 0.00 0.00 -0.72 -1.31 119.26 117.92 1uuz h ALA 11 Ca 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1uuz h ALA 11 Cb 0.03 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 1uuz h ALA 11 CO -0.05 -0.04 0.56 0.52 0.00 0.00 0.00 179.25 180.24 1uuz h MET 12 N 0.54 1.28 -0.59 0.00 2.86 -0.58 -2.07 114.93 116.38 1uuz h MET 12 Ca 0.18 -0.12 -0.04 0.00 -2.06 0.00 0.00 59.70 57.66 1uuz h MET 12 Cb 0.02 -0.27 -0.03 0.00 0.06 0.00 0.00 31.60 31.39 1uuz h MET 12 CO -0.09 0.91 0.21 -0.22 1.06 0.00 0.00 176.91 178.78 1uuz h LYS 13 N 1.30 0.90 0.00 1.72 3.64 -0.68 -1.95 116.57 121.50 1uuz h LYS 13 Ca 0.34 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 59.51 1uuz h LYS 13 Cb -0.04 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 31.64 1uuz h LYS 13 CO -0.06 0.79 -0.10 0.00 -2.27 0.00 0.00 179.45 177.81 1uuz h ARG 14 N 0.82 0.00 -0.64 1.90 3.08 -0.83 -1.96 114.38 116.75 1uuz h ARG 14 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1uuz h ARG 14 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1uuz h ARG 14 CO -0.01 0.10 0.00 0.72 -1.07 0.00 0.00 179.97 179.71 1uuz n HIS 15 N -3.90 1.31 -1.06 3.04 8.25 -0.78 -4.95 115.22 117.13 1uuz n HIS 15 Ca -0.02 -0.50 -0.02 0.00 -0.26 0.00 0.00 57.72 56.92 1uuz n HIS 15 Cb 0.20 -0.27 -0.01 0.00 1.12 0.00 0.00 29.99 31.03 1uuz n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1uuz n GLY 16 N 0.83 0.54 0.15 -1.41 0.00 -0.74 -4.96 105.19 99.60 1uuz n GLY 16 Ca 0.21 -0.96 0.06 0.00 0.00 0.00 0.00 46.02 45.33 1uuz n GLY 16 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1uuz h LEU 17 N 0.00 0.00 -9.20 0.99 3.38 -1.62 -3.40 115.31 105.47 1uuz h LEU 17 Ca -0.04 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.35 1uuz h LEU 17 Cb 0.13 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.90 1uuz h LEU 17 CO 0.06 0.30 1.27 -0.67 0.09 0.00 0.00 178.44 179.49 1uuz n ASP 18 N -3.03 3.65 -0.43 -0.43 2.03 -1.26 -0.79 116.55 116.29 1uuz n ASP 18 Ca -0.00 0.74 -0.06 0.00 0.52 0.00 0.00 54.79 55.99 1uuz n ASP 18 Cb 0.67 -1.47 -0.02 0.00 -0.72 0.00 0.00 41.12 39.58 1uuz n ASP 18 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1uuz n ASN 19 N 8.33 -4.74 -4.71 1.67 3.02 0.52 -4.84 115.26 114.51 1uuz n ASN 19 Ca 0.24 0.14 -0.42 0.00 -0.03 0.00 0.00 54.58 54.51 1uuz n ASN 19 Cb 0.37 -2.74 -0.03 0.00 -0.61 0.00 0.00 39.78 36.78 1uuz n ASN 19 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1uuz s TYR 20 N -1.85 2.67 -1.84 3.10 5.04 0.03 0.04 117.35 124.54 1uuz s TYR 20 Ca 0.00 0.22 0.00 0.00 -2.44 0.00 0.00 57.07 54.85 1uuz s TYR 20 Cb 0.00 -4.16 0.00 0.00 0.35 0.00 0.00 41.96 38.15 1uuz s TYR 20 CO 0.00 -4.54 0.00 0.54 -1.34 0.00 0.00 175.55 170.21 1uuz n ARG 21 N 4.49 -1.56 -0.75 4.97 5.12 -1.26 -1.16 116.66 126.52 1uuz n ARG 21 Ca 0.17 1.03 0.00 0.00 -1.93 0.00 0.00 57.85 57.12 1uuz n ARG 21 Cb 0.36 -5.48 0.00 0.00 -1.16 0.00 0.00 32.46 26.18 1uuz n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1uuz n GLY 22 N -0.56 0.75 3.50 -0.13 0.00 0.11 -5.02 105.19 103.83 1uuz n GLY 22 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 1uuz n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1uuz s TYR 23 N -2.72 3.21 0.83 1.61 1.51 -0.31 -4.87 117.35 116.62 1uuz s TYR 23 Ca 0.00 -0.30 -0.13 0.00 -1.01 0.00 0.00 57.07 55.63 1uuz s TYR 23 Cb 0.00 -2.70 0.08 0.00 -0.11 0.00 0.00 41.96 39.23 1uuz s TYR 23 CO 0.00 -0.55 1.06 -1.13 -1.11 0.00 0.00 175.55 173.82 1uuz n SER 24 N 5.37 0.43 -0.30 2.29 3.41 -1.26 -0.36 113.62 123.20 1uuz n SER 24 Ca -0.09 0.53 0.14 0.00 -0.26 0.00 0.00 58.87 59.19 1uuz n SER 24 Cb 0.48 -1.45 0.31 0.00 -0.26 0.00 0.00 64.21 63.29 1uuz n SER 24 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1uuz h LEU 25 N -1.10 0.11 -2.00 1.04 5.85 -1.88 -0.69 