#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r9s n ILE 2 N 0.00 0.00 -1.64 2.02 2.08 -1.26 -4.77 119.36 115.78 1r9s n ILE 2 Ca 0.00 0.00 -0.44 0.00 0.56 0.00 0.00 62.75 62.87 1r9s n ILE 2 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 39.64 38.86 1r9s n ILE 2 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 1r9s n VAL 3 N -0.91 0.63 -1.63 1.39 0.31 -1.26 -4.90 118.33 111.96 1r9s n VAL 3 Ca 0.00 -0.21 -0.53 0.00 -0.01 0.00 0.00 64.34 63.59 1r9s n VAL 3 Cb 0.00 -2.27 -0.06 0.00 -0.91 0.00 0.00 33.84 30.60 1r9s n VAL 3 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1r9s n PRO 4 N 7.67 1.23 -2.35 5.55 -0.02 -1.26 -4.57 135.00 141.24 1r9s n PRO 4 Ca 0.23 0.44 -0.43 0.00 -2.02 0.00 0.00 63.50 61.73 1r9s n PRO 4 Cb 0.39 -2.11 -0.02 0.00 -0.02 0.00 0.00 33.50 31.74 1r9s n PRO 4 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1r9s s VAL 5 N 1.43 4.15 0.36 -1.45 1.01 -1.26 -2.16 120.40 122.48 1r9s s VAL 5 Ca 0.88 1.40 0.00 0.00 0.00 0.00 0.00 61.98 64.26 1r9s s VAL 5 Cb -0.97 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 31.51 1r9s s VAL 5 CO 0.52 -0.11 0.00 0.54 0.00 0.00 0.00 175.10 176.05 1r9s n ARG 6 N 6.53 -3.03 -2.70 2.72 1.74 -1.26 -4.80 116.66 115.86 1r9s n ARG 6 Ca 0.14 2.27 -0.43 0.00 -0.77 0.00 0.00 57.85 59.06 1r9s n ARG 6 Cb 0.45 -2.58 -0.02 0.00 -1.02 0.00 0.00 32.46 29.28 1r9s n ARG 6 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1r9s n PHE 8 N 6.02 -0.16 0.00 0.00 0.99 -1.26 -0.76 117.46 122.29 1r9s n PHE 8 Ca 0.10 0.47 0.00 0.00 -0.00 0.00 0.00 57.45 58.02 1r9s n PHE 8 Cb 0.47 -0.46 0.00 0.00 -1.00 0.00 0.00 39.48 38.48 1r9s n PHE 8 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 1r9s n SER 9 N -3.84 0.00 0.02 4.37 7.64 -1.26 -4.33 113.62 116.21 1r9s n SER 9 Ca 0.01 0.68 0.10 0.00 1.01 0.00 0.00 58.87 60.66 1r9s n SER 9 Cb 0.10 -0.18 -0.12 0.00 -1.01 0.00 0.00 64.21 63.00 1r9s n SER 9 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1r9s n GLY 11 N 1.26 0.68 3.64 0.00 0.00 0.06 -4.96 105.19 105.88 1r9s n GLY 11 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 1r9s n GLY 11 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1r9s s LYS 12 N -0.93 3.93 0.09 1.61 2.20 -1.26 -4.48 119.74 120.90 1r9s s LYS 12 Ca 0.00 1.81 -0.36 0.00 -0.36 0.00 0.00 55.97 57.07 1r9s s LYS 12 Cb 0.00 -4.01 -0.18 0.00 -1.51 0.00 0.00 37.83 32.14 1r9s s LYS 12 CO 0.00 -1.14 1.13 0.28 -0.36 0.00 0.00 175.35 175.26 1r9s n VAL 13 N 6.09 0.43 0.00 4.02 0.31 -1.26 -2.37 118.33 125.55 1r9s n VAL 13 Ca 0.18 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 1r9s n VAL 13 Cb 0.44 -0.49 0.00 0.00 -0.91 0.00 0.00 33.84 32.89 1r9s n VAL 13 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1r9s