#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bo5 s ALA 2 N 0.00 -1.16 -0.17 1.98 0.00 -1.26 -5.03 121.76 116.11 2bo5 s ALA 2 Ca 0.00 1.35 -0.01 0.00 0.00 0.00 0.00 51.96 53.30 2bo5 s ALA 2 Cb 0.00 -1.44 -0.11 0.00 0.00 0.00 0.00 23.12 21.57 2bo5 s ALA 2 CO 0.00 -0.91 -0.17 1.63 0.00 0.00 0.00 175.76 176.31 2bo5 n LYS 3 N 5.38 0.42 -1.83 0.00 5.02 -1.26 -5.01 118.16 120.88 2bo5 n LYS 3 Ca -0.07 0.11 -0.37 0.00 -2.02 0.00 0.00 58.31 55.97 2bo5 n LYS 3 Cb 0.50 -1.31 0.06 0.00 -0.02 0.00 0.00 35.03 34.25 2bo5 n LYS 3 CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 2bo5 s LEU 4 N -6.18 3.62 -0.48 -0.35 0.05 -1.26 -5.00 118.68 109.08 2bo5 s LEU 4 Ca -0.23 2.56 0.03 0.00 0.05 0.00 0.00 54.13 56.53 2bo5 s LEU 4 Cb 0.07 -4.60 0.15 0.00 -2.05 0.00 0.00 46.19 39.76 2bo5 s LEU 4 CO 0.38 -1.85 0.32 0.68 -0.55 0.00 0.00 176.35 175.33 2bo5 s VAL 5 N -1.45 1.33 -0.66 1.48 -7.23 -1.26 -5.04 120.40 107.56 2bo5 s VAL 5 Ca 0.81 -2.89 -0.00 0.00 -1.81 0.00 0.00 61.98 58.08 2bo5 s VAL 5 Cb -0.35 -1.91 0.17 0.00 0.56 0.00 0.00 36.38 34.84 2bo5 s VAL 5 CO 0.38 -1.02 0.47 -0.13 -0.31 0.00 0.00 175.10 174.48 2bo5 s ARG 6 N -0.07 2.56 1.08 4.82 3.00 -1.26 -5.10 118.95 123.99 2bo5 s ARG 6 Ca 0.24 -2.78 -0.17 0.00 0.00 0.00 0.00 55.73 53.02 2bo5 s ARG 6 Cb -0.12 -3.65 0.09 0.00 0.00 0.00 0.00 34.95 31.27 2bo5 s ARG 6 CO -0.09 -1.19 0.07 -2.30 0.00 0.00 0.00 175.30 171.79 2bo5 n PRO 7 N 3.03 -1.31 -2.24 3.54 -0.02 -1.26 -4.90 135.00 131.83 2bo5 n PRO 7 Ca 0.11 -0.36 -0.41 0.00 -2.02 0.00 0.00 63.50 60.82 2bo5 n PRO 7 Cb 0.36 -1.72 -0.03 0.00 -0.02 0.00 0.00 33.50 32.09 2bo5 n PRO 7 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2bo5 s PRO 8 N -3.47 4.42 -0.30 0.52 0.04 -1.26 -5.02 135.00 129.93 2bo5 s PRO 8 Ca 0.56 2.03 -0.08 0.00 0.04 0.00 0.00 61.00 63.55 2bo5 s PRO 8 Cb -0.14 -3.18 0.18 0.00 0.04 0.00 0.00 34.50 31.40 2bo5 s PRO 8 CO 0.66 -0.18 0.83 0.54 0.04 0.00 0.00 177.00 178.89 2bo5 s VAL 9 N -0.20 -0.68 -0.10 -0.36 0.11 -1.26 -5.04 120.40 112.86 2bo5 s VAL 9 Ca 0.54 0.00 0.08 0.00 -2.93 0.00 0.00 61.98 59.67 2bo5 s VAL 9 Cb -0.36 -1.00 -0.12 0.00 -1.53 0.00 0.00 36.38 33.37 2bo5 s VAL 9 CO 0.40 0.00 0.01 0.00 -3.33 0.00 0.00 175.10 172.19 2bo5 n GLN 10 N 5.38 2.08 -3.75 1.54 10.64 -1.26 -5.04 117.38 126.97 2bo5 n GLN 10 Ca -0.05 0.01 -0.13 0.00 -1.83 0.00 0.00 57.00 54.99 2bo5 n GLN 10 Cb 0.52 -1.26 -0.09 0.00 -0.86 0.00 0.00 30.24 28.55 2bo5 n GLN 10 CO 0.00 0.00 0.00 -1.50 -1.83 0.00 0.00 177.06 173.73 2bo5 s ILE 11 N -2.24 0.03 -0.41 -0.39 1.10 -1.26 -4.52 121.20 113.50 2bo5 s ILE 11 Ca -0.07 -0.24 0.04 0.00 -0.51 0.00 0.00 60.65 59.88 2bo5 s ILE 11 Cb 0.03 -0.58 0.17 0.00 0.15 0.00 0.00 42.46 42.23 2bo5 s ILE 11 CO 0.40 -0.13 0.40 -0.72 -2.11 0.00 0.00 174.94 172.78 2bo5 s TYR 12 N -0.61 0.25 0.00 3.50 1.13 -1.26 -5.07 117.35 115.29 2bo5 s TYR 12 Ca -0.07 -1.59 0.00 0.00 -1.41 0.00 0.00 57.07 54.00 2bo5 s TYR 12 Cb -0.04 -0.58 0.00 0.00 -1.10 0.00 0.00 41.96 40.24 2bo5 s TYR 12 CO 0.03 -0.94 0.00 0.41 -2.51 0.00 0.00 175.55 172.54 2bo5 n GLY 13 N 3.33 3.15 0.60 5.49 0.00 -1.26 -4.82 105.19 111.68 2bo5 n GLY 13 Ca 0.21 -0.84 0.43 0.00 0.00 0.00 0.00 46.02 45.82 2bo5 n GLY 13 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2bo5 h ILE 14 N 0.00 0.22 -0.23 -0.61 -0.00 -2.01 0.99 117.51 115.88 2bo5 h ILE 14 Ca 0.00 -0.01 0.04 0.00 -0.00 0.00 0.00 64.86 64.90 2bo5 h ILE 14 Cb 0.00 0.21 -0.01 0.00 -0.00 0.00 0.00 36.82 37.01 2bo5 h ILE 14 CO 0.00 0.00 0.16 -0.08 -0.00 0.00 0.00 178.15 178.23 2bo5 h GLU 15 N 0.01 0.11 0.00 2.19 4.57 -1.96 -0.39 114.58 119.12 2bo5 h GLU 15 Ca 0.74 -0.01 -0.13 0.00 -1.18 0.00 0.00 59.36 58.79 2bo5 h GLU 15 Cb 2.92 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 31.47 2bo5 h GLU 15 CO -0.04 0.07 -0.62 0.78 -1.18 0.00 0.00 179.01 178.03 2bo5 h GLY 16 N 0.12 0.00 2.00 1.92 0.00 0.79 -2.92 103.07 104.98 2bo5 h GLY 16 Ca 0.10 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.38 2bo5 h GLY 16 CO -0.01 0.00 -0.26 3.21 0.00 0.00 0.00 176.54 179.48 2bo5 h ARG 17 N 0.00 0.00 -0.55 4.80 3.08 -1.11 -2.91 