#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 3.22 -0.60 3.13 0.00 -1.26 -4.91 121.76 121.34 2bo5 s ALA 2 Ca 0.00 1.01 -0.28 0.00 0.00 0.00 0.00 51.96 52.69 2bo5 s ALA 2 Cb 0.00 -3.93 0.01 0.00 0.00 0.00 0.00 23.12 19.20 2bo5 s ALA 2 CO 0.00 -2.09 1.42 0.15 0.00 0.00 0.00 175.76 175.24 2bo5 s LYS 3 N 5.21 3.23 -0.26 0.00 1.02 -1.26 -4.81 119.74 122.88 2bo5 s LYS 3 Ca 0.91 0.34 -0.03 0.00 0.02 0.00 0.00 55.97 57.20 2bo5 s LYS 3 Cb -0.37 -4.15 -0.15 0.00 -0.52 0.00 0.00 37.83 32.64 2bo5 s LYS 3 CO 0.37 -2.03 -0.26 1.28 -0.92 0.00 0.00 175.35 173.79 2bo5 n LEU 4 N 9.77 2.62 -4.56 3.17 4.77 -1.26 -4.83 117.00 126.68 2bo5 n LEU 4 Ca 0.11 0.02 -0.24 0.00 -0.03 0.00 0.00 56.01 55.87 2bo5 n LEU 4 Cb 0.49 -0.85 -0.05 0.00 -2.33 0.00 0.00 43.42 40.69 2bo5 n LEU 4 CO 0.71 0.80 1.40 -0.69 -1.33 0.00 0.00 177.39 178.28 2bo5 s VAL 5 N -2.50 3.21 0.07 4.08 1.01 -1.26 -4.91 120.40 120.10 2bo5 s VAL 5 Ca -0.35 -0.12 0.05 0.00 0.00 0.00 0.00 61.98 61.56 2bo5 s VAL 5 Cb 0.11 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 2bo5 s VAL 5 CO 0.54 -0.46 -0.14 -0.13 0.00 0.00 0.00 175.10 174.92 2bo5 s ARG 6 N 7.93 0.82 -0.51 2.72 0.52 -1.26 -5.08 118.95 124.08 2bo5 s ARG 6 Ca 0.82 -0.93 -0.32 0.00 -0.52 0.00 0.00 55.73 54.78 2bo5 s ARG 6 Cb -0.11 -0.82 -0.13 0.00 0.52 0.00 0.00 34.95 34.41 2bo5 s ARG 6 CO 0.08 0.18 2.34 -2.30 0.02 0.00 0.00 175.30 175.63 2bo5 n PRO 7 N 1.35 0.83 -2.06 3.54 -0.02 -1.26 -4.84 135.00 132.55 2bo5 n PRO 7 Ca -0.21 0.16 -0.28 0.00 -2.02 0.00 0.00 63.50 61.15 2bo5 n PRO 7 Cb 0.54 -2.48 -0.05 0.00 -0.02 0.00 0.00 33.50 31.49 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 7.26 2.58 -0.20 0.52 0.04 -1.26 -4.95 135.00 138.99 2bo5 s PRO 8 Ca 1.12 -0.25 -0.08 0.00 0.04 0.00 0.00 61.00 61.83 2bo5 s PRO 8 Cb -0.79 -5.03 -0.04 0.00 0.04 0.00 0.00 34.50 28.68 2bo5 s PRO 8 CO 0.44 -3.32 0.09 0.14 0.04 0.00 0.00 177.00 174.39 2bo5 s VAL 9 N 9.92 4.99 0.00 -0.36 -7.23 -1.26 -4.79 120.40 121.67 2bo5 s VAL 9 Ca 0.69 0.04 0.00 0.00 -1.81 0.00 0.00 61.98 60.91 2bo5 s VAL 9 Cb -0.07 -3.27 0.00 0.00 0.56 0.00 0.00 36.38 33.60 2bo5 s VAL 9 CO 0.00 0.44 0.00 1.67 -0.31 0.00 0.00 175.10 176.90 2bo5 n GLN 10 N 3.67 0.00 0.00 4.82 7.27 -1.26 -4.95 117.38 126.94 2bo5 n GLN 10 Ca -0.16 0.00 0.03 0.00 0.07 0.00 0.00 57.00 56.94 2bo5 n GLN 10 Cb 0.52 0.00 -0.01 0.00 2.41 0.00 0.00 30.24 33.16 2bo5 n GLN 10 CO 0.00 0.00 0.00 1.51 0.07 0.00 0.00 177.06 178.64 2bo5 n ILE 11 N -1.60 0.00 -3.34 1.69 3.06 -1.26 -5.07 119.36 112.85 2bo5 n ILE 11 Ca 0.00 -0.41 -0.26 0.00 -2.50 0.00 0.00 62.75 59.58 2bo5 n ILE 11 Cb 0.00 1.06 0.03 0.00 0.54 0.00 0.00 39.64 41.27 2bo5 n ILE 11 CO 0.00 0.00 0.00 -1.22 -2.50 0.00 0.00 176.55 172.83 2bo5 n TYR 12 N -0.49 -1.75 0.13 9.51 4.02 -1.26 -4.40 117.16 122.92 2bo5 n TYR 12 Ca 0.02 0.73 -0.13 0.00 -0.01 0.00 0.00 57.90 58.52 2bo5 n TYR 12 Cb 0.13 -1.45 -0.06 0.00 -0.02 0.00 0.00 39.34 37.94 2bo5 n TYR 12 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2bo5 h GLY 13 N 2.53 -0.48 0.89 2.72 0.00 -1.97 0.91 103.07 107.67 2bo5 h GLY 13 Ca -0.38 0.28 0.02 0.00 0.00 0.00 0.00 47.33 47.25 2bo5 h GLY 13 CO 0.15 -0.21 0.25 1.19 0.00 0.00 0.00 176.54 177.91 2bo5 h ILE 14 N -0.47 1.04 -0.12 2.60 -0.00 -2.00 -0.50 117.51 118.06 2bo5 h ILE 14 Ca 0.02 -0.17 -0.10 0.00 -0.00 0.00 0.00 64.86 64.61 2bo5 h ILE 14 Cb 0.47 0.50 -0.01 0.00 -0.00 0.00 0.00 36.82 37.77 2bo5 h ILE 14 CO -0.11 0.09 -0.37 -0.33 -0.00 0.00 0.00 178.15 177.43 2bo5 h GLU 15 N 0.50 0.25 0.00 2.19 5.08 -1.84 -2.67 114.58 118.09 2bo5 h GLU 15 Ca 0.17 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.34 2bo5 h GLU 15 Cb 0.01 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 2bo5 h GLU 15 CO -0.08 0.60 -0.38 0.78 -1.00 0.00 0.00 179.01 178.93 2bo5 h GLY 16 N 1.16 0.00 2.00 -3.84 0.00 0.16 -2.73 103.07 99.82 2bo5 h GLY 16 Ca 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.30 2bo5 h GLY 16 CO 0.06 0.00 -0.24 3.21 0.00 0.00 0.00 176.54 179.57 2bo5 h ARG 17 N 0.00 0.00 -0.12 