#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1twh n ASP 2 N 0.00 -1.54 -0.31 7.83 8.00 -1.26 -5.02 116.55 124.25 1twh n ASP 2 Ca 0.00 -2.26 0.11 0.00 0.71 0.00 0.00 54.79 53.35 1twh n ASP 2 Cb 0.00 0.74 0.24 0.00 -0.02 0.00 0.00 41.12 42.08 1twh n ASP 2 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 1twh h GLN 3 N 1.17 0.05 0.00 -1.24 7.50 -2.06 0.98 115.11 121.51 1twh h GLN 3 Ca -0.42 -0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.73 1twh h GLN 3 Cb 1.30 -0.01 0.00 0.00 0.05 0.00 0.00 27.48 28.82 1twh h GLN 3 CO -0.17 0.04 0.00 0.39 -1.50 0.00 0.00 178.83 177.59 1twh n GLU 4 N -5.43 1.19 0.14 1.46 1.02 -1.26 -4.44 120.64 113.32 1twh n GLU 4 Ca 0.20 -0.99 0.10 0.00 -0.02 0.00 0.00 57.16 56.45 1twh n GLU 4 Cb 0.65 -0.94 0.05 0.00 -0.02 0.00 0.00 31.44 31.19 1twh n GLU 4 CO 0.00 0.00 0.00 -0.97 1.18 0.00 0.00 177.13 177.34 1twh h ASN 5 N 0.00 0.00 0.02 1.62 -0.73 -1.28 -3.17 115.58 112.04 1twh h ASN 5 Ca 0.00 0.00 -0.30 0.00 1.87 0.00 0.00 56.30 57.87 1twh h ASN 5 Cb 0.36 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 38.91 1twh h ASN 5 CO 0.00 0.10 -1.65 1.21 -0.37 0.00 0.00 177.43 176.72 1twh n GLU 6 N -2.88 0.61 -0.13 6.67 4.07 -0.30 -2.96 120.64 125.71 1twh n GLU 6 Ca 0.01 0.45 -0.07 0.00 -0.06 0.00 0.00 57.16 57.49 1twh n GLU 6 Cb 0.59 -1.69 -0.05 0.00 -0.06 0.00 0.00 31.44 30.22 1twh n GLU 6 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1twh h ARG 7 N -0.75 -0.11 -1.23 5.31 3.08 -1.78 -2.64 114.38 116.25 1twh h ARG 7 Ca -0.43 0.01 0.36 0.00 0.07 0.00 0.00 59.98 59.99 1twh h ARG 7 Cb 1.52 0.03 -0.05 0.00 0.08 0.00 0.00 29.97 31.55 1twh h ARG 7 CO -0.18 -0.08 1.16 -0.91 -1.07 0.00 0.00 179.97 178.89 1twh h ASN 8 N -0.12 0.00 0.05 7.04 2.35 -1.50 0.37 115.58 123.77 1twh h ASN 8 Ca 0.06 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.74 1twh h ASN 8 Cb 0.27 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.64 1twh h ASN 8 CO -0.38 0.00 -0.32 0.40 -1.65 0.00 0.00 177.43 175.48 1twh h ILE 9 N 0.00 1.67 -0.36 2.81 2.04 -1.42 -2.55 117.51 119.70 1twh h ILE 9 Ca 0.58 -2.41 0.06 0.00 1.00 0.00 0.00 64.86 64.10 1twh h ILE 9 Cb 2.90 3.30 -0.09 0.00 -0.74 0.00 0.00 36.82 42.19 1twh h ILE 9 CO -0.01 0.64 -0.44 -1.28 0.00 0.00 0.00 178.15 177.07 1twh h SER 10 N -0.79 -1.43 -0.75 1.72 0.87 0.00 1.00 113.55 114.18 1twh h SER 10 Ca -0.06 0.21 0.17 0.00 -1.23 0.00 0.00 61.79 60.88 1twh h SER 10 Cb 1.23 0.62 -0.12 0.00 -0.44 0.00 0.00 62.40 63.69 1twh h SER 10 CO 0.04 -0.38 0.12 0.03 -0.53 0.00 0.00 176.83 176.12 1twh h ARG 11 N -0.36 0.20 -0.09 2.24 3.08 -1.15 0.50 114.38 118.79 1twh h ARG 11 Ca 0.12 -0.01 -0.08 0.00 0.07 0.00 0.00 59.98 60.08 1twh h ARG 11 Cb 0.59 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 1twh h ARG 11 CO -0.55 0.13 -0.30 1.25 -1.07 0.00 0.00 179.97 179.44 1twh h LEU 12 N 0.20 0.16 -0.32 3.04 5.85 -0.15 0.60 115.31 124.70 1twh h LEU 12 Ca 0.42 -0.05 -0.10 0.00 0.84 0.00 0.00 57.88 58.99 1twh h LEU 12 Cb 0.75 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 1twh h LEU 12 CO -0.57 0.46 -0.21 -0.25 -0.34 0.00 0.00 178.44 177.53 1twh h TRP 13 N 0.15 0.82 -0.53 1.25 7.01 0.36 0.51 115.95 125.52 1twh h TRP 13 Ca 0.02 -0.22 -0.11 0.00 2.11 0.00 0.00 58.89 60.69 1twh h TRP 13 Cb 0.61 -0.18 -0.02 0.00 -2.10 0.00 0.00 29.16 27.47 1twh h TRP 13 CO 0.01 0.94 -0.09 0.00 -2.79 0.00 0.00 178.44 176.51 1twh h ARG 14 N 0.46 0.99 0.00 2.65 3.08 0.59 0.18 114.38 122.34 1twh h ARG 14 Ca 0.06 -0.36 -0.04 0.00 0.07 0.00 0.00 59.98 59.70 1twh h ARG 14 Cb 0.76 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.74 1twh h ARG 14 CO 0.06 1.04 -0.21 0.00 -1.07 0.00 0.00 179.97 179.79 1twh h ALA 15 N 0.92 1.17 -0.01 0.04 0.00 0.48 0.11 119.26 121.97 1twh h ALA 15 Ca 0.14 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 1twh h ALA 15 Cb 0.66 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1twh h ALA 15 CO 0.05 0.27 -0.59 0.35 0.00 0.00 0.00 179.25 179.33 1twh h PHE 16 N 0.00 0.04 -0.42 0.00 3.57 0.10 -0.96 116.94 119.26 1twh h PHE 16 Ca -0.00 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.55 1twh h PHE 16 Cb 0.57 -0.01 -0.06 0.00 2.79 0.00 0.00 35.95 39.25 1twh h PHE 16 CO 0.00 0.61 0.09 -0.09 -2.23 0.00 0.00 178.31 176.69 1twh h ARG 17 N 0.02 0.21 -0.52 1.11 2.43 0.19 -0.94 114.38 116.88 1twh h ARG 17 Ca -0.01 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.08 1twh h ARG 17 Cb 1.04 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.53 1twh h ARG 17 CO 0.08 0.14 0.05 1.15 -1.51 0.00 0.00 179.97 179.88 1twh h THR 18 N 0.22 1.26 -0.19 0.20 2.02 -0.52 0.23 112.91 116.13 1twh h THR 18 Ca 0.21 -1.02 -0.02 0.00 0.77 0.00 0.00 66.41 66.35 1twh h THR 18 Cb 0.25 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 1twh h THR 18 CO -0.27 0.36 0.03 0.58 0.37 0.00 0.00 175.52 176.59 1twh h VAL 19 N 0.77 1.11 -0.28 3.16 2.07 -0.64 1.30 116.25 123.75 1twh h VAL 19 Ca 0.15 -0.39 -0.09 0.00 0.82 0.00 0.00 66.70 67.19 1twh h VAL 19 Cb 0.46 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1twh h VAL 19 CO 0.02 0.14 -0.17 0.11 0.02 0.00 0.00 177.57 177.69 1twh h LYS 20 N 0.27 0.60 -0.62 1.57 1.79 0.40 0.19 116.57 120.78 1twh h LYS 20 Ca 0.07 -0.28 -0.03 0.00 -2.18 0.00 0.00 60.65 58.23 1twh h LYS 20 Cb 0.14 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.75 1twh h LYS 20 CO -0.00 0.86 0.26 0.93 -1.08 0.00 0.00 179.45 180.42 1twh h GLU 21 N 0.34 0.92 -0.73 3.15 5.08 0.11 0.25 114.58 123.70 1twh h GLU 21 Ca 0.06 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.23 1twh h GLU 21 Cb 0.70 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 1twh h GLU 21 CO 0.05 0.77 0.34 1.98 -1.00 0.00 0.00 179.01 181.14 1twh h MET 22 N 0.86 1.05 -0.37 2.33 4.05 0.18 0.13 114.93 123.16 1twh h MET 22 Ca 0.21 -0.15 0.02 0.00 -0.28 0.00 0.00 59.70 59.50 1twh h MET 22 Cb 0.18 -0.19 -0.03 0.00 -0.80 0.00 0.00 31.60 30.76 1twh h MET 22 CO -0.02 0.82 0.21 0.28 0.23 0.00 0.00 176.91 178.43 1twh h VAL 23 N 1.04 1.02 -0.62 -5.77 2.07 0.08 -1.08 116.25 113.00 1twh h VAL 23 Ca 0.25 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.62 1twh h VAL 23 Cb 0.12 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1twh h VAL 23 CO -0.03 0.08 0.39 0.50 0.02 0.00 0.00 177.57 178.52 1twh h LYS 24 N 0.43 0.84 0.00 1.57 3.64 0.20 -0.11 116.57 123.14 1twh h LYS 24 Ca 0.15 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 1twh h LYS 24 Cb 0.02 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 1twh h LYS 24 CO -0.08 0.59 -0.24 -0.44 -2.27 0.00 0.00 179.45 177.01 1twh h ASP 25 N 0.84 0.00 0.62 4.20 3.32 0.11 -0.72 116.42 124.80 1twh h ASP 25 Ca 0.22 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 1twh h ASP 25 Cb -0.04 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 1twh h ASP 25 CO -0.04 0.24 -0.01 0.03 -1.72 0.00 0.00 179.24 177.73 1twh h ARG 26 N 0.00 0.00 0.00 3.56 3.08 0.20 -3.46 114.38 117.76 1twh h ARG 26 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1twh h ARG 26 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.71 1twh h ARG 26 CO 0.03 0.01 0.00 0.41 -1.07 0.00 0.00 179.97 179.35 1twh n GLY 27 N -0.40 0.95 3.39 0.04 0.00 -0.28 -5.11 105.19 103.78 1twh n GLY 27 Ca -0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 1twh n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1twh s TYR 28 N -1.74 2.28 -0.37 1.61 1.51 -1.17 -3.87 117.35 115.60 1twh s TYR 28 Ca 0.00 -0.38 -0.28 0.00 -1.01 0.00 0.00 57.07 55.40 1twh s TYR 28 Cb 0.00 -1.21 -0.02 0.00 -0.11 0.00 0.00 41.96 40.62 1twh s TYR 28 CO 0.00 0.37 1.85 0.12 -1.11 0.00 0.00 175.55 176.78 1twh s PHE 29 N -1.21 1.73 -0.00 2.71 5.36 0.27 -4.44 117.98 122.39 1twh s PHE 29 Ca 0.15 0.68 0.02 0.00 -0.96 0.00 0.00 56.93 56.82 1twh s PHE 29 Cb -0.09 -4.09 -0.00 0.00 -0.34 0.00 0.00 43.02 38.49 1twh s PHE 29 CO 0.07 -2.90 -0.05 0.42 -1.46 0.00 0.00 175.22 171.30 1twh s ILE 30 N 7.46 0.39 0.08 3.12 -1.09 -1.26 -4.66 121.20 125.24 1twh s ILE 30 Ca 0.80 -0.22 -0.08 0.00 -2.23 0.00 0.00 60.65 58.91 1twh s ILE 30 Cb -0.21 -0.33 -0.06 0.00 -1.58 0.00 0.00 42.46 40.28 1twh s ILE 30 CO 0.32 0.10 0.37 0.42 -1.23 0.00 0.00 174.94 174.92 1twh s THR 31 N -0.14 5.15 0.38 2.92 -4.23 -1.26 -4.90 115.64 113.56 1twh s THR 31 Ca 0.02 0.30 0.18 0.00 -1.18 0.00 0.00 61.69 61.01 1twh s THR 31 Cb -0.02 -3.62 0.38 0.00 1.34 0.00 0.00 72.50 70.57 1twh s THR 31 CO -0.00 0.25 1.71 -0.61 -0.54 0.00 0.00 174.62 175.43 1twh h GLN 32 N 3.57 0.35 0.00 3.99 5.75 -2.01 0.94 115.11 127.70 1twh h GLN 32 Ca -0.49 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 57.99 1twh h GLN 32 Cb 1.19 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.66 1twh h GLN 32 CO 0.68 0.23 0.00 0.39 -2.65 0.00 0.00 178.83 177.48 1twh n GLU 33 N -4.79 0.05 0.15 1.69 4.71 -1.26 -0.50 120.64 120.69 1twh n GLU 33 Ca 0.29 0.06 0.00 0.00 -0.01 0.00 0.00 57.16 57.50 1twh n GLU 33 Cb 0.97 -1.56 0.26 0.00 -1.01 0.00 0.00 31.44 30.10 1twh n GLU 33 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 1twh h GLU 34 N 0.00 0.06 0.06 3.49 4.81 -1.18 -2.69 114.58 119.13 1twh h GLU 34 Ca 0.00 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1twh h GLU 34 Cb 0.53 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.91 1twh h GLU 34 CO 0.00 0.51 -0.03 0.28 -0.73 0.00 0.00 179.01 179.04 1twh h VAL 35 N 0.05 1.26 0.00 0.32 2.07 -0.82 -3.32 116.25 115.81 1twh h VAL 35 Ca 0.00 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.24 1twh h VAL 35 Cb 0.84 2.07 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 1twh h VAL 35 CO 0.06 0.31 0.00 -0.62 0.02 0.00 0.00 177.57 177.34 1twh n GLU 36 N -4.85 0.16 -0.06 1.57 1.02 -0.86 -4.79 120.64 112.82 1twh n GLU 36 Ca -0.09 0.18 -0.02 0.00 -0.02 0.00 0.00 57.16 57.22 1twh n GLU 36 Cb 0.29 -1.70 -0.01 0.00 -0.02 0.00 0.00 31.44 30.00 1twh n GLU 36 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1twh n LEU 37 N -1.98 0.03 -4.24 -4.62 7.94 -1.02 -4.80 117.00 108.31 1twh n LEU 37 Ca 0.05 0.02 -0.28 0.00 -1.11 0.00 0.00 56.01 54.69 1twh n LEU 37 Cb 0.35 -0.04 0.27 0.00 0.53 0.00 0.00 43.42 44.53 1twh n LEU 37 CO 0.26 -0.03 0.30 -2.65 -1.11 0.00 0.00 177.39 174.16 1twh n PRO 38 N 0.36 -4.00 -0.08 1.96 -0.01 -1.26 -4.80 135.00 127.15 1twh n PRO 38 Ca 0.03 -1.18 -0.10 0.00 -0.01 0.00 0.00 63.50 62.24 1twh n PRO 38 Cb -0.00 -1.90 -0.04 0.00 -0.01 0.00 0.00 33.50 31.55 1twh n PRO 38 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 175.50 175.38 1twh n LEU 39 N -4.92 1.86 -0.33 2.45 7.94 -1.26 -2.59 117.00 120.15 1twh n LEU 39 Ca 0.10 0.51 0.21 0.00 -1.11 0.00 0.00 56.01 55.72 1twh n LEU 39 Cb 0.56 -0.85 0.43 0.00 0.53 0.00 0.00 43.42 44.09 1twh n LEU 39 CO 0.42 -0.25 1.11 -0.08 -1.11 0.00 0.00 177.39 177.48 1twh h GLU 40 N -1.00 0.37 0.00 1.96 4.57 -1.99 2.09 114.58 120.58 1twh h GLU 40 Ca -0.10 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.06 1twh h GLU 40 Cb 0.82 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.33 1twh h GLU 40 CO -0.06 0.25 0.00 -0.25 -1.18 0.00 0.00 179.01 177.77 1twh n ASP 41 N -5.03 0.00 -0.17 1.04 8.00 -1.25 -0.60 116.55 118.55 1twh n ASP 41 Ca 0.29 0.63 0.01 0.00 0.71 0.00 0.00 54.79 56.43 1twh n ASP 41 Cb 0.88 -0.13 0.04 0.00 -0.02 0.00 0.00 41.12 41.89 1twh n ASP 41 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1twh n PHE 42 N -1.40 0.09 0.25 1.24 7.35 0.21 0.11 117.46 125.30 1twh n PHE 42 Ca 0.00 0.56 0.13 0.00 -0.76 0.00 0.00 57.45 57.38 1twh n PHE 42 Cb 0.00 -0.72 0.59 0.00 0.35 0.00 0.00 39.48 39.70 1twh n PHE 42 CO 0.00 0.00 0.00 -0.22 -0.76 0.00 0.00 176.76 175.78 1twh h LYS 43 N 0.00 0.00 0.00 -4.13 3.64 0.55 -2.22 116.57 114.41 1twh h LYS 43 Ca 0.19 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 1twh h LYS 43 Cb 0.30 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1twh h LYS 43 CO -0.46 0.12 0.00 0.00 -2.27 0.00 0.00 179.45 176.84 1twh n ALA 44 N -2.18 -0.09 0.29 5.00 0.00 0.30 -2.79 120.51 121.05 1twh n ALA 44 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 1twh n ALA 44 Cb 0.35 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.28 1twh n ALA 44 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1twh h LYS 45 N 0.00 0.00 0.00 0.00 3.64 -0.65 0.26 116.57 119.83 1twh h LYS 45 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1twh h LYS 45 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1twh h LYS 45 CO 0.00 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.84 1twh n TYR 46 N -2.56 0.00 -4.95 1.91 0.53 -0.86 -4.98 117.16 106.24 1twh n TYR 46 Ca -0.01 -0.02 -0.32 0.00 -1.02 0.00 0.00 57.90 56.53 1twh n TYR 46 Cb 0.55 -0.00 -0.14 0.00 -1.03 0.00 0.00 39.34 38.72 1twh n TYR 46 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1twh n ASP 48 N 2.34 -1.71 -4.37 0.00 5.68 -1.18 -4.92 116.55 112.39 1twh n ASP 48 Ca -0.17 -0.07 -0.45 0.00 -0.50 0.00 0.00 54.79 53.60 1twh n ASP 48 Cb 0.52 -0.09 -0.01 0.00 -1.14 0.00 0.00 41.12 40.40 1twh n ASP 48 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1twh s SER 49 N -1.83 7.06 0.00 -1.12 0.15 -1.26 -4.63 113.70 112.08 1twh s SER 49 Ca 0.05 -3.10 0.00 0.00 0.70 0.00 0.00 55.95 53.60 1twh s SER 49 Cb -0.01 -2.26 0.00 0.00 -1.71 0.00 0.00 66.02 62.04 1twh s SER 49 CO 0.04 -0.51 0.00 1.15 1.20 0.00 0.00 173.24 175.12 1twh n MET 50 N 3.89 0.00 0.00 5.44 0.00 -1.26 -5.07 117.12 120.12 1twh n MET 50 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.93 1twh n MET 50 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.65 1twh n MET 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1twh n GLY 51 N -0.08 1.88 3.77 3.17 0.00 -1.26 -5.16 105.19 107.51 1twh n GLY 51 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1twh n GLY 51 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1twh s ARG 52 N 0.00 4.56 0.03 1.61 3.52 -1.26 -4.99 118.95 122.42 1twh s ARG 52 Ca 0.00 1.52 -0.01 0.00 -0.13 0.00 0.00 55.73 57.12 1twh s ARG 52 Cb 0.00 -2.94 -0.04 0.00 -1.56 0.00 0.00 34.95 30.41 1twh s ARG 52 CO 0.00 0.22 0.16 -1.25 -0.81 0.00 0.00 175.30 173.62 1twh s PRO 53 N -1.81 3.29 -0.43 5.12 0.05 -1.26 -3.12 135.00 136.84 1twh s PRO 53 Ca 0.48 -0.45 -0.04 0.00 0.05 0.00 0.00 61.00 61.05 1twh s PRO 53 Cb -0.24 -2.98 0.12 0.00 0.05 0.00 0.00 34.50 31.44 1twh s PRO 53 CO 0.31 0.63 0.24 -0.65 0.05 0.00 0.00 177.00 177.58 1twh s GLN 54 N -2.16 2.10 0.22 4.56 -1.52 0.15 -4.87 119.66 118.13 1twh s GLN 54 Ca 0.29 -1.88 -0.08 0.00 -1.95 0.00 0.00 55.36 51.75 1twh s GLN 54 Cb -0.13 -3.63 0.17 0.00 -0.22 0.00 0.00 33.01 29.20 1twh s GLN 54 CO 0.21 -1.10 1.81 0.00 -0.25 0.00 0.00 175.29 175.97 1twh h ARG 55 N 8.01 1.18 -0.07 2.91 3.08 -1.90 -1.99 114.38 125.61 1twh h ARG 55 Ca -0.13 -0.18 0.01 0.00 0.07 0.00 0.00 