#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bo5 n ALA 2 N 0.00 1.78 -1.46 1.98 0.00 -1.26 -4.64 120.51 116.91 2bo5 n ALA 2 Ca 0.00 -0.64 -0.24 0.00 0.00 0.00 0.00 53.44 52.56 2bo5 n ALA 2 Cb 0.00 0.20 0.12 0.00 0.00 0.00 0.00 19.45 19.77 2bo5 n ALA 2 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2bo5 n LYS 3 N -3.21 2.58 -1.32 0.00 4.01 -1.26 -5.07 118.16 113.90 2bo5 n LYS 3 Ca -0.28 -3.37 0.18 0.00 -0.51 0.00 0.00 58.31 54.32 2bo5 n LYS 3 Cb 0.76 -2.16 -0.04 0.00 -0.51 0.00 0.00 35.03 33.07 2bo5 n LYS 3 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 2bo5 n LEU 4 N -0.98 0.00 -2.70 -0.35 7.99 -1.26 -4.86 117.00 114.84 2bo5 n LEU 4 Ca 0.53 1.42 -0.07 0.00 -0.01 0.00 0.00 56.01 57.87 2bo5 n LEU 4 Cb 1.02 -3.98 0.11 0.00 -0.11 0.00 0.00 43.42 40.46 2bo5 n LEU 4 CO 0.56 -2.75 0.46 0.55 -1.51 0.00 0.00 177.39 174.69 2bo5 n VAL 5 N -4.06 0.05 -2.70 4.08 3.14 -1.26 -5.00 118.33 112.58 2bo5 n VAL 5 Ca 0.01 -1.60 -0.01 0.00 -2.96 0.00 0.00 64.34 59.78 2bo5 n VAL 5 Cb 0.60 1.01 0.00 0.00 -1.06 0.00 0.00 33.84 34.39 2bo5 n VAL 5 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2bo5 n ARG 6 N -0.50 -3.33 -0.18 1.45 3.00 -1.26 -4.91 116.66 110.93 2bo5 n ARG 6 Ca -0.02 2.69 -0.04 0.00 -0.01 0.00 0.00 57.85 60.48 2bo5 n ARG 6 Cb 0.84 -5.33 0.06 0.00 0.00 0.00 0.00 32.46 28.03 2bo5 n ARG 6 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 2bo5 h PRO 7 N 2.88 0.53 -6.52 5.56 0.11 -2.01 -3.43 132.00 129.12 2bo5 h PRO 7 Ca 0.00 -0.03 -0.60 0.00 0.11 0.00 0.00 66.00 65.48 2bo5 h PRO 7 Cb 0.10 -0.12 0.09 0.00 0.11 0.00 0.00 31.00 31.18 2bo5 h PRO 7 CO 0.11 0.35 0.40 -2.30 -0.21 0.00 0.00 178.00 176.35 2bo5 n PRO 8 N -4.86 1.67 -3.66 1.05 -0.02 -1.26 -5.00 135.00 122.93 2bo5 n PRO 8 Ca 0.05 0.59 -0.05 0.00 -2.02 0.00 0.00 63.50 62.07 2bo5 n PRO 8 Cb 0.14 -2.13 -0.07 0.00 -0.02 0.00 0.00 33.50 31.42 2bo5 n PRO 8 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2bo5 s VAL 9 N -0.47 -0.72 0.00 -1.45 -7.23 -1.26 -5.15 120.40 104.13 2bo5 s VAL 9 Ca 0.65 0.08 0.00 0.00 -1.81 0.00 0.00 61.98 60.90 2bo5 s VAL 9 Cb -0.70 -0.83 0.00 0.00 0.56 0.00 0.00 36.38 35.41 2bo5 s VAL 9 CO 0.54 0.03 0.00 0.00 -0.31 0.00 0.00 175.10 175.37 2bo5 n GLN 10 N 5.27 0.00 -1.72 4.82 6.02 -1.26 -4.93 117.38 125.58 2bo5 n GLN 10 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.87 2bo5 n GLN 10 Cb 0.50 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.76 2bo5 n GLN 10 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 2bo5 n ILE 11 N -0.01 -9.04 0.05 5.09 -0.00 -1.26 -5.05 119.36 109.14 2bo5 n ILE 11 Ca 0.00 2.64 0.00 0.00 -0.00 0.00 0.00 62.75 65.39 2bo5 n ILE 11 Cb 0.00 -4.22 0.00 0.00 -0.00 0.00 0.00 39.64 35.42 2bo5 n ILE 11 CO 0.00 0.00 0.00 -1.22 -0.00 0.00 0.00 176.55 175.33 2bo5 n TYR 12 N 1.09 -2.02 0.00 1.39 4.02 -1.26 -5.07 117.16 115.31 2bo5 n TYR 12 Ca 0.00 0.28 0.00 0.00 -0.01 0.00 0.00 57.90 58.17 2bo5 n TYR 12 Cb 0.00 1.01 0.00 0.00 -0.02 0.00 0.00 39.34 40.33 2bo5 n TYR 12 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2bo5 n GLY 13 N -0.23 -1.64 0.22 2.72 0.00 -1.26 -4.94 105.19 100.06 2bo5 n GLY 13 Ca 0.00 0.56 -0.02 0.00 0.00 0.00 0.00 46.02 46.56 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 0.85 -0.07 -0.61 6.09 -2.00 0.87 117.51 122.64 2bo5 h ILE 14 Ca 0.00 -0.15 -0.15 0.00 -1.37 0.00 0.00 64.86 63.19 2bo5 h ILE 14 Cb 0.00 0.36 -0.01 0.00 0.47 0.00 0.00 36.82 37.64 2bo5 h ILE 14 CO 0.00 0.08 -0.62 -0.33 -3.07 0.00 0.00 178.15 174.22 2bo5 h GLU 15 N 0.45 0.24 0.00 2.19 5.08 -1.97 -2.97 114.58 117.60 2bo5 h GLU 15 Ca 0.27 -0.17 -0.13 0.00 -1.00 0.00 0.00 59.36 58.34 2bo5 h GLU 15 Cb 0.28 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2bo5 h GLU 15 CO -0.24 0.78 -0.60 0.78 -1.00 0.00 0.00 179.01 178.73 2bo5 h GLY 16 N 1.48 0.00 2.00 -3.84 0.00 -1.56 -3.03 103.07 98.12 2bo5 h GLY 16 Ca -0.01 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.24 2bo5 h GLY 16 CO 0.10 0.00 -0.38 -0.09 0.00 0.00 0.00 176.54 176.17 2bo5 h ARG 17 N 0.00 0.00 -0.22 4.80 2.43 0.87 -2.94 114.38 119.33 2bo5 h ARG 17 Ca -0.01 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.22 2bo5 h ARG 17 Cb 1.20 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.70 2bo5 h ARG 17 CO 0.08 0.38 -0.11 1.88 -1.51 0.00 0.00 179.97 180.68 2bo5 h TYR 18 N 0.00 -0.26 -0.43 2.20 -1.99 -1.40 1.26 116.97 116.36 2bo5 h TYR 18 Ca -0.00 0.02 -0.11 0.00 2.00 0.00 0.00 58.73 60.64 2bo5 h TYR 18 Cb 0.87 0.15 -0.01 0.00 2.00 0.00 0.00 36.73 39.74 2bo5 h TYR 18 CO 0.00 -0.17 -0.16 0.00 -0.00 0.00 0.00 178.16 177.83 2bo5 h ALA 19 N 1.10 0.59 0.00 3.88 0.00 -1.69 -2.46 119.26 120.69 2bo5 h ALA 19 Ca 0.12 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2bo5 h ALA 19 Cb 0.27 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2bo5 h ALA 19 CO -0.28 0.53 -0.05 1.79 0.00 0.00 0.00 179.25 181.24 2bo5 h THR 20 N 0.69 0.15 -0.10 0.00 1.35 -1.21 1.16 112.91 114.95 2bo5 h THR 20 Ca 0.10 -0.63 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 2bo5 h THR 20 Cb 0.72 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 2bo5 h THR 20 CO 0.05 0.05 0.00 0.00 -0.25 0.00 0.00 175.52 175.38 2bo5 n ALA 21 N -2.13 2.52 0.00 6.62 0.00 0.43 -1.64 120.51 126.32 2bo5 n ALA 21 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.88 2bo5 n ALA 21 Cb 0.32 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.72 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 0.54 2.88 0.22 0.00 -0.00 -0.72 -4.59 117.00 115.32 2bo5 n LEU 22 Ca 0.17 0.00 0.13 0.00 -0.00 0.00 0.00 56.01 56.31 2bo5 n LEU 22 Cb 0.41 0.00 0.25 0.00 -0.00 0.00 0.00 43.42 44.08 2bo5 n LEU 22 CO 0.15 0.48 0.84 0.10 -0.00 0.00 0.00 177.39 178.96 2bo5 h TYR 23 N 0.00 0.00 -0.91 1.96 -0.00 0.12 -3.19 116.97 114.95 2bo5 h TYR 