114.38 117.69 2bo5 h ARG 17 Ca -0.01 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.15 2bo5 h ARG 17 Cb 1.11 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 31.08 2bo5 h ARG 17 CO 0.08 0.26 0.06 1.88 -1.07 0.00 0.00 179.97 181.18 2bo5 h TYR 18 N 0.00 0.08 -0.48 3.04 -1.99 -1.36 0.92 116.97 117.19 2bo5 h TYR 18 Ca -0.00 0.04 -0.12 0.00 2.00 0.00 0.00 58.73 60.65 2bo5 h TYR 18 Cb 0.57 0.05 -0.01 0.00 2.00 0.00 0.00 36.73 39.33 2bo5 h TYR 18 CO 0.00 -0.07 -0.16 0.00 -0.00 0.00 0.00 178.16 177.93 2bo5 h ALA 19 N 1.46 0.67 0.00 3.88 0.00 -1.67 -2.40 119.26 121.20 2bo5 h ALA 19 Ca 0.28 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2bo5 h ALA 19 Cb 0.42 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2bo5 h ALA 19 CO -0.41 0.61 -0.27 1.15 0.00 0.00 0.00 179.25 180.32 2bo5 h THR 20 N 0.80 0.84 -0.17 0.00 2.02 -1.10 1.16 112.91 116.46 2bo5 h THR 20 Ca 0.12 -1.09 0.00 0.00 0.77 0.00 0.00 66.41 66.21 2bo5 h THR 20 Cb 0.72 1.66 0.00 0.00 -1.74 0.00 0.00 68.15 68.79 2bo5 h THR 20 CO 0.06 0.27 0.00 0.00 0.37 0.00 0.00 175.52 176.21 2bo5 n ALA 21 N -2.33 2.52 0.00 6.16 0.00 0.31 -1.20 120.51 125.97 2bo5 n ALA 21 Ca -0.01 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.92 2bo5 n ALA 21 Cb 0.38 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.75 2bo5 n ALA 21 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2bo5 n LEU 22 N 0.27 2.36 0.16 0.00 -0.00 -0.60 -4.61 117.00 114.59 2bo5 n LEU 22 Ca 0.15 0.00 0.12 0.00 -0.00 0.00 0.00 56.01 56.29 2bo5 n LEU 22 Cb 0.31 0.00 0.24 0.00 -0.00 0.00 0.00 43.42 43.97 2bo5 n LEU 22 CO 0.12 0.39 0.77 0.10 -0.00 0.00 0.00 177.39 178.77 2bo5 h TYR 23 N 0.00 0.00 -1.02 1.96 -0.00 0.12 -3.21 116.97 114.82 2bo5 h TYR 23 Ca 0.00 0.00 0.25 0.00 0.00 0.00 0.00 58.73 58.98 2bo5 h TYR 23 Cb 0.91 0.00 -0.10 0.00 0.00 0.00 0.00 36.73 37.54 2bo5 h TYR 23 CO 0.00 0.00 0.64 0.66 -0.00 0.00 0.00 178.16 179.46 2bo5 h SER 24 N 0.00 0.52 0.19 0.10 4.64 -1.31 1.88 113.55 119.58 2bo5 h SER 24 Ca 0.00 0.09 -0.27 0.00 -0.47 0.00 0.00 61.79 61.14 2bo5 h SER 24 Cb 0.90 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.01 2bo5 h SER 24 CO 0.00 0.12 -1.11 0.00 -0.87 0.00 0.00 176.83 174.97 2bo5 h ALA 25 N 1.64 0.14 -0.89 5.18 0.00 -1.83 -3.20 119.26 120.29 2bo5 h ALA 25 Ca 0.59 -0.75 0.03 0.00 0.00 0.00 0.00 54.91 54.78 2bo5 h ALA 25 Cb 1.36 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 19.15 2bo5 h ALA 25 CO -0.32 0.75 0.58 0.00 0.00 0.00 0.00 179.25 180.25 2bo5 h ALA 26 N 0.46 1.16 -0.46 0.00 0.00 0.14 -2.39 119.26 118.18 2bo5 h ALA 26 Ca -0.14 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 54.79 2bo5 h ALA 26 Cb 1.77 -0.32 -0.06 0.00 0.00 0.00 0.00 17.79 19.18 2bo5 h ALA 26 CO 0.21 0.46 0.13 0.66 0.00 0.00 0.00 179.25 180.70 2bo5 h SER 27 N 1.14 0.08 -0.90 0.00 4.64 0.23 0.92 113.55 119.67 2bo5 h SER 27 Ca 0.35 0.07 0.20 0.00 -0.47 0.00 0.00 61.79 61.94 2bo5 h SER 27 Cb -0.04 0.08 -0.07 0.00 -0.31 0.00 0.00 62.40 62.06 2bo5 h SER 27 CO -0.10 0.08 0.59 0.50 -0.87 0.00 0.00 176.83 177.03 2bo5 h LYS 28 N 0.27 0.40 0.16 4.77 3.11 -1.44 -0.16 116.57 123.68 2bo5 h LYS 28 Ca 0.22 -0.02 -0.26 0.00 -2.81 0.00 0.00 60.65 57.78 2bo5 h LYS 28 Cb 0.26 -0.09 0.02 0.00 -1.00 0.00 0.00 32.23 31.42 2bo5 h LYS 28 CO -0.26 0.26 -1.24 1.96 -2.81 0.00 0.00 179.45 177.37 2bo5 h GLN 29 N 0.41 0.34 -0.05 1.90 4.20 -0.82 -3.49 115.11 117.61 2bo5 h GLN 29 Ca 0.47 -0.58 0.00 0.00 0.06 0.00 0.00 58.65 58.60 2bo5 h GLN 29 Cb 1.16 0.22 0.00 0.00 0.30 0.00 0.00 27.48 29.15 2bo5 h GLN 29 CO -0.18 1.28 0.00 -1.71 -0.67 0.00 0.00 178.83 177.55 2bo5 n ASN 30 N -3.93 -0.46 -1.88 1.46 2.85 0.30 -4.99 115.26 108.62 2bo5 n ASN 30 Ca -0.19 0.00 -0.08 0.00 -0.11 0.00 0.00 54.58 54.20 2bo5 n ASN 30 Cb 0.93 -0.20 0.27 0.00 1.24 0.00 0.00 39.78 42.02 2bo5 n ASN 30 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2bo5 n LYS 31 N -0.91 3.24 0.03 1.20 5.02 -1.14 -4.61 118.16 120.99 2bo5 n LYS 31 Ca 0.00 -3.07 0.21 0.00 -2.02 0.00 0.00 58.31 53.43 2bo5 n LYS 31 Cb 0.20 -2.15 0.59 0.00 -0.02 0.00 0.00 35.03 33.66 2bo5 n LYS 31 