n VAL 14 N 1.67 0.00 0.09 2.52 0.31 -1.26 -4.73 118.33 116.93 1r9s n VAL 14 Ca 0.18 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.56 1r9s n VAL 14 Cb 0.18 0.08 0.27 0.00 -0.91 0.00 0.00 33.84 33.45 1r9s n VAL 14 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1r9s n GLY 15 N 1.21 -0.68 2.10 2.92 0.00 -0.92 -1.49 105.19 108.33 1r9s n GLY 15 Ca 0.00 0.09 -0.19 0.00 0.00 0.00 0.00 46.02 45.91 1r9s n GLY 15 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1r9s n ASP 16 N -1.83 3.83 0.00 1.61 5.75 -1.26 -4.18 116.55 120.46 1r9s n ASP 16 Ca -0.00 -3.56 0.00 0.00 -0.01 0.00 0.00 54.79 51.22 1r9s n ASP 16 Cb 0.02 -0.81 0.00 0.00 -1.03 0.00 0.00 41.12 39.31 1r9s n ASP 16 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1r9s n LYS 17 N -0.98 0.10 0.18 0.11 5.02 -0.55 -4.85 118.16 117.19 1r9s n LYS 17 Ca 0.54 -0.32 -0.13 0.00 -2.02 0.00 0.00 58.31 56.38 1r9s n LYS 17 Cb 1.57 -0.55 -0.08 0.00 -0.02 0.00 0.00 35.03 35.96 1r9s n LYS 17 CO 0.00 0.00 0.00 2.35 -0.52 0.00 0.00 177.40 179.23 1r9s h TRP 18 N 0.00 -0.46 -0.47 2.13 2.91 -1.73 -0.66 115.95 117.67 1r9s h TRP 18 Ca 0.00 -0.01 0.01 0.00 1.13 0.00 0.00 58.89 60.02 1r9s h TRP 18 Cb 0.70 0.15 -0.03 0.00 -0.51 0.00 0.00 29.16 29.48 1r9s h TRP 18 CO 0.00 -0.13 0.30 0.93 -1.03 0.00 0.00 178.44 178.51 1r9s h GLU 19 N -0.86 0.59 -0.23 2.65 5.08 -1.90 0.45 114.58 120.37 1r9s h GLU 19 Ca -0.05 -0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.33 1r9s h GLU 19 Cb 0.54 -0.13 -0.07 0.00 0.50 0.00 0.00 28.75 29.58 1r9s h GLU 19 CO 0.08 0.39 -0.26 0.77 -1.00 0.00 0.00 179.01 178.99 1r9s h SER 20 N 0.61 -0.84 -0.09 1.42 0.02 -1.88 -0.47 113.55 112.32 1r9s h SER 20 Ca 0.18 0.14 0.04 0.00 -0.84 0.00 0.00 61.79 61.31 1r9s h SER 20 Cb -0.04 0.39 -0.06 0.00 0.14 0.00 0.00 62.40 62.83 1r9s h SER 20 CO -0.05 -0.30 -0.29 0.22 -1.14 0.00 0.00 176.83 175.26 1r9s h TYR 21 N -0.28 -0.80 -0.28 3.45 3.20 -0.36 -1.33 116.97 120.57 1r9s h TYR 21 Ca 0.13 0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.10 1r9s h TYR 21 Cb 0.48 0.37 -0.07 0.00 1.54 0.00 0.00 36.73 39.05 1r9s h TYR 21 CO -0.41 -0.38 -0.16 -0.07 -1.64 0.00 0.00 178.16 175.50 1r9s h LEU 22 N -0.39 -0.54 0.06 2.82 4.07 -0.22 -2.04 115.31 119.07 1r9s h LEU 22 Ca 0.09 0.12 0.03 0.00 0.08 0.00 0.00 57.88 58.19 1r9s h LEU 22 Cb 0.52 0.29 -0.04 0.00 1.08 0.00 0.00 40.66 42.50 1r9s h LEU 22 CO -0.31 -0.20 -0.29 0.78 -1.08 0.00 0.00 178.44 177.33 1r9s h ASN 23 N -0.14 -0.86 -1.12 -0.43 2.35 -0.79 0.17 115.58 114.77 1r9s h ASN 23 Ca 0.15 0.11 0.32 0.00 -0.55 0.00 0.00 56.30 56.33 1r9s h ASN 23 Cb 0.36 0.34 -0.04 0.00 0.05 0.00 0.00 38.32 39.02 1r9s h ASN 23 CO -0.36 -0.37 0.91 -0.07 -1.65 0.00 