23 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 58.73 58.93 2bo5 h TYR 23 Cb 0.97 0.00 -0.11 0.00 0.00 0.00 0.00 36.73 37.59 2bo5 h TYR 23 CO 0.00 0.00 0.46 1.03 -0.00 0.00 0.00 178.16 179.65 2bo5 h SER 24 N 0.00 0.49 0.02 0.10 0.87 -1.45 2.10 113.55 115.69 2bo5 h SER 24 Ca 0.00 0.13 -0.18 0.00 -1.23 0.00 0.00 61.79 60.51 2bo5 h SER 24 Cb 0.92 0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 62.93 2bo5 h SER 24 CO 0.00 0.11 -0.62 0.00 -0.53 0.00 0.00 176.83 175.79 2bo5 h ALA 25 N 1.66 0.60 0.00 6.23 0.00 -1.83 -2.79 119.26 123.13 2bo5 h ALA 25 Ca 0.55 -0.55 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2bo5 h ALA 25 Cb 0.95 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2bo5 h ALA 25 CO -0.46 0.70 -0.29 0.00 0.00 0.00 0.00 179.25 179.21 2bo5 h ALA 26 N 0.88 1.43 -0.10 0.00 0.00 0.81 -2.93 119.26 119.35 2bo5 h ALA 26 Ca -0.01 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 2bo5 h ALA 26 Cb 1.19 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 2bo5 h ALA 26 CO 0.12 0.36 -0.00 0.66 0.00 0.00 0.00 179.25 180.38 2bo5 h SER 27 N 0.00 0.17 -0.74 0.00 4.64 0.32 1.12 113.55 119.06 2bo5 h SER 27 Ca -0.00 -0.32 0.18 0.00 -0.47 0.00 0.00 61.79 61.18 2bo5 h SER 27 Cb 0.54 -0.05 -0.04 0.00 -0.31 0.00 0.00 62.40 62.54 2bo5 h SER 27 CO 0.04 0.45 0.51 0.11 -0.87 0.00 0.00 176.83 177.06 2bo5 h LYS 28 N -0.12 0.21 0.14 4.77 1.57 -1.37 -1.22 116.57 120.56 2bo5 h LYS 28 Ca 0.03 -0.01 -0.33 0.00 -1.87 0.00 0.00 60.65 58.46 2bo5 h LYS 28 Cb 0.36 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 2bo5 h LYS 28 CO 0.01 0.14 -1.73 1.96 -0.57 0.00 0.00 179.45 179.25 2bo5 h GLN 29 N 0.22 0.29 -0.03 3.15 4.20 -1.41 -3.49 115.11 118.04 2bo5 h GLN 29 Ca 0.36 -0.49 0.00 0.00 0.06 0.00 0.00 58.65 58.58 2bo5 h GLN 29 Cb 1.09 0.18 0.00 0.00 0.30 0.00 0.00 27.48 29.06 2bo5 h GLN 29 CO -0.08 1.24 0.00 -1.71 -0.67 0.00 0.00 178.83 177.61 2bo5 n ASN 30 N -3.69 -0.15 -0.81 1.46 2.85 0.37 -4.99 115.26 110.29 2bo5 n ASN 30 Ca -0.28 0.00 0.06 0.00 -0.11 0.00 0.00 54.58 54.25 2bo5 n ASN 30 Cb 1.00 -0.06 0.18 0.00 1.24 0.00 0.00 39.78 42.14 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 -0.81 2.10 -0.31 1.20 4.76 -0.04 -4.35 118.16 120.71 2bo5 n LYS 31 Ca 0.00 -1.48 0.35 0.00 -2.87 0.00 0.00 58.31 54.31 2bo5 n LYS 31 Cb 0.06 -1.40 0.71 0.00 -1.84 0.00 0.00 35.03 32.56 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 2.32 0.00 -0.37 -0.35 -0.00 -1.93 2.15 115.31 117.13 2bo5 h LEU 32 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.88 57.69 2bo5 h LEU 32 Cb 0.65 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.29 2bo5 h LEU 32 CO 0.04 0.00 -0.81 -0.33 -0.00 0.00 0.00 178.44 177.34 2bo5 h GLU 33 N 0.00 0.21 0.00 1.13 4.39 -1.96 0.99 114.58 119.34 2bo5 h GLU 33 Ca 0.56 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 60.06 2bo5 h GLU 33 Cb 2.50 