#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1twh s ILE 2 N 0.00 0.04 0.13 1.12 1.09 -1.26 -0.71 121.20 121.62 1twh s ILE 2 Ca 0.00 -0.36 -0.33 0.00 -1.10 0.00 0.00 60.65 58.86 1twh s ILE 2 Cb 0.00 -0.71 -0.17 0.00 -1.06 0.00 0.00 42.46 40.52 1twh s ILE 2 CO 0.00 -0.20 0.93 1.33 -0.10 0.00 0.00 174.94 176.91 1twh n VAL 3 N 1.19 1.01 -2.29 2.92 0.24 -1.26 -4.83 118.33 115.32 1twh n VAL 3 Ca -0.21 -0.25 -0.35 0.00 -2.04 0.00 0.00 64.34 61.49 1twh n VAL 3 Cb 0.56 -0.34 -0.00 0.00 -1.47 0.00 0.00 33.84 32.59 1twh n VAL 3 CO 0.00 0.00 0.00 -2.84 -2.14 0.00 0.00 176.83 171.85 1twh s PRO 4 N -0.50 3.45 0.11 7.34 0.02 -1.26 -4.85 135.00 139.29 1twh s PRO 4 Ca 0.75 1.61 -0.27 0.00 0.02 0.00 0.00 61.00 63.11 1twh s PRO 4 Cb -0.99 -2.06 -0.09 0.00 0.02 0.00 0.00 34.50 31.37 1twh s PRO 4 CO 0.55 -0.77 1.65 0.28 -0.33 0.00 0.00 177.00 178.38 1twh h VAL 5 N 1.31 0.50 -2.87 3.83 2.07 -1.90 -3.17 116.25 116.02 1twh h VAL 5 Ca -0.50 0.00 -0.51 0.00 0.82 0.00 0.00 66.70 66.51 1twh h VAL 5 Cb 1.26 0.50 -0.15 0.00 -1.52 0.00 0.00 31.29 31.38 1twh h VAL 5 CO 0.57 0.00 -0.75 -0.13 0.02 0.00 0.00 177.57 177.28 1twh s ARG 6 N -6.09 1.39 0.10 1.57 1.81 -1.26 -0.31 118.95 116.15 1twh s ARG 6 Ca -0.15 -1.57 -0.35 0.00 -1.72 0.00 0.00 55.73 51.93 1twh s ARG 6 Cb 0.07 -1.33 -0.14 0.00 -0.45 0.00 0.00 34.95 33.10 1twh s ARG 6 CO 0.65 0.24 1.56 0.00 -0.68 0.00 0.00 175.30 177.07 1twh h PHE 8 N 5.98 0.49 0.00 0.00 -1.00 -1.92 -1.87 116.94 118.62 1twh h PHE 8 Ca -0.46 0.01 -0.23 0.00 2.81 0.00 0.00 57.97 60.10 1twh h PHE 8 Cb 1.28 -0.15 -0.04 0.00 3.61 0.00 0.00 35.95 40.64 1twh h PHE 8 CO 0.65 0.17 -1.93 0.43 -1.61 0.00 0.00 178.31 176.03 1twh n SER 9 N -4.48 0.38 -0.00 2.17 7.64 -1.26 -4.46 113.62 113.61 1twh n SER 9 Ca 0.15 0.17 0.00 0.00 1.01 0.00 0.00 58.87 60.21 1twh n SER 9 Cb 0.57 0.77 -0.00 0.00 -1.01 0.00 0.00 64.21 64.53 1twh n SER 9 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1twh n GLY 11 N 1.30 2.91 3.53 0.00 0.00 -0.70 -4.99 105.19 107.24 1twh n GLY 11 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.47 1twh n GLY 11 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1twh n LYS 12 N -2.00 0.43 -2.00 1.61 4.81 -1.26 -4.57 118.16 115.19 1twh n LYS 12 Ca 0.00 0.16 -0.36 0.00 -0.87 0.00 0.00 58.31 57.24 1twh n LYS 12 Cb 0.00 -1.67 0.03 0.00 0.02 0.00 0.00 35.03 33.41 1twh n LYS 12 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1twh s VAL 13 N 0.08 2.71 0.00 3.15 1.01 -1.26 -1.50 120.40 124.58 1twh s VAL 13 Ca 0.86 0.43 0.00 0.00 0.00 0.00 0.00 61.98 63.27 1twh s VAL 13 Cb -1.13 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 32.11 1twh s VAL 13 CO 0.53 -0.11 0.00 0.52 0.00 0.00 0.00 175.10 176.05 1twh n VAL 14 N -1.67 0.00 0.94 2.92 0.31 0.57 -4.83 118.33 116.58 1twh n VAL 14 Ca 0.13 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.57 1twh n VAL 14 Cb 0.50 0.91 0.31 0.00 -0.91 0.00 0.00 33.84 34.65 1twh n VAL 14 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1twh n GLY 15 N 0.00 0.76 1.24 2.92 0.00 -0.41 -2.05 105.19 107.66 1twh n GLY 15 Ca 0.00 -0.54 0.11 0.00 0.00 0.00 0.00 46.02 45.60 1twh n GLY 15 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1twh n ASP 16 N 0.74 3.75 -0.23 1.61 5.75 -1.26 -4.37 116.55 122.53 1twh n ASP 16 Ca 0.17 -1.99 0.02 0.00 -0.01 0.00 0.00 54.79 52.98 1twh n ASP 16 Cb 0.43 -0.41 0.05 0.00 -1.03 0.00 0.00 41.12 40.17 1twh n ASP 16 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1twh n LYS 17 N 1.52 2.37 0.10 0.11 5.02 -0.87 -4.80 118.16 121.60 1twh n LYS 17 Ca 0.22 -1.54 -0.16 0.00 -2.02 0.00 0.00 58.31 54.81 1twh n LYS 17 Cb 0.60 -1.10 -0.11 0.00 -0.02 0.00 0.00 35.03 34.40 1twh n LYS 17 CO 0.00 0.00 0.00 2.35 -0.52 0.00 0.00 177.40 179.23 1twh h TRP 18 N 0.78 0.57 -0.64 2.13 2.91 -1.76 -3.15 115.95 116.79 1twh h TRP 18 Ca 0.00 -0.38 -0.09 0.00 1.13 0.00 0.00 58.89 59.55 1twh h TRP 18 Cb 0.52 -0.04 -0.02 0.00 -0.51 0.00 0.00 29.16 29.11 1twh h TRP 18 CO 0.07 1.27 0.06 0.93 -1.03 0.00 0.00 178.44 179.74 1twh h GLU 19 N 0.12 1.09 0.00 2.65 5.08 -1.93 -1.76 114.58 119.84 1twh h GLU 19 Ca -0.13 -0.32 -0.02 0.00 -1.00 0.00 0.00 59.36 57.89 1twh h GLU 19 Cb 1.87 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 31.01 1twh h GLU 19 CO 0.20 1.03 -0.12 0.77 -1.00 0.00 0.00 179.01 179.89 1twh h SER 20 N 1.01 0.00 0.00 1.42 0.02 -1.87 0.28 113.55 114.41 1twh h SER 20 Ca 0.19 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.96 1twh h SER 20 Cb 0.50 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.01 1twh h SER 20 CO 0.02 0.12 -0.98 0.22 -1.14 0.00 0.00 176.83 175.07 1twh h TYR 21 N 0.00 0.02 -0.20 3.45 3.20 -1.35 -1.07 116.97 121.02 1twh h TYR 21 Ca -0.00 -0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.71 1twh h TYR 21 Cb 0.53 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.80 1twh h TYR 21 CO 0.00 1.38 -0.43 1.25 -1.64 0.00 0.00 178.16 178.72 1twh h LEU 22 N -0.97 0.72 -0.95 2.82 5.85 -1.02 -1.73 115.31 120.04 1twh h LEU 22 Ca -0.27 -0.56 0.23 0.00 0.84 0.00 0.00 57.88 58.13 1twh h LEU 22 Cb 1.26 -0.21 -0.12 0.00 0.37 0.00 0.00 40.66 41.95 1twh h LEU 22 CO -0.15 1.15 0.49 0.78 -0.34 0.00 0.00 178.44 180.37 1twh h ASN 23 N 0.33 0.50 0.93 1.25 2.35 -0.50 -1.80 115.58 118.64 1twh h ASN 23 Ca 0.00 0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.88 1twh h ASN 23 Cb 1.04 0.08 -0.00 0.00 0.05 0.00 0.00 38.32 39.49 1twh h ASN 23 CO 0.10 0.05 -0.06 -0.07 -1.65 0.00 0.00 177.43 175.80 1twh h LEU 24 N 0.49 0.00 0.00 1.61 3.38 -0.44 -2.17 115.31 118.18 1twh h LEU 24 Ca 0.60 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.50 1twh h LEU 24 Cb 1.