4.80 3.08 -0.75 -2.86 114.38 118.53 2bo5 h ARG 17 Ca -0.00 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.08 2bo5 h ARG 17 Cb 0.80 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.82 2bo5 h ARG 17 CO 0.05 0.24 -0.06 1.88 -1.07 0.00 0.00 179.97 181.01 2bo5 h TYR 18 N 0.00 -0.15 -0.40 3.04 -1.99 -1.48 1.46 116.97 117.45 2bo5 h TYR 18 Ca -0.00 0.01 -0.13 0.00 2.00 0.00 0.00 58.73 60.61 2bo5 h TYR 18 Cb 0.69 0.09 -0.01 0.00 2.00 0.00 0.00 36.73 39.50 2bo5 h TYR 18 CO 0.00 -0.10 -0.27 0.00 -0.00 0.00 0.00 178.16 177.79 2bo5 h ALA 19 N 1.05 0.57 0.00 3.88 0.00 -1.68 -2.25 119.26 120.82 2bo5 h ALA 19 Ca 0.07 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 2bo5 h ALA 19 Cb 0.16 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2bo5 h ALA 19 CO -0.16 0.58 -0.17 1.79 0.00 0.00 0.00 179.25 181.29 2bo5 h THR 20 N 0.69 0.44 -0.07 0.00 1.35 -1.23 0.87 112.91 114.95 2bo5 h THR 20 Ca 0.08 -0.95 0.00 0.00 -0.55 0.00 0.00 66.41 64.99 2bo5 h THR 20 Cb 0.84 1.68 0.00 0.00 -1.73 0.00 0.00 68.15 68.94 2bo5 h THR 20 CO 0.07 0.17 0.00 0.00 -0.25 0.00 0.00 175.52 175.51 2bo5 n ALA 21 N -2.20 2.54 -0.01 6.62 0.00 0.50 -1.37 120.51 126.59 2bo5 n ALA 21 Ca 0.00 -0.51 -0.01 0.00 0.00 0.00 0.00 53.44 52.92 2bo5 n ALA 21 Cb 0.39 -1.10 -0.01 0.00 0.00 0.00 0.00 19.45 18.73 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 0.37 2.18 0.14 0.00 0.00 -0.77 -4.59 117.00 114.32 2bo5 n LEU 22 Ca 0.18 -0.01 0.12 0.00 0.00 0.00 0.00 56.01 56.30 2bo5 n LEU 22 Cb 0.38 -0.05 0.15 0.00 0.00 0.00 0.00 43.42 43.91 2bo5 n LEU 22 CO 0.15 0.40 0.50 0.10 0.00 0.00 0.00 177.39 178.55 2bo5 h TYR 23 N 0.00 0.00 -0.90 1.96 -0.00 0.61 -3.29 116.97 115.35 2bo5 h TYR 23 Ca -0.05 0.00 0.21 0.00 0.00 0.00 0.00 58.73 58.89 2bo5 h TYR 23 Cb 1.09 0.00 -0.12 0.00 0.00 0.00 0.00 36.73 37.70 2bo5 h TYR 23 CO 0.00 0.00 0.42 0.66 -0.00 0.00 0.00 178.16 179.24 2bo5 h SER 24 N 0.00 0.39 0.13 0.10 4.64 -1.37 2.31 113.55 119.75 2bo5 h SER 24 Ca 0.00 0.14 -0.23 0.00 -0.47 0.00 0.00 61.79 61.23 2bo5 h SER 24 Cb 0.92 0.10 0.01 0.00 -0.31 0.00 0.00 62.40 63.12 2bo5 h SER 24 CO 0.00 0.05 -0.92 0.00 -0.87 0.00 0.00 176.83 175.08 2bo5 h ALA 25 N 1.68 0.30 0.00 5.18 0.00 -1.84 -3.00 119.26 121.59 2bo5 h ALA 25 Ca 0.55 -0.67 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2bo5 h ALA 25 Cb 1.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 2bo5 h ALA 25 CO -0.49 0.74 -0.16 0.00 0.00 0.00 0.00 179.25 179.34 2bo5 h ALA 26 N 0.62 1.39 0.10 0.00 0.00 0.16 -2.87 119.26 118.66 2bo5 h ALA 26 Ca -0.09 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2bo5 h ALA 26 Cb 1.56 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.32 2bo5 h ALA 26 CO 0.17 0.20 -0.05 1.03 0.00 0.00 0.00 179.25 180.60 2bo5 h SER 27 N 0.00 -0.11 -0.87 0.00 0.87 0.36 1.25 113.55 115.05 2bo5 h SER 27 Ca -0.00 -0.30 0.21 0.00 -1.23 0.00 0.00 61.79 60.47 2bo5 h SER 27 Cb 0.37 0.03 -0.06 0.00 -0.44 0.00 0.00 62.40 62.30 2bo5 h SER 27 CO 0.02 0.25 0.59 0.11 -0.53 0.00 0.00 176.83 177.28 2bo5 h LYS 28 N -0.50 0.26 0.09 2.24 1.57 -1.45 -1.05 116.57 117.73 2bo5 h LYS 28 Ca -0.01 -0.02 -0.23 0.00 -1.87 0.00 0.00 60.65 58.52 2bo5 h LYS 28 Cb 0.41 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 2bo5 h LYS 28 CO 0.02 0.17 -1.20 0.37 -0.57 0.00 0.00 179.45 178.25 2bo5 h GLN 29 N 0.27 0.19 0.00 3.15 4.15 -1.41 -3.49 115.11 117.97 2bo5 h GLN 29 Ca 0.44 -0.32 0.00 0.00 0.77 0.00 0.00 58.65 59.54 2bo5 h GLN 29 Cb 1.30 0.12 0.00 0.00 0.21 0.00 0.00 27.48 29.11 2bo5 h GLN 29 CO -0.12 1.15 0.00 -1.71 -1.93 0.00 0.00 178.83 176.22 2bo5 n ASN 30 N -4.08 0.00 -0.79 -0.69 2.85 0.39 -5.01 115.26 107.93 2bo5 n ASN 30 Ca -0.24 0.00 0.06 0.00 -0.11 0.00 0.00 54.58 54.30 2bo5 n ASN 30 Cb 0.82 0.00 0.18 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 -0.55 2.05 -0.42 1.20 4.76 0.12 -4.36 118.16 120.96 2bo5 n LYS 31 Ca 0.00 -1.47 0.40 0.00 -2.87 0.00 0.00 58.31 54.37 2bo5 n LYS 31 Cb 0.00 -1.37 0.71 0.00 -1.84 0.00 0.00 35.03 32.53 2bo5 n LYS 31 