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 31.20 2bo5 h GLU 33 CO -0.01 0.91 -0.44 0.94 -1.16 0.00 0.00 179.01 179.26 2bo5 n GLN 34 N -3.71 0.05 -0.06 2.33 -0.06 0.69 -2.96 117.38 113.66 2bo5 n GLN 34 Ca -0.03 0.01 -0.06 0.00 -2.00 0.00 0.00 57.00 54.92 2bo5 n GLN 34 Cb 0.76 -1.53 -0.09 0.00 -4.06 0.00 0.00 30.24 25.32 2bo5 n GLN 34 CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 2bo5 n VAL 35 N -1.60 0.80 -0.03 1.69 0.31 0.12 -3.81 118.33 115.81 2bo5 n VAL 35 Ca 0.05 -0.48 -0.14 0.00 -0.01 0.00 0.00 64.34 63.76 2bo5 n VAL 35 Cb 0.35 -0.71 -0.10 0.00 -0.91 0.00 0.00 33.84 32.47 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 0.18 0.00 5.55 4.81 0.89 -0.30 114.58 125.72 2bo5 h GLU 36 Ca -0.32 -0.15 -0.06 0.00 -0.13 0.00 0.00 59.36 58.70 2bo5 h GLU 36 Cb 1.71 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 31.11 2bo5 h GLU 36 CO 0.01 0.80 -0.31 -0.22 -0.73 0.00 0.00 179.01 178.56 2bo5 h LYS 37 N -0.38 0.00 -0.42 1.92 3.64 -1.70 -0.06 116.57 119.57 2bo5 h LYS 37 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2bo5 h LYS 37 Cb 0.82 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.64 2bo5 h LYS 37 CO 0.04 0.31 0.00 0.39 -2.27 0.00 0.00 179.45 177.91 2bo5 n GLU 38 N -4.02 1.96 -0.05 1.90 4.71 -1.13 -3.55 120.64 120.45 2bo5 n GLU 38 Ca -0.02 -1.26 -0.06 0.00 -0.01 0.00 0.00 57.16 55.81 2bo5 n GLU 38 Cb 0.37 -1.37 -0.07 0.00 -1.01 0.00 0.00 31.44 29.36 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 0.45 1.22 0.18 -4.62 7.94 -0.08 -4.44 117.00 117.64 2bo5 n LEU 39 Ca 0.12 -0.03 0.04 0.00 -1.11 0.00 0.00 56.01 55.03 2bo5 n LEU 39 Cb 0.36 -0.03 0.32 0.00 0.53 0.00 0.00 43.42 44.59 2bo5 n LEU 39 CO 0.09 0.43 0.65 0.25 -1.11 0.00 0.00 177.39 177.70 2bo5 h LEU 40 N 0.00 0.00 -0.32 -1.96 5.85 -1.50 -3.00 115.31 114.38 2bo5 h LEU 40 Ca -0.27 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.43 2bo5 h LEU 40 Cb 1.53 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.54 2bo5 h LEU 40 CO -0.01 0.42 0.13 0.03 -0.34 0.00 0.00 178.44 178.67 2bo5 h ARG 41 N 0.00 0.48 0.00 1.25 -0.00 -1.78 0.41 114.38 114.73 2bo5 h ARG 41 Ca -0.00 -0.09 -0.03 0.00 -0.50 0.00 0.00 59.98 59.36 2bo5 h ARG 41 Cb 0.89 -0.08 -0.00 0.00 0.00 0.00 0.00 29.97 30.78 2bo5 h ARG 41 CO 0.06 0.48 -0.14 0.28 0.00 0.00 0.00 179.97 180.65 2bo5 h VAL 42 N 0.37 0.62 0.07 2.04 2.07 -1.75 0.10 116.25 119.77 2bo5 h VAL 42 Ca 0.11 -0.59 -0.29 0.00 0.82 0.00 0.00 66.70 66.74 2bo5 h VAL 42 Cb 0.19 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 2bo5 h VAL 42 CO -0.01 0.13 -1.54 1.23 0.02 0.00 0.00 177.57 177.41 2bo5 h GLY 43 N 0.91 0.17 2.00 2.17 0.00 -1.27 -3.27 103.07 103.79 2bo5 h GLY 43 Ca -0.00 -0.44 -0.13 0.00 0.00 0.00 0.00 47.33 46.76 2bo5 h GLY 43 CO 0.02 0.39 -0.60 1.46 0.00 0.00 0.00 176.54 177.81 2bo5 h GLN 44 N 0.04 0.00 0.00 4.80 7.50 0.23 -2.72 115.11 124.96 2bo5 h GLN 44 Ca -0.23 