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 1twh h LEU 24 CO -0.50 0.06 -1.43 0.18 0.09 0.00 0.00 178.44 176.84 1twh n LEU 25 N -3.19 0.60 -0.10 1.67 4.77 -0.72 -3.68 117.00 116.34 1twh n LEU 25 Ca 0.00 0.24 -0.12 0.00 -0.03 0.00 0.00 56.01 56.11 1twh n LEU 25 Cb 0.32 0.02 -0.13 0.00 -2.33 0.00 0.00 43.42 41.31 1twh n LEU 25 CO 0.29 -0.02 -1.15 1.67 -1.33 0.00 0.00 177.39 176.85 1twh n GLN 26 N -2.64 0.87 -0.02 3.23 0.00 -0.74 -3.28 117.38 114.80 1twh n GLN 26 Ca -0.05 0.05 -0.16 0.00 -0.00 0.00 0.00 57.00 56.84 1twh n GLN 26 Cb 0.67 -1.46 -0.12 0.00 0.00 0.00 0.00 30.24 29.33 1twh n GLN 26 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 1twh h GLU 27 N 0.00 0.15 -0.15 3.69 5.08 -1.59 -3.38 114.58 118.39 1twh h GLU 27 Ca -0.50 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 57.67 1twh h GLU 27 Cb 1.98 0.06 0.00 0.00 0.50 0.00 0.00 28.75 31.29 1twh h GLU 27 CO -0.02 0.99 0.00 -0.25 -1.00 0.00 0.00 179.01 178.73 1twh n ASP 28 N -4.47 2.23 -0.91 1.42 9.92 -1.22 -5.02 116.55 118.50 1twh n ASP 28 Ca -0.10 -1.74 -0.12 0.00 -0.53 0.00 0.00 54.79 52.30 1twh n ASP 28 Cb 0.55 -0.09 -0.05 0.00 -0.64 0.00 0.00 41.12 40.88 1twh n ASP 28 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1twh n GLU 29 N 0.26 -1.18 -2.43 -1.24 1.02 -1.20 -4.97 120.64 110.89 1twh n GLU 29 Ca 0.06 0.89 -0.32 0.00 -0.02 0.00 0.00 57.16 57.77 1twh n GLU 29 Cb 0.30 -5.04 -0.03 0.00 -0.02 0.00 0.00 31.44 26.64 1twh n GLU 29 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1twh s LEU 30 N -2.71 3.68 0.19 -4.62 1.43 -1.24 -5.04 118.68 110.37 1twh s LEU 30 Ca 0.00 1.65 -0.30 0.00 -1.03 0.00 0.00 54.13 54.45 1twh s LEU 30 Cb 0.00 -4.52 -0.08 0.00 0.03 0.00 0.00 46.19 41.62 1twh s LEU 30 CO 0.00 -0.64 0.99 1.51 0.23 0.00 0.00 176.35 178.44 1twh s ASP 31 N -2.81 7.51 0.30 2.29 -4.77 -1.26 -4.67 116.67 113.26 1twh s ASP 31 Ca 0.61 1.96 0.16 0.00 -3.30 0.00 0.00 52.55 51.97 1twh s ASP 31 Cb -0.11 -2.60 1.06 0.00 -1.09 0.00 0.00 42.92 40.18 1twh s ASP 31 CO 0.28 0.00 1.29 -0.62 0.70 0.00 0.00 175.17 176.82 1twh n GLU 32 N 1.99 -0.05 0.21 2.11 4.71 -1.26 0.38 120.64 128.74 1twh n GLU 32 Ca 0.00 1.13 0.11 0.00 -0.01 0.00 0.00 57.16 58.40 1twh n GLU 32 Cb 0.47 -2.02 0.20 0.00 -1.01 0.00 0.00 31.44 29.08 1twh n GLU 32 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 1twh h GLY 33 N 0.00 0.00 1.03 