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2bo5 h LEU 32 N 2.33 0.00 0.09 -0.35 -0.00 -1.92 2.03 115.31 117.48 2bo5 h LEU 32 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.88 57.59 2bo5 h LEU 32 Cb 0.61 0.00 0.02 0.00 -0.00 0.00 0.00 40.66 41.30 2bo5 h LEU 32 CO 0.03 0.00 -1.22 1.05 -0.00 0.00 0.00 178.44 178.29 2bo5 h GLU 33 N 0.00 0.53 -0.02 1.13 4.11 -1.95 1.21 114.58 119.58 2bo5 h GLU 33 Ca 0.67 -0.72 0.00 0.00 0.07 0.00 0.00 59.36 59.37 2bo5 h GLU 33 Cb 2.93 0.24 0.00 0.00 0.50 0.00 0.00 28.75 32.42 2bo5 h GLU 33 CO -0.01 1.32 0.00 1.04 0.07 0.00 0.00 179.01 181.43 2bo5 n GLN 34 N -3.73 1.27 0.00 1.06 1.13 0.65 -2.48 117.38 115.28 2bo5 n GLN 34 Ca -0.12 -0.40 0.00 0.00 -1.94 0.00 0.00 57.00 54.54 2bo5 n GLN 34 Cb 0.98 -1.44 0.00 0.00 0.11 0.00 0.00 30.24 29.89 2bo5 n GLN 34 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2bo5 n VAL 35 N -0.48 0.00 -0.03 5.09 0.31 0.10 -4.18 118.33 119.14 2bo5 n VAL 35 Ca 0.20 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.37 2bo5 n VAL 35 Cb 0.20 -0.47 -0.12 0.00 -0.91 0.00 0.00 33.84 32.54 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 0.13 0.00 5.55 4.22 0.14 -1.98 114.58 122.64 2bo5 h GLU 36 Ca 0.00 -0.17 -0.03 0.00 0.08 0.00 0.00 59.36 59.24 2bo5 h GLU 36 Cb 0.71 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.01 2bo5 h GLU 36 CO 0.00 0.97 -0.16 0.87 -2.18 0.00 0.00 179.01 178.51 2bo5 h LYS 37 N -0.63 0.00 -0.58 1.92 1.57 -1.55 0.29 116.57 117.59 2bo5 h LYS 37 Ca -0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2bo5 h LYS 37 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 2bo5 h LYS 37 CO 0.05 0.16 0.00 0.39 -0.57 0.00 0.00 179.45 179.48 2bo5 n GLU 38 N -4.16 2.46 -0.04 3.15 4.71 -1.19 -3.66 120.64 121.89 2bo5 n GLU 38 Ca -0.02 -1.53 -0.05 0.00 -0.01 0.00 0.00 57.16 55.55 2bo5 n GLU 38 Cb 0.24 -1.59 -0.06 0.00 -1.01 0.00 0.00 31.44 29.02 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 0.50 0.86 0.16 -4.62 7.94 0.98 -4.46 117.00 118.34 2bo5 n LEU 39 Ca 0.14 -0.02 0.02 0.00 -1.11 0.00 0.00 56.01 55.04 2bo5 n LEU 39 Cb 0.53 0.04 0.21 0.00 0.53 0.00 0.00 43.42 44.73 2bo5 n LEU 39 CO 0.13 0.34 0.55 0.25 -1.11 0.00 0.00 177.39 177.55 2bo5 h LEU 40 N 0.00 0.00 -0.88 -1.96 5.85 -1.49 -3.05 115.31 113.79 2bo5 h LEU 40 Ca -0.22 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.42 2bo5 h LEU 40 Cb 1.46 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.47 2bo5 h LEU 40 CO -0.00 0.52 -0.04 0.03 -0.34 0.00 0.00 178.44 178.61 2bo5 h ARG 41 N 0.00 0.79 0.00 1.25 -0.00 -1.79 -2.25 114.38 112.38 2bo5 h ARG 41 Ca -0.01 -0.23 -0.04 0.00 -0.50 0.00 0.00 59.98 59.20 2bo5 h ARG 41 Cb 1.08 -0.08 -0.01 0.00 0.00 0.00 0.00 29.97 30.96 2bo5 h ARG 41 CO 0.07 0.82 -0.21 0.28 0.00 0.00 0.00 179.97 180.93 2bo5 h VAL 42 N 0.73 1.00 -0.12 2.04 2.07 -1.75 -2.50 116.25 117.73 2bo5 h VAL 42 Ca 0.14 -0.76 -0.10 0.00 0.82 0.00 0.00 66.70 66.79 2bo5 h VAL 42 Cb 0.50 1.43 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 2bo5 h VAL 42 CO 0.03 0.21 -0.31 1.23 0.02 0.00 0.00 177.57 178.74 2bo5 h GLY 43 N 0.79 0.46 2.00 2.17 0.00 -1.44 -3.10 103.07 103.94 2bo5 h GLY 43 Ca -0.00 -0.58 -0.02 0.00 0.00 0.00 0.00 47.33 46.73 2bo5 h GLY 43 CO 0.03 0.51 -0.09 -1.61 0.00 0.00 0.00 176.54 175.38 2bo5 h GLN 44 N -0.01 0.00 0.00 4.80 4.15 -1.26 -0.28 115.11 122.52 2bo5 h GLN 44 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.41 2bo5 h GLN 44 Cb 0.92 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.61 2bo5 h GLN 44 CO 0.07 0.09 0.00 -0.89 -1.93 0.00 0.00 178.83 176.17 2bo5 n ILE 45 N -4.39 0.98 -0.06 2.39 5.41 -0.96 -1.33 119.36 121.40 2bo5 n ILE 45 Ca -0.03 0.30 -0.12 0.00 1.00 0.00 0.00 62.75 63.90 2bo5 n ILE 45 Cb 0.17 -1.19 -0.14 0.00 -0.71 0.00 0.00 39.64 37.77 2bo5 n ILE 45 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 2bo5 n LEU 46 N -1.95 1.16 0.19 1.39 7.94 -0.13 -4.14 117.00 121.46 2bo5 n LEU 46 Ca 0.02 0.17 0.09 0.00 -1.11 0.00 0.00 56.01 55.18 2bo5 n LEU 46 Cb 0.18 -0.08 0.17 0.00 0.53 0.00 