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2bo5 h LEU 32 N 2.16 0.00 -0.58 -0.35 -0.00 -1.93 1.70 115.31 116.30 2bo5 h LEU 32 Ca 0.31 0.00 -0.16 0.00 -0.00 0.00 0.00 57.88 58.03 2bo5 h LEU 32 Cb 2.31 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 42.95 2bo5 h LEU 32 CO 0.74 0.00 -0.68 -0.33 -0.00 0.00 0.00 178.44 178.17 2bo5 h GLU 33 N 0.00 0.17 0.00 1.13 5.08 -1.97 1.75 114.58 120.73 2bo5 h GLU 33 Ca 0.26 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2bo5 h GLU 33 Cb 1.75 0.03 0.00 0.00 0.50 0.00 0.00 28.75 31.03 2bo5 h GLU 33 CO -0.00 0.78 -0.34 1.96 -1.00 0.00 0.00 179.01 180.40 2bo5 h GLN 34 N 0.12 0.00 0.00 2.33 1.08 0.21 -2.70 115.11 116.14 2bo5 h GLN 34 Ca -0.01 0.00 -0.27 0.00 -1.45 0.00 0.00 58.65 56.92 2bo5 h GLN 34 Cb 1.21 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.59 2bo5 h GLN 34 CO 0.10 0.00 -2.01 0.28 -0.95 0.00 0.00 178.83 176.25 2bo5 n VAL 35 N -2.70 1.01 -0.03 -0.54 0.31 -0.50 -3.79 118.33 112.09 2bo5 n VAL 35 Ca 0.03 -0.55 -0.13 0.00 -0.01 0.00 0.00 64.34 63.68 2bo5 n VAL 35 Cb 0.50 -0.77 -0.11 0.00 -0.91 0.00 0.00 33.84 32.55 2bo5 n VAL 35 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2bo5 h GLU 36 N 0.00 -0.02 -0.03 5.55 4.22 0.25 -0.94 114.58 123.61 2bo5 h GLU 36 Ca -0.40 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.03 2bo5 h GLU 36 Cb 1.82 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.07 2bo5 h GLU 36 CO -0.00 0.69 -0.05 -0.22 -2.18 0.00 0.00 179.01 177.24 2bo5 h LYS 37 N -0.75 0.05 -0.49 1.92 3.64 -1.59 0.54 116.57 119.88 2bo5 h LYS 37 Ca -0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2bo5 h LYS 37 Cb 0.71 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.52 2bo5 h LYS 37 CO 0.00 0.10 0.00 0.39 -2.27 0.00 0.00 179.45 177.68 2bo5 n GLU 38 N -4.45 2.10 -0.06 1.90 4.71 -1.15 -3.59 120.64 120.11 2bo5 n GLU 38 Ca -0.02 -1.28 -0.06 0.00 -0.01 0.00 0.00 57.16 55.79 2bo5 n GLU 38 Cb 0.15 -1.46 -0.07 0.00 -1.01 0.00 0.00 31.44 29.05 2bo5 n GLU 38 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 2bo5 n LEU 39 N 0.41 1.02 0.15 -4.62 7.94 0.18 -4.43 117.00 117.66 2bo5 n LEU 39 Ca 0.12 -0.02 0.01 0.00 -1.11 0.00 0.00 56.01 55.00 2bo5 n LEU 39 Cb 0.41 0.01 0.23 0.00 0.53 0.00 0.00 43.42 44.60 2bo5 n LEU 39 CO 0.10 0.41 0.56 0.25 -1.11 0.00 0.00 177.39 177.60 2bo5 h LEU 40 N 0.00 0.00 -0.82 -1.96 5.85 -1.45 -2.99 115.31 113.94 2bo5 h LEU 40 Ca -0.28 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.36 2bo5 h LEU 40 Cb 1.57 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.58 2bo5 h LEU 40 CO -0.01 0.54 0.08 0.03 -0.34 0.00 0.00 178.44 178.75 2bo5 h ARG 41 N 0.00 0.97 0.00 1.25 -0.00 -1.79 -2.14 114.38 112.67 2bo5 h ARG 41 Ca -0.01 -0.25 -0.06 0.00 -0.50 0.00 0.00 59.98 59.17 2bo5 h ARG 41 Cb 1.02 -0.12 -0.01 0.00 0.00 0.00 0.00 29.97 30.86 2bo5 h ARG 41 CO 0.07 0.90 -0.28 0.28 0.00 0.00 0.00 179.97 180.94 2bo5 h VAL 42 N 0.91 0.99 -0.16 2.04 2.07 -1.74 -2.79 116.25 117.58 2bo5 h VAL 42 Ca 0.18 -1.05 -0.09 0.00 0.82 0.00 0.00 66.70 66.57 2bo5 h VAL 42 Cb 0.42 1.60 -0.00 0.00 -1.52 0.00 0.00 31.29 31.79 2bo5 h VAL 42 CO 0.01 0.28 -0.24 1.23 0.02 0.00 0.00 177.57 178.87 2bo5 h GLY 43 N 1.16 0.48 1.75 2.17 0.00 -1.33 -3.03 103.07 104.26 2bo5 h GLY 43 Ca -0.00 -0.53 -0.01 0.00 0.00 0.00 0.00 47.33 46.78 2bo5 h GLY 43 CO 0.04 0.48 0.09 -1.61 0.00 0.00 0.00 176.54 175.54 2bo5 h GLN 44 N 0.06 0.33 -0.54 4.80 4.15 -1.32 -1.50 115.11 121.10 2bo5 h GLN 44 Ca 0.01 -0.03 -0.04 0.00 0.77 0.00 0.00 58.65 59.36 2bo5 h GLN 44 Cb 0.81 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.41 2bo5 h GLN 44 CO 0.05 0.28 0.16 0.82 -1.93 0.00 0.00 178.83 178.21 2bo5 h ILE 45 N 0.33 1.21 -0.05 2.39 2.04 -1.41 0.84 117.51 122.86 2bo5 h ILE 45 Ca 0.08 -0.74 -0.13 0.00 1.00 0.00 0.00 64.86 65.08 2bo5 h ILE 45 Cb 0.08 0.63 0.01 0.00 -0.74 0.00 0.00 36.82 36.80 2bo5 h ILE 45 CO -0.01 0.28 -0.48 0.25 0.00 0.00 0.00 178.15 178.19 2bo5 h LEU 46 N 0.78 0.50 -0.92 1.44 7.12 -1.19 -3.19 115.31 119.84 2bo5 h LEU 46 Ca 0.18 -0.70 -0.04 0.00 0.13 0.00 0.00 57.88 57.44 2bo5 h LEU 46 Cb 0.24 -0.15 -0.01 0.00 -0.53 0.00 0.00 40.66 40.21 2bo5 h LEU 46 CO -0.01 1.13 -0.21 0.50 -0.13 0.00 0.00 178.44 179.72 2bo5 h LYS 47 N -0.08 0.00 -5.99 1.25 3.11 -1.16 -3.38 116.57 110.32 2bo5 h LYS 47 Ca -0.05 0.00 -0.60 0.00 -2.81 0.00 0.00 60.65 57.19 2bo5 h LYS 47 Cb 1.16 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 32.38 2bo5 h LYS 47 CO 0.10 0.21 1.49 0.39 -2.81 0.00 0.00 179.45 178.82 2bo5 n GLU 48 N -3.31 1.85 0.16 1.90 -0.58 0.29 -4.81 120.64 116.14 2bo5 n GLU 48 Ca 0.01 0.50 0.19 0.00 -0.42 0.00 0.00 57.16 57.44 2bo5 n GLU 48 Cb 0.46 -3.14 0.74 0.00 -0.57 0.00 0.00 31.44 28.93 2bo5 n GLU 48 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 2bo5 h PRO 49 N 14.74 0.00 0.00 3.49 0.11 -1.88 0.38 132.00 148.84 2bo5 h PRO 49 Ca -0.39 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.53 2bo5 h PRO 49 Cb 1.25 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.33 2bo5 h PRO 49 CO 0.97 0.00 -0.89 0.87 -0.21 0.00 0.00 178.00 178.74 2bo5 h LYS 50 N 0.00 0.00 0.00 1.05 6.56 -1.92 -3.30 116.57 118.96 2bo5 h LYS 50 Ca 0.14 0.00 -0.19 0.00 -1.06 0.00 0.00 60.65 59.54 2bo5 h LYS 50 Cb 1.03 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 32.66 2bo5 h LYS 50 CO -0.00 0.89 -1.79 -1.33 -2.06 0.00 0.00 179.45 175.16 2bo5 n MET 51 N -3.48 0.65 0.05 3.15 2.81 0.96 -4.16 117.12 117.11 2bo5 n MET 51 Ca -0.00 0.08 0.18 0.00 -1.81 0.00 0.00 57.70 56.15 2bo5 n MET 51 Cb 0.85 -1.68 0.69 0.00 -0.71 0.00 0.00 33.22 32.37 2bo5 n MET 51 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2bo5 h ALA 52 N 1.41 2.38 0.00 3.04 0.00 -0.63 0.38 119.26 125.84 2bo5 h ALA 52 Ca -0.24 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.50 2bo5 h ALA 52 Cb 1.66 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.46 2bo5 h ALA 52 CO 0.03 -0.53 -0.72 0.00 0.00 0.00 0.00 179.25 178.04 2bo5 h ALA 53 N 1.78 0.71 0.15 0.00 0.00 -1.72 -2.94 119.26 117.24 2bo5 h ALA 53 Ca 0.20 -0.65 -0.30 0.00 0.00 0.00 0.00 54.91 54.15 2bo5 h ALA 53 Cb 0.82 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2bo5 h ALA 53 CO -0.00 0.90 -1.54 1.03 0.00 0.00 0.00 179.25 179.64 2bo5 h SER 54 N 0.00 0.48 0.03 0.00 0.87 -0.97 -3.05 113.55 110.92 2bo5 h SER 54 Ca -0.01 -0.89 -0.00 0.00 -1.23 0.00 0.00 61.79 59.65 2bo5 h SER 54 Cb 1.35 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 63.15 2bo5 h SER 54 CO 0.09 1.68 -0.02 -0.07 -0.53 0.00 0.00 176.83 177.99 2bo5 h LEU 55 N -0.14 0.00 -3.44 2.23 3.38 -0.48 -1.07 115.31 115.80 2bo5 h LEU 55 Ca -0.32 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.51 2bo5 h LEU 55 Cb 1.90 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 42.56 2bo5 h LEU 55 CO 0.11 0.02 0.07 -0.11 0.09 0.00 0.00 178.44 178.63 2bo5 n LEU 56 N -4.31 4.61 -4.26 1.67 -0.00 -1.11 -4.94 117.00 108.66 2bo5 n LEU 56 Ca -0.03 -3.38 -0.34 0.00 -0.00 0.00 0.00 56.01 52.26 2bo5 n LEU 56 Cb 0.11 -0.64 -0.15 0.00 -0.00 0.00 0.00 43.42 42.74 2bo5 n LEU 56 CO 0.32 0.94 -0.43 0.20 -0.00 0.00 0.00 177.39 178.43 2bo5 s ASN 57 N -1.94 3.97 0.00 1.96 -0.87 -0.41 -4.98 114.94 112.67 2bo5 s ASN 57 Ca 0.47 -0.46 0.20 0.00 -1.57 0.00 0.00 52.86 51.50 2bo5 s ASN 57 Cb 0.40 -1.66 1.17 0.00 -0.02 0.00 0.00 41.25 41.13 2bo5 s ASN 57 CO 0.07 -0.00 1.57 -0.81 -2.57 0.00 0.00 177.10 175.35 2bo5 n PRO 58 N 4.68 0.60 0.08 -0.60 -0.04 -1.26 -2.76 135.00 135.70 2bo5 n PRO 58 Ca -0.19 0.01 -0.12 0.00 -0.04 0.00 0.00 63.50 63.16 2bo5 n PRO 58 Cb 0.51 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.34 2bo5 n PRO 58 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2bo5 h TYR 59 N 0.00 0.26 -0.00 0.54 -1.99 -1.93 -3.24 116.97 110.61 2bo5 h TYR 59 Ca 0.00 -0.19 0.00 0.00 2.00 0.00 0.00 58.73 60.54 2bo5 h TYR 59 Cb 0.01 -0.01 -0.00 0.00 2.00 0.00 0.00 36.73 38.73 2bo5 h TYR 59 CO 0.00 1.16 0.03 -0.39 -0.00 0.00 0.00 178.16 178.96 2bo5 h VAL 60 N 0.04 0.07 -2.86 -2.88 -1.51 -1.81 -3.48 116.25 103.81 2bo5 h VAL 60 Ca -0.10 0.00 0.30 0.00 -1.23 0.00 0.00 66.70 65.68 2bo5 h VAL 60 Cb 1.89 0.97 -0.14 0.00 -2.13 0.00 0.00 31.29 31.89 2bo5 h VAL 60 CO 0.16 0.00 -0.88 0.29 -1.23 0.00 0.00 