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.92 2bo5 h GLN 44 Cb 1.98 0.00 0.00 0.00 0.05 0.00 0.00 27.48 29.51 2bo5 h GLN 44 CO 0.13 0.60 0.00 -0.89 -1.50 0.00 0.00 178.83 177.17 2bo5 n ILE 45 N -3.47 0.15 -0.03 2.54 5.41 0.31 -2.65 119.36 121.61 2bo5 n ILE 45 Ca 0.00 0.04 0.03 0.00 1.00 0.00 0.00 62.75 63.82 2bo5 n ILE 45 Cb 0.68 -0.59 -0.14 0.00 -0.71 0.00 0.00 39.64 38.89 2bo5 n ILE 45 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2bo5 n LEU 46 N -1.38 0.00 0.14 1.39 7.99 -1.10 -4.12 117.00 119.92 2bo5 n LEU 46 Ca 0.10 0.00 0.02 0.00 -0.01 0.00 0.00 56.01 56.12 2bo5 n LEU 46 Cb 0.26 0.14 0.02 0.00 -0.11 0.00 0.00 43.42 43.73 2bo5 n LEU 46 CO 0.22 0.14 0.46 0.50 -1.51 0.00 0.00 177.39 177.20 2bo5 h LYS 47 N 0.00 0.00 -6.84 3.23 3.11 -1.37 -3.44 116.57 111.26 2bo5 h LYS 47 Ca -0.16 0.00 -0.48 0.00 -2.81 0.00 0.00 60.65 57.20 2bo5 h LYS 47 Cb 1.24 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 32.46 2bo5 h LYS 47 CO 0.01 0.53 0.38 -1.21 -2.81 0.00 0.00 179.45 176.35 2bo5 s GLU 48 N -2.96 4.64 0.25 1.90 0.41 -1.08 -4.97 118.70 116.89 2bo5 s GLU 48 Ca 0.04 1.48 0.13 0.00 -0.41 0.00 0.00 54.97 56.21 2bo5 s GLU 48 Cb 0.08 -2.99 0.12 0.00 -1.78 0.00 0.00 34.13 29.55 2bo5 s GLU 48 CO 0.75 0.30 1.46 -1.00 -0.49 0.00 0.00 175.26 176.28 2bo5 h PRO 49 N 3.53 0.00 0.00 0.39 0.13 -1.92 -1.96 132.00 132.16 2bo5 h PRO 49 Ca -0.46 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.56 2bo5 h PRO 49 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 2bo5 h PRO 49 CO 0.66 0.63 -0.51 -0.22 -0.23 0.00 0.00 178.00 178.33 2bo5 h LYS 50 N 0.00 0.00 -0.06 0.86 3.11 -1.95 -3.19 116.57 115.35 2bo5 h LYS 50 Ca -0.01 0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.82 2bo5 h LYS 50 Cb 1.39 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 32.61 2bo5 h LYS 50 CO 0.08 0.51 -0.19 0.00 -2.81 0.00 0.00 179.45 177.04 2bo5 n MET 51 N -3.57 1.59 -0.10 1.90 0.00 -1.22 -4.58 117.12 111.14 2bo5 n MET 51 Ca -0.00 -2.93 -0.18 0.00 0.00 0.00 0.00 57.70 54.59 2bo5 n MET 51 Cb 0.60 -1.61 -0.09 0.00 0.00 0.00 0.00 33.22 32.13 2bo5 n MET 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2bo5 n ALA 52 N -1.21 1.59 0.16 3.17 0.00 -0.74 -4.07 120.51 119.41 2bo5 n ALA 52 Ca 0.19 -0.85 0.01 0.00 0.00 0.00 0.00 53.44 52.80 2bo5 n ALA 52 Cb 0.72 0.12 0.26 0.00 0.00 0.00 0.00 19.45 20.55 2bo5 n ALA 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bo5 h ALA 53 N -0.33 1.05 0.00 0.00 0.00 -1.83 -2.66 119.26 115.49 2bo5 h ALA 53 Ca -0.49 -0.46 -0.14 0.00 0.00 0.00 0.00 54.91 53.82 2bo5 h ALA 53 Cb 1.60 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.29 2bo5 h ALA 53 CO -0.18 0.63 -0.68 0.77 0.00 0.00 0.00 179.25 179.79 2bo5 h SER 54 N 0.00 0.00 1.08 0.00 0.02 -1.81 0.24 113.55 113.08 2bo5 h SER 54 Ca -0.01 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.80 2bo5 h SER 54 Cb 0.96 