0.00 43.42 44.22 2bo5 n LEU 46 CO 0.15 0.57 0.70 0.50 -1.11 0.00 0.00 177.39 178.21 2bo5 h LYS 47 N 0.01 0.00 -6.38 1.96 3.64 -1.28 -3.41 116.57 111.11 2bo5 h LYS 47 Ca -0.43 0.00 -0.59 0.00 -1.27 0.00 0.00 60.65 58.35 2bo5 h LYS 47 Cb 2.08 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 33.93 2bo5 h LYS 47 CO 0.04 0.20 0.99 0.39 -2.27 0.00 0.00 179.45 178.80 2bo5 n GLU 48 N -3.17 2.24 -0.04 1.90 1.02 -0.44 -4.88 120.64 117.27 2bo5 n GLU 48 Ca 0.03 0.82 -0.08 0.00 -0.02 0.00 0.00 57.16 57.90 2bo5 n GLU 48 Cb 0.59 -2.64 -0.02 0.00 -0.02 0.00 0.00 31.44 29.35 2bo5 n GLU 48 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2bo5 h PRO 49 N 7.96 -0.16 -0.04 3.49 0.11 -1.91 -0.14 132.00 141.31 2bo5 h PRO 49 Ca -0.47 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 2bo5 h PRO 49 Cb 1.26 0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.40 2bo5 h PRO 49 CO 0.93 -0.10 -0.02 0.87 -0.21 0.00 0.00 178.00 179.46 2bo5 h LYS 50 N -0.16 0.05 -0.25 1.05 1.57 -1.97 -1.95 116.57 114.90 2bo5 h LYS 50 Ca 0.12 -0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.72 2bo5 h LYS 50 Cb 0.35 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 2bo5 h LYS 50 CO -0.31 0.08 -0.54 0.52 -0.57 0.00 0.00 179.45 178.62 2bo5 h MET 51 N 0.05 0.76 -0.60 3.15 2.86 -1.40 -3.04 114.93 116.71 2bo5 h MET 51 Ca 0.01 -0.48 0.17 0.00 -2.06 0.00 0.00 59.70 57.35 2bo5 h MET 51 Cb 0.07 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.76 2bo5 h MET 51 CO 0.00 1.10 0.44 0.00 1.06 0.00 0.00 176.91 179.52 2bo5 h ALA 52 N 0.80 2.54 -0.15 6.32 0.00 -0.27 0.94 119.26 129.44 2bo5 h ALA 52 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2bo5 h ALA 52 Cb 1.13 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2bo5 h ALA 52 CO 0.11 -0.75 0.00 0.00 0.00 0.00 0.00 179.25 178.61 2bo5 n ALA 53 N -2.63 2.52 0.00 0.00 0.00 -1.15 -2.82 120.51 116.43 2bo5 n ALA 53 Ca 0.11 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.13 2bo5 n ALA 53 Cb 0.69 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 19.03 2bo5 n ALA 53 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2bo5 n SER 54 N 0.08 2.61 0.13 0.00 7.64 0.24 -4.25 113.62 120.08 2bo5 n SER 54 Ca 0.14 0.00 0.04 0.00 1.01 0.00 0.00 58.87 60.06 2bo5 n SER 54 Cb 0.25 0.07 0.03 0.00 -1.01 0.00 0.00 64.21 63.56 2bo5 n SER 54 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2bo5 h LEU 55 N 0.00 0.00 0.00 -3.43 3.38 0.37 -3.34 115.31 112.29 2bo5 h LEU 55 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2bo5 h LEU 55 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2bo5 h LEU 55 CO 0.00 0.38 -1.54 -0.11 0.09 0.00 0.00 178.44 177.27 2bo5 n LEU 56 N -3.11 0.02 -4.62 1.67 0.00 -1.13 -4.95 117.00 104.89 2bo5 n LEU 56 Ca 0.00 -0.02 -0.43 0.00 0.00 0.00 0.00 56.01 55.57 2bo5 n LEU 56 Cb 0.70 0.00 -0.02 0.00 0.00 0.00 0.00 43.42 44.10 2bo5 n LEU 56 CO 0.40 0.01 1.33 0.20 0.00 0.00 0.00 177.39 179.33 2bo5 s ASN 57 N -3.40 6.34 0.04 1.96 0.02 -1.25 -4.86 114.94 113.80 2bo5 s ASN 57 Ca -0.04 1.36 0.04 0.00 -1.02 0.00 0.00 52.86 53.20 2bo5 s ASN 57 Cb 0.08 -2.53 0.20 0.00 0.02 0.00 0.00 41.25 39.02 2bo5 s ASN 57 CO 0.52 -1.33 1.12 -2.65 0.02 0.00 0.00 177.10 174.78 2bo5 n PRO 58 N 7.80 0.02 -0.03 -0.60 -0.02 -1.26 -1.37 135.00 139.54 2bo5 n PRO 58 Ca 0.18 0.50 0.09 0.00 -2.02 0.00 0.00 63.50 62.26 2bo5 n PRO 58 Cb 0.46 -1.56 0.45 0.00 -0.02 0.00 0.00 33.50 32.83 2bo5 n PRO 58 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2bo5 n TYR 59 N -1.61 0.09 0.38 6.00 4.02 -1.26 -3.60 117.16 121.17 2bo5 n TYR 59 Ca 0.00 -0.04 0.06 0.00 -0.01 0.00 0.00 57.90 57.91 2bo5 n TYR 59 Cb 0.02 0.00 0.21 0.00 -0.02 0.00 0.00 39.34 39.55 2bo5 n TYR 59 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 176.86 177.18 2bo5 n VAL 60 N -0.35 0.91 -1.37 -0.72 0.24 -0.47 -5.04 118.33 111.53 2bo5 n VAL 60 Ca 0.14 -0.66 0.17 0.00 -2.04 0.00 0.00 64.34 61.94 2bo5 n VAL 60 Cb 0.16 0.10 -0.07 0.00 -1.47 0.00 0.00 33.84 32.56 2bo5 n VAL 60 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2bo5 