0.62 0.00 -1.99 -1.48 103.07 101.25 1twh h GLY 33 Ca 0.68 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 47.66 1twh h GLY 33 CO -0.64 0.00 -1.68 -0.84 0.00 0.00 0.00 176.54 173.38 1twh h THR 34 N 0.00 1.02 -0.94 4.70 2.02 -0.45 -1.69 112.91 117.58 1twh h THR 34 Ca -0.00 -2.59 0.13 0.00 0.77 0.00 0.00 66.41 64.72 1twh h THR 34 Cb 1.01 2.80 -0.08 0.00 -1.74 0.00 0.00 68.15 70.15 1twh h THR 34 CO 0.01 0.84 0.60 0.00 0.37 0.00 0.00 175.52 177.34 1twh h ALA 35 N 0.19 1.68 0.14 6.16 0.00 -1.22 -1.60 119.26 124.61 1twh h ALA 35 Ca -0.31 0.02 -0.29 0.00 0.00 0.00 0.00 54.91 54.32 1twh h ALA 35 Cb 2.10 -0.16 0.02 0.00 0.00 0.00 0.00 17.79 19.75 1twh h ALA 35 CO 0.19 0.07 -1.26 -0.07 0.00 0.00 0.00 179.25 178.18 1twh h LEU 36 N 0.83 0.71 0.00 0.00 3.38 -1.21 -2.52 115.31 116.49 1twh h LEU 36 Ca 0.47 -0.69 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1twh h LEU 36 Cb 0.61 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1twh h LEU 36 CO -0.24 1.51 0.00 -1.20 0.09 0.00 0.00 178.44 178.61 1twh n SER 37 N -3.70 0.00 0.06 -0.43 7.64 -0.64 -1.30 113.62 115.26 1twh n SER 37 Ca -0.12 0.25 -0.14 0.00 1.01 0.00 0.00 58.87 59.88 1twh n SER 37 Cb 1.00 -0.38 -0.14 0.00 -1.01 0.00 0.00 64.21 63.69 1twh n SER 37 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1twh h ARG 38 N 0.00 0.17 -0.79 1.43 9.65 -0.98 -2.55 114.38 121.31 1twh h ARG 38 Ca 0.00 -0.30 -0.00 0.00 -1.10 0.00 0.00 59.98 58.58 1twh h ARG 38 Cb 0.19 0.11 -0.00 0.00 -1.39 0.00 0.00 29.97 28.88 1twh h ARG 38 CO 0.00 1.05 0.00 1.28 2.80 0.00 0.00 179.97 185.10 1twh n LEU 39 N -3.41 3.38 0.00 3.80 4.77 -0.42 -4.87 117.00 120.26 1twh n LEU 39 Ca -0.11 -1.71 0.00 0.00 -0.03 0.00 0.00 56.01 54.16 1twh n LEU 39 Cb 1.02 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1twh n LEU 39 CO 0.50 0.44 0.00 0.61 -1.33 0.00 0.00 177.39 177.61 1twh n GLY 40 N 0.31 0.75 3.52 -0.72 0.00 -0.96 -4.94 105.19 103.16 1twh n GLY 40 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1twh n GLY 40 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1twh s LEU 41 N 0.00 3.57 -0.06 0.99 1.43 -1.15 -4.72 118.68 118.73 1twh s LEU 41 Ca 0.00 -0.76 0.05 0.00 -1.03 0.00 0.00 54.13 52.39 1twh s LEU 41 Cb 0.00 -2.52 -0.07 0.00 0.03 0.00 0.00 46.19 43.63 1twh s LEU 41 CO 0.00 -1.68 0.02 2.29 0.23 0.00 0.00 176.35 177.22 1twh n LYS 42 N 8.81 2.99 -2.30 1.70 2.85 -1.26 -4.28 118.16 126.68 1twh n LYS 42 Ca 0.06 -0.00 -0.40 0.00 -1.05 0.00 0.00 58.31 56.91 1twh n LYS 42 Cb 0.48 -1.15 -0.03 0.00 -0.65 0.00 0.00 35.03 33.68 1twh n LYS 42 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 177.40 176.37 1twh s ARG 43 N -2.15 4.46 0.64 -1.58 1.70 -1.26 -4.92 118.95 115.84 1twh s ARG 43 Ca -0.03 1.99 0.40 0.00 -0.47 0.00 0.00 55.73 57.62 1twh s ARG 43 Cb 0.02 -3.09 2.19 0.00 -0.57 0.00 0.00 34.95 33.50 1twh s ARG 43 CO 0.24 -0.01 2.32 0.10 -1.08 0.00 0.00 175.30 176.87 1twh h TYR 44 N 3.51 0.00 0.00 5.89 -0.00 -1.99 0.15 116.97 124.54 1twh h TYR 44 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.25 1twh h TYR 44 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.95 1twh h TYR 44 CO 0.57 0.01 0.00 0.00 -0.00 0.00 0.00 178.16 178.74 1twh h ARG 47 N 0.46 0.59 0.00 0.00 3.08 -0.51 -0.87 114.38 117.13 1twh h ARG 47 Ca 0.64 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.59 1twh h ARG 47 Cb 1.45 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 31.39 1twh h ARG 47 CO -0.40 0.53 -0.04 0.07 -1.07 0.00 0.00 179.97 179.06 1twh h ARG 48 N 0.58 0.00 -0.12 0.04 -0.00 -0.28 -0.31 114.38 114.29 1twh h ARG 48 Ca 0.14 0.00 -0.05 0.00 -0.00 0.00 0.00 59.98 60.07 1twh h ARG 48 Cb 0.20 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 30.16 1twh h ARG 48 CO -0.01 0.04 -0.13 1.98 -0.00 0.00 0.00 179.97 181.85 1twh h MET 49 N 0.00 0.30 0.09 0.08 4.05 -0.82 -2.52 114.93 116.11 1twh h MET 49 Ca -0.00 -0.16 -0.35 0.00 -0.28 0.00 0.00 59.70 58.91 1twh h MET 49 Cb 0.32 0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 31.10 1twh h MET 49 CO 0.00 0.71 -1.95 -0.89 0.23 0.00 0.00 176.91 175.01 1twh n ILE 50 N -4.60 1.73 0.28 1.77 -0.00 -0.84 -3.05 119.36 114.66 1twh n ILE 50 Ca -0.07 -0.69 0.15 0.00 -0.00 0.00 0.00 62.75 62.14 1twh n ILE 50 Cb 0.35 -1.54 0.85 0.00 -0.00 0.00 0.00 39.64 39.30 1twh n ILE 50 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.55 176.80 1twh h LEU 51 N 0.05 0.00 -2.31 1.39 5.85 -1.07 -2.43 115.31 116.79 1twh h LEU 51 Ca -0.40 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.32 1twh h LEU 51 Cb 2.03 0.00 0.00 0.00 0.37 0.00 0.00 40.66 43.06 1twh h LEU 51 CO 0.08 0.06 0.00 0.35 -0.34 0.00 0.00 178.44 178.59 1twh n THR 52 N -3.63 0.64 -1.93 1.05 -2.24 -0.95 -5.03 114.28 102.20 1twh n THR 52 Ca -0.02 -0.82 -0.38 0.00 -2.27 0.00 0.00 64.05 60.56 1twh n THR 52 Cb 0.16 0.70 0.03 0.00 -2.10 0.00 0.00 70.33 69.13 1twh n THR 52 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1twh s HIS 53 N -0.74 2.44 -0.10 4.78 5.65 -0.92 -5.05 115.29 121.36 1twh s HIS 53 Ca 0.06 1.43 -0.01 0.00 0.25 0.00 0.00 55.06 56.79 1twh s HIS 53 Cb 0.03 -3.66 0.03 0.00 -1.18 0.00 0.00 32.58 27.81 1twh s HIS 53 CO 0.04 -2.47 -0.02 0.08 -0.65 0.00 0.00 174.74 171.73 1twh s VAL 54 N -1.40 0.62 -1.15 0.89 1.01 -1.26 -5.05 120.40 114.06 1twh s VAL 54 Ca 0.70 -0.09 -0.09 0.00 0.00 0.00 0.00 61.98 62.50 1twh s VAL 