115.31 116.64 1uuz h LEU 25 Ca -0.45 0.19 0.18 0.00 0.84 0.00 0.00 57.88 58.63 1uuz h LEU 25 Cb 1.30 0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.53 1uuz h LEU 25 CO 0.44 -0.12 0.45 1.23 -0.34 0.00 0.00 178.44 180.10 1uuz h GLY 26 N 0.26 0.00 1.03 3.75 0.00 -1.90 -1.09 103.07 105.12 1uuz h GLY 26 Ca 0.57 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.86 1uuz h GLY 26 CO -0.62 0.00 0.30 3.43 0.00 0.00 0.00 176.54 179.65 1uuz h ASN 27 N 0.00 1.01 -0.18 0.19 2.35 -1.35 -1.16 115.58 116.45 1uuz h ASN 27 Ca 0.29 -0.17 -0.20 0.00 -0.55 0.00 0.00 56.30 55.68 1uuz h ASN 27 Cb 1.19 -0.26 0.01 0.00 0.05 0.00 0.00 38.32 39.30 1uuz h ASN 27 CO -0.00 0.90 -0.65 -0.50 -1.65 0.00 0.00 177.43 175.52 1uuz h TRP 28 N 1.05 1.00 -0.45 1.19 4.06 -1.33 -2.05 115.95 119.42 1uuz h TRP 28 Ca 0.25 -0.42 -0.05 0.00 2.06 0.00 0.00 58.89 60.73 1uuz h TRP 28 Cb 0.20 -0.16 -0.02 0.00 -1.00 0.00 0.00 29.16 28.18 1uuz h TRP 28 CO 0.02 1.24 0.08 0.28 -3.56 0.00 0.00 178.44 176.49 1uuz h VAL 29 N 0.48 1.24 -0.11 1.49 2.07 -1.46 -1.55 116.25 118.42 1uuz h VAL 29 Ca -0.03 -0.89 0.01 0.00 0.82 0.00 0.00 66.70 66.61 1uuz h VAL 29 Cb 1.28 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.99 1uuz h VAL 29 CO 0.14 0.31 0.02 0.00 0.02 0.00 0.00 177.57 178.06 1uuz h ALA 31 N 1.07 1.03 -0.75 0.00 0.00 -1.21 -2.28 119.26 117.13 1uuz h ALA 31 Ca 0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1uuz h ALA 31 Cb 0.04 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1uuz h ALA 31 CO -0.06 0.25 0.39 0.00 0.00 0.00 0.00 179.25 179.83 1uuz h ALA 32 N 1.35 1.27 -0.10 0.00 0.00 -0.93 -0.59 119.26 120.26 1uuz h ALA 32 Ca 0.32 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1uuz h ALA 32 Cb 0.08 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1uuz h ALA 32 CO -0.14 0.58 0.00 -0.22 0.00 0.00 0.00 179.25 179.47 1uuz h LYS 33 N 1.06 0.17 -0.10 0.00 1.63 -0.82 -0.18 116.57 118.33 1uuz h LYS 33 Ca 0.26 -0.05 -0.07 0.00 -0.85 0.00 0.00 60.65 59.94 1uuz h LYS 33 Cb 0.06 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.66 1uuz h LYS 33 CO -0.04 0.42 -0.26 0.74 -3.45 0.00 0.00 179.45 176.87 1uuz h PHE 34 N -0.10 0.19 0.20 1.91 -1.00 -1.35 -1.45 116.94 115.34 1uuz h PHE 34 Ca 0.03 -0.03 -0.33 0.00 2.81 0.00 0.00 57.97 60.45 1uuz h PHE 34 Cb 0.35 -0.05 0.02 0.00 3.61 0.00 0.00 35.95 39.88 1uuz h PHE 34 CO 0.03 0.42 -1.53 0.93 -1.61 0.00 0.00 178.31 176.55 1uuz h GLU 35 N 0.16 0.42 0.00 1.51 4.39 -1.00 -3.44 114.58 116.62 1uuz h GLU 35 Ca 0.03 -0.72 0.00 0.00 0.34 0.00 0.00 59.36 59.01 1uuz h GLU 35 Cb 0.54 0.27 0.00 0.00 -0.10 0.00 0.00 28.75 29.46 1uuz h GLU 35 CO 0.04 1.33 0.00 -1.13 -1.16 0.00 0.00 179.01 178.09 1uuz n SER 36 N -3.62 0.00 -1.93 1.42 3.41 -0.10 -4.83 113.62 107.98 1uuz n SER 36 Ca -0.18 -1.00 -0.19 0.00 -0.26 0.00 0.00 58.87 57.24 1uuz n SER 36 Cb 1.08 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.99 1uuz n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1uuz n ASN 37 N 0.00 -5.50 -1.03 4.04 5.15 -0.55 -1.42 115.26 115.96 1uuz n ASN 37 Ca 0.00 0.18 -0.11 0.00 -0.60 0.00 0.00 54.58 54.05 1uuz n ASN 37 Cb 0.33 -4.61 -0.03 0.00 -0.53 0.00 0.00 39.78 34.94 1uuz n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1uuz n PHE 38 N -3.38 -0.19 -3.22 1.20 3.72 -1.21 -4.79 117.46 109.59 1uuz n PHE 38 Ca -0.22 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.76 1uuz n PHE 38 Cb 0.66 -2.31 -0.08 0.00 -0.94 0.00 0.00 39.48 36.82 1uuz n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1uuz s ASN 39 N -2.74 6.27 0.56 4.37 3.84 -0.51 -1.51 114.94 125.22 1uuz s ASN 39 Ca 0.00 -0.42 0.32 0.00 0.21 0.00 0.00 52.86 52.97 1uuz s ASN 39 Cb 0.00 -2.27 1.64 0.00 -0.55 0.00 0.00 41.25 40.07 1uuz s ASN 39 CO 0.00 -0.64 2.12 0.71 -2.79 