n LYS 61 N 0.67 -2.90 -1.55 7.34 4.76 -1.24 -2.29 118.16 122.96 2bo5 n LYS 61 Ca 0.15 2.23 -0.33 0.00 -2.87 0.00 0.00 58.31 57.49 2bo5 n LYS 61 Cb 0.51 -3.50 0.06 0.00 -1.84 0.00 0.00 35.03 30.26 2bo5 n LYS 61 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 2bo5 n ARG 62 N -4.13 2.89 0.00 1.97 3.00 -1.26 -4.38 116.66 114.74 2bo5 n ARG 62 Ca -0.05 -3.51 0.00 0.00 -0.00 0.00 0.00 57.85 54.29 2bo5 n ARG 62 Cb 0.66 -2.28 0.00 0.00 0.00 0.00 0.00 32.46 30.83 2bo5 n ARG 62 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2bo5 n SER 63 N -0.83 0.00 -0.29 6.15 3.41 -1.26 -4.97 113.62 115.82 2bo5 n SER 63 Ca 0.58 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 59.15 2bo5 n SER 63 Cb 0.67 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.69 2bo5 n SER 63 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2bo5 h VAL 64 N 0.00 1.22 -0.86 -3.33 2.07 -1.79 -2.39 116.25 111.17 2bo5 h VAL 64 Ca 0.00 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 2bo5 h VAL 64 Cb 0.00 0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 29.81 2bo5 h VAL 64 CO 0.00 0.22 0.48 0.50 0.02 0.00 0.00 177.57 178.80 2bo5 h LYS 65 N 1.10 1.19 -0.95 1.57 3.11 -1.66 -2.47 116.57 118.47 2bo5 h LYS 65 Ca 0.29 -0.13 0.00 0.00 -2.81 0.00 0.00 60.65 58.00 2bo5 h LYS 65 Cb -0.07 -0.24 -0.05 0.00 -1.00 0.00 0.00 32.23 30.88 2bo5 h LYS 65 CO -0.06 0.87 0.60 0.28 -2.81 0.00 0.00 179.45 178.33 2bo5 h VAL 66 N 1.20 1.25 -0.16 2.00 2.07 -1.75 -1.67 116.25 119.19 2bo5 h VAL 66 Ca 0.30 -0.50 0.01 0.00 0.82 0.00 0.00 66.70 67.33 2bo5 h VAL 66 Cb 0.01 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 29.65 2bo5 h VAL 66 CO -0.05 0.25 0.11 0.50 0.02 0.00 0.00 177.57 178.40 2bo5 h LYS 67 N 1.30 0.18 -0.03 1.57 1.63 -1.07 -0.95 116.57 119.20 2bo5 h LYS 67 Ca 0.34 -0.01 -0.12 0.00 -0.85 0.00 0.00 60.65 60.02 2bo5 h LYS 67 Cb -0.10 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 31.47 2bo5 h LYS 67 CO -0.07 0.12 -0.53 1.03 -3.45 0.00 0.00 179.45 176.55 2bo5 h SER 68 N 0.18 0.08 0.34 4.20 0.87 -1.19 -2.91 113.55 115.12 2bo5 h SER 68 Ca 0.06 -0.04 -0.09 0.00 -1.23 0.00 0.00 61.79 60.49 2bo5 h SER 68 Cb 0.02 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2bo5 h SER 68 CO -0.01 0.59 -0.39 -0.07 -0.53 0.00 0.00 176.83 176.42 2bo5 h LEU 69 N 0.06 0.07 -0.63 2.23 3.38 -1.02 0.27 115.31 119.66 2bo5 h LEU 69 Ca -0.00 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 2bo5 h LEU 69 Cb 0.95 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 2bo5 h LEU 69 CO 0.07 0.45 -0.09 -1.28 0.09 0.00 0.00 178.44 177.69 2bo5 h SER 70 N 0.06 0.98 0.76 -0.43 0.87 -1.37 0.99 113.55 115.41 2bo5 h SER 70 Ca 0.00 -0.31 -0.25 0.00 -1.23 0.00 0.00 61.79 60.00 2bo5 h SER 70 Cb 0.71 -0.27 -0.04 0.00 -0.44 0.00 0.00 62.40 62.37 2bo5 h SER 70 CO 0.05 1.08 -1.34 -0.78 -0.53 0.00 0.00 176.83 175.32 2bo5 h ASP 71 N 0.89 0.00 1.17 6.23 1.82 -1.53 -3.28 116.42 121.72 2bo5 h ASP 71 Ca 0.14 -0.00 -0.12 0.00 -0.39 0.00 0.00 57.03 56.66 2bo5 h ASP 71 Cb 0.64 -0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.63 2bo5 h ASP 71 CO 0.04 1.00 -0.57 -0.03 -1.61 0.00 0.00 179.24 178.07 2bo5 h MET 72 N 0.00 0.00 -0.05 0.28 4.05 -0.34 -3.06 114.93 115.81 2bo5 h MET 72 Ca -0.14 0.00 -0.05 0.00 -0.28 0.00 0.00 59.70 59.23 2bo5 h MET 72 Cb 1.89 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.68 2bo5 h MET 72 CO 0.11 0.57 -0.19 0.00 0.23 0.00 0.00 176.91 177.63 2bo5 h THR 73 N 0.00 1.17 -0.75 -0.77 1.03 0.96 -1.21 112.91 113.34 2bo5 h THR 73 Ca -0.01 -0.77 0.22 0.00 -0.01 0.00 0.00 66.41 65.84 2bo5 h THR 73 Cb 1.31 1.34 -0.03 0.00 -1.07 0.00 0.00 68.15 69.70 2bo5 h THR 73 CO 0.07 0.23 0.64 0.00 -0.01 0.00 0.00 175.52 176.45 2bo5 h ALA 74 N 1.73 2.60 0.00 0.00 0.00 -1.62 0.43 119.26 122.40 2bo5 h ALA 74 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2bo5 h ALA 74 Cb 0.39 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2bo5 h ALA 74 CO 0.03 -1.03 -1.83 1.63 0.00 0.00 0.00 179.25 178.05 