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.48 2bo5 h SER 54 CO 0.07 0.68 -0.70 0.25 -1.14 0.00 0.00 176.83 175.98 2bo5 h LEU 55 N 0.00 0.00 -3.02 5.07 5.85 -1.66 -3.28 115.31 118.28 2bo5 h LEU 55 Ca -0.01 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 2bo5 h LEU 55 Cb 1.29 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 2bo5 h LEU 55 CO 0.09 0.70 -0.23 0.00 -0.34 0.00 0.00 178.44 178.66 2bo5 n LEU 56 N -3.40 2.64 -4.71 2.25 -0.00 -1.02 -5.02 117.00 107.74 2bo5 n LEU 56 Ca 0.00 -3.49 -0.42 0.00 -0.00 0.00 0.00 56.01 52.10 2bo5 n LEU 56 Cb 0.77 -0.49 -0.03 0.00 -0.00 0.00 0.00 43.42 43.67 2bo5 n LEU 56 CO 0.43 1.05 0.81 0.21 -0.00 0.00 0.00 177.39 179.89 2bo5 s ASN 57 N -3.00 7.20 0.50 1.45 2.47 0.82 -4.91 114.94 119.46 2bo5 s ASN 57 Ca 0.36 1.82 0.31 0.00 0.42 0.00 0.00 52.86 55.77 2bo5 s ASN 57 Cb 0.33 -2.57 1.69 0.00 -1.45 0.00 0.00 41.25 39.25 2bo5 s ASN 57 CO -0.02 -0.40 1.94 -0.65 -3.72 0.00 0.00 177.10 174.25 2bo5 h PRO 58 N 6.91 0.00 0.00 0.43 0.11 -1.94 -0.33 132.00 137.17 2bo5 h PRO 58 Ca -0.40 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.53 2bo5 h PRO 58 Cb 1.20 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.29 2bo5 h PRO 58 CO 0.80 0.00 -1.00 1.88 -0.21 0.00 0.00 178.00 179.47 2bo5 h TYR 59 N 0.00 0.00 -2.46 0.65 -1.99 -1.95 -3.37 116.97 107.85 2bo5 h TYR 59 Ca 0.00 0.00 -0.68 0.00 2.00 0.00 0.00 58.73 60.05 2bo5 h TYR 59 Cb 0.12 0.00 -0.37 0.00 2.00 0.00 0.00 36.73 38.48 2bo5 h TYR 59 CO 0.00 0.76 -0.06 1.55 -0.00 0.00 0.00 178.16 180.41 2bo5 n VAL 60 N -3.19 3.56 0.00 -2.88 3.14 -0.13 -4.95 118.33 113.88 2bo5 n VAL 60 Ca -0.03 -5.52 0.00 0.00 -2.96 0.00 0.00 64.34 55.83 2bo5 n VAL 60 Cb 0.87 -2.06 0.00 0.00 -1.06 0.00 0.00 33.84 31.59 2bo5 n VAL 60 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 2bo5 n LYS 61 N 0.96 -1.09 -0.07 1.45 4.81 -1.25 -4.03 118.16 118.94 2bo5 n LYS 61 Ca 0.29 0.00 -0.07 0.00 -0.87 0.00 0.00 58.31 57.66 2bo5 n LYS 61 Cb 0.38 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.42 2bo5 n LYS 61 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 2bo5 h ARG 62 N 0.00 0.09 0.36 1.64 2.43 -1.94 0.30 114.38 117.27 2bo5 h ARG 62 Ca 0.00 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 2bo5 h ARG 62 Cb 0.00 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 2bo5 h ARG 62 CO 0.00 0.06 -0.32 0.66 -1.51 0.00 0.00 179.97 178.86 2bo5 h SER 63 N 0.10 -0.86 -0.37 -3.80 4.64 -1.93 -0.01 113.55 111.31 2bo5 h SER 63 Ca 0.13 0.06 0.10 0.00 -0.47 0.00 0.00 61.79 61.61 2bo5 h SER 63 Cb 0.17 0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 62.52 2bo5 h SER 63 CO -0.21 -0.44 0.27 0.58 -0.87 0.00 0.00 176.83 176.15 2bo5 h VAL 64 N -0.67 0.85 -0.04 0.95 2.07 -1.83 0.83 116.25 118.41 2bo5 h VAL 64 Ca -0.05 -0.02 -0.10 0.00 0.82 0.00 0.00 66.70 67.35 2bo5 h VAL 64 Cb 0.57 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 