0.00 177.43 175.89 1r9s h LEU 24 N -0.48 0.00 0.00 1.61 3.38 -0.62 -2.21 115.31 116.99 1r9s h LEU 24 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1r9s h LEU 24 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1r9s h LEU 24 CO -0.21 0.00 -0.00 -0.07 0.09 0.00 0.00 178.44 178.25 1r9s h LEU 25 N 0.00 0.00 0.01 1.67 3.38 -0.04 -2.82 115.31 117.51 1r9s h LEU 25 Ca 0.53 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.51 1r9s h LEU 25 Cb 2.35 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 43.08 1r9s h LEU 25 CO -0.01 0.09 -0.23 -0.61 0.09 0.00 0.00 178.44 177.78 1r9s h GLN 26 N -0.17 -0.28 0.00 1.13 4.15 -0.76 -2.39 115.11 116.78 1r9s h GLN 26 Ca 0.00 0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.44 1r9s h GLN 26 Cb 0.00 0.06 -0.00 0.00 0.21 0.00 0.00 27.48 27.76 1r9s h GLN 26 CO 0.00 -0.19 -0.01 0.93 -1.93 0.00 0.00 178.83 177.64 1r9s h GLU 27 N -0.29 0.00 0.00 1.69 5.08 -1.67 -3.30 114.58 116.09 1r9s h GLU 27 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1r9s h GLU 27 Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1r9s h GLU 27 CO -0.14 0.26 0.01 -0.25 -1.00 0.00 0.00 179.01 177.88 1r9s n ASP 28 N -4.73 0.00 -4.00 1.42 9.92 -1.19 -4.81 116.55 113.16 1r9s n ASP 28 Ca -0.03 0.18 -0.40 0.00 -0.53 0.00 0.00 54.79 54.01 1r9s n ASP 28 Cb 0.13 -0.18 0.01 0.00 -0.64 0.00 0.00 41.12 40.44 1r9s n ASP 28 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1r9s n GLU 29 N -1.17 -0.59 -4.31 -1.24 1.02 -0.90 -4.96 120.64 108.48 1r9s n GLU 29 Ca 0.00 0.24 -0.24 0.00 -0.02 0.00 0.00 57.16 57.14 1r9s n GLU 29 Cb 0.01 -2.30 -0.08 0.00 -0.02 0.00 0.00 31.44 29.05 1r9s n GLU 29 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1r9s s LEU 30 N -6.71 3.01 -0.03 -4.62 1.43 -1.07 -5.05 118.68 105.64 1r9s s LEU 30 Ca 0.34 -0.98 -0.15 0.00 -1.03 0.00 0.00 54.13 52.31 1r9s s LEU 30 Cb -0.19 -1.39 -0.05 0.00 0.03 0.00 0.00 46.19 44.59 1r9s s LEU 30 CO 0.93 -0.26 0.42 1.51 0.23 0.00 0.00 176.35 179.18 1r9s s ASP 31 N -3.74 6.77 0.25 2.29 -4.77 -1.26 -4.66 116.67 111.55 1r9s s ASP 31 Ca 0.35 0.91 0.14 0.00 -3.30 0.00 0.00 52.55 50.65 1r9s s ASP 31 Cb 0.00 -2.26 0.90 0.00 -1.09 0.00 0.00 42.92 40.48 1r9s s ASP 31 CO 0.20 0.24 1.08 -0.62 0.70 0.00 0.00 175.17 176.77 1r9s n GLU 32 N 2.31 -0.04 0.16 2.11 4.71 -1.26 -0.79 120.64 127.83 1r9s n GLU 32 Ca -0.12 0.95 -0.14 0.00 -0.01 0.00 0.00 57.16 57.84 1r9s n GLU 32 Cb 0.52 -1.69 -0.07 0.00 -1.01 0.00 0.00 31.44 29.19 1r9s n GLU 32 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 1r9s h GLY 33 N 0.00 -0.40 0.71 0.62 0.00 -2.00 -2.22 103.07 99.78 1r9s h GLY 33 Ca 0.57 0.19 -0.10 0.00 0.00 0.00 0.00 47.33 47.99 1r9s h GLY 33 CO -0.53 -0.17 -0.36 -0.84 0.00 0.00 0.00 176.54 174.64 1r9s h THR 34 N -0.40 1.42 -0.94 4.70 2.02 -1.36 -2.98 112.91 115.36 1r9s h THR 34 Ca -0.01 -1.77 0.25 0.00 0.77 0.00 0.00 66.41 65.64 1r9s h THR 34 Cb 0.35 2.34 -0.17 0.00 -1.74 0.00 0.00 68.15 68.93 1r9s h THR 34 CO -0.00 0.51 0.05 0.00 0.37 0.00 0.00 175.52 176.45 1r9s h ALA 35 N 0.42 1.13 0.68 6.16 0.00 -1.39 0.13 119.26 126.40 1r9s h ALA 35 Ca -0.03 0.31 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 1r9s h ALA 35 Cb 1.02 0.54 -0.00 0.00 0.00 0.00 0.00 17.79 19.35 1r9s h ALA 35 CO 0.08 -0.54 -0.39 -0.07 0.00 0.00 0.00 179.25 178.32 1r9s h LEU 36 N 0.04 -0.98 -1.28 0.00 3.38 -1.33 -2.63 115.31 112.51 1r9s h LEU 36 Ca 0.57 0.05 0.23 0.00 0.09 0.00 0.00 57.88 58.82 1r9s h LEU 36 Cb 1.15 0.28 -0.09 0.00 0.09 0.00 0.00 40.66 42.09 1r9s h LEU 36 CO -0.86 -0.62 0.63 0.28 0.09 0.00 0.00 178.44 177.97 1r9s h SER 37 N -1.00 0.54 0.09 -0.43 0.02 -0.69 0.21 113.55 112.28 1r9s h SER 37 Ca -0.09 0.08 -0.07 0.00 -0.84 0.00 0.00 61.79 60.86 1r9s h SER 37 Cb 0.79 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.31 1r9s h SER 37 CO 0.11 0.15 -0.24 -0.09 -1.14 0.00 0.00 176.83 175.62 1r9s h ARG 38 N 0.50 0.26 0.00 3.45 2.43 -0.79 -1.79 114.38 118.45 1r9s h ARG 38 Ca 0.57 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.65 1r9s h ARG 38 Cb 1.26 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1r9s h ARG 38 CO -0.30 0.49 0.00 1.28 -1.51 0.00 0.00 179.97 179.93 1r9s n LEU 39 N -4.17 0.00 0.00 3.80 4.77 0.72 -4.85 117.00 117.27 1r9s n LEU 39 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1r9s n LEU 39 Cb 0.36 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 1r9s n LEU 39 CO 0.40 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 1r9s n GLY 40 N 0.53 0.72 3.50 -0.72 0.00 -0.67 -4.97 105.19 103.57 1r9s n GLY 40 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 1r9s n GLY 40 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r9s s LEU 41 N 0.00 4.60 0.01 0.99 1.43 -1.14 -4.81 118.68 119.75 1r9s s LEU 41 Ca 0.00 -2.48 0.15 0.00 -1.03 0.00 0.00 54.13 50.77 1r9s s LEU 41 Cb 0.00 -2.46 -0.18 0.00 0.03 0.00 0.00 46.19 43.58 1r9s s LEU 41 CO 0.00 -1.00 0.74 2.29 0.23 0.00 0.00 176.35 178.60 1r9s n LYS 42 N 6.84 0.63 -3.86 1.70 2.85 -1.26 -4.05 118.16 121.02 1r9s n LYS 42 Ca 0.36 0.26 -0.33 0.00 -1.05 0.00 0.00 58.31 57.55 1r9s n LYS 42 Cb 0.46 -1.80 -0.05 0.00 -0.65 0.00 0.00 35.03 32.99 1r9s n LYS 42 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 177.40 176.37 1r9s s ARG 43 N -2.76 3.49 0.56 -1.58 1.70 -1.26 -4.98 118.95 114.12 1r9s s ARG 43 Ca -0.04 -0.27 0.26 0.00 -0.47 0.00 0.00 55.73 55.21 1r9s s ARG 43 Cb 0.08 -3.06 1.62 0.00 -0.57 0.00 0.00 34.95 33.03 