0.00 0.00 177.10 176.50 1uuz h THR 40 N 5.77 0.37 -0.55 -5.21 1.35 -1.10 -2.84 112.91 110.70 1uuz h THR 40 Ca -0.26 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.19 1uuz h THR 40 Cb 1.11 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.82 1uuz h THR 40 CO 0.83 0.07 0.00 0.00 -0.25 0.00 0.00 175.52 176.17 1uuz n GLN 41 N -3.46 2.54 -2.58 4.72 6.02 -1.26 -4.19 117.38 119.17 1uuz n GLN 41 Ca -0.02 -2.36 -0.40 0.00 -0.01 0.00 0.00 57.00 54.21 1uuz n GLN 41 Cb 0.21 -1.53 -0.05 0.00 1.02 0.00 0.00 30.24 29.90 1uuz n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1uuz s ALA 42 N -1.27 3.37 0.02 -1.58 0.00 -1.07 -4.89 121.76 116.33 1uuz s ALA 42 Ca 0.43 0.78 0.02 0.00 0.00 0.00 0.00 51.96 53.18 1uuz s ALA 42 Cb 0.23 -3.30 -0.01 0.00 0.00 0.00 0.00 23.12 20.04 1uuz s ALA 42 CO 0.32 -0.07 -0.05 0.95 0.00 0.00 0.00 175.76 176.90 1uuz s THR 43 N -0.81 0.39 -0.17 0.00 -4.23 -1.26 -1.69 115.64 107.87 1uuz s THR 43 Ca 0.45 -0.57 0.01 0.00 -1.18 0.00 0.00 61.69 60.40 1uuz s THR 43 Cb -0.29 -0.40 0.03 0.00 1.34 0.00 0.00 72.50 73.18 1uuz s THR 43 CO 0.36 -0.13 -0.12 0.21 -0.54 0.00 0.00 174.62 174.41 1uuz s ASN 44 N -0.75 3.06 -0.17 3.99 3.04 -0.66 -4.94 114.94 118.51 1uuz s ASN 44 Ca -0.04 -0.70 -0.29 0.00 0.04 0.00 0.00 52.86 51.87 1uuz s ASN 44 Cb -0.05 -1.20 -0.01 0.00 -1.54 0.00 0.00 41.25 38.45 1uuz s ASN 44 CO -0.00 -0.10 1.14 -0.13 -3.04 0.00 0.00 177.10 174.96 1uuz s ARG 45 N 1.44 4.28 0.36 0.43 1.81 -1.26 -0.89 118.95 125.12 1uuz s ARG 45 Ca 0.02 1.51 -0.12 0.00 -1.72 0.00 0.00 55.73 55.42 1uuz s ARG 45 Cb -0.15 -3.67 -0.07 0.00 -0.45 0.00 0.00 34.95 30.61 1uuz s ARG 45 CO -0.09 -0.60 0.74 -0.80 -0.68 0.00 0.00 175.30 173.86 1uuz s ASN 46 N 1.51 6.63 0.32 0.23 0.02 -0.33 -4.99 114.94 118.34 1uuz s ASN 46 Ca 0.50 1.17 0.04 0.00 -1.02 0.00 0.00 52.86 53.55 1uuz s ASN 46 Cb -0.19 -2.33 0.65 0.00 0.02 0.00 0.00 41.25 39.40 1uuz s ASN 46 CO 0.12 -0.30 1.88 0.71 0.02 0.00 0.00 177.10 179.54 1uuz h THR 47 N 1.51 0.95 0.00 1.60 1.35 -1.96 -2.12 112.91 114.24 1uuz h THR 47 Ca -0.47 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 1uuz h THR 47 Cb 1.18 -0.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.59 1uuz h THR 47 CO 0.65 0.16 0.00 -0.90 -0.25 0.00 0.00 175.52 175.18 1uuz n ASP 48 N -4.54 0.22 0.00 5.36 5.75 -1.26 -4.87 116.55 117.21 1uuz n ASP 48 Ca 0.16 0.55 0.00 0.00 -0.01 0.00 0.00 54.79 55.48 1uuz n ASP 48 Cb 0.33 -0.60 0.00 0.00 -1.03 0.00 0.00 41.12 39.82 1uuz n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1uuz n GLY 49 N 0.36 2.35 3.89 6.12 0.00 -0.80 -5.10 105.19 112.01 1uuz n GLY 49 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 1uuz n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uuz s SER 50 N -1.89 3.19 0.01 1.61 1.04 -1.26 -4.71 113.70 111.69 1uuz s SER 50 Ca 0.00 0.44 -0.02 0.00 0.48 0.00 0.00 55.95 56.85 1uuz s SER 50 Cb 0.00 -0.61 -0.01 0.00 0.10 0.00 0.00 66.02 65.49 1uuz s SER 50 CO 0.00 -2.70 0.02 -0.89 0.98 0.00 0.00 173.24 170.65 1uuz s THR 51 N -3.71 0.09 -0.12 2.02 2.01 -1.26 -1.18 115.64 113.48 1uuz s THR 51 Ca 0.71 -0.71 -0.11 0.00 0.31 0.00 0.00 61.69 61.89 1uuz s THR 51 Cb -0.06 -0.27 -0.05 0.00 0.01 0.00 0.00 72.50 72.13 1uuz s THR 51 CO 0.53 -0.39 0.23 -1.81 -0.69 0.00 0.00 174.62 172.49 1uuz s ASP 52 N -1.20 6.45 -0.02 3.53 1.11 -0.07 -1.21 116.67 125.26 1uuz s ASP 52 Ca -0.13 0.53 0.07 0.00 0.18 0.00 0.00 52.55 53.20 1uuz s ASP 52 Cb -0.08 -2.14 -0.02 0.00 1.07 0.00 0.00 42.92 41.76 1uuz s ASP 52 CO -0.00 0.27 -0.23 -0.31 1.18 0.00 0.00 175.17 176.08 1uuz s TYR 53 N -0.38 2.06 0.01 4.23 2.02 0.57 -1.65 117.35 124.21 1uuz s TYR 53 Ca 0.16 -0.43 0.00 0.00 -0.37 0.00 0.00 57.07 56.42 1uuz s TYR 53 Cb -0.13 -1.33 0.00 0.00 -0.40 0.00 0.00 41.96 40.10 1uuz s TYR 53 