177.57 175.91 2bo5 n LYS 61 N -3.16 -2.69 0.02 5.19 4.01 -1.22 -1.39 118.16 118.92 2bo5 n LYS 61 Ca -0.03 2.09 -0.06 0.00 -0.51 0.00 0.00 58.31 59.80 2bo5 n LYS 61 Cb 0.10 -3.18 -0.11 0.00 -0.51 0.00 0.00 35.03 31.33 2bo5 n LYS 61 CO 0.00 0.00 0.00 -0.09 -1.11 0.00 0.00 177.40 176.20 2bo5 h ARG 62 N -1.17 0.00 0.00 1.97 1.12 -1.93 -3.13 114.38 111.25 2bo5 h ARG 62 Ca -0.11 0.00 -0.18 0.00 -1.11 0.00 0.00 59.98 58.58 2bo5 h ARG 62 Cb 1.14 0.00 -0.03 0.00 -0.01 0.00 0.00 29.97 31.08 2bo5 h ARG 62 CO 0.05 0.62 -1.07 1.03 -3.11 0.00 0.00 179.97 177.49 2bo5 h SER 63 N 0.00 0.00 -0.65 -3.80 0.87 -1.98 -3.32 113.55 104.66 2bo5 h SER 63 Ca -0.16 -0.42 0.04 0.00 -1.23 0.00 0.00 61.79 60.02 2bo5 h SER 63 Cb 1.83 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.76 2bo5 h SER 63 CO 0.09 1.33 0.43 0.58 -0.53 0.00 0.00 176.83 178.73 2bo5 h VAL 64 N -1.00 1.06 -0.12 2.23 2.07 -1.76 -0.91 116.25 117.82 2bo5 h VAL 64 Ca -0.27 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 66.96 2bo5 h VAL 64 Cb 1.13 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 2bo5 h VAL 64 CO -0.16 0.13 -0.13 0.50 0.02 0.00 0.00 177.57 177.93 2bo5 h LYS 65 N 0.73 0.18 -0.03 1.57 1.63 -1.17 -2.14 116.57 117.34 2bo5 h LYS 65 Ca 0.27 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.99 2bo5 h LYS 65 Cb 0.15 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.74 2bo5 h LYS 65 CO -0.08 0.32 -0.16 0.28 -3.45 0.00 0.00 179.45 176.36 2bo5 h VAL 66 N 0.17 1.13 -0.07 2.00 2.07 -1.26 -2.82 116.25 117.47 2bo5 h VAL 66 Ca 0.04 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 2bo5 h VAL 66 Cb 0.34 1.29 -0.00 0.00 -1.52 0.00 0.00 31.29 31.39 2bo5 h VAL 66 CO 0.02 0.18 0.02 0.50 0.02 0.00 0.00 177.57 178.31 2bo5 h LYS 67 N 0.05 0.11 -0.15 1.57 3.64 -1.38 -2.60 116.57 117.80 2bo5 h LYS 67 Ca 0.01 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.41 2bo5 h LYS 67 Cb 0.31 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 2bo5 h LYS 67 CO 0.02 0.29 0.12 1.03 -2.27 0.00 0.00 179.45 178.64 2bo5 h SER 68 N -0.09 0.00 -0.26 4.20 0.87 -1.55 -1.91 113.55 114.82 2bo5 h SER 68 Ca 0.02 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.56 2bo5 h SER 68 Cb 0.23 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.18 2bo5 h SER 68 CO -0.00 0.00 0.06 -0.07 -0.53 0.00 0.00 176.83 176.29 2bo5 h LEU 69 N 0.00 0.40 -0.77 2.23 4.07 -1.31 -0.90 115.31 119.03 2bo5 h LEU 69 Ca 0.07 -0.23 0.06 0.00 0.08 0.00 0.00 57.88 57.86 2bo5 h LEU 69 Cb 0.31 -0.10 -0.06 0.00 1.08 0.00 0.00 40.66 41.89 2bo5 h LEU 69 CO -0.00 0.53 0.46 -1.28 -1.08 0.00 0.00 178.44 177.07 2bo5 h SER 70 N 0.25 0.72 -0.05 -0.43 0.87 -1.17 0.64 113.55 114.38 2bo5 h SER 70 Ca 0.08 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 2bo5 h SER 70 Cb 0.28 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 2bo5 h SER 70 CO 0.00 0.47 0.00 0.47 -0.53 0.00 0.00 176.83 177.24 2bo5 n ASP 71 N -4.68 0.70 -0.06 6.23 9.92 -1.13 -2.78 116.55 124.75 2bo5 n ASP 71 Ca 0.10 -1.44 -0.06 0.00 -0.53 0.00 0.00 54.79 52.86 2bo5 n ASP 71 Cb 0.16 -0.03 -0.10 0.00 -0.64 0.00 0.00 41.12 40.51 2bo5 n ASP 71 CO 0.00 0.00 0.00 0.80 0.13 0.00 0.00 177.20 178.13 2bo5 n MET 72 N -0.36 1.96 0.09 -1.24 1.56 0.23 -4.12 117.12 115.22 2bo5 n MET 72 Ca 0.17 -0.01 -0.07 0.00 -0.27 0.00 0.00 57.70 57.53 2bo5 n MET 72 Cb 0.19 -1.32 -0.00 0.00 2.15 0.00 0.00 33.22 34.24 2bo5 n MET 72 CO 0.00 0.00 0.00 1.15 -0.73 0.00 0.00 175.97 176.39 2bo5 h THR 73 N 0.00 1.55 -0.01 1.12 2.02 0.15 -0.82 112.91 116.93 2bo5 h THR 73 Ca -0.33 -2.75 0.00 0.00 0.77 0.00 0.00 66.41 64.09 2bo5 h THR 73 Cb 1.76 2.52 0.00 0.00 -1.74 0.00 0.00 68.15 70.68 2bo5 h THR 73 CO 0.02 0.79 -0.02 0.00 0.37 0.00 0.00 175.52 176.69 2bo5 n ALA 74 N -2.42 2.64 -0.05 6.16 0.00 -1.12 -1.49 120.51 124.24 2bo5 n ALA 74 Ca -0.02 -0.35 -0.10 0.00 0.00 0.00 0.00 53.44 52.97 2bo5 n ALA 74 Cb 0.81 -1.30 -0.04 0.00 0.00 0.00 0.00 19.45 18.92 2bo5 n ALA 74 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2bo5 n LYS 75 N -0.34 0.22 0.35 0.00 4.81 -1.15 -4.79 118.16 117.25 2bo5 n LYS 75 Ca 0.20 0.08 -0.16 0.00 -0.87 0.00 0.00 58.31 57.57 2bo5 n LYS 75 Cb 0.27 -0.92 -0.08 0.00 0.02 0.00 0.00 35.03 34.31 2bo5 n LYS 75 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2bo5 h GLU 76 N -0.29 -0.86 0.00 1.64 4.39 -1.31 -3.47 114.58 114.68 2bo5 h GLU 76 Ca -0.24 0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.51 2bo5 h GLU 76 Cb 1.24 0.20 0.00 0.00 -0.10 0.00 0.00 28.75 30.09 2bo5 h GLU 76 CO -0.13 -0.54 0.00 1.17 -1.16 0.00 0.00 179.01 178.35 2bo5 n LYS 77 N -5.41 0.00 -0.55 2.33 3.00 -1.21 -5.09 118.16 111.23 2bo5 n LYS 77 Ca -0.13 0.00 -0.11 0.00 -0.00 0.00 0.00 58.31 58.08 2bo5 n LYS 77 Cb 0.38 0.00 0.11 0.00 0.00 0.00 0.00 35.03 35.51 2bo5 n LYS 77 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 2bo5 n PHE 78 N 0.00 -2.17 0.00 5.64 3.72 -0.55 -4.76 117.46 119.34 2bo5 n PHE 78 Ca 0.00 0.14 0.00 0.00 -0.05 0.00 0.00 57.45 57.54 2bo5 n PHE 78 Cb 0.00 -1.32 0.00 0.00 -0.94 0.00 0.00 39.48 37.22 2bo5 n PHE 78 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2bo5 n SER 79 N -0.20 0.00 -0.01 4.37 3.41 -1.25 -4.23 113.62 115.72 2bo5 n SER 79 Ca 0.05 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.65 2bo5 n SER 79 Cb 0.22 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.16 2bo5 n SER 79 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2bo5 n PRO 80 N 0.00 0.03 -0.18 4.33 -0.04 -1.26 -4.06 135.00 133.82 2bo5 n PRO 80 Ca 0.00 0.01 0.12 0.00 -0.04 0.00 0.00 63.50 63.59 2bo5 n PRO 80 Cb 0.00 -0.51 0.22 0.00 -0.04 0.00 0.00 33.50 33.18 2bo5 n PRO 80 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2bo5 n LEU 81 N -2.63 3.35 0.00 1.53 4.77 -1.26 -3.84 117.00 118.92 2bo5 n LEU 81 Ca -0.01 -1.42 0.00 0.00 -0.03 0.00 0.00 56.01 54.55 2bo5 n LEU 81 Cb 0.03 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 2bo5 n LEU 81 CO 0.01 0.71 0.17 0.41 -1.33 0.00 0.00 177.39 177.37 2bo5 n THR 82 N 1.43 0.00 -0.10 -5.08 -1.04 -1.26 -4.43 114.28 103.79 2bo5 n THR 82 Ca 0.19 -0.47 -0.12 0.00 -2.04 0.00 0.00 64.05 61.61 2bo5 n THR 82 Cb 0.59 1.04 0.08 0.00 -1.82 0.00 0.00 70.33 70.23 2bo5 n THR 82 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2bo5 n SER 83 N -0.26 3.47 0.00 8.00 2.88 -1.25 -1.79 113.62 124.67 2bo5 n SER 83 Ca 0.00 -2.78 0.00 0.00 -1.33 0.00 0.00 58.87 54.76 2bo5 n SER 83 Cb 0.01 -0.68 0.00 0.00 -0.75 0.00 0.00 64.21 62.79 2bo5 n SER 83 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2bo5 n ASN 84 N -0.27 0.00 0.29 -3.46 5.15 -1.26 -4.77 115.26 110.94 2bo5 n ASN 84 Ca 0.29 0.00 0.18 0.00 -0.60 0.00 0.00 54.58 54.45 2bo5 n ASN 84 Cb 1.05 0.07 0.80 0.00 -0.53 0.00 0.00 39.78 41.17 2bo5 n ASN 84 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 2bo5 h LEU 85 N 0.00 0.00 0.13 1.20 5.85 -1.77 -1.76 115.31 118.96 2bo5 h LEU 85 Ca 0.00 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 2bo5 h LEU 85 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2bo5 h LEU 85 CO 0.00 0.03 -0.06 0.40 -0.34 0.00 0.00 178.44 178.47 2bo5 h ILE 86 N 0.00 1.05 0.00 4.05 5.03 -1.65 -0.75 117.51 125.24 2bo5 h ILE 86 Ca -0.00 -1.06 -0.07 0.00 -0.12 0.00 0.00 64.86 63.61 2bo5 h ILE 86 Cb 0.39 1.67 -0.01 0.00 -3.03 0.00 0.00 36.82 35.85 2bo5 h ILE 86 CO 0.00 0.24 -0.31 0.78 -0.68 0.00 0.00 178.15 178.18 2bo5 h ASN 87 N -0.70 0.00 0.23 1.72 -0.26 -1.78 -2.22 115.58 112.57 2bo5 h ASN 87 Ca -0.02 0.00 -0.21 0.00 -0.56 0.00 0.00 56.30 55.51 2bo5 h ASN 87 Cb 0.52 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.78 2bo5 h ASN 87 CO 0.03 0.31 -0.84 0.25 -1.06 0.00 0.00 177.43 176.13 2bo5 h LEU 88 N 0.00 0.57 -0.75 1.61 5.85 -1.32 0.22 115.31 121.49 2bo5 h LEU 88 Ca -0.00 -0.41 -0.13 0.00 0.84 0.00 0.00 57.88 58.17 2bo5 h LEU 88 Cb 0.56 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 2bo5 h LEU 88 CO 0.04 1.19 -0.48 -0.07 -0.34 0.00 0.00 178.44 178.77 2bo5 h LEU 89 N 0.29 0.37 -3.49 2.25 3.38 -0.82 -2.95 115.31 114.34 2bo5 h LEU 89 Ca -0.06 -0.18 -0.15 0.00 0.09 0.00 0.00 57.88 57.58 2bo5 h LEU 89 Cb 1.45 -0.11 -0.09 0.00 0.09 0.00 0.00 40.66 42.00 2bo5 h LEU 89 CO 0.15 0.80 0.11 0.00 0.09 0.00 0.00 178.44 179.59 2bo5 