2bo5 h VAL 64 CO -0.01 0.01 -0.42 0.50 0.02 0.00 0.00 177.57 177.66 2bo5 h LYS 65 N 0.07 0.08 -0.59 1.57 1.63 0.16 -2.85 116.57 116.64 2bo5 h LYS 65 Ca 0.18 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.91 2bo5 h LYS 65 Cb 0.62 -0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.22 2bo5 h LYS 65 CO -0.01 0.49 0.24 0.28 -3.45 0.00 0.00 179.45 177.00 2bo5 h VAL 66 N 0.07 1.21 0.25 2.00 2.07 0.11 -1.45 116.25 120.50 2bo5 h VAL 66 Ca 0.00 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 2bo5 h VAL 66 Cb 0.78 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 2bo5 h VAL 66 CO 0.06 0.26 -0.12 0.11 0.02 0.00 0.00 177.57 177.89 2bo5 h LYS 67 N 0.84 -0.32 -0.06 1.57 6.56 -1.48 -2.32 116.57 121.35 2bo5 h LYS 67 Ca 0.20 0.02 0.02 0.00 -1.06 0.00 0.00 60.65 59.83 2bo5 h LYS 67 Cb 0.15 0.07 -0.00 0.00 -0.57 0.00 0.00 32.23 31.88 2bo5 h LYS 67 CO -0.02 -0.06 0.05 1.03 -2.06 0.00 0.00 179.45 178.38 2bo5 h SER 68 N -0.56 0.00 -0.33 0.86 0.87 -1.49 -1.87 113.55 111.03 2bo5 h SER 68 Ca -0.03 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.47 2bo5 h SER 68 Cb 0.41 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.36 2bo5 h SER 68 CO 0.06 0.00 -0.01 -0.07 -0.53 0.00 0.00 176.83 176.27 2bo5 h LEU 69 N 0.00 0.57 -0.63 2.23 4.07 -0.98 -0.32 115.31 120.26 2bo5 h LEU 69 Ca 0.03 -0.32 0.01 0.00 0.08 0.00 0.00 57.88 57.68 2bo5 h LEU 69 Cb 0.12 -0.15 -0.03 0.00 1.08 0.00 0.00 40.66 41.68 2bo5 h LEU 69 CO -0.00 0.75 0.41 0.28 -1.08 0.00 0.00 178.44 178.81 2bo5 h SER 70 N 0.38 0.71 -0.03 -0.43 0.02 -0.80 0.60 113.55 113.99 2bo5 h SER 70 Ca 0.09 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 2bo5 h SER 70 Cb 0.47 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.84 2bo5 h SER 70 CO 0.02 0.51 0.00 -0.67 -1.14 0.00 0.00 176.83 175.55 2bo5 n ASP 71 N -4.66 0.62 -0.06 3.07 2.03 -1.05 -2.97 116.55 113.52 2bo5 n ASP 71 Ca 0.05 -1.36 -0.06 0.00 0.52 0.00 0.00 54.79 53.94 2bo5 n ASP 71 Cb 0.03 -0.02 -0.11 0.00 -0.72 0.00 0.00 41.12 40.30 2bo5 n ASP 71 CO 0.00 0.00 0.00 0.80 -1.92 0.00 0.00 177.20 176.08 2bo5 n MET 72 N -0.45 1.71 0.10 -0.67 1.56 -0.14 -4.12 117.12 115.11 2bo5 n MET 72 Ca 0.19 -0.01 -0.05 0.00 -0.27 0.00 0.00 57.70 57.55 2bo5 n MET 72 Cb 0.19 -1.35 0.08 0.00 2.15 0.00 0.00 33.22 34.29 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 1.47 -0.17 1.12 2.02 0.14 0.12 112.91 117.61 2bo5 h THR 73 Ca -0.35 -2.35 0.00 0.00 0.77 0.00 0.00 66.41 64.48 2bo5 h THR 73 Cb 1.78 2.26 0.00 0.00 -1.74 0.00 0.00 68.15 70.45 2bo5 h THR 73 CO 0.02 0.68 0.00 0.00 0.37 0.00 0.00 175.52 176.59 2bo5 n ALA 74 N -2.44 2.52 0.00 6.16 0.00 -1.16 -1.59 120.51 124.00 2bo5 n ALA 74 Ca -0.02 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.93 2bo5 n ALA 74 Cb 0.70 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 19.06 2bo5 n ALA 74 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2bo5 