CO 0.05 -0.07 0.00 0.41 -1.57 0.00 0.00 175.55 174.37 1uuz n GLY 54 N 2.62 -1.82 0.36 0.71 0.00 -0.68 -1.32 105.19 105.06 1uuz n GLY 54 Ca -0.16 -1.32 0.17 0.00 0.00 0.00 0.00 46.02 44.71 1uuz n GLY 54 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1uuz h ILE 55 N -0.04 0.80 -0.49 -0.61 3.07 -1.75 -0.55 117.51 117.93 1uuz h ILE 55 Ca 0.00 -0.02 0.00 0.00 1.55 0.00 0.00 64.86 66.39 1uuz h ILE 55 Cb 0.04 0.73 0.00 0.00 -0.27 0.00 0.00 36.82 37.31 1uuz h ILE 55 CO 0.00 0.01 0.00 0.18 -1.05 0.00 0.00 178.15 177.29 1uuz n LEU 56 N -4.42 3.34 -3.99 0.16 4.77 -1.26 -4.05 117.00 111.56 1uuz n LEU 56 Ca 0.08 -1.89 -0.42 0.00 -0.03 0.00 0.00 56.01 53.75 1uuz n LEU 56 Cb 0.49 -0.32 0.02 0.00 -2.33 0.00 0.00 43.42 41.28 1uuz n LEU 56 CO 0.36 0.82 -0.16 0.00 -1.33 0.00 0.00 177.39 177.08 1uuz n GLN 57 N 1.08 -0.59 -2.81 3.23 1.13 -0.22 -4.90 117.38 114.30 1uuz n GLN 57 Ca 0.17 0.18 -0.41 0.00 -1.94 0.00 0.00 57.00 54.99 1uuz n GLN 57 Cb 0.52 -3.02 -0.03 0.00 0.11 0.00 0.00 30.24 27.81 1uuz n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1uuz s ILE 58 N -3.57 4.91 0.28 5.09 1.01 -0.44 -4.36 121.20 124.11 1uuz s ILE 58 Ca 0.46 1.87 -0.26 0.00 0.00 0.00 0.00 60.65 62.72 1uuz s ILE 58 Cb -0.23 -4.24 -0.09 0.00 0.01 0.00 0.00 42.46 37.91 1uuz s ILE 58 CO 0.94 0.16 0.89 0.21 0.00 0.00 0.00 174.94 177.14 1uuz s ASN 59 N 0.97 7.36 0.00 3.58 3.04 -1.26 -0.32 114.94 128.32 1uuz s ASN 59 Ca 0.47 1.77 0.29 0.00 0.04 0.00 0.00 52.86 55.43 1uuz s ASN 59 Cb -0.20 -2.55 1.40 0.00 -1.54 0.00 0.00 41.25 38.37 1uuz s ASN 59 CO 0.23 0.02 1.97 -1.54 -3.04 0.00 0.00 177.10 174.75 1uuz n SER 60 N 0.87 0.00 -0.05 -4.21 3.41 -0.35 -2.16 113.62 111.13 1uuz n SER 60 Ca -0.00 -0.02 -0.01 0.00 -0.26 0.00 0.00 58.87 58.58 1uuz n SER 60 Cb 0.49 -0.32 0.27 0.00 -0.26 0.00 0.00 64.21 64.39 1uuz n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1uuz h ARG 61 N 0.00 0.63 0.00 4.33 2.43 -1.84 -3.40 114.38 116.54 1uuz h ARG 61 Ca 0.00 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 1uuz h ARG 61 Cb 0.30 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1uuz h ARG 61 CO 0.00 0.61 -0.27 0.91 -1.51 0.00 0.00 179.97 179.71 1uuz n TRP 62 N -4.29 0.00 -0.03 2.20 7.02 -1.23 -2.32 117.44 118.79 1uuz n TRP 62 Ca 0.02 0.00 0.02 0.00 -1.02 0.00 0.00 57.50 56.52 1uuz n TRP 62 Cb 0.23 0.00 -0.15 0.00 -2.42 0.00 0.00 31.31 28.97 1uuz n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 1uuz n TRP 63 N -0.69 0.18 -3.99 -5.99 7.02 -0.92 -0.88 117.44 112.17 1uuz n TRP 63 Ca 0.00 0.06 -0.09 0.00 -1.02 0.00 0.00 57.50 56.44 1uuz n TRP 63 Cb 0.08 -0.79 -0.08 0.00 -2.42 0.00 0.00 31.31 28.10 1uuz n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1uuz s ASN 65 N -2.97 5.06 0.00 0.00 3.04 -0.59 -4.61 114.94 114.87 1uuz s ASN 65 Ca 0.17 -0.61 0.09 0.00 0.04 0.00 0.00 52.86 52.55 1uuz s ASN 65 Cb 0.04 -1.87 0.23 0.00 -1.54 0.00 0.00 41.25 38.11 1uuz s ASN 65 CO -0.01 -0.16 1.14 -0.90 -3.04 0.00 0.00 177.10 174.13 1uuz n ASP 66 N 4.87 2.61 -0.05 -4.21 5.68 -1.26 -1.09 116.55 123.10 1uuz n ASP 66 Ca -0.15 -1.88 -0.01 0.00 -0.50 0.00 0.00 54.79 52.25 1uuz n ASP 66 Cb 0.49 -0.16 -0.00 0.00 -1.14 0.00 0.00 41.12 40.30 1uuz n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1uuz n GLY 67 N 0.41 0.15 0.03 6.12 0.00 -1.26 -4.75 105.19 105.88 1uuz n GLY 67 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1uuz n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1uuz n ARG 68 N 0.20 1.30 -3.56 1.61 1.85 -1.26 -4.90 116.66 111.90 1uuz n ARG 68 Ca -0.01 -1.03 -0.27 0.00 -1.00 0.00 0.00 57.85 55.54 1uuz n ARG 68 Cb 0.42 -0.75 -0.10 0.00 -1.05 0.00 0.00 32.46 30.98 1uuz n ARG 68 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1uuz n THR 69 N -0.27 1.40 -1.58 8.89 -1.04 -1.26 -4.84 114.28 115.58 1uuz n THR 69 Ca 0.01 -4.78 -0.52 0.00 -2.04 0.00 0.00 64.05 56.72 1uuz n THR 69 Cb 0.41 -2.07 -0.06 0.00 -1.82 0.00 0.00 70.33 66.80 1uuz n THR 69 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1uuz n PRO 70 N 1.50 1.07 -0.37 -2.82 -0.02 -1.26 -2.03 135.00 131.07 1uuz n PRO 70 Ca 0.25 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1uuz n PRO 70 Cb 0.41 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 1uuz n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uuz n GLY 71 N 2.34 1.99 3.66 -1.23 0.00 -1.26 -5.03 105.19 105.66 1uuz n GLY 71 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1uuz n GLY 71 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uuz s SER 72 N -3.47 1.99 0.30 1.61 0.01 -0.86 -5.08 113.70 108.20 1uuz s SER 72 Ca 0.00 0.93 0.08 0.00 1.31 0.00 0.00 55.95 58.27 1uuz s SER 72 Cb 0.00 -1.42 -0.04 0.00 0.21 0.00 0.00 66.02 64.78 1uuz s SER 72 CO 0.00 -3.49 0.16 -0.13 0.41 0.00 0.00 173.24 170.19 1uuz s ARG 73 N -5.17 2.57 -0.39 12.44 1.81 -0.98 -5.02 118.95 124.21 1uuz s ARG 73 Ca 0.68 -1.35 0.10 0.00 -1.72 0.00 0.00 55.73 53.44 1uuz s ARG 73 Cb -0.15 -2.33 0.30 0.00 -0.45 0.00 0.00 34.95 32.32 1uuz s ARG 73 CO 0.57 0.23 0.63 -1.71 -0.68 0.00 0.00 175.30 174.33 1uuz n ASN 74 N -1.16 0.59 0.27 0.23 5.15 -1.16 -3.69 115.26 115.49 1uuz n ASN 74 Ca -0.05 -2.86 0.11 0.00 -0.60 0.00 0.00 54.58 51.18 1uuz n ASN 74 Cb 0.60 -0.63 0.76 0.00 -0.53 0.00 0.00 39.78 39.97 1uuz n ASN 74 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1uuz h LEU 75 N 3.52 0.00 -0.53 1.20 3.38 -1.07 0.27 115.31 122.07 1uuz h LEU 75 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1uuz h LEU 75 Cb 0.91 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1uuz h LEU 75 CO 0.49 0.02 -0.16 0.00 0.09 0.00 0.00 178.44 178.88 1uuz n ASN 77 N -0.54 -4.91 -3.73 0.00 5.15 0.08 -5.00 115.26 106.31 1uuz n ASN 77 Ca 0.14 -1.09 -0.13 0.00 -0.60 0.00 0.00 54.58 52.91 1uuz n ASN 77 Cb 0.33 -2.55 -0.08 0.00 -0.53 0.00 0.00 39.78 36.96 1uuz n ASN 77 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 1uuz s ILE 78 N -3.40 0.06 0.38 -1.44 -4.36 -1.26 -5.07 121.20 106.11 1uuz s ILE 78 Ca 0.40 -0.53 -0.25 0.00 -0.26 0.00 0.00 60.65 60.01 1uuz s ILE 78 Cb -0.18 -0.83 -0.09 0.00 1.25 0.00 0.00 42.46 42.61 1uuz s ILE 78 CO 0.91 -0.29 1.06 -2.16 0.24 0.00 0.00 174.94 174.70 1uuz s PRO 79 N -2.05 4.24 0.58 0.37 0.04 -1.26 -1.53 135.00 135.38 1uuz s PRO 79 Ca -0.08 1.58 0.28 0.00 0.04 0.00 0.00 61.00 62.81 1uuz s PRO 79 Cb -0.02 -2.66 1.61 0.00 0.04 0.00 0.00 34.50 33.47 1uuz s PRO 79 CO 0.00 -0.09 2.10 0.00 0.04 0.00 0.00 177.00 179.05 1uuz h SER 81 N 0.00 0.00 0.12 0.00 4.64 -1.90 -1.14 113.55 115.26 1uuz h SER 81 Ca 0.09 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.41 1uuz h SER 81 Cb 0.50 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1uuz h SER 81 CO -0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 176.83 175.92 1uuz h ALA 82 N 1.96 1.39 -0.05 5.18 0.00 -1.63 -1.19 119.26 124.92 1uuz h ALA 82 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1uuz h ALA 82 Cb 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1uuz h ALA 82 CO -0.00 0.04 0.00 1.28 0.00 0.00 0.00 179.25 180.57 1uuz n LEU 83 N -3.69 0.81 -0.51 0.00 4.77 -0.43 -3.63 117.00 114.32 1uuz n LEU 83 Ca -0.03 -0.31 0.08 0.00 -0.03 0.00 0.00 56.01 55.72 1uuz n LEU 83 Cb 0.13 -0.03 0.03 0.00 -2.33 0.00 0.00 43.42 41.22 1uuz n LEU 83 CO 0.27 0.15 0.39 0.18 -1.33 0.00 0.00 177.39 177.05 1uuz n LEU 84 N -0.31 1.98 -4.71 2.23 4.77 -0.45 -3.86 117.00 116.66 1uuz n LEU 84 Ca 0.18 -0.89 -0.30 0.00 -0.03 0.00 0.00 56.01 54.97 1uuz n LEU 84 Cb 0.21 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.44 1uuz n LEU 84 CO 0.14 0.36 0.67 -0.55 -1.33 0.00 0.00 177.39 176.68 1uuz s SER 85 N -1.58 3.49 0.00 -1.43 0.15 -1.24 -4.23 113.70 108.86 1uuz s SER 85 Ca 0.16 1.74 0.29 0.00 0.70 0.00 0.00 55.95 58.84 1uuz s SER 85 Cb 0.13 -2.38 1.35 0.00 -1.71 0.00 0.00 66.02 63.41 1uuz s SER 85 CO 0.29 -2.67 1.96 -1.20 1.20 0.00 0.00 173.24 172.82 1uuz n SER 86 N -3.92 0.07 -4.42 5.45 7.64 -1.26 -4.43 113.62 112.75 1uuz n SER 86 Ca 0.08 0.03 -0.44 0.00 1.01 0.00 0.00 58.87 59.55 1uuz n SER 86 Cb 0.54 -0.31 -0.08 0.00 -1.01 0.00 0.00 64.21 63.34 1uuz n SER 86 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1uuz s ASP 87 N -2.73 6.14 0.00 6.43 -1.08 -1.26 -4.95 116.67 119.22 1uuz s ASP 87 Ca 0.23 -1.13 0.13 0.00 -0.52 0.00 0.00 52.55 51.26 1uuz s ASP 87 Cb 0.20 -2.18 0.80 0.00 -1.46 0.00 0.00 42.92 40.27 1uuz s ASP 87 CO 0.50 -0.58 1.33 2.30 0.52 0.00 0.00 175.17 179.24 1uuz n ILE 88 N 5.21 0.00 -0.11 4.11 -5.35 -1.26 -4.22 119.36 117.74 1uuz n ILE 88 Ca -0.12 0.00 -0.07 0.00 -0.27 0.00 0.00 62.75 62.30 1uuz n ILE 88 Cb 0.45 -0.40 -0.00 0.00 -1.74 0.00 0.00 39.64 37.95 1uuz n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1uuz h THR 89 N 0.00 0.30 -0.72 7.28 2.02 -1.93 -0.23 112.91 119.64 1uuz h THR 89 Ca 0.00 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.19 1uuz h THR 89 Cb 0.00 0.30 -0.04 0.00 -1.74 0.00 0.00 68.15 66.67 1uuz h THR 89 CO 0.00 0.00 0.47 0.00 0.37 0.00 0.00 175.52 176.36 1uuz h ALA 90 N 0.90 0.91 -0.62 6.16 0.00 -1.82 -0.27 119.26 124.52 1uuz h ALA 90 Ca 0.18 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1uuz h ALA 90 Cb 0.50 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1uuz h ALA 90 CO -0.51 0.32 0.13 0.77 0.00 0.00 0.00 179.25 179.97 1uuz h SER 91 N 0.96 0.96 -0.12 0.00 0.02 -1.64 -1.54 113.55 112.18 1uuz h SER 91 Ca 0.26 -0.24 -0.03 0.00 -0.84 0.00 0.00 61.79 60.94 1uuz h SER 91 Cb -0.10 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.18 1uuz h SER 91 CO -0.06 0.95 -0.04 0.58 -1.14 0.00 0.00 176.83 177.12 1uuz h VAL 92 N 0.92 1.30 -0.88 2.27 2.07 -0.71 -0.26 116.25 120.96 1uuz h VAL 92 Ca 0.19 -1.01 0.02 0.00 0.82 0.00 0.00 66.70 66.73 1uuz h VAL 92 Cb 0.38 1.73 -0.05 0.00 -1.52 0.00 0.00 31.29 31.83 1uuz h VAL 92 CO 0.01 0.29 0.58 0.78 0.02 0.00 0.00 177.57 179.24 1uuz h ASN 93 N -0.09 0.97 0.05 0.57 -0.26 -1.01 -0.20 115.58 115.61 1uuz h ASN 93 Ca 0.03 -0.02 -0.21 0.00 -0.56 0.00 0.00 56.30 55.54 1uuz h ASN 93 Cb 0.47 -0.23 0.01 0.00 -1.06 0.00 0.00 38.32 37.50 1uuz h ASN 93 CO 0.01 0.68 -0.80 0.00 -1.06 0.00 0.00 177.43 176.27 1uuz h ALA 95 N 0.69 1.23 -0.79 0.00 0.00 -0.45 -1.06 119.26 118.88 1uuz h ALA 95 Ca -0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1uuz h ALA 95 Cb 1.41 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 1uuz h ALA 95 CO 0.15 0.60 0.40 0.87 0.00 0.00 0.00 179.25 181.28 1uuz h LYS 96 N 1.09 1.12 -0.32 0.00 1.57 -0.93 -0.86 116.57 118.24 1uuz h LYS 96 Ca 0.27 -0.15 -0.15 0.00 -1.87 0.00 0.00 60.65 58.75 1uuz h LYS 96 Cb 0.08 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 1uuz h LYS 96 CO -0.04 0.84 -0.41 0.87 -0.57 0.00 0.00 179.45 180.15 1uuz h LYS 97 N 1.12 0.78 0.10 3.15 1.57 -1.19 -2.72 116.57 119.37 1uuz h LYS 97 Ca 0.28 -0.41 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 1uuz h LYS 97 Cb 0.08 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1uuz h LYS 97 CO -0.04 1.04 -0.05 0.82 -0.57 0.00 0.00 179.45 180.65 1uuz h ILE 98 N 0.63 0.97 0.00 1.86 2.04 -0.65 -2.13 117.51 120.23 1uuz h ILE 98 Ca 0.05 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.65 1uuz h ILE 98 Cb 0.97 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 38.19 1uuz h ILE 98 CO 0.09 0.06 0.00 0.55 0.00 0.00 0.00 178.15 178.86 1uuz n VAL 99 N -5.09 0.94 1.02 1.67 3.14 -0.38 -1.48 118.33 118.15 