n ALA 90 N -2.48 4.03 -0.09 1.53 0.00 -0.86 -0.53 120.51 122.10 2bo5 n ALA 90 Ca -0.02 -2.58 -0.18 0.00 0.00 0.00 0.00 53.44 50.66 2bo5 n ALA 90 Cb 0.54 -0.94 -0.11 0.00 0.00 0.00 0.00 19.45 18.94 2bo5 n ALA 90 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2bo5 h GLU 91 N 1.85 0.00 -0.15 0.00 4.81 -0.76 -3.40 114.58 116.94 2bo5 h GLU 91 Ca 0.18 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.36 2bo5 h GLU 91 Cb 1.89 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 31.24 2bo5 h GLU 91 CO 0.49 0.88 -0.15 0.09 -0.73 0.00 0.00 179.01 179.60 2bo5 n ASN 92 N -4.50 2.52 -0.06 1.04 3.02 -1.26 -4.93 115.26 111.10 2bo5 n ASN 92 Ca -0.24 -3.47 -0.01 0.00 -0.03 0.00 0.00 54.58 50.83 2bo5 n ASN 92 Cb 0.58 -0.53 -0.00 0.00 -0.61 0.00 0.00 39.78 39.21 2bo5 n ASN 92 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bo5 n GLY 93 N -1.09 0.37 0.29 7.41 0.00 -1.26 -4.92 105.19 105.99 2bo5 n GLY 93 Ca 0.23 -0.94 0.20 0.00 0.00 0.00 0.00 46.02 45.50 2bo5 n GLY 93 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2bo5 h ARG 94 N 0.00 0.00 -4.92 1.61 9.65 -1.07 -3.36 114.38 116.28 2bo5 h ARG 94 Ca -0.01 0.00 -0.49 0.00 -1.10 0.00 0.00 59.98 58.38 2bo5 h ARG 94 Cb 0.66 0.00 0.03 0.00 -1.39 0.00 0.00 29.97 29.28 2bo5 h ARG 94 CO 0.02 0.00 1.59 1.28 2.80 0.00 0.00 179.97 185.65 2bo5 n LEU 95 N -2.91 3.09 0.00 3.80 4.77 -0.03 -3.03 117.00 122.68 2bo5 n LEU 95 Ca -0.02 -2.75 0.00 0.00 -0.03 0.00 0.00 56.01 53.21 2bo5 n LEU 95 Cb 0.11 -1.28 0.00 0.00 -2.33 0.00 0.00 43.42 39.92 2bo5 n LEU 95 CO 0.19 -1.34 0.00 0.35 -1.33 0.00 0.00 177.39 175.26 2bo5 n THR 96 N 6.98 0.00 -0.45 -5.08 -2.24 -1.26 -4.88 114.28 107.35 2bo5 n THR 96 Ca 0.47 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 62.33 2bo5 n THR 96 Cb 0.43 -0.05 0.25 0.00 -2.10 0.00 0.00 70.33 68.85 2bo5 n THR 96 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2bo5 n ASN 97 N -1.87 3.68 -0.40 3.42 3.02 -1.17 -4.74 115.26 117.20 2bo5 n ASN 97 Ca 0.00 -2.27 -0.08 0.00 -0.03 0.00 0.00 54.58 52.19 2bo5 n ASN 97 Cb 0.00 -0.40 -0.06 0.00 -0.61 0.00 0.00 39.78 38.70 2bo5 n ASN 97 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2bo5 n THR 98 N 0.66 -0.62 -0.27 3.41 -1.04 -1.25 -0.90 114.28 114.27 2bo5 n THR 98 Ca 0.19 2.31 0.01 0.00 -2.04 0.00 0.00 64.05 64.52 2bo5 n THR 98 Cb 0.64 -2.90 0.08 0.00 -1.82 0.00 0.00 70.33 66.33 2bo5 n THR 98 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 2bo5 h PRO 99 N 0.00 -0.02 0.00 -2.82 0.13 -1.85 0.86 132.00 128.30 2bo5 h PRO 99 Ca 0.20 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.29 2bo5 h PRO 99 Cb 0.44 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.57 2bo5 h PRO 99 CO -0.92 -0.01 -0.18 0.00 -0.23 0.00 0.00 178.00 176.66 2bo5 h ALA 100 N 1.67 1.46 -0.01 -0.56 0.00 -1.39 -1.98 119.26 118.45 2bo5 h ALA 100 Ca 0.36 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.96 2bo5 h ALA 100 Cb 0.57 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2bo5 h ALA 100 CO -0.80 0.22 -0.65 0.28 0.00 0.00 0.00 179.25 178.29 2bo5 h VAL 101 N 0.00 1.46 -0.15 0.00 2.07 0.18 -3.17 116.25 116.63 2bo5 h VAL 101 Ca -0.00 -2.21 -0.22 0.00 0.82 0.00 0.00 66.70 65.09 2bo5 h VAL 101 Cb 0.37 2.19 0.01 0.00 -1.52 0.00 0.00 31.29 32.34 2bo5 h VAL 101 CO 0.02 0.64 -0.76 0.40 0.02 0.00 0.00 177.57 177.89 2bo5 h ILE 102 N 0.03 1.29 -0.85 4.57 2.04 -0.29 -3.16 117.51 121.14 2bo5 h ILE 102 Ca -0.01 -1.98 0.07 0.00 1.00 0.00 0.00 64.86 63.95 2bo5 h ILE 102 Cb 1.16 1.97 -0.06 0.00 -0.74 0.00 0.00 36.82 39.16 2bo5 h ILE 102 CO 0.09 0.62 0.55 0.28 0.00 0.00 0.00 178.15 179.70 2bo5 h SER 103 N 0.52 0.81 -0.65 1.72 0.02 -1.46 -0.81 113.55 113.69 2bo5 h SER 103 Ca -0.05 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.88 2bo5 h SER 103 Cb 1.38 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 63.72 2bo5 h SER 103 CO 0.15 0.51 0.30 0.00 -1.14 0.00 0.00 176.83 176.65 2bo5 h ALA 104 N 1.55 1.24 -0.52 3.77 0.00 -1.53 -1.76 119.26 122.01 2bo5 h ALA 104 Ca 0.37 -0.16 0.13 0.00 0.00 0.00 0.00 54.91 55.25 2bo5 h ALA 104 Cb 0.26 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2bo5 