1r9s s ARG 43 CO 0.82 0.64 2.20 0.10 -1.08 0.00 0.00 175.30 177.97 1r9s h TYR 44 N 3.60 0.00 -0.75 5.89 -0.00 -1.97 0.88 116.97 124.62 1r9s h TYR 44 Ca -0.48 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.23 1r9s h TYR 44 Cb 1.18 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 37.88 1r9s h TYR 44 CO 0.65 0.03 0.39 0.00 -0.00 0.00 0.00 178.16 179.23 1r9s n ARG 47 N -0.64 0.68 0.16 0.00 1.74 -0.26 -4.07 116.66 114.27 1r9s n ARG 47 Ca 0.12 0.19 0.02 0.00 -0.77 0.00 0.00 57.85 57.41 1r9s n ARG 47 Cb 0.35 -1.66 0.25 0.00 -1.02 0.00 0.00 32.46 30.38 1r9s n ARG 47 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 1r9s h ARG 48 N 0.02 0.00 -0.47 5.56 -0.00 -1.48 -1.65 114.38 116.36 1r9s h ARG 48 Ca -0.44 0.00 0.09 0.00 -0.00 0.00 0.00 59.98 59.63 1r9s h ARG 48 Cb 2.05 0.00 -0.07 0.00 -0.00 0.00 0.00 29.97 31.95 1r9s h ARG 48 CO 0.04 0.50 0.03 1.98 -0.00 0.00 0.00 179.97 182.51 1r9s h MET 49 N 0.00 0.14 0.04 0.08 4.05 -1.71 -1.09 114.93 116.44 1r9s h MET 49 Ca -0.00 -0.01 -0.23 0.00 -0.28 0.00 0.00 59.70 59.18 1r9s h MET 49 Cb 1.00 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.75 1r9s h MET 49 CO 0.06 0.09 -1.21 0.82 0.23 0.00 0.00 176.91 176.91 1r9s h ILE 50 N 0.14 1.02 -0.91 1.77 1.08 -1.72 -3.23 117.51 115.67 1r9s h ILE 50 Ca 0.24 -2.27 0.18 0.00 -0.39 0.00 0.00 64.86 62.62 1r9s h ILE 50 Cb 0.34 2.51 -0.07 0.00 -3.07 0.00 0.00 36.82 36.53 1r9s h ILE 50 CO -0.37 0.50 0.59 0.25 -0.69 0.00 0.00 178.15 178.43 1r9s h LEU 51 N -0.74 0.54 0.00 1.44 5.85 -1.30 -2.29 115.31 118.81 1r9s h LEU 51 Ca -0.30 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.42 1r9s h LEU 51 Cb 1.44 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.41 1r9s h LEU 51 CO -0.09 0.23 -1.42 0.41 -0.34 0.00 0.00 178.44 177.23 1r9s n THR 52 N -4.56 0.57 -1.63 1.05 -1.04 -0.42 -4.96 114.28 103.29 1r9s n THR 52 Ca 0.19 -0.57 -0.44 0.00 -2.04 0.00 0.00 64.05 61.19 1r9s n THR 52 Cb 0.60 -0.31 -0.01 0.00 -1.82 0.00 0.00 70.33 68.79 1r9s n THR 52 CO 0.00 0.00 0.00 1.57 -0.64 0.00 0.00 175.07 176.00 1r9s n HIS 53 N -2.59 1.66 -3.92 -1.42 -0.00 -0.86 -4.94 115.22 103.14 1r9s n HIS 53 Ca -0.04 0.64 -0.30 0.00 -0.00 0.00 0.00 57.72 58.02 1r9s n HIS 53 Cb 0.63 -2.32 -0.13 0.00 -0.00 0.00 0.00 29.99 28.17 1r9s n HIS 53 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1r9s s VAL 54 N -1.02 2.76 0.00 3.57 1.01 -1.26 -5.01 120.40 120.45 1r9s s VAL 54 Ca 0.58 -3.48 -0.02 0.00 0.00 0.00 0.00 61.98 59.07 1r9s s VAL 54 Cb -0.66 -2.88 -0.02 0.00 0.00 0.00 0.00 36.38 32.82 1r9s s VAL 54 CO 0.60 -0.85 0.63 -0.67 0.00 0.00 0.00 175.10 174.81 1r9s n ASP 55 N 2.92 0.01 0.14 3.32 2.03 -1.26 -2.76 116.55 120.96 1r9s n ASP 55 Ca 0.08 -1.38 0.17 