1uuz n VAL 99 Ca -0.08 0.26 0.12 0.00 -2.96 0.00 0.00 64.34 61.68 1uuz n VAL 99 Cb 0.13 -1.13 0.08 0.00 -1.06 0.00 0.00 33.84 31.87 1uuz n VAL 99 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1uuz n SER 100 N -1.92 2.61 0.31 6.55 7.64 -1.02 -3.52 113.62 124.28 1uuz n SER 100 Ca 0.02 -1.81 0.19 0.00 1.01 0.00 0.00 58.87 58.28 1uuz n SER 100 Cb 0.19 0.16 1.02 0.00 -1.01 0.00 0.00 64.21 64.57 1uuz n SER 100 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 1uuz h ASP 101 N 3.84 0.00 0.00 6.43 -0.00 -0.60 -3.45 116.42 122.64 1uuz h ASP 101 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 1uuz h ASP 101 Cb 0.90 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.23 1uuz h ASP 101 CO 0.00 0.02 0.00 0.61 -0.00 0.00 0.00 179.24 179.87 1uuz n GLY 102 N -0.97 0.97 0.00 -0.78 0.00 -1.26 -5.02 105.19 98.13 1uuz n GLY 102 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1uuz n GLY 102 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1uuz n ASN 103 N 0.00 0.00 0.00 1.61 2.85 -1.26 -5.14 115.26 113.31 1uuz n ASN 103 Ca 0.00 -1.00 0.00 0.00 -0.11 0.00 0.00 54.58 53.47 1uuz n ASN 103 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 1uuz n ASN 103 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1uuz n GLY 104 N 0.00 0.70 0.00 8.20 0.00 -1.23 -2.78 105.19 110.08 1uuz n GLY 104 Ca 0.00 -0.86 0.10 0.00 0.00 0.00 0.00 46.02 45.26 1uuz n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1uuz n MET 105 N 0.00 0.44 0.25 1.61 2.81 -1.26 -2.96 117.12 118.00 1uuz n MET 105 Ca 0.00 0.06 0.16 0.00 -1.81 0.00 0.00 57.70 56.11 1uuz n MET 105 Cb 0.00 -1.50 0.85 0.00 -0.71 0.00 0.00 33.22 31.86 1uuz n MET 105 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 1uuz h ASN 106 N 0.00 0.00 0.00 7.83 2.35 -1.93 0.17 115.58 124.01 1uuz h ASN 106 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1uuz h ASN 106 Cb 0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.48 1uuz h ASN 106 CO 0.00 0.00 0.12 0.00 -1.65 0.00 0.00 177.43 175.90 1uuz h ALA 107 N 1.85 1.11 -3.02 -0.83 0.00 -1.69 -3.20 119.26 113.48 1uuz h ALA 107 Ca 0.00 0.00 -0.70 0.00 0.00 0.00 0.00 54.91 54.21 1uuz h ALA 107 Cb 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 17.79 17.59 1uuz h ALA 107 CO 0.00 -0.11 -0.48 -1.58 0.00 0.00 0.00 179.25 177.08 1uuz s TRP 108 N -3.93 3.53 0.43 0.00 0.51 0.60 -4.92 118.94 115.15 1uuz s TRP 108 Ca -0.04 -2.32 0.12 0.00 -2.12 0.00 0.00 56.10 51.75 1uuz s TRP 108 Cb 0.10 -3.30 1.00 0.00 -0.81 0.00 0.00 33.47 30.45 1uuz s TRP 108 CO 0.30 -0.96 2.00 0.28 -0.51 0.00 0.00 176.95 178.06 1uuz h VAL 109 N 6.15 0.94 -0.62 4.03 2.07 -1.81 0.14 116.25 127.16 1uuz h VAL 109 Ca -0.13 -0.15 0.05 0.00 0.82 0.00 0.00 66.70 67.29 1uuz h VAL 109 Cb 1.04 0.47 -0.05 0.00 -1.52 0.00 0.00 31.29 31.23 1uuz h VAL 109 CO 0.74 0.08 0.34 0.00 0.02 0.00 0.00 177.57 178.75 1uuz h ALA 110 N 1.71 0.82 -0.11 1.67 0.00 -1.91 0.20 119.26 121.64 1uuz h ALA 110 Ca 0.24 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 1uuz h ALA 110 Cb 0.40 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1uuz h ALA 110 CO -0.07 0.01 -0.04 2.35 0.00 0.00 0.00 179.25 181.51 1uuz h TRP 111 N 0.64 0.25 -0.44 0.00 7.01 -1.09 -1.18 115.95 121.13 1uuz h TRP 111 Ca 0.27 -0.06 0.06 0.00 2.11 0.00 0.00 58.89 61.28 1uuz h TRP 111 Cb 0.16 -0.06 -0.06 0.00 -2.10 0.00 0.00 29.16 27.11 1uuz h TRP 111 CO -0.08 0.54 0.12 -0.09 -2.79 0.00 0.00 178.44 176.14 1uuz h ARG 112 N -0.12 0.27 0.00 2.65 2.43 -0.59 0.11 114.38 119.13 1uuz h ARG 112 Ca 0.03 -0.02 -0.21 0.00 -0.81 0.00 0.00 59.98 58.97 1uuz h ARG 112 Cb 0.46 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.92 1uuz h ARG 112 CO 0.01 0.18 -1.16 -0.91 -1.51 0.00 0.00 179.97 176.57 1uuz h ASN 113 N 0.27 0.00 0.00 -3.80 2.35 -0.64 -3.38 115.58 110.39 1uuz h ASN 113 Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 1uuz h ASN 113 Cb 0.