59.98 59.75 1twh h ARG 55 Cb 1.04 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.87 1twh h ARG 55 CO 0.72 0.92 -0.04 1.63 -1.07 0.00 0.00 179.97 182.13 1twh n LYS 56 N -4.33 -0.03 0.07 0.04 4.76 -1.26 -0.73 118.16 116.68 1twh n LYS 56 Ca 0.08 0.12 0.12 0.00 -2.87 0.00 0.00 58.31 55.76 1twh n LYS 56 Cb 0.14 -0.18 0.17 0.00 -1.84 0.00 0.00 35.03 33.32 1twh n LYS 56 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1twh h MET 57 N 0.00 0.00 -0.10 1.97 -0.00 -1.70 -3.24 114.93 111.86 1twh h MET 57 Ca 0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.70 1twh h MET 57 Cb 0.03 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.62 1twh h MET 57 CO -0.06 0.00 0.03 0.52 -0.00 0.00 0.00 176.91 177.40 1twh h MET 58 N 0.00 0.16 -3.54 -0.10 2.86 -1.05 -3.45 114.93 109.80 1twh h MET 58 Ca 0.00 -0.03 -0.33 0.00 -2.06 0.00 0.00 59.70 57.27 1twh h MET 58 Cb 0.77 -0.02 0.13 0.00 0.06 0.00 0.00 31.60 32.54 1twh h MET 58 CO 0.00 0.31 -0.99 0.43 1.06 0.00 0.00 176.91 177.71 1twh n SER 59 N -4.90 -3.21 -3.63 1.22 7.64 -1.22 -4.95 113.62 104.58 1twh n SER 59 Ca -0.06 0.18 0.01 0.00 1.01 0.00 0.00 58.87 60.02 1twh n SER 59 Cb 0.13 -0.46 -0.00 0.00 -1.01 0.00 0.00 64.21 62.87 1twh n SER 59 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1twh s PHE 60 N -1.18 -0.04 0.30 1.43 -0.12 0.22 -5.02 117.98 113.57 1twh s PHE 60 Ca 0.26 -0.08 0.02 0.00 -0.05 0.00 0.00 56.93 57.09 1twh s PHE 60 Cb -0.16 0.55 -0.05 0.00 -0.63 0.00 0.00 43.02 42.74 1twh s PHE 60 CO 0.46 -0.32 0.11 -1.14 -0.05 0.00 0.00 175.22 174.28 1twh s GLN 61 N -2.46 1.57 -0.04 1.99 0.74 -1.26 -1.01 119.66 119.18 1twh s GLN 61 Ca 0.15 -1.88 -0.29 0.00 0.05 0.00 0.00 55.36 53.39 1twh s GLN 61 Cb 0.04 -0.40 0.10 0.00 1.10 0.00 0.00 33.01 33.85 1twh s GLN 61 CO -0.03 -0.33 0.83 0.00 -0.55 0.00 0.00 175.29 175.21 1twh s ALA 62 N -3.56 -1.81 0.18 1.58 0.00 0.54 -4.96 121.76 113.73 1twh s ALA 62 Ca 0.35 1.21 0.08 0.00 0.00 0.00 0.00 51.96 53.60 1twh s ALA 62 Cb 0.07 0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.15 1twh s ALA 62 CO 0.15 -0.49 -0.16 -0.80 0.00 0.00 0.00 175.76 174.45 1twh s ASN 63 N -1.73 2.60 0.13 0.00 0.01 -1.26 -1.29 114.94 113.39 1twh s ASN 63 Ca -0.02 -0.92 0.00 0.00 -0.71 0.00 0.00 52.86 51.21 1twh s ASN 63 Cb -0.01 -0.15 0.00 0.00 0.41 0.00 0.00 41.25 41.51 1twh s ASN 63 CO -0.01 -0.09 0.00 -2.65 -1.51 0.00 0.00 177.10 172.84 1twh n PRO 64 N 0.04 0.64 -3.77 -0.60 -0.02 -1.26 -0.57 135.00 129.45 1twh n PRO 64 Ca -0.11 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.27 1twh n PRO 64 Cb 0.58 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 34.02 1twh n PRO 64 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1twh s THR 65 N -0.13 0.04 0.15 3.45 -4.23 -1.25 -3.84 115.64 109.83 1twh s THR 65 Ca 0.00 -0.88 -0.11 0.00 -1.18 0.00 0.00 61.69 59.51 1twh s THR 65 Cb 0.00 -1.59 0.01 0.00 1.34 0.00 0.00 72.50 72.26 1twh s THR 65 CO 0.00 -0.17 1.57 -0.33 -0.54 0.00 0.00 174.62 175.14 1twh h GLU 66 N 2.28 0.93 -0.59 3.99 5.08 -1.95 0.11 114.58 124.44 1twh h GLU 66 Ca -0.30 -0.35 -0.00 0.00 -1.00 0.00 0.00 59.36 57.71 1twh h GLU 66 Cb 1.25 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 1twh h GLU 66 CO 0.40 1.01 0.37 0.93 -1.00 0.00 0.00 179.01 180.72 1twh h GLU 67 N 0.78 0.79 0.27 2.33 5.08 -1.94 -0.96 114.58 120.92 1twh h GLU 67 Ca 0.12 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1twh h GLU 67 Cb 0.66 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 1twh h GLU 67 CO 0.05 0.55 -0.24 0.77 -1.00 0.00 0.00 179.01 179.14 1twh h SER 68 N 0.80 -0.65 0.35 1.42 0.02 -1.34 -0.05 113.55 114.10 1twh h SER 68 Ca 0.21 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.21 1twh h SER 68 Cb -0.04 0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.71 1twh h SER 68 CO -0.04 -0.36 -0.05 0.16 -1.14 0.00 0.00 176.83 175.39 1twh h ILE 69 N -0.53 0.31 -0.95 3.27 3.07 -0.79 0.78 117.51 122.66 1twh h ILE 69 Ca -0.01 -0.33 0.00 0.00 1.55 0.00 0.00 64.86 66.07 1twh h ILE 69 Cb 0.49 1.25 -0.05 0.00 -0.27 0.00 0.00 36.82 38.24 1twh h ILE 69 CO -0.04 0.05 0.60 -1.28 -1.05 0.00 0.00 178.15 176.43 1twh h SER 70 N 0.00 1.12 0.06 2.16 0.87 0.41 -3.17 113.55 115.00 1twh h SER 70 Ca -0.00 -0.05 -0.31 0.00 -1.23 0.00 0.00 61.79 60.19 1twh h SER 70 Cb 0.24 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.89 1twh h SER 70 CO 0.01 0.84 -1.73 0.29 -0.53 0.00 0.00 176.83 175.71 1twh n LYS 71 N -4.37 0.67 -3.86 2.24 5.02 0.14 -4.70 118.16 113.31 1twh n LYS 71 Ca 0.11 0.39 -0.34 0.00 -2.02 0.00 0.00 58.31 56.45 1twh n LYS 71 Cb 0.04 -1.71 -0.12 0.00 -0.02 0.00 0.00 35.03 33.22 1twh n LYS 71 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1twh s PHE 72 N -2.47 3.54 -0.09 2.13 0.40 0.25 -4.81 117.98 116.92 1twh s PHE 72 Ca -0.26 -2.75 -0.05 0.00 -0.60 0.00 0.00 56.93 53.27 1twh s PHE 72 Cb 0.07 -3.08 -0.26 0.00 0.51 0.00 0.00 43.02 40.25 1twh s PHE 72 CO 0.68 -0.91 0.47 -1.00 0.70 0.00 0.00 175.22 175.15 1twh h PRO 73 N 7.51 0.25 -0.47 0.24 0.14 -1.74 -3.25 132.00 134.68 1twh h PRO 73 Ca -0.08 -0.43 0.00 0.00 0.14 0.00 0.00 66.00 65.64 1twh h PRO 73 Cb 1.00 0.16 0.00 0.00 0.14 0.00 0.00 31.00 32.30 1twh h PRO 73 CO 0.65 1.14 0.00 -0.25 0.14 0.00 0.00 178.00 179.68 1twh n ASP 74 N -3.44 0.47 -4.70 1.44 8.00 -1.26 -4.81 116.55 112.26 1twh n ASP 74 Ca -0.28 -1.25 -0.42 0.00 0.71 0.00 0.00 54.79 53.54 1twh n ASP 74 Cb 1.05 -0.24 -0.03 0.00 -0.02 0.00 0.00 41.12 41.89 1twh n ASP 74 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1twh s MET 75 N -1.24 4.48 0.00 -1.24 1.75 -1.23 -4.98 119.30 116.84 1twh s MET 75 Ca 0.00 1.48 0.00 0.00 -1.25 0.00 0.00 55.69 55.92 1twh s MET 75 Cb 0.00 -3.48 0.00 0.00 2.84 0.00 0.00 34.83 34.19 1twh s MET 75 CO 0.00 -0.20 0.00 0.41 -0.65 0.00 0.00 175.02 174.58 1twh n GLY 76 N 3.05 -0.51 1.40 2.11 0.00 -1.26 -4.88 105.19 105.09 1twh n GLY 76 Ca 0.08 -1.72 -0.12 0.00 0.00 0.00 0.00 46.02 44.26 1twh n GLY 76 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1twh n SER 77 N -1.78 2.25 -3.69 1.61 3.41 -1.26 -4.36 113.62 109.80 1twh n SER 77 Ca 0.00 -1.80 -0.14 0.00 -0.26 0.00 0.00 58.87 56.67 1twh n SER 77 Cb 0.00 0.09 -0.08 0.00 -0.26 0.00 0.00 64.21 63.95 1twh n SER 77 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1twh s LEU 78 N 0.00 0.24 -0.02 1.04 0.20 -0.41 -2.91 118.68 116.82 1twh s LEU 78 Ca 0.04 0.57 0.06 0.00 0.69 0.00 0.00 54.13 55.49 1twh s LEU 78 Cb -0.00 1.71 -0.02 0.00 -0.43 0.00 0.00 46.19 47.44 1twh s LEU 78 CO 0.02 -0.38 -0.21 0.86 -0.29 0.00 0.00 176.35 176.35 1twh s TRP 79 N -0.69 2.48 0.10 5.38 -0.11 -0.83 -0.34 118.94 124.92 1twh s TRP 79 Ca -0.08 -0.33 0.02 0.00 1.22 0.00 0.00 56.10 56.93 1twh s TRP 79 Cb -0.03 -1.54 -0.04 0.00 -1.50 0.00 0.00 33.47 30.36 1twh s TRP 79 CO 0.04 0.07 -0.07 0.08 -4.62 0.00 0.00 176.95 172.46 1twh s VAL 80 N -0.69 0.69 -0.28 5.86 1.01 -0.18 -2.57 120.40 124.25 1twh s VAL 80 Ca 0.11 -1.88 -0.23 0.00 0.00 0.00 0.00 61.98 59.98 1twh s VAL 80 Cb -0.10 -1.61 0.09 0.00 0.00 0.00 0.00 36.38 34.75 1twh s VAL 80 CO 0.00 -0.84 0.80 -0.70 0.00 0.00 0.00 175.10 174.36 1twh s GLU 81 N -3.68 0.72 0.33 2.72 2.12 -0.83 -0.61 118.70 119.48 1twh s GLU 81 Ca 0.10 0.93 0.09 0.00 0.36 0.00 0.00 54.97 56.45 1twh s GLU 81 Cb 0.04 0.32 -0.05 0.00 0.26 0.00 0.00 34.13 34.70 1twh s GLU 81 CO -0.04 -0.10 0.01 -0.06 -0.54 