2bo5 n LYS 75 N -3.95 0.60 0.05 0.00 4.76 -0.52 -4.61 118.16 114.50 2bo5 n LYS 75 Ca 0.15 -0.17 -0.03 0.00 -2.87 0.00 0.00 58.31 55.39 2bo5 n LYS 75 Cb 0.91 -1.47 -0.02 0.00 -1.84 0.00 0.00 35.03 32.61 2bo5 n LYS 75 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 2bo5 h GLU 76 N 0.00 -0.20 0.00 1.97 4.57 0.44 -3.49 114.58 117.87 2bo5 h GLU 76 Ca 0.00 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 2bo5 h GLU 76 Cb 0.88 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.51 2bo5 h GLU 76 CO 0.00 -0.13 0.00 1.63 -1.18 0.00 0.00 179.01 179.33 2bo5 n LYS 77 N -4.09 0.00 -0.20 1.92 5.02 -0.23 -5.01 118.16 115.58 2bo5 n LYS 77 Ca -0.03 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.19 2bo5 n LYS 77 Cb 0.08 0.00 0.07 0.00 -0.02 0.00 0.00 35.03 35.16 2bo5 n LYS 77 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2bo5 n PHE 78 N 0.00 -1.81 0.00 2.13 3.72 -1.25 -4.80 117.46 115.45 2bo5 n PHE 78 Ca 0.00 -0.07 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 2bo5 n PHE 78 Cb 0.00 -0.58 0.00 0.00 -0.94 0.00 0.00 39.48 37.96 2bo5 n PHE 78 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2bo5 n SER 79 N -1.80 0.00 0.00 4.37 2.88 -1.26 -4.71 113.62 113.10 2bo5 n SER 79 Ca 0.03 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 2bo5 n SER 79 Cb 0.15 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.61 2bo5 n SER 79 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2bo5 n PRO 80 N 0.00 0.00 -0.64 -1.46 -0.04 -1.26 -3.95 135.00 127.64 2bo5 n PRO 80 Ca 0.00 0.01 0.09 0.00 -0.04 0.00 0.00 63.50 63.56 2bo5 n PRO 80 Cb 0.00 -0.44 0.36 0.00 -0.04 0.00 0.00 33.50 33.38 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 -2.34 4.81 0.00 1.53 4.77 -1.26 -3.78 117.00 120.73 2bo5 n LEU 81 Ca 0.00 -2.43 0.00 0.00 -0.03 0.00 0.00 56.01 53.55 2bo5 n LEU 81 Cb 0.00 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 40.50 2bo5 n LEU 81 CO 0.00 0.77 0.07 0.41 -1.33 0.00 0.00 177.39 177.31 2bo5 n THR 82 N 1.06 0.00 -0.15 -5.08 -1.04 -1.26 -4.59 114.28 103.22 2bo5 n THR 82 Ca 0.26 -0.17 -0.12 0.00 -2.04 0.00 0.00 64.05 61.97 2bo5 n THR 82 Cb 0.92 1.55 0.09 0.00 -1.82 0.00 0.00 70.33 71.07 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 -0.06 3.39 0.00 8.00 2.88 -1.25 -1.76 113.62 124.83 2bo5 n SER 83 Ca 0.00 -2.83 0.00 0.00 -1.33 0.00 0.00 58.87 54.71 2bo5 n SER 83 Cb 0.14 -0.67 0.00 0.00 -0.75 0.00 0.00 64.21 62.92 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 -0.34 0.00 0.29 -3.46 5.15 -1.26 -4.77 115.26 110.86 2bo5 n ASN 84 Ca 0.31 0.00 0.18 0.00 -0.60 0.00 0.00 54.58 54.47 2bo5 n ASN 84 Cb 1.10 0.07 0.76 0.00 -0.53 0.00 0.00 39.78 41.19 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 0.09 1.20 5.85 -1.81 -1.84 115.31 118.80 2bo5 h LEU 85 Ca 0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 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 0.01 -0.04 0.40 -0.34 0.00 0.00 178.44 178.47 2bo5 h ILE 86 N 0.00 1.15 -0.15 4.05 5.03 -1.65 -0.61 117.51 125.33 2bo5 h ILE 86 Ca -0.00 -0.97 -0.08 0.00 -0.12 0.00 0.00 64.86 63.69 2bo5 h ILE 86 Cb 0.44 1.76 -0.01 0.00 -3.03 0.00 0.00 36.82 35.98 2bo5 h ILE 86 CO 0.00 0.23 -0.26 0.78 -0.68 0.00 0.00 178.15 178.22 2bo5 h ASN 87 N -0.57 0.28 -0.33 1.72 2.35 -1.78 -2.50 115.58 114.74 2bo5 h ASN 87 Ca -0.01 -0.09 -0.13 0.00 -0.55 0.00 0.00 56.30 55.52 2bo5 h ASN 87 Cb 0.47 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 2bo5 h ASN 87 CO 0.02 0.55 -0.27 0.25 -1.65 0.00 0.00 177.43 176.33 2bo5 h LEU 88 N 0.25 0.87 -1.19 1.61 5.85 -1.30 -0.30 115.31 121.11 2bo5 h LEU 88 Ca 0.04 -0.34 -0.07 0.00 0.84 0.00 0.00 57.88 58.35 2bo5 h LEU 88 Cb 0.61 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 2bo5 h LEU 88 CO 0.04 1.09 -0.31 -0.07 -0.34 0.00 0.00 178.44 178.85 2bo5 h LEU 89 N 0.72 0.00 -3.23 2.25 3.38 -0.81 -2.71 115.31 114.92 2bo5 h LEU 89 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2bo5 h LEU 89 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2bo5 h LEU 89 CO 0.07 0.31 