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.61 1uuz h ASN 113 CO -0.25 0.88 -0.66 0.54 -1.65 0.00 0.00 177.43 176.29 1uuz n ARG 114 N -3.20 3.04 -0.03 0.81 5.12 -0.45 -4.86 116.66 117.09 1uuz n ARG 114 Ca -0.05 -0.02 -0.05 0.00 -1.93 0.00 0.00 57.85 55.80 1uuz n ARG 114 Cb 0.93 -0.88 -0.03 0.00 -1.16 0.00 0.00 32.46 31.32 1uuz n ARG 114 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1uuz n LYS 116 N -2.94 1.95 -0.64 0.00 4.81 0.21 -1.43 118.16 120.12 1uuz n LYS 116 Ca -0.11 0.71 0.00 0.00 -0.87 0.00 0.00 58.31 58.03 1uuz n LYS 116 Cb 0.60 -2.47 0.00 0.00 0.02 0.00 0.00 35.03 33.18 1uuz n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1uuz n GLY 117 N 3.55 1.06 4.03 3.14 0.00 -1.26 -4.94 105.19 110.76 1uuz n GLY 117 Ca 0.19 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.01 1uuz n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uuz s THR 118 N -3.39 2.18 -1.42 2.61 -4.23 -0.51 -4.98 115.64 105.90 1uuz s THR 118 Ca 0.00 -0.93 -0.14 0.00 -1.18 0.00 0.00 61.69 59.44 1uuz s THR 118 Cb 0.00 -2.25 0.06 0.00 1.34 0.00 0.00 72.50 71.65 1uuz s THR 118 CO 0.00 0.00 2.12 -0.67 -0.54 0.00 0.00 174.62 175.53 1uuz n ASP 119 N -2.33 4.16 0.27 3.99 4.64 -1.26 -4.74 116.55 121.28 1uuz n ASP 119 Ca 0.15 -2.89 0.17 0.00 -1.38 0.00 0.00 54.79 50.85 1uuz n ASP 119 Cb 0.61 -1.65 0.93 0.00 -1.04 0.00 0.00 41.12 39.97 1uuz n ASP 119 CO 0.00 0.00 0.00 -0.37 -0.82 0.00 0.00 177.20 176.01 1uuz h VAL 120 N 4.15 0.38 0.00 5.18 -1.51 -1.90 -1.46 116.25 121.09 1uuz h VAL 120 Ca 0.53 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 66.00 1uuz h VAL 120 Cb 0.67 0.91 -0.00 0.00 -2.13 0.00 0.00 31.29 30.74 1uuz h VAL 120 CO 1.80 0.00 -0.02 -0.61 -1.23 0.00 0.00 177.57 177.51 1uuz h GLN 121 N 0.00 0.00 0.00 5.19 5.75 -1.88 -1.91 115.11 122.26 1uuz h GLN 121 Ca 0.04 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.53 1uuz h GLN 121 Cb 0.25 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.80 1uuz h GLN 121 CO -0.00 0.02 -0.01 0.00 -2.65 0.00 0.00 178.83 176.19 1uuz h ALA 122 N 1.98 1.74 0.00 3.38 0.00 -1.66 -2.19 119.26 122.51 1uuz h ALA 122 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1uuz h ALA 122 Cb 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1uuz h ALA 122 CO 0.00 0.01 0.00 -1.49 0.00 0.00 0.00 179.25 177.78 1uuz h TRP 123 N 0.00 0.00 -0.10 0.00 4.06 -1.54 -3.04 115.95 115.32 1uuz h TRP 123 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1uuz h TRP 123 Cb 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.18 1uuz h TRP 123 CO 0.00 0.00 0.00 0.44 -3.56 0.00 0.00 178.44 175.32 1uuz n ILE 124 N -2.86 0.60 -2.39 1.49 -5.35 -0.83 -4.81 119.36 105.20 1uuz n ILE 124 Ca 0.01 -0.80 -0.41 0.00 -0.27 0.00 0.00 62.75 61.28 1uuz n ILE 124 Cb 0.26 0.74 -0.04 0.00 -1.74 0.00 0.00 39.64 38.87 1uuz n ILE 124 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1uuz s ARG 125 N -0.78 4.55 0.00 6.28 0.52 -1.15 -2.50 118.95 125.87 1uuz s ARG 125 Ca 0.09 1.88 0.00 0.00 -0.52 0.00 0.00 55.73 57.18 1uuz s ARG 125 Cb 0.05 -3.20 0.00 0.00 0.52 0.00 0.00 34.95 32.33 1uuz s ARG 125 CO 0.07 0.04 0.00 0.41 0.02 0.00 0.00 175.30 175.85 1uuz n GLY 126 N 1.54 0.77 3.91 -3.53 0.00 -1.26 -5.04 105.19 101.58 1uuz n GLY 126 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1uuz n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uuz h ARG 128 N 3.06 -0.30 0.00 0.00 -0.00 -1.90 -3.52 114.38 111.73 1uuz h ARG 128 Ca -0.46 0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.04 1uuz h ARG 128 Cb 1.16 0.07 0.00 0.00 0.00 0.00 0.00 29.97 31.20 1uuz h ARG 128 CO 0.74 -0.20 0.00 -0.11 0.00 0.00 0.00 179.97 180.41