0.00 0.00 175.26 174.53 1twh s PHE 82 N 0.58 2.57 -0.03 5.30 0.40 -1.26 -1.00 117.98 124.54 1twh s PHE 82 Ca -0.01 -0.39 -0.02 0.00 -0.60 0.00 0.00 56.93 55.91 1twh s PHE 82 Cb -0.05 -1.44 0.02 0.00 0.51 0.00 0.00 43.02 42.06 1twh s PHE 82 CO -0.05 0.49 0.08 0.00 0.70 0.00 0.00 175.22 176.45 1twh h ASP 84 N 6.67 0.43 -2.17 0.00 -0.00 -1.92 -3.42 116.42 116.00 1twh h ASP 84 Ca -0.35 -0.79 -0.58 0.00 -0.00 0.00 0.00 57.03 55.31 1twh h ASP 84 Cb 1.17 -0.13 0.02 0.00 -0.00 0.00 0.00 39.33 40.39 1twh h ASP 84 CO 0.46 1.17 1.14 -0.62 -0.00 0.00 0.00 179.24 181.38 1twh n GLU 85 N -4.29 2.44 -0.15 0.28 1.02 -1.26 -4.97 120.64 113.71 1twh n GLU 85 Ca -0.11 0.89 -0.08 0.00 -0.02 0.00 0.00 57.16 57.85 1twh n GLU 85 Cb 0.64 -2.78 0.01 0.00 -0.02 0.00 0.00 31.44 29.29 1twh n GLU 85 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1twh h PRO 86 N 9.51 0.62 -5.98 3.49 0.13 -1.95 -3.42 132.00 134.40 1twh h PRO 86 Ca -0.49 -0.07 -0.68 0.00 -0.87 0.00 0.00 66.00 63.89 1twh h PRO 86 Cb 1.26 -0.12 -0.24 0.00 0.13 0.00 0.00 31.00 32.02 1twh h PRO 86 CO 0.94 0.49 -0.77 0.45 -0.23 0.00 0.00 178.00 178.89 1twh s SER 87 N -5.74 4.02 -0.35 1.44 0.15 -1.26 -2.51 113.70 109.45 1twh s SER 87 Ca -0.13 -0.24 -0.09 0.00 0.70 0.00 0.00 55.95 56.18 1twh s SER 87 Cb 0.11 -1.11 0.03 0.00 -1.71 0.00 0.00 66.02 63.33 1twh s SER 87 CO 0.74 0.28 0.17 -0.69 1.20 0.00 0.00 173.24 174.95 1twh s VAL 88 N -0.36 4.35 0.67 4.45 1.01 -0.87 -4.99 120.40 124.66 1twh s VAL 88 Ca 0.04 -0.87 -0.10 0.00 0.00 0.00 0.00 61.98 61.05 1twh s VAL 88 Cb -0.12 -3.40 0.01 0.00 0.00 0.00 0.00 36.38 32.87 1twh s VAL 88 CO 0.02 -0.17 1.04 -0.83 0.00 0.00 0.00 175.10 175.16 1twh s GLY 89 N 1.52 1.62 0.46 4.51 0.00 -1.26 -1.58 107.32 112.59 1twh s GLY 89 Ca 0.01 -0.46 0.32 0.00 0.00 0.00 0.00 44.72 44.60 1twh s GLY 89 CO 0.05 -0.11 1.65 -0.24 0.00 0.00 0.00 173.10 174.45 1twh h VAL 90 N -0.51 0.18 0.91 1.40 3.04 -1.93 -1.49 116.25 117.86 1twh h VAL 90 Ca -0.45 -0.04 -0.04 0.00 -1.01 0.00 0.00 66.70 65.16 1twh h VAL 90 Cb 1.26 0.07 0.01 0.00 -2.01 0.00 0.00 31.29 30.62 1twh h VAL 90 CO 0.63 0.02 -0.44 0.50 -1.01 0.00 0.00 177.57 177.27 1twh h LYS 91 N 0.10 -1.18 -0.86 4.17 3.11 -1.98 -0.93 116.57 118.99 1twh h LYS 91 Ca 0.78 0.08 -0.03 0.00 -2.81 0.00 0.00 60.65 58.68 1twh h LYS 91 Cb 2.59 0.27 -0.04 0.00 -1.00 0.00 0.00 32.23 34.04 1twh h LYS 91 CO -0.30 -0.79 0.43 1.15 -2.81 0.00 0.00 179.45 177.13 1twh h THR 92 N -1.26 1.26 -0.24 1.00 2.02 -1.75 -2.81 112.91 111.13 1twh h THR 92 Ca -0.13 -0.70 -0.03 0.00 0.77 0.00 0.00 66.41 66.33 1twh h THR 92 Cb 0.94 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 1twh h THR 92 CO 0.21 0.31 0.05 -0.03 0.37 0.00 0.00 175.52 176.42 1twh h MET 93 N 1.22 0.40 0.00 6.66 1.85 -1.33 -3.21 114.93 120.51 1twh h MET 93 Ca 0.30 -0.10 -0.03 0.00 -0.61 0.00 0.00 59.70 59.26 1twh h MET 93 Cb 0.09 -0.05 -0.00 0.00 0.43 0.00 0.00 31.60 32.07 1twh h MET 93 CO -0.04 0.52 -0.13 0.87 -0.40 0.00 0.00 176.91 177.72 1twh h LYS 94 N 0.21 0.00 0.00 0.39 1.57 -0.90 -1.44 116.57 116.41 1twh h LYS 94 Ca 0.07 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.81 1twh h LYS 94 Cb 0.31 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 1twh h LYS 94 CO 0.00 0.13 -0.84 1.15 -0.57 0.00 0.00 179.45 179.33 1twh h THR 95 N 0.00 0.18 0.03 -0.16 2.02 -1.58 -1.14 112.91 112.26 1twh h THR 95 Ca -0.00 -1.32 -0.04 0.00 0.77 0.00 0.00 66.41 65.82 1twh h THR 95 Cb 0.38 1.80 0.00 0.00 -1.74 0.00 0.00 68.15 68.59 1twh h THR 95 CO 0.02 0.11 -0.19 0.15 0.37 0.00 0.00 175.52 175.97 1twh h PHE 96 N 0.00 0.11 0.00 3.16 3.57 -1.45 -2.61 116.94 119.72 1twh h PHE 96 Ca -0.03 -0.08 -0.03 0.00 3.53 0.00 0.00 57.97 61.36 1twh h PHE 96 Cb 1.16 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.89 1twh h PHE 96 CO 0.00 1.07 -0.12 0.28 -2.23 0.00 0.00 178.31 177.31 1twh h VAL 97 N -0.87 0.70 0.04 1.41 2.07 -1.27 0.43 116.25 118.76 1twh h VAL 97 Ca -0.04 -0.49 -0.22 0.00 0.82 0.00 0.00 66.70 66.77 1twh h VAL 97 Cb 1.14 1.30 0.02 0.00 -1.52 0.00 0.00 31.29 32.23 1twh h VAL 97 CO 0.03 0.12 -0.90 0.40 0.02 0.00 0.00 177.57 177.24 1twh h ILE 98 N 0.00 1.36 -0.47 4.57 5.03 -1.25 -3.09 117.51 123.66 1twh h ILE 98 Ca -0.00 -2.25 0.03 0.00 -0.12 0.00 0.00 64.86 62.52 1twh h ILE 98 Cb 0.29 2.60 -0.03 0.00 -3.03 0.00 0.00 36.82 36.65 1twh h ILE 98 CO 0.02 0.67 0.31 -0.74 -0.68 0.00 0.00 178.15 177.73 1twh h HIS 99 N 0.12 0.49 0.34 1.37 -0.00 0.25 -0.79 115.15 116.92 1twh h HIS 99 Ca -0.12 0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.24 1twh h HIS 99 Cb 1.59 -0.16 0.00 0.00 -0.00 0.00 0.00 27.41 28.84 1twh h HIS 99 CO 0.13 0.29 -0.16 0.82 -0.00 0.00 0.00 177.93 179.00 1twh h ILE 100 N 0.51 0.55 -1.47 6.26 5.03 -1.45 -1.34 117.51 125.60 1twh h ILE 100 Ca 0.19 -0.68 0.43 0.00 -0.12 0.00 0.00 64.86 64.67 1twh h ILE 100 Cb 0.12 0.83 -0.06 0.00 -3.03 0.00 0.00 36.82 34.69 1twh h ILE 100 CO -0.05 0.11 1.26 -0.61 -0.68 0.00 0.00 178.15 178.18 1twh h GLN 101 N -0.89 0.00 0.00 2.37 4.15 -1.05 0.12 115.11 119.80 1twh h GLN 101 Ca -0.05 0.00 -0.20 0.00 0.77 0.00 0.00 58.65 59.18 1twh h GLN 101 Cb 0.53 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.18 1twh h GLN 101 CO 0.08 0.00 -1.93 0.39 -1.93 0.00 0.00 178.83 175.44 1twh n GLU 102 N -3.66 0.66 -0.49 1.69 1.02 -0.53 -3.51 120.64 115.82 1twh n GLU 102 Ca 0.33 0.03 0.08 0.00 -0.02 0.00 0.00 57.16 57.57 1twh n GLU 102 Cb 1.70 -1.63 0.27 0.00 -0.02 0.00 0.00 31.44 31.77 1twh n GLU 102 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1twh n LYS 103 N -2.67 3.28 -3.51 3.49 4.76 0.38 -4.92 118.16 118.97 1twh n LYS 103 Ca -0.17 -2.78 -0.21 0.00 -2.87 0.00 0.00 58.31 52.28 1twh n LYS 103 Cb 0.88 -1.83 0.06 0.00 -1.84 0.00 0.00 35.03 32.30 1twh n LYS 103 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1twh n ASN 104 N -0.06 -3.91 -4.67 4.39 4.05 -1.07 -4.99 115.26 108.98 1twh n ASN 104 Ca 0.21 -0.79 -0.38 0.00 0.45 0.00 0.00 54.58 54.06 1twh n ASN 104 Cb 0.87 -4.45 -0.07 0.00 1.23 0.00 0.00 39.78 37.35 1twh n ASN 104 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 1twh s PHE 105 N -3.49 3.38 -0.64 1.20 2.99 -1.17 -4.80 117.98 115.45 1twh s PHE 105 Ca 0.25 0.66 0.24 0.00 0.00 0.00 0.00 56.93 58.07 1twh s PHE 105 Cb -0.05 -2.55 0.28 0.00 0.00 0.00 0.00 43.02 40.69 1twh s PHE 105 CO 0.79 -0.01 1.25 0.94 -0.00 0.00 0.00 175.22 178.18 1twh n GLN 106 N 4.47 0.29 -3.97 0.44 0.00 -1.15 -4.67 117.38 112.79 1twh n GLN 106 Ca -0.08 0.06 -0.11 0.00 -0.00 0.00 0.00 57.00 56.88 1twh n GLN 106 Cb 0.51 -1.66 -0.12 0.00 0.00 0.00 0.00 30.24 28.97 1twh n GLN 106 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1twh s THR 107 N -3.17 0.15 -0.17 1.69 2.01 -1.18 -1.96 115.64 113.01 1twh s THR 107 Ca 0.06 -0.60 -0.14 0.00 0.31 0.00 0.00 61.69 61.31 1twh s THR 107 Cb 0.14 -0.23 0.05 0.00 0.01 0.00 0.00 72.50 72.46 1twh s THR 107 CO 0.74 -0.29 0.44 -0.83 -0.69 0.00 0.00 174.62 173.99 1twh s GLY 108 N -0.92 -0.33 -0.04 4.40 0.00 -0.49 -1.97 107.32 107.96 1twh s GLY 108 Ca -0.09 1.30 0.05 0.00 0.00 0.00 0.00 44.72 45.98 1twh s GLY 108 CO -0.00 1.18 -0.18 -0.42 0.00 0.00 0.00 173.10 173.68 1twh s ILE 109 N 0.43 1.46 -0.05 0.90 1.01 -1.06 0.82 121.20 124.70 1twh s ILE 109 Ca -0.02 -0.74 -0.01 0.00 0.00 0.00 0.00 60.65 59.88 1twh s ILE 109 Cb -0.04 -1.25 0.03 0.00 0.01 0.00 0.00 42.46 41.21 1twh s