0.00 0.00 0.09 0.00 0.00 178.44 178.91 2bo5 n ALA 90 N -2.31 3.06 -0.01 1.53 0.00 -0.97 -2.19 120.51 119.62 2bo5 n ALA 90 Ca -0.01 -1.88 -0.02 0.00 0.00 0.00 0.00 53.44 51.54 2bo5 n ALA 90 Cb 0.43 -0.82 -0.01 0.00 0.00 0.00 0.00 19.45 19.06 2bo5 n ALA 90 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2bo5 n GLU 91 N 0.27 0.09 0.21 0.00 4.71 -0.15 -4.67 120.64 121.10 2bo5 n GLU 91 Ca 0.22 0.04 0.07 0.00 -0.01 0.00 0.00 57.16 57.47 2bo5 n GLU 91 Cb 0.88 -0.57 0.46 0.00 -1.01 0.00 0.00 31.44 31.20 2bo5 n GLU 91 CO 0.00 0.00 0.00 -0.91 0.09 0.00 0.00 177.13 176.31 2bo5 h ASN 92 N -0.17 0.00 0.00 1.62 2.35 -1.82 -3.47 115.58 114.10 2bo5 h ASN 92 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2bo5 h ASN 92 Cb 0.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.54 2bo5 h ASN 92 CO 0.00 0.29 0.00 0.61 -1.65 0.00 0.00 177.43 176.68 2bo5 n GLY 93 N -0.29 1.12 2.00 2.83 0.00 -1.26 -5.02 105.19 104.57 2bo5 n GLY 93 Ca -0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 2bo5 n GLY 93 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2bo5 n ARG 94 N -0.08 2.71 -1.14 1.61 3.00 -0.93 -4.38 116.66 117.44 2bo5 n ARG 94 Ca 0.00 -2.69 -0.20 0.00 -0.00 0.00 0.00 57.85 54.96 2bo5 n ARG 94 Cb 0.00 -2.08 0.19 0.00 0.00 0.00 0.00 32.46 30.57 2bo5 n ARG 94 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2bo5 n LEU 95 N -0.57 6.47 -0.05 6.15 4.77 -1.09 -3.48 117.00 129.20 2bo5 n LEU 95 Ca 0.46 -3.44 -0.06 0.00 -0.03 0.00 0.00 56.01 52.93 2bo5 n LEU 95 Cb 1.43 -0.81 -0.05 0.00 -2.33 0.00 0.00 43.42 41.66 2bo5 n LEU 95 CO 0.47 0.99 -0.82 0.35 -1.33 0.00 0.00 177.39 177.05 2bo5 n THR 96 N -0.92 0.57 -1.61 -5.08 -2.24 -1.26 -4.70 114.28 99.05 2bo5 n THR 96 Ca 0.54 -0.24 0.06 0.00 -2.27 0.00 0.00 64.05 62.15 2bo5 n THR 96 Cb 1.58 -0.85 0.15 0.00 -2.10 0.00 0.00 70.33 69.12 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 -2.71 1.68 -0.25 3.42 3.02 -1.26 -4.85 115.26 114.31 2bo5 n ASN 97 Ca -0.17 -3.33 0.05 0.00 -0.03 0.00 0.00 54.58 51.10 2bo5 n ASN 97 Cb 0.70 -0.45 0.17 0.00 -0.61 0.00 0.00 39.78 39.59 2bo5 n ASN 97 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bo5 h THR 98 N 1.89 0.45 -0.70 3.41 1.03 -1.84 0.13 112.91 117.29 2bo5 h THR 98 Ca -0.03 -0.07 0.20 0.00 -0.01 0.00 0.00 66.41 66.50 2bo5 h THR 98 Cb 1.14 0.24 -0.03 0.00 -1.07 0.00 0.00 68.15 68.43 2bo5 h THR 98 CO 0.01 0.04 0.58 1.55 -0.01 0.00 0.00 175.52 177.69 2bo5 h PRO 99 N 0.20 0.00 0.03 0.00 0.13 -1.88 0.41 132.00 130.88 2bo5 h PRO 99 Ca 0.41 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 65.33 2bo5 h PRO 99 Cb 0.72 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.83 2bo5 h PRO 99 CO -0.56 0.00 -0.97 0.00 -0.23 0.00 0.00 178.00 176.23 2bo5 h ALA 100 N 1.49 0.41 0.00 -0.56 0.00 -1.13 -2.92 119.26 116.54 2bo5 h ALA 100 Ca 0.33 -0.81 -0.14 0.00 0.00 0.00 0.00 54.91 54.30 2bo5 h ALA 100 Cb 1.50 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 2bo5 h ALA 100 CO -0.00 1.03 -0.64 0.28 0.00 0.00 0.00 179.25 179.91 2bo5 h VAL 101 N 0.06 1.25 -0.01 0.00 2.07 -0.09 -3.21 116.25 116.32 2bo5 h VAL 101 Ca -0.05 -2.39 -0.20 0.00 0.82 0.00 0.00 66.70 64.89 2bo5 h VAL 101 Cb 1.66 2.37 -0.01 0.00 -1.52 0.00 0.00 31.29 33.79 2bo5 h VAL 101 CO 0.14 0.63 -0.86 0.40 0.02 0.00 0.00 177.57 177.90 2bo5 h ILE 102 N 0.00 1.47 -0.77 4.57 2.04 -1.19 -3.25 117.51 120.37 2bo5 h ILE 102 Ca -0.01 -2.53 0.08 0.00 1.00 0.00 0.00 64.86 63.40 2bo5 h ILE 102 Cb 1.32 2.41 -0.07 0.00 -0.74 0.00 0.00 36.82 39.74 2bo5 h ILE 102 CO 0.08 0.74 0.44 0.28 0.00 0.00 0.00 178.15 179.69 2bo5 h SER 103 N 0.14 0.64 -0.47 1.72 0.02 -1.51 -0.83 113.55 113.26 2bo5 h SER 103 Ca -0.05 0.04 0.02 0.00 -0.84 0.00 0.00 61.79 60.96 2bo5 h SER 103 Cb 1.48 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.91 2bo5 h SER 103 CO 0.14 0.39 0.31 0.00 -1.14 0.00 0.00 176.83 176.52 2bo5 h ALA 104 N 1.41 1.74 -0.68 3.77 0.00 -1.65 -1.53 119.26 122.32 2bo5 h ALA 104 Ca 0.36 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.27 2bo5 h ALA 