h ALA 104 CO -0.14 0.57 0.37 0.35 0.00 0.00 0.00 179.25 180.39 2bo5 h PHE 105 N 0.97 0.16 0.00 0.00 3.04 -1.15 0.83 116.94 120.79 2bo5 h PHE 105 Ca 0.23 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.19 2bo5 h PHE 105 Cb 0.14 -0.05 0.00 0.00 2.56 0.00 0.00 35.95 38.60 2bo5 h PHE 105 CO 0.01 0.07 -0.16 1.03 -2.02 0.00 0.00 178.31 177.24 2bo5 h SER 106 N 0.15 0.00 0.03 0.41 0.87 -1.26 -1.65 113.55 112.10 2bo5 h SER 106 Ca 0.25 -0.04 -0.37 0.00 -1.23 0.00 0.00 61.79 60.40 2bo5 h SER 106 Cb 0.79 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 62.68 2bo5 h SER 106 CO -0.03 0.02 -2.37 0.41 -0.53 0.00 0.00 176.83 174.33 2bo5 n THR 107 N -2.43 1.46 0.16 2.23 -1.04 0.85 -4.22 114.28 111.29 2bo5 n THR 107 Ca 0.05 -0.74 0.04 0.00 -2.04 0.00 0.00 64.05 61.36 2bo5 n THR 107 Cb 0.46 -0.91 0.13 0.00 -1.82 0.00 0.00 70.33 68.19 2bo5 n THR 107 CO 0.00 0.00 0.00 0.24 -0.64 0.00 0.00 175.07 174.67 2bo5 h MET 108 N 0.00 0.00 -0.61 -2.82 2.86 0.39 -3.11 114.93 111.64 2bo5 h MET 108 Ca -0.54 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.09 2bo5 h MET 108 Cb 2.10 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 33.73 2bo5 h MET 108 CO -0.01 0.42 0.34 0.00 1.06 0.00 0.00 176.91 178.72 2bo5 h MET 109 N 0.00 0.84 -0.08 1.72 3.00 -1.47 -0.30 114.93 118.64 2bo5 h MET 109 Ca -0.00 -0.08 0.02 0.00 0.00 0.00 0.00 59.70 59.64 2bo5 h MET 109 Cb 1.22 -0.17 -0.00 0.00 0.00 0.00 0.00 31.60 32.65 2bo5 h MET 109 CO 0.05 0.61 0.19 0.77 0.00 0.00 0.00 176.91 178.54 2bo5 h SER 110 N 0.85 0.00 0.09 -0.10 0.02 -1.71 0.12 113.55 112.82 2bo5 h SER 110 Ca 0.22 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.92 2bo5 h SER 110 Cb 0.01 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.58 2bo5 h SER 110 CO -0.04 0.00 -1.01 0.58 -1.14 0.00 0.00 176.83 175.22 2bo5 h VAL 111 N 0.00 1.36 -0.02 2.27 2.07 -1.21 -2.00 116.25 118.72 2bo5 h VAL 111 Ca 0.04 -2.38 -0.16 0.00 0.82 0.00 0.00 66.70 65.02 2bo5 h VAL 111 Cb 0.41 2.75 -0.02 0.00 -1.52 0.00 0.00 31.29 32.92 2bo5 h VAL 111 CO -0.00 0.71 -0.73 1.12 0.02 0.00 0.00 177.57 178.69 2bo5 h HIS 112 N 0.08 0.15 0.00 1.57 -0.00 -1.12 -3.12 115.15 112.71 2bo5 h HIS 112 Ca -0.15 -0.07 -0.17 0.00 -0.00 0.00 0.00 60.37 59.98 2bo5 h HIS 112 Cb 1.72 -0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 29.09 2bo5 h HIS 112 CO 0.14 0.80 -0.81 -0.09 -0.00 0.00 0.00 177.93 177.97 2bo5 h ARG 113 N 0.07 0.01 0.00 5.12 2.43 -1.12 -3.17 114.38 117.72 2bo5 h ARG 113 Ca -0.02 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 2bo5 h ARG 113 Cb 1.29 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.84 2bo5 h ARG 113 CO 0.10 0.81 -0.07 0.78 -1.51 0.00 0.00 179.97 180.09 2bo5 h GLY 114 N 2.37 0.00 -6.37 2.80 0.00 -1.29 -3.19 103.07 97.39 2bo5 h GLY 114 Ca -0.01 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 46.65 2bo5 h GLY 114 CO 0.11 0.00 -0.12 -2.21 0.00 0.00 0.00 176.54 174.32 2bo5 n GLU 115 N -4.20 3.27 -3.44 4.80 2.13 -1.20 -4.92 120.64 117.08 2bo5 n GLU 115 Ca -0.03 -4.65 -0.28 0.00 0.66 0.00 0.00 57.16 52.86 2bo5 n GLU 115 Cb 0.15 -2.34 -0.11 0.00 0.27 0.00 0.00 31.44 29.41 2bo5 n GLU 115 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2bo5 s VAL 116 N -2.75 0.32 0.00 6.31 1.01 -1.21 -5.00 120.40 119.09 2bo5 s VAL 116 Ca 0.38 -2.25 -0.36 0.00 0.00 0.00 0.00 61.98 59.75 2bo5 s VAL 116 Cb 0.13 -1.24 -0.14 0.00 0.00 0.00 0.00 36.38 35.12 2bo5 s VAL 116 CO 0.02 -1.11 1.63 -2.65 0.00 0.00 0.00 175.10 172.98 2bo5 n PRO 117 N 3.39 1.73 0.11 2.72 -0.02 -1.26 -4.82 135.00 136.85 2bo5 n PRO 117 Ca 0.21 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 2bo5 n PRO 117 Cb 0.42 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 2bo5 n PRO 117 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bo5 h THR 119 N 0.00 0.00 -0.02 0.00 2.02 -2.07 -3.58 112.91 109.26 2bo5 h THR 119 Ca 0.00 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.82 2bo5 h THR 119 Cb 0.00 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.41 2bo5 h THR 119 CO 0.00 0.00 0.00 0.52 0.37 0.00 0.00 175.52 176.41