ILE 109 CO -0.02 0.42 0.03 0.12 0.00 0.00 0.00 174.94 175.49 1twh s PHE 110 N -0.04 0.38 -0.18 3.97 5.36 0.56 -1.95 117.98 126.07 1twh s PHE 110 Ca -0.02 0.03 -0.03 0.00 -0.96 0.00 0.00 56.93 55.95 1twh s PHE 110 Cb -0.11 -0.62 -0.01 0.00 -0.34 0.00 0.00 43.02 41.93 1twh s PHE 110 CO 0.02 -0.25 -0.07 0.08 -1.46 0.00 0.00 175.22 173.54 1twh s VAL 111 N 1.94 3.38 0.30 3.12 1.01 -0.17 -1.85 120.40 128.13 1twh s VAL 111 Ca 0.03 -0.52 0.08 0.00 0.00 0.00 0.00 61.98 61.58 1twh s VAL 111 Cb -0.12 -2.49 -0.06 0.00 0.00 0.00 0.00 36.38 33.70 1twh s VAL 111 CO -0.04 0.47 -0.08 -0.72 0.00 0.00 0.00 175.10 174.72 1twh s TYR 112 N 0.92 2.15 -0.11 5.22 -0.85 -0.59 -3.50 117.35 120.58 1twh s TYR 112 Ca -0.01 -0.59 0.03 0.00 -0.52 0.00 0.00 57.07 55.98 1twh s TYR 112 Cb -0.15 -1.20 -0.24 0.00 0.38 0.00 0.00 41.96 40.75 1twh s TYR 112 CO 0.01 0.43 0.42 1.04 -1.52 0.00 0.00 175.55 175.92 1twh n GLN 113 N -0.66 0.70 0.00 -3.49 6.02 -1.26 -1.87 117.38 116.82 1twh n GLN 113 Ca -0.05 0.25 0.00 0.00 -0.01 0.00 0.00 57.00 57.19 1twh n GLN 113 Cb 0.63 -1.72 0.00 0.00 1.02 0.00 0.00 30.24 30.18 1twh n GLN 113 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1twh n ASN 114 N -3.25 0.00 -2.96 1.08 0.23 -1.04 -4.75 115.26 104.57 1twh n ASN 114 Ca -0.27 0.00 -0.10 0.00 -0.53 0.00 0.00 54.58 53.68 1twh n ASN 114 Cb 1.05 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 38.77 1twh n ASN 114 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1twh s ASN 115 N -0.78 0.19 0.50 0.53 2.20 -1.20 -5.06 114.94 111.31 1twh s ASN 115 Ca 0.00 -1.22 0.05 0.00 -0.94 0.00 0.00 52.86 50.74 1twh s ASN 115 Cb 0.00 0.82 0.00 0.00 -2.00 0.00 0.00 41.25 40.08 1twh s ASN 115 CO 0.00 -1.63 0.24 -0.63 -2.94 0.00 0.00 177.10 172.14 1twh s ILE 116 N -2.40 1.69 -0.03 0.54 1.09 -1.26 -2.05 121.20 118.78 1twh s ILE 116 Ca 0.18 -1.67 -0.16 0.00 -1.10 0.00 0.00 60.65 57.90 1twh s ILE 116 Cb -0.04 -2.37 -0.05 0.00 -1.06 0.00 0.00 42.46 38.94 1twh s ILE 116 CO 0.13 0.00 0.45 0.42 -0.10 0.00 0.00 174.94 175.84 1twh s THR 117 N -2.75 5.05 0.03 2.92 -4.23 -0.62 -4.82 115.64 111.22 1twh s THR 117 Ca 0.28 0.92 0.02 0.00 -1.18 0.00 0.00 61.69 61.73 1twh s THR 117 Cb 0.00 -3.77 0.03 0.00 1.34 0.00 0.00 72.50 70.11 1twh s THR 117 CO 0.17 0.49 0.14 -2.65 -0.54 0.00 0.00 174.62 172.22 1twh n PRO 118 N 2.46 -0.01 0.00 3.99 -0.02 -1.26 0.18 135.00 140.35 1twh n PRO 118 Ca -0.11 0.12 0.04 0.00 -2.02 0.00 0.00 63.50 61.53 1twh n PRO 118 Cb 0.52 -0.22 -0.04 0.00 -0.02 0.00 0.00 33.50 33.75 1twh n PRO 118 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1twh n SER 119 N -3.30 0.57 0.15 2.55 3.41 -1.26 -3.83 113.62 111.91 1twh n SER 119 Ca 0.03 -0.79 -0.13 0.00 -0.26 0.00 0.00 58.87 57.72 1twh n SER 119 Cb 0.11 0.88 -0.08 0.00 -0.26 0.00 0.00 64.21 64.85 1twh n SER 119 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1twh h ALA 120 N 1.28 -0.40 0.00 7.33 0.00 -0.57 -3.27 119.26 123.62 1twh h ALA 120 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1twh h ALA 120 Cb 0.22 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1twh h ALA 120 CO 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 179.25 178.69 1twh n MET 121 N -5.13 0.17 0.20 0.00 0.00 -0.81 0.13 117.12 111.69 1twh n MET 121 Ca -0.09 0.54 0.09 0.00 0.00 0.00 0.00 57.70 58.24 1twh n MET 121 Cb 0.26 -1.93 0.25 0.00 0.00 0.00 0.00 33.22 31.80 1twh n MET 121 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 1twh h LYS 122 N 0.00 0.00 0.00 3.17 1.57 -1.66 -3.18 116.57 116.47 1twh h LYS 122 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1twh h LYS 122 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1twh h LYS 122 CO 0.00 0.21 0.00 1.28 -0.57 0.00 0.00 179.45 180.37 1twh n LEU 123 N -3.21 0.00 -0.02 2.94 4.77 0.35 -4.23 117.00 117.60 1twh n LEU 123 Ca 0.02 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1twh n LEU 123 Cb 0.54 -0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.63 1twh n LEU 123 CO 0.35 -0.00 -0.02 0.58 -1.33 0.00 0.00 177.39 176.97 1twh h VAL 124 N 0.00 0.00 -3.06 4.08 2.07 -1.70 -3.39 116.25 114.25 1twh h VAL 124 Ca 0.00 -0.38 -0.58 0.00 0.82 0.00 0.00 66.70 66.56 1twh h VAL 124 Cb 0.00 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.72 1twh h VAL 124 CO 0.00 0.00 0.80 -2.16 0.02 0.00 0.00 177.57 176.23 1twh s PRO 125 N -1.24 4.27 0.00 1.57 0.04 -1.26 -4.48 135.00 133.89 1twh s PRO 125 Ca -0.01 1.43 0.00 0.00 0.04 0.00 0.00 61.00 62.46 1twh s PRO 125 Cb 0.00 -3.66 0.00 0.00 0.04 0.00 0.00 34.50 30.88 1twh s PRO 125 CO 0.01 -0.62 0.00 0.45 0.04 0.00 0.00 177.00 176.88 1twh n SER 126 N 6.27 0.00 -1.32 6.66 2.88 -1.26 -5.03 113.62 121.83 1twh n SER 126 Ca 0.12 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.62 1twh n SER 126 Cb 0.46 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.89 1twh n SER 126 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1twh n ILE 127 N 0.00 0.04 -1.08 2.46 -5.35 -1.26 -5.12 119.36 109.04 1twh n ILE 127 Ca 0.00 -0.38 -0.41 0.00 -0.27 0.00 0.00 62.75 61.69 1twh n ILE 127 Cb 0.00 0.67 -0.05 0.00 -1.74 0.00 0.00 39.64 38.52 1twh n ILE 127 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 1twh n PRO 128 N -0.08 0.00 0.01 6.28 -0.02 -1.26 -3.56 135.00 136.37 1twh n PRO 128 Ca -0.19 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.40 1twh n PRO 128 Cb 0.81 -1.02 0.13 0.00 -0.02 0.00 0.00 33.50 33.40 1twh n PRO 128 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1twh n PRO 129 N 1.02 0.04 -2.37 0.52 -0.04 -1.26 -5.11 135.00 127.80 1twh n PRO 129 Ca 0.14 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.20 1twh n PRO 129 Cb 0.08 -1.52 -0.04 0.00 -0.04 0.00 0.00 33.50 31.99 1twh n PRO 129 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1twh s ALA 130 N -3.03 3.44 0.23 0.55 0.00 -1.23 -4.94 121.76 116.78 1twh s ALA 130 Ca 0.09 0.98 0.10 0.00 0.00 0.00 0.00 51.96 53.14 1twh s ALA 130 Cb 0.17 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.85 1twh s ALA 130 CO 0.75 -0.34 -0.13 0.95 0.00 0.00 0.00 175.76 176.99 1twh s THR 131 N -0.57 2.89 -0.05 0.00 -4.23 -0.83 -4.33 115.64 108.54 1twh s THR 131 Ca 0.50 -1.98 0.02 0.00 -1.18 0.00 0.00 61.69 59.04 1twh s THR 131 Cb -0.34 -2.47 0.01 0.00 1.34 0.00 0.00 72.50 71.05 1twh s THR 131 CO 0.40 -0.24 -0.09 -0.63 -0.54 0.00 0.00 174.62 173.52 1twh s ILE 132 N -2.04 0.83 -0.05 2.99 -1.09 -1.26 -1.39 121.20 119.19 1twh s ILE 132 Ca 0.27 -0.32 0.05 0.00 -2.23 0.00 0.00 60.65 58.42 1twh s ILE 132 Cb -0.07 -0.79 -0.01 0.00 -1.58 0.00 0.00 42.46 40.02 1twh s ILE 132 CO 0.15 0.28 -0.21 -1.61 -1.23 0.00 0.00 174.94 172.32 1twh s GLU 133 N 0.65 2.15 -0.07 2.79 2.02 0.24 -4.91 118.70 121.57 1twh s GLU 133 Ca -0.11 -0.75 0.02 0.00 0.02 0.00 0.00 54.97 54.15 1twh s GLU 133 Cb -0.14 -1.85 -0.03 0.00 0.10 0.00 0.00 34.13 32.22 1twh s GLU 133 CO 0.02 0.31 -0.12 0.95 0.02 0.00 0.00 175.26 176.44 1twh s THR 134 N -0.07 3.26 -0.01 3.63 -4.23 -1.26 -0.32 115.64 116.64 1twh s THR 134 Ca -0.04 -0.64 0.05 0.00 -1.18 0.00 0.00 61.69 59.88 1twh s THR 134 Cb -0.13 -2.31 -0.01 0.00 1.34 0.00 0.00 72.50 71.40 1twh s THR 134 CO 0.03 0.58 -0.16 -0.36 -0.54 0.00 0.00 174.62 174.17 1twh s PHE 135 N -0.61 1.45 0.35 3.99 0.40 -0.77 -4.95 117.98 117.83 1twh s PHE 135 Ca 0.09 -0.28 -0.26 0.00 -0.60 0.00 0.00 56.93 55.88 1twh s PHE 135 Cb -0.11 -0.93 -0.09 0.00 0.51 0.00 0.00 43.02 42.39 1twh s PHE 135 CO 0.01 -0.02 1.07 1.21 0.70 0.00 0.00 175.22 178.20 1twh s ASN 136 N -0.44 6.98 0.18 1.36 3.84 -1.26 -1.55 114.94 124.06 1twh s ASN 136 Ca 0.06 2.14 -0.13 0.00 0.21 0.00 0.00 52.86 55.14 1twh s ASN 136 Cb -0.06 -2.60 0.13 0.00 -0.55 0.00 0.00 41.25 38.16 1twh s ASN 136 CO -0.00 -0.34 1.80 -0.33 -2.79 0.00 0.00 177.10 175.43 1twh h GLU 137 N 3.09 0.53 0.00 0.43 5.08 -1.67 -2.97 114.58 119.07 1twh h GLU 137 Ca -0.48 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1twh h GLU 137 Cb 1.21 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.34 1twh h GLU 137 CO 0.64 0.35 -0.01 0.00 -1.00 0.00 0.00 179.01 179.00 1twh h ALA 138 N 1.26 1.98 0.00 3.43 0.00 -1.89 0.56 119.26 124.60 1twh h ALA 138 Ca 0.22 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1twh h ALA 138 Cb 0.09 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1twh h ALA 138 CO -0.13 0.01 -0.16 0.00 0.00 0.00 0.00 179.25 178.97 1twh h ALA 139 N 1.99 1.16 -0.03 0.00 0.00 -1.90 -2.42 119.26 118.08 1twh h ALA 139 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1twh h ALA 139 Cb 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1twh h ALA 139 CO 0.00 0.20 -0.15 1.28 0.00 0.00 0.00 179.25 180.58 1twh n LEU 140 N -3.52 2.69 0.15 0.00 4.77 0.19 -4.42 117.00 116.87 1twh n LEU 140 Ca -0.01 -0.92 0.02 0.00 -0.03 0.00 0.00 56.01 55.06 1twh n LEU 140 Cb 0.31 0.00 0.36 0.00 -2.33 0.00 0.00 43.42 41.76 1twh n LEU 140 CO 0.31 0.46 0.78 0.58 -1.33 0.00 0.00 177.39 178.19 1twh h VAL 141 N 3.99 1.23 -4.32 4.08 2.07 -0.86 -3.36 116.25 119.08 1twh h VAL 141 Ca 0.00 -1.09 -0.60 0.00 0.82 0.00 0.00 66.70 65.83 1twh h VAL 141 Cb 0.92 1.49 -0.28 0.00 -1.52 0.00 0.00 31.29 31.90 1twh h VAL 141 CO 0.00 0.32 -0.85 -0.69 0.02 0.00 0.00 177.57 176.37 1twh s VAL 142 N -4.41 1.66 -0.57 2.57 1.01 -1.26 -4.36 120.40 115.04 1twh s VAL 142 Ca -0.04 -1.03 -0.26 0.00 0.00 0.00 0.00 61.98 60.65 1twh s VAL 142 Cb 0.15 -1.41 0.04 0.00 0.00 0.00 0.00 36.38 35.16 1twh s VAL 142 CO 0.73 0.35 1.05 0.21 0.00 0.00 0.00 175.10 177.44 1twh s ASN 143 N -0.80 6.37 0.48 3.32 3.84 -1.26 -4.91 114.94 121.98 1twh s ASN 143 Ca 0.08 -0.19 0.27 0.00 0.21 0.00 0.00 52.86 53.22 1twh s ASN 143 Cb -0.08 -2.48 1.11 0.00 -0.55 0.00 0.00 41.25 39.25 1twh s ASN 143 CO 0.00 -1.34 1.90 0.16 -2.79 0.00 0.00 177.10 175.04 1twh h ILE 144 N 6.07 0.45 0.00 -5.21 3.07 -1.95 -0.78 117.51 119.15 1twh h ILE 144 Ca -0.26 -0.90 0.00 0.00 1.55 0.00 0.00 64.86 65.26 1twh h ILE 144 Cb 1.07 1.64 0.00 0.00 -0.27 0.00 0.00 36.82 39.25 1twh h ILE 144 CO 1.13 0.16 0.00 0.35 -1.05 0.00 0.00 178.15 178.74 1twh n THR 145 N -3.37 0.12 1.07 0.16 -2.24 -1.26 -2.45 114.28 106.31 1twh n THR 145 Ca -0.00 0.03 0.11 0.00 -2.27 0.00 0.00 64.05 61.92 1twh n THR 145 Cb 0.37 -0.73 0.34 0.00 -2.10 0.00 0.00 70.33 68.21 1twh n THR 145 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1twh n HIS 146 N -1.08 0.26 -3.17 4.78 8.25 -0.30 -4.83 115.22 119.14 1twh n HIS 146 Ca 0.13 -0.13 -0.28 0.00 -0.26 0.00 0.00 57.72 57.18 1twh n HIS 146 Cb 0.09 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.17 1twh n HIS 146 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1twh s HIS 147 N -1.74 3.49 0.24 4.41 5.04 -1.02 -4.91 115.29 120.79 1twh s HIS 147 Ca 0.33 0.72 0.36 0.00 -1.54 0.00 0.00 55.06 54.93 1twh s HIS 147 Cb 0.18 -2.18 1.74 0.00 0.04 0.00 0.00 32.58 32.36 1twh s HIS 147 CO 0.27 0.06 2.09 1.05 -2.34 0.00 0.00 174.74 175.87 1twh h GLU 148 N 1.36 0.00 -0.08 2.88 4.11 -1.91 -0.26 114.58 120.68 1twh h GLU 148 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 1twh h GLU 148 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1twh h GLU 148 CO 0.65 0.00 0.00 1.28 0.07 0.00 0.00 179.01 181.01 1twh n LEU 149 N -2.94 2.31 -4.36 3.06 4.32 -1.26 -4.80 117.00 113.33 1twh n LEU 149 Ca -0.01 -0.82 -0.36 0.00 -0.02 0.00 0.00 56.01 54.80 1twh n LEU 149 Cb 0.18 -0.04 -0.13 0.00 -1.62 0.00 0.00 43.42 41.81 1twh n LEU 149 CO 0.22 0.41 -0.32 -0.69 -1.22 0.00 0.00 177.39 175.79 1twh s VAL 150 N -1.92 3.83 0.69 4.08 1.01 -0.11 -5.05 120.40 122.93 1twh s VAL 150 Ca 0.34 -0.48 -0.05 0.00 0.00 0.00 0.00 61.98 61.79 1twh s VAL 150 Cb 0.20 -2.84 0.06 0.00 0.00 0.00 0.00 36.38 33.80 1twh s VAL 150 CO 0.31 0.28 0.98 -2.16 0.00 0.00 0.00 175.10 174.51 1twh s PRO 151 N 1.52 2.18 -0.22 2.72 0.04 -1.26 -4.71 135.00 135.27 1twh s PRO 151 Ca 0.05 -0.40 -0.29 0.00 0.04 0.00 0.00 61.00 60.40 1twh s PRO 151 Cb -0.16 -2.22 -0.03 0.00 0.04 0.00 0.00 34.50 32.13 1twh s PRO 151 CO 0.01 -1.20 1.80 0.21 0.04 0.00 0.00 177.00 177.86 1twh s LYS 152 N -5.18 3.59 -0.15 4.56 2.20 -1.26 -4.85 119.74 118.66 1twh s LYS 152 Ca 0.60 1.76 -0.05 0.00 -0.36 0.00 0.00 55.97 57.92 1twh s LYS 152 Cb -0.10 -4.15 -0.04 0.00 -1.51 0.00 0.00 37.83 32.03 1twh s LYS 152 CO 0.44 -1.55 0.03 -1.01 -0.36 0.00 0.00 175.35 172.90 1twh s HIS 153 N 6.11 3.19 -0.07 4.03 3.76 -1.26 -0.77 115.29 130.28 1twh s HIS 153 Ca 0.80 0.03 -0.00 0.00 -0.15 0.00 0.00 55.06 55.75 1twh s HIS 153 Cb -0.27 -1.97 0.02 0.00 1.11 0.00 0.00 32.58 31.47 1twh s HIS 153 CO 0.33 0.21 -0.04 0.42 -0.85 0.00 0.00 174.74 174.81 1twh s ILE 154 N -0.00 0.59 0.04 0.60 1.09 -0.24 -4.90 121.20 118.38 1twh s ILE 154 Ca 0.04 -0.08 -0.29 0.00 -1.10 0.00 0.00 60.65 59.22 1twh s ILE 154 Cb -0.13 -0.65 -0.04 0.00 -1.06 0.00 0.00 42.46 40.58 1twh s ILE 154 CO 0.01 0.27 0.94 -0.60 -0.10 0.00 0.00 174.94 175.47 1twh s ARG 155 N 1.42 4.60 0.18 2.79 3.52 -1.26 -1.84 118.95 128.36 1twh s ARG 155 Ca -0.03 1.38 -0.30 0.00 -0.13 0.00 0.00 55.73 56.65 1twh s ARG 155 Cb -0.13 -3.43 -0.07 0.00 -1.56 0.00 0.00 34.95 29.76 1twh s ARG 155 CO -0.03 0.07 1.00 -0.51 -0.81 0.00 0.00 175.30 175.02 1twh s LEU 156 N 0.59 4.54 0.73 -0.88 1.43 -1.11 -4.99 118.68 118.99 1twh s LEU 156 Ca 0.49 1.95 -0.15 0.00 -1.03 0.00 0.00 54.13 55.38 1twh s LEU 156 Cb -0.22 -3.60 0.04 0.00 0.03 0.00 0.00 46.19 42.44 1twh s LEU 156 CO 0.28 -0.05 1.24 -0.94 0.23 0.00 0.00 176.35 177.11 1twh s SER 157 N -0.42 4.07 0.54 2.29 1.04 -1.26 -4.54 113.70 115.42 1twh s SER 157 Ca 0.46 2.48 0.33 0.00 0.48 0.00 0.00 55.95 59.70 1twh s SER 157 Cb -0.26 -2.60 1.35 0.00 0.10 0.00 0.00 66.02 64.61 1twh s SER 157 CO 0.32 -2.35 1.98 0.77 0.98 0.00 0.00 173.24 174.94 1twh h SER 158 N -0.23 0.00 0.65 7.02 4.64 -1.99 0.41 113.55 124.05 1twh h SER 158 Ca -0.48 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.80 1twh h SER 158 Cb 1.31 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.41 1twh h SER 158 CO 0.49 0.00 -0.31 -0.78 -0.87 0.00 0.00 176.83 175.36 1twh h ASP 159 N 0.00 -0.74 -0.32 4.97 1.82 -1.94 -0.71 116.42 119.50 1twh h ASP 159 Ca 0.00 0.03 0.03 0.00 -0.39 0.00 0.00 57.03 56.69 1twh h ASP 159 Cb 0.51 0.19 -0.04 0.00 0.68 0.00 0.00 39.33 40.68 1twh h ASP 159 CO 0.00 -0.41 -0.19 -0.62 -1.61 0.00 0.00 179.24 176.41 1twh n GLU 160 N -5.03 -0.14 -0.24 0.28 1.02 -0.59 0.22 120.64 116.16 1twh n GLU 160 Ca -0.11 0.76 0.05 0.00 -0.02 0.00 0.00 57.16 57.84 1twh n GLU 160 Cb 0.35 -1.13 0.17 0.00 -0.02 0.00 0.00 31.44 30.81 1twh n GLU 160 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 1twh h LYS 161 N 0.00 0.30 0.00 3.49 3.11 -0.98 0.49 116.57 122.98 1twh h LYS 161 Ca 0.05 -0.02 -0.07 0.00 -2.81 0.00 0.00 60.65 57.80 1twh h LYS 161 Cb 0.13 -0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 