54 Cb -0.36 -0.76 0.25 0.00 0.00 0.00 0.00 36.38 35.50 1twh s VAL 54 CO 0.43 0.25 1.39 -0.67 0.00 0.00 0.00 175.10 176.50 1twh n ASP 55 N 5.07 5.67 0.22 3.32 2.03 -1.26 -4.15 116.55 127.44 1twh n ASP 55 Ca -0.09 -3.14 0.09 0.00 0.52 0.00 0.00 54.79 52.16 1twh n ASP 55 Cb 0.50 -1.40 0.49 0.00 -0.72 0.00 0.00 41.12 39.98 1twh n ASP 55 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1twh h LEU 56 N 7.07 0.00 -1.99 -2.67 3.38 -1.89 -2.15 115.31 117.06 1twh h LEU 56 Ca 0.24 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.32 1twh h LEU 56 Cb 0.76 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 1twh h LEU 56 CO 1.24 0.26 0.28 -0.29 0.09 0.00 0.00 178.44 180.02 1twh h ILE 57 N 0.00 0.81 0.00 1.22 2.10 -1.20 0.36 117.51 120.79 1twh h ILE 57 Ca -0.00 -0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.93 1twh h ILE 57 Cb 0.67 0.80 0.00 0.00 -1.09 0.00 0.00 36.82 37.20 1twh h ILE 57 CO 0.03 0.00 0.00 -0.62 -1.08 0.00 0.00 178.15 176.49 1twh n GLU 58 N -4.42 0.16 -0.07 2.19 -0.58 -0.81 0.22 120.64 117.32 1twh n GLU 58 Ca 0.06 0.52 -0.10 0.00 -0.42 0.00 0.00 57.16 57.22 1twh n GLU 58 Cb 0.46 -1.88 -0.15 0.00 -0.57 0.00 0.00 31.44 29.30 1twh n GLU 58 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1twh n LYS 59 N -2.19 0.67 0.16 3.49 5.02 0.12 -4.27 118.16 121.16 1twh n LYS 59 Ca 0.01 0.10 0.01 0.00 -2.02 0.00 0.00 58.31 56.41 1twh n LYS 59 Cb 0.13 -1.61 0.25 0.00 -0.02 0.00 0.00 35.03 33.78 1twh n LYS 59 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 1twh h PHE 60 N 0.00 0.00 0.00 2.13 0.04 0.36 -1.89 116.94 117.58 1twh h PHE 60 Ca -0.46 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.31 1twh h PHE 60 Cb 2.15 0.00 0.00 0.00 2.20 0.00 0.00 35.95 40.30 1twh h PHE 60 CO 0.00 0.51 0.00 -0.07 -0.60 0.00 0.00 178.31 178.15 1twh h LEU 61 N 0.00 0.00 -0.09 1.54 3.38 -0.88 -2.28 115.31 116.98 1twh h LEU 61 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1twh h LEU 61 Cb 0.98 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1twh h LEU 61 CO 0.07 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.14 1twh n ARG 62 N -2.90 0.74 -3.69 1.13 1.74 -0.71 -4.76 116.66 108.21 1twh n ARG 62 Ca -0.02 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.85 1twh n ARG 62 Cb 0.13 -1.04 -0.04 0.00 -1.02 0.00 0.00 32.46 30.50 1twh n ARG 62 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1twh s TYR 63 N -1.91 2.68 -1.49 -1.55 1.51 -0.86 -5.13 117.35 110.60 1twh s TYR 63 Ca 0.00 -0.52 0.12 0.00 -1.01 0.00 0.00 57.07 55.66 1twh s TYR 63 Cb 0.00 -2.13 0.09 0.00 -0.11 0.00 0.00 41.96 39.82 1twh s TYR 63 CO 0.00 -0.06 0.88 -1.71 -1.11 0.00 0.00 175.55 173.55