0.00 0.52 0.00 0.00 54.79 54.18 1r9s n ASP 55 Cb 0.33 -0.28 0.76 0.00 -0.72 0.00 0.00 41.12 41.21 1r9s n ASP 55 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1r9s h LEU 56 N 8.40 0.00 -1.27 -2.67 3.38 -1.95 -2.74 115.31 118.46 1r9s h LEU 56 Ca 0.02 0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.16 1r9s h LEU 56 Cb 0.06 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.73 1r9s h LEU 56 CO 0.65 0.00 0.60 -0.29 0.09 0.00 0.00 178.44 179.49 1r9s h ILE 57 N 0.00 0.74 0.00 1.22 2.10 -1.89 0.24 117.51 119.93 1r9s h ILE 57 Ca 0.13 -0.21 0.00 0.00 1.08 0.00 0.00 64.86 65.86 1r9s h ILE 57 Cb 0.64 0.06 0.00 0.00 -1.09 0.00 0.00 36.82 36.43 1r9s h ILE 57 CO -0.00 0.11 0.07 -0.33 -1.08 0.00 0.00 178.15 176.93 1r9s h GLU 58 N 0.63 0.00 0.00 2.19 4.39 -1.89 0.12 114.58 120.02 1r9s h GLU 58 Ca 0.50 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 60.16 1r9s h GLU 58 Cb 0.93 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.58 1r9s h GLU 58 CO -0.25 0.00 -1.93 1.63 -1.16 0.00 0.00 179.01 177.30 1r9s n LYS 59 N -2.27 0.64 0.16 2.33 5.02 0.82 -4.23 118.16 120.64 1r9s n LYS 59 Ca -0.01 -0.16 0.05 0.00 -2.02 0.00 0.00 58.31 56.17 1r9s n LYS 59 Cb 0.11 -1.46 0.09 0.00 -0.02 0.00 0.00 35.03 33.75 1r9s n LYS 59 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 1r9s h PHE 60 N 0.00 0.00 0.00 2.13 0.04 -0.45 -3.24 116.94 115.42 1r9s h PHE 60 Ca -0.06 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.71 1r9s h PHE 60 Cb 1.03 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.18 1r9s h PHE 60 CO 0.00 0.39 0.00 -0.07 -0.60 0.00 0.00 178.31 178.03 1r9s h LEU 61 N 0.00 0.00 0.00 1.54 3.38 -1.48 -2.96 115.31 115.79 1r9s h LEU 61 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1r9s h LEU 61 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1r9s h LEU 61 CO 0.05 0.00 0.00 -1.14 0.09 0.00 0.00 178.44 177.44 1r9s n ARG 62 N -2.79 0.14 -2.68 1.13 0.63 -1.22 -4.57 116.66 107.29 1r9s n ARG 62 Ca 0.03 0.07 -0.42 0.00 -0.92 0.00 0.00 57.85 56.61 1r9s n ARG 62 Cb 0.39 -1.50 -0.03 0.00 0.45 0.00 0.00 32.46 31.77 1r9s n ARG 62 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1r9s s TYR 63 N -2.84 2.57 0.01 -0.14 1.51 -1.12 -4.97 117.35 112.37 1r9s s TYR 63 Ca 0.16 0.01 -0.01 0.00 -1.01 0.00 0.00 57.07 56.22 1r9s s TYR 63 Cb 0.16 -4.40 -0.00 0.00 -0.11 0.00 0.00 41.96 37.61 1r9s s TYR 63 CO 0.42 -1.68 0.52 -1.71 -1.11 0.00 0.00 175.55 171.98 1r9s n ASN 64 N 8.34 -0.04 -0.21 2.29 5.15 -1.26 -5.10 115.26 124.42 1r9s n ASN 64 Ca 0.03 0.53 0.15 0.00 -0.60 0.00 0.00 54.58 54.69 1r9s n ASN 64 Cb 0.48 -0.24 0.76 0.00 -0.53 0.00 0.00 39.78 40.25 1r9s n ASN 64 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85