31.28 1twh h LYS 161 CO -0.30 0.20 -0.35 0.00 -2.81 0.00 0.00 179.45 176.19 1twh h ARG 162 N 0.31 0.00 -0.10 1.90 3.08 0.42 -1.12 114.38 118.87 1twh h ARG 162 Ca 0.40 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 60.22 1twh h ARG 162 Cb 0.65 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.71 1twh h ARG 162 CO -0.47 0.35 -0.83 1.49 -1.07 0.00 0.00 179.97 179.44 1twh h GLU 163 N 0.00 0.69 -0.12 0.04 4.57 0.34 0.27 114.58 120.37 1twh h GLU 163 Ca -0.00 -0.60 -0.01 0.00 -1.18 0.00 0.00 59.36 57.57 1twh h GLU 163 Cb 0.64 0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.36 1twh h GLU 163 CO 0.05 1.21 0.04 1.25 -1.18 0.00 0.00 179.01 180.38 1twh h LEU 164 N 0.45 0.16 -1.50 1.64 5.85 -0.16 0.62 115.31 122.37 1twh h LEU 164 Ca -0.06 -0.18 -0.05 0.00 0.84 0.00 0.00 57.88 58.42 1twh h LEU 164 Cb 1.46 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.43 1twh h LEU 164 CO 0.16 0.30 -0.21 -0.07 -0.34 0.00 0.00 178.44 178.28 1twh h LEU 165 N 0.02 0.05 -0.16 2.25 3.38 -1.05 -2.59 115.31 117.21 1twh h LEU 165 Ca 0.04 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1twh h LEU 165 Cb 0.19 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1twh h LEU 165 CO -0.00 0.27 -0.13 0.50 0.09 0.00 0.00 178.44 179.16 1twh h LYS 166 N 0.05 0.37 0.00 1.13 3.64 0.15 -1.01 116.57 120.91 1twh h LYS 166 Ca 0.01 -0.19 -0.03 0.00 -1.27 0.00 0.00 60.65 59.17 1twh h LYS 166 Cb 0.41 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1twh h LYS 166 CO 0.03 0.73 -0.13 0.00 -2.27 0.00 0.00 179.45 177.81 1twh h ARG 167 N 0.02 0.00 -0.23 1.90 2.47 0.28 -0.06 114.38 118.75 1twh h ARG 167 Ca 0.03 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.75 1twh h ARG 167 Cb 0.65 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.97 1twh h ARG 167 CO 0.03 0.13 0.00 0.66 0.56 0.00 0.00 179.97 181.35 1twh n TYR 168 N -3.58 0.28 -4.27 3.04 4.02 -1.00 -4.98 117.16 110.67 1twh n TYR 168 Ca -0.01 -0.19 -0.32 0.00 -0.01 0.00 0.00 57.90 57.37 1twh n TYR 168 Cb 0.26 -0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.49 1twh n TYR 168 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1twh n ARG 169 N 1.06 -0.90 -3.73 -0.72 1.74 -0.04 -4.92 116.66 109.15 1twh n ARG 169 Ca 0.14 0.10 -0.25 0.00 -0.77 0.00 0.00 57.85 57.06 1twh n ARG 169 Cb 0.48 -3.63 -0.02 0.00 -1.02 0.00 0.00 32.46 28.26 1twh n ARG 169 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1twh s LEU 170 N -7.14 4.22 0.56 0.55 1.43 -0.68 -5.05 118.68 112.57 1twh s LEU 170 Ca 0.16 0.31 -0.10 0.00 -1.03 0.00 0.00 54.13 53.47 1twh s LEU 170 Cb -0.09 -3.10 -0.04 0.00 0.03 0.00 0.00 46.19 42.99 1twh s LEU 170 CO 0.96 -0.09 0.95 -0.54 0.23 0.00 0.00 176.35 177.87 1twh s LYS 171 N -3.66 3.64 0.17 1.70 1.02 -1.26 -4.89 119.74 116.46 1twh s LYS 171 Ca 0.37 0.63 -0.15 0.00 0.02 0.00 0.00 55.97 56.85 1twh s LYS 171 Cb -0.10 -2.17 0.11 0.00 -0.52 0.00 0.00 37.83 35.15 1twh s LYS 171 CO 0.30 -0.42 1.75 0.93 -0.92 0.00 0.00 175.35 176.99 1twh h GLU 172 N 0.04 0.29 0.00 1.68 5.08 -1.98 0.18 114.58 119.87 1twh h GLU 172 Ca -0.45 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1twh h GLU 172 Cb 1.19 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.38 1twh h GLU 172 CO 0.62 0.19 0.00 -1.13 -1.00 0.00 0.00 179.01 177.69 1twh n SER 173 N -5.02 0.00 -0.38 1.42 3.41 -1.26 -2.56 113.62 109.23 1twh n SER 173 Ca 0.03 0.38 0.09 0.00 -0.26 0.00 0.00 58.87 59.11 1twh n SER 173 Cb 0.16 -0.43 0.40 0.00 -0.26 0.00 0.00 64.21 64.09 1twh n SER 173 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1twh n GLN 174 N -1.43 1.49 -3.95 4.33 6.02 0.63 -4.86 117.38 119.61 1twh n GLN 174 Ca 0.03 -0.74 -0.25 0.00 -0.01 0.00 0.00 57.00 56.03 1twh n GLN 174 Cb 0.10 -1.34 -0.03 0.00 1.02 0.00 0.00 30.24 29.99 1twh n GLN 174 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1twh s LEU 175 N -1.52 4.32 0.82 1.08 1.43 -1.06 -5.00 118.68 118.75 1twh s LEU 175 Ca 0.29 0.14 -0.11 0.00 -1.03 0.00 0.00 54.13 53.42 1twh s LEU 175 Cb 0.15 -2.88 0.09 0.00 0.03 0.00 0.00 46.19 43.58 1twh s LEU 175 CO 0.23 0.03 1.13 -2.84 0.23 0.00 0.00 176.35 175.14 1twh s PRO 176 N -3.37 1.74 0.26 1.29 0.02 -1.26 -4.86 135.00 128.82 1twh s PRO 176 Ca 0.34 1.44 0.11 0.00 0.02 0.00 0.00 61.00 62.91 1twh s PRO 176 Cb -0.11 -1.82 -0.05 0.00 0.02 0.00 0.00 34.50 32.55 1twh s PRO 176 CO 0.28 -2.08 -0.13 1.03 -0.33 0.00 0.00 177.00 175.77 1twh s ARG 177 N -4.58 1.89 -0.02 5.54 0.52 -1.26 -1.56 118.95 119.47 1twh s ARG 177 Ca 0.66 -1.60 0.00 0.00 -0.52 0.00 0.00 55.73 54.28 1twh s ARG 177 Cb -0.22 -1.93 0.03 0.00 0.52 0.00 0.00 34.95 33.35 1twh s ARG 177 CO 0.54 0.36 0.01 -1.50 0.02 0.00 0.00 175.30 174.73 1twh s ILE 178 N -2.30 0.08 0.70 1.52 2.07 -1.07 -4.71 121.20 117.48 1twh s ILE 178 Ca 0.29 0.13 -0.11 0.00 -1.41 0.00 0.00 60.65 59.55 1twh s ILE 178 Cb -0.06 -0.18 0.01 0.00 0.13 0.00 0.00 42.46 42.36 1twh s ILE 178 CO 0.16 0.11 1.07 -1.10 -1.91 0.00 0.00 174.94 173.27 1twh s GLN 179 N 0.96 2.91 0.47 3.50 -1.52 -1.26 -2.10 119.66 122.61 1twh s GLN 179 Ca -0.09 0.75 0.14 0.00 -1.95 0.00 0.00 55.36 54.22 1twh s GLN 179 Cb -0.12 -2.00 1.12 0.00 -0.22 0.00 0.00 33.01 31.78 1twh s GLN 179 CO -0.02 -1.07 2.06 -0.09 -0.25 0.00 0.00 175.29 175.92 1twh h ARG 180 N -0.69 0.24 -0.28 2.91 2.43 -1.92 0.10 114.38 117.17 1twh h ARG 180 Ca -0.45 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 58.61 1twh h ARG 180 Cb 1.22 -0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 30.66 1twh h ARG 180 CO 0.60 0.16 -0.06 0.00 -1.51 0.00 0.00 179.97 179.16 1twh n ALA 181 N -2.53 3.68 -1.72 2.80 0.00 -1.26 -4.06 120.51 117.41 1twh n ALA 181 Ca 0.04 -2.84 -0.40 0.00 0.00 0.00 0.00 53.44 50.24 1twh n ALA 181 Cb 0.22 -0.68 0.03 0.00 0.00 0.00 0.00 19.45 19.02 1twh n ALA 181 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1twh n ASP 182 N -0.96 2.56 0.25 0.00 -0.08 0.02 -4.79 116.55 113.54 1twh n ASP 182 Ca 0.27 1.04 0.08 0.00 -1.51 0.00 0.00 54.79 54.67 1twh n ASP 182 Cb 0.94 -1.53 0.63 0.00 2.34 0.00 0.00 41.12 43.50 1twh n ASP 182 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1twh h PRO 183 N 1.73 0.00 0.00 -0.67 0.11 -1.90 -0.52 132.00 130.75 1twh h PRO 183 Ca -0.49 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.46 1twh h PRO 183 Cb 1.30 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.38 1twh h PRO 183 CO 0.58 0.06 -1.40 0.28 -0.21 0.00 0.00 178.00 177.31 1twh n VAL 184 N -4.37 1.13 0.06 3.15 0.31 -1.26 -1.69 118.33 115.67 1twh n VAL 184 Ca -0.03 -0.68 -0.01 0.00 -0.01 0.00 0.00 64.34 63.61 1twh n VAL 184 Cb 0.14 -0.70 0.26 0.00 -0.91 0.00 0.00 33.84 32.63 1twh n VAL 184 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1twh h ALA 185 N 1.47 1.22 -0.25 3.52 0.00 -1.42 0.69 119.26 124.50 1twh h ALA 185 Ca -0.15 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.33 1twh h ALA 185 Cb 1.54 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 1twh h ALA 185 CO 0.04 0.51 -0.28 -0.07 0.00 0.00 0.00 179.25 179.45 1twh h LEU 186 N 0.31 0.49 -0.58 0.00 3.38 -1.08 0.32 115.31 118.15 1twh h LEU 186 Ca 0.05 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 1twh h LEU 186 Cb 0.62 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 1twh h LEU 186 CO 0.04 0.76 0.22 0.22 0.09 0.00 0.00 178.44 179.77 1twh h TYR 187 N 0.42 0.90 -0.11 1.13 3.20 -0.52 -2.79 116.97 119.20 1twh h TYR 187 Ca 0.06 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1twh h TYR 187 Cb 0.71 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 38.71 1twh h TYR 187 CO 0.02 0.73 0.00 1.28 -1.64 0.00 0.00 178.16 178.55 1twh n LEU 188 N -4.46 0.84 -4.00 2.82 4.77 0.16 -4.90 117.00 112.22 1twh n LEU 188 Ca 0.03 -0.38 -0.26 0.00 -0.03 0.00 0.00 56.01 55.37 1twh n LEU 188 Cb 0.18 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.16 1twh n LEU 188 CO 0.39 0.19 -0.25 0.61 -1.33 0.00 0.00 177.39 177.00 1twh n GLY 189 N 0.89 -0.22 3.88 -0.72 0.00 -0.79 -4.94 105.19 103.29 1twh n GLY 189 Ca 0.12 0.15 -0.30 0.00 0.00 0.00 0.00 46.02 45.99 1twh n GLY 189 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1twh s LEU 190 N -7.02 3.28 0.01 0.99 1.43 0.04 -5.04 118.68 112.36 1twh s LEU 190 Ca 0.04 1.25 0.07 0.00 -1.03 0.00 0.00 54.13 54.46 1twh s LEU 190 Cb -0.02 -4.24 -0.03 0.00 0.03 0.00 0.00 46.19 41.93 1twh s LEU 190 CO 0.90 -0.87 -0.19 -0.54 0.23 0.00 0.00 176.35 175.88 1twh s LYS 191 N -5.10 2.14 0.35 1.70 1.02 -1.26 -4.89 119.74 113.70 1twh s LYS 191 Ca 0.54 -0.92 -0.24 0.00 0.02 0.00 0.00 55.97 55.36 1twh s LYS 191 Cb -0.11 -2.19 -0.14 0.00 -0.52 0.00 0.00 37.83 34.87 1twh s LYS 191 CO 0.51 0.56 0.55 -2.13 -0.92 0.00 0.00 175.35 173.92 1twh n ARG 192 N 1.86 0.49 0.00 1.68 0.63 -1.26 0.05 116.66 120.10 1twh n ARG 192 Ca -0.16 0.18 0.00 0.00 -0.92 0.00 0.00 57.85 56.94 1twh n ARG 192 Cb 0.52 -1.38 0.00 0.00 0.45 0.00 0.00 32.46 32.05 1twh n ARG 192 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1twh n GLY 193 N 1.82 1.59 3.80 5.14 0.00 -0.56 -4.99 105.19 111.98 1twh n GLY 193 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 1twh n GLY 193 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1twh s GLU 194 N -0.48 3.50 -0.10 1.61 2.02 0.11 -4.79 118.70 120.56 1twh s GLU 194 Ca 0.00 1.33 0.03 0.00 0.02 0.00 0.00 54.97 56.36 1twh s GLU 194 Cb 0.00 -2.05 -0.01 0.00 0.10 0.00 0.00 34.13 32.17 1twh s GLU 194 CO 0.00 -0.68 -0.21 0.08 0.02 0.00 0.00 175.26 174.47 1twh s VAL 195 N -2.16 2.32 0.06 2.63 1.01 -1.26 -1.27 120.40 121.74 1twh s VAL 195 Ca 0.67 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.75 1twh s VAL 195 Cb -0.17 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 1twh s VAL 195 CO 0.29 0.56 -0.00 0.68 0.00 0.00 0.00 175.10 176.62 1twh s VAL 196 N 0.21 4.03 -0.17 2.92 -7.23 0.17 -2.77 120.40 117.56 1twh s VAL 196 Ca -0.13 -0.88 -0.01 0.00 -1.81 0.00 0.00 61.98 59.15 1twh s VAL 196 Cb -0.16 -2.88 -0.00 0.00 0.56 0.00 0.00 36.38 33.89 1twh s VAL 196 CO 0.07 0.20 -0.12 -0.75 -0.31 0.00 0.00 175.10 174.19 1twh s LYS 197 N -2.07 3.28 -0.24 4.82 2.20 -0.76 -0.85 119.74 126.12 1twh s LYS 197 Ca 0.24 -0.71 -0.07 0.00 -0.36 0.00 0.00 55.97 55.07 1twh s LYS 197 Cb -0.12 -2.74 -0.03 0.00 -1.51 0.00 0.00 37.83 33.43 1twh s LYS 197 CO 0.16 -0.04 0.06 0.42 -0.36 0.00 0.00 175.35 175.59 1twh s ILE 198 N 0.98 4.30 -0.21 5.43 1.09 0.32 -1.08 121.20 132.04 1twh s ILE 198 Ca -0.02 -0.18 -0.02 0.00 -1.10 0.00 0.00 60.65 59.33 1twh s ILE 198 Cb -0.15 -3.00 -0.00 0.00 -1.06 0.00 0.00 42.46 38.25 1twh s ILE 198 CO -0.02 0.36 -0.09 -0.63 -0.10 0.00 0.00 174.94 174.47 1twh s ILE 199 N 1.44 3.01 0.24 2.92 1.01 0.05 -2.04 121.20 127.83 1twh s ILE 199 Ca 0.05 -0.62 0.11 0.00 0.00 0.00 0.00 60.65 60.20 1twh s ILE 199 Cb -0.15 -2.35 -0.05 0.00 0.01 0.00 0.00 42.46 39.93 1twh s ILE 199 CO 0.03 0.46 -0.19 0.00 0.00 0.00 0.00 174.94 175.24 1twh s ARG 200 N 1.39 1.71 0.86 2.79 1.70 0.13 -4.01 118.95 123.53 1twh s ARG 200 Ca 0.05 -1.61 -0.12 0.00 -0.47 0.00 0.00 55.73 53.59 1twh s ARG 200 Cb -0.14 -1.87 0.11 0.00 -0.57 0.00 0.00 34.95 32.48 1twh s ARG 200 CO -0.06 0.37 1.11 0.15 -1.08 0.00 0.00 175.30 175.79 1twh s LYS 201 N -3.16 1.59 -0.28 3.89 -0.14 -1.26 -1.27 119.74 119.10 1twh s LYS 201 Ca 0.26 0.50 -0.18 0.00 -1.36 0.00 0.00 55.97 55.19 1twh s LYS 201 Cb -0.06 -1.87 0.12 0.00 -1.68 0.00 0.00 37.83 34.33 1twh s LYS 201 CO 0.14 -1.93 0.88 0.45 -0.76 0.00 0.00 175.35 174.12 1twh s SER 202 N -3.91 -0.65 0.00 2.83 0.15 -0.96 -4.70 113.70 106.47 1twh s SER 202 Ca 0.62 1.08 0.21 0.00 0.70 0.00 0.00 55.95 58.56 1twh s SER 202 Cb -0.15 1.22 0.83 0.00 -1.71 0.00 0.00 66.02 66.21 1twh s SER 202 CO 0.54 -0.17 1.59 -1.84 1.20 0.00 0.00 173.24 174.55 1twh n GLU 203 N 3.54 1.61 -0.07 5.44 0.28 -1.26 -1.18 120.64 129.01 1twh n GLU 203 Ca -0.18 -0.91 -0.11 0.00 -0.16 0.00 0.00 57.16 55.80 1twh n GLU 203 Cb 0.57 -1.38 -0.06 0.00 1.43 0.00 0.00 31.44 32.00 1twh n GLU 203 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 1twh n THR 204 N 0.13 0.80 -0.09 3.84 -1.04 -1.26 -4.81 114.28 111.85 1twh n THR 204 Ca 0.16 -0.28 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 1twh n THR 204 Cb 0.29 -1.13 0.00 0.00 -1.82 0.00 0.00 70.33 67.66 1twh n THR 204 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1twh n SER 205 N -3.06 0.29 0.00 8.00 3.41 -1.24 -5.03 113.62 116.00 1twh n SER 205 Ca -0.25 -0.62 0.00 0.00 -0.26 0.00 0.00 58.87 57.74 1twh n SER 205 Cb 0.75 0.46 0.00 0.00 -0.26 0.00 0.00 64.21 65.16 1twh n SER 205 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1twh n GLY 206 N 0.46 1.21 3.18 5.00 0.00 -0.32 -4.86 105.19 109.87 1twh n GLY 206 Ca 0.00 -0.02 -0.21 0.00 0.00 0.00 0.00 46.02 45.79 1twh n GLY 206 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1twh s ARG 207 N 0.00 1.05 -0.03 1.61 0.52 -1.26 -2.27 118.95 118.57 1twh s ARG 207 Ca 0.00 -0.86 -0.02 0.00 -0.52 0.00 0.00 55.73 54.33 1twh s ARG 207 Cb 0.00 -1.10 0.01 0.00 0.52 0.00 0.00 34.95 34.38 1twh s ARG 207 CO 0.00 0.27 0.08 -0.47 0.02 0.00 0.00 175.30 175.20 1twh s TYR 208 N -0.91 -0.08 -0.00 -0.53 5.04 -0.40 -4.90 117.35 115.57 1twh s TYR 208 Ca 0.03 0.22 0.02 0.00 -2.44 0.00 0.00 57.07 54.90 1twh s TYR 208 Cb -0.08 -0.01 -0.03 0.00 0.35 0.00 0.00 41.96 42.18 1twh s TYR 208 CO 0.02 -0.06 -0.03 0.00 -1.34 0.00 0.00 175.55 174.14 1twh s ALA 209 N 0.27 3.16 0.22 3.97 0.00 -1.26 0.22 121.76 128.35 1twh s ALA 209 Ca -0.02 -0.97 0.03 0.00 0.00 0.00 0.00 51.96 50.99 1twh s ALA 209 Cb -0.03 -1.25 -0.01 0.00 0.00 0.00 0.00 23.12 21.83 1twh s ALA 209 CO -0.01 0.63 0.10 0.45 0.00 0.00 0.00 175.76 176.93 1twh n SER 210 N 1.50 0.74 -3.89 0.00 2.88 -0.87 -4.94 113.62 109.05 1twh n SER 210 Ca -0.15 -2.24 -0.11 0.00 -1.33 0.00 0.00 58.87 55.03 1twh n SER 210 Cb 0.53 0.68 -0.13 0.00 -0.75 0.00 0.00 64.21 64.53 1twh n SER 210 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1twh s TYR 211 N -2.51 0.06 0.07 0.66 1.51 -1.26 -0.52 117.35 115.36 1twh s TYR 211 Ca 0.14 -0.11 0.04 0.00 -1.01 0.00 0.00 57.07 56.13 1twh s TYR 211 Cb 0.01 -0.04 -0.03 0.00 -0.11 0.00 0.00 41.96 41.79 1twh s TYR 211 CO 0.10 -0.04 -0.10 1.03 -1.11 0.00 0.00 175.55 175.43 1twh s ARG 212 N -0.30 0.73 -0.22 -0.62 0.52 -0.03 -4.20 118.95 114.83 1twh s ARG 212 Ca -0.03 -0.97 -0.07 0.00 -0.52 0.00 0.00 55.73 54.14 1twh s ARG 212 Cb -0.02 -0.53 -0.03 0.00 0.52 0.00 0.00 34.95 34.89 1twh s ARG 212 CO -0.00 0.10 0.05 -1.50 0.02 0.00 0.00 175.30 173.97 1twh s ILE 213 N -1.77 4.29 0.18 1.52 2.07 -0.60 0.42 121.20 127.31 1twh s ILE 213 Ca -0.02 -0.19 -0.32 0.00 -1.41 0.00 0.00 60.65 58.71 1twh s ILE 213 Cb -0.07 -2.98 -0.12 0.00 0.13 0.00 0.00 42.46 39.42 1twh s ILE 213 CO 0.01 0.38 1.74 0.00 -1.91 0.00 0.00 174.94 175.16