104 Cb 0.28 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 2bo5 h ALA 104 CO -0.22 0.22 0.45 0.35 0.00 0.00 0.00 179.25 180.05 2bo5 h PHE 105 N 0.57 0.80 -0.11 0.00 3.04 -1.24 0.84 116.94 120.83 2bo5 h PHE 105 Ca 0.18 0.02 -0.11 0.00 3.98 0.00 0.00 57.97 62.04 2bo5 h PHE 105 Cb 0.03 -0.27 -0.01 0.00 2.56 0.00 0.00 35.95 38.26 2bo5 h PHE 105 CO -0.00 0.48 -0.43 1.03 -2.02 0.00 0.00 178.31 177.36 2bo5 h SER 106 N 0.84 0.28 0.79 0.41 0.87 -1.21 0.51 113.55 116.04 2bo5 h SER 106 Ca 0.26 -0.12 -0.16 0.00 -1.23 0.00 0.00 61.79 60.54 2bo5 h SER 106 Cb 0.03 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 61.88 2bo5 h SER 106 CO -0.07 0.68 -1.31 0.74 -0.53 0.00 0.00 176.83 176.34 2bo5 h THR 107 N 0.22 0.54 0.00 2.23 2.02 -1.20 -3.30 112.91 113.41 2bo5 h THR 107 Ca 0.02 -2.02 -0.11 0.00 0.77 0.00 0.00 66.41 65.07 2bo5 h THR 107 Cb 0.86 2.07 -0.02 0.00 -1.74 0.00 0.00 68.15 69.32 2bo5 h THR 107 CO 0.07 0.31 -0.83 0.24 0.37 0.00 0.00 175.52 175.68 2bo5 h MET 108 N 0.00 0.00 0.00 6.66 2.07 0.80 -3.20 114.93 121.26 2bo5 h MET 108 Ca -0.14 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.49 2bo5 h MET 108 Cb 1.56 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 31.29 2bo5 h MET 108 CO 0.05 0.37 0.00 0.00 1.07 0.00 0.00 176.91 178.40 2bo5 n MET 109 N -3.07 0.12 0.06 1.72 3.85 0.18 -2.75 117.12 117.24 2bo5 n MET 109 Ca -0.02 0.21 0.09 0.00 -1.00 0.00 0.00 57.70 56.98 2bo5 n MET 109 Cb 0.75 -1.68 -0.06 0.00 -1.05 0.00 0.00 33.22 31.19 2bo5 n MET 109 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 2bo5 n SER 110 N -1.89 0.62 0.10 3.17 7.64 -1.21 -3.89 113.62 118.15 2bo5 n SER 110 Ca 0.05 0.25 0.13 0.00 1.01 0.00 0.00 58.87 60.30 2bo5 n SER 110 Cb 0.31 0.80 0.41 0.00 -1.01 0.00 0.00 64.21 64.72 2bo5 n SER 110 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 2bo5 n VAL 111 N -2.61 0.54 0.13 0.44 3.14 -1.11 -3.25 118.33 115.62 2bo5 n VAL 111 Ca -0.03 -0.26 0.01 0.00 -2.96 0.00 0.00 64.34 61.09 2bo5 n VAL 111 Cb 0.61 -0.56 0.09 0.00 -1.06 0.00 0.00 33.84 32.91 2bo5 n VAL 111 CO 0.00 0.00 0.00 1.12 -6.46 0.00 0.00 176.83 171.49 2bo5 h HIS 112 N 0.00 0.00 -0.11 1.45 -0.00 -1.67 -3.19 115.15 111.62 2bo5 h HIS 112 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 60.37 60.27 2bo5 h HIS 112 Cb 0.72 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.12 2bo5 h HIS 112 CO 0.00 0.59 -0.37 -0.09 -0.00 0.00 0.00 177.93 178.06 2bo5 h ARG 113 N 0.00 0.24 -0.94 5.12 2.43 -1.74 -2.79 114.38 116.70 2bo5 h ARG 113 Ca -0.01 -0.10 -0.33 0.00 -0.81 0.00 0.00 59.98 58.73 2bo5 h ARG 113 Cb 1.32 -0.01 -0.20 0.00 -0.42 0.00 0.00 29.97 30.66 2bo5 h ARG 113 CO 0.08 0.58 0.42 0.41 -1.51 0.00 0.00 179.97 179.95 2bo5 n GLY 114 N -0.27 3.73 3.11 2.80 0.00 -1.21 -4.68 105.19 108.67 2bo5 n GLY 114 Ca -0.01 -0.84 0.03 0.00 0.00 0.00 0.00 46.02 45.20 2bo5 n GLY 114 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2bo5 s GLU 115 N -2.57 0.48 0.00 1.61 -6.30 -1.05 -5.00 118.70 105.87 2bo5 s GLU 115 Ca 0.45 0.15 0.00 0.00 -2.50 0.00 0.00 54.97 53.07 2bo5 s GLU 115 Cb 0.37 0.13 0.00 0.00 0.00 0.00 0.00 34.13 34.63 2bo5 s GLU 115 CO 0.09 -0.79 0.00 1.55 0.02 0.00 0.00 175.26 176.13 2bo5 n VAL 116 N 4.82 0.00 -1.38 3.70 3.14 -1.26 -4.79 118.33 122.56 2bo5 n VAL 116 Ca 0.08 0.00 -0.29 0.00 -2.96 0.00 0.00 64.34 61.17 2bo5 n VAL 116 Cb 0.57 0.00 0.17 0.00 -1.06 0.00 0.00 33.84 33.52 2bo5 n VAL 116 CO 0.00 0.00 0.00 -2.84 -6.46 0.00 0.00 176.83 167.53 2bo5 s PRO 117 N 0.00 0.43 -0.22 1.45 0.02 -1.26 -5.02 135.00 130.40 2bo5 s PRO 117 Ca 0.00 0.22 0.08 0.00 0.02 0.00 0.00 61.00 61.32 2bo5 s PRO 117 Cb 0.00 -1.76 0.26 0.00 0.02 0.00 0.00 34.50 33.02 2bo5 s PRO 117 CO 0.00 -2.66 1.33 0.00 -0.33 0.00 0.00 177.00 175.34 2bo5 n THR 119 N -1.00 1.53 -1.75 0.00 -2.24 -1.26 -5.35 114.28 104.21 2bo5 n THR 119 Ca -0.21 -2.93 0.00 0.00 -2.27 0.00 0.00 64.05 58.65 2bo5 n THR 119 Cb 0.81 0.25 0.00 0.00 -2.10 0.00 0.00 70.33 69.28 2bo5 n THR 119 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83