n LYS 75 N 0.23 0.00 0.15 0.00 4.76 -1.09 -4.84 118.16 117.37 2bo5 n LYS 75 Ca 0.15 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.49 2bo5 n LYS 75 Cb 0.30 -0.96 -0.06 0.00 -1.84 0.00 0.00 35.03 32.46 2bo5 n LYS 75 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2bo5 h GLU 76 N 0.00 -0.44 0.00 1.97 4.39 -0.93 -3.48 114.58 116.10 2bo5 h GLU 76 Ca 0.00 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.73 2bo5 h GLU 76 Cb 0.93 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.68 2bo5 h GLU 76 CO 0.00 -0.15 0.00 1.17 -1.16 0.00 0.00 179.01 178.87 2bo5 n LYS 77 N -5.09 0.00 -0.31 2.33 3.00 -1.22 -5.09 118.16 111.78 2bo5 n LYS 77 Ca -0.08 0.00 -0.09 0.00 -0.00 0.00 0.00 58.31 58.14 2bo5 n LYS 77 Cb 0.25 0.00 0.09 0.00 0.00 0.00 0.00 35.03 35.37 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 -1.87 0.00 5.64 3.72 -0.62 -4.74 117.46 119.58 2bo5 n PHE 78 Ca 0.00 -0.01 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 2bo5 n PHE 78 Cb 0.00 -0.82 0.00 0.00 -0.94 0.00 0.00 39.48 37.72 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 -1.22 0.00 0.00 4.37 2.88 -1.24 -4.28 113.62 114.14 2bo5 n SER 79 Ca 0.04 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.58 2bo5 n SER 79 Cb 0.17 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 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 -0.13 -1.46 -0.04 -1.26 -3.96 135.00 128.15 2bo5 n PRO 80 Ca 0.00 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.57 2bo5 n PRO 80 Cb 0.00 -0.48 0.27 0.00 -0.04 0.00 0.00 33.50 33.24 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 -2.48 2.73 0.00 1.53 7.99 -1.26 -3.78 117.00 121.73 2bo5 n LEU 81 Ca 0.00 -1.14 0.00 0.00 -0.01 0.00 0.00 56.01 54.86 2bo5 n LEU 81 Cb 0.00 -0.17 0.00 0.00 -0.11 0.00 0.00 43.42 43.14 2bo5 n LEU 81 CO 0.00 0.57 0.17 0.41 -1.51 0.00 0.00 177.39 177.03 2bo5 n THR 82 N 1.03 0.00 -0.17 -5.08 -1.04 -1.26 -4.47 114.28 103.29 2bo5 n THR 82 Ca 0.18 -0.44 -0.12 0.00 -2.04 0.00 0.00 64.05 61.62 2bo5 n THR 82 Cb 0.50 1.09 0.09 0.00 -1.82 0.00 0.00 70.33 70.19 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 -0.20 3.50 0.00 8.00 2.88 -1.25 -1.94 113.62 124.61 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 0.02 -0.69 0.00 0.00 -0.75 0.00 0.00 64.21 62.80 2bo5 n SER 83 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2bo5 n ASN 84 N -0.32 0.00 0.29 -3.46 5.03 -1.26 -4.76 115.26 110.77 2bo5 n ASN 84 Ca 0.31 0.00 0.18 0.00 0.87 0.00 0.00 54.58 55.94 2bo5 n ASN 84 Cb 1.08 0.06 0.81 0.00 -1.02 0.00 0.00 39.78 40.72 2bo5 n ASN 84 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.26 175.68 2bo5 h LEU 85 N 0.00 0.00 0.22 3.41 5.85 -1.78 -0.97 115.31 122.04 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 -0.10 0.40 -0.34 0.00 0.00 178.44 178.42 2bo5 h ILE 86 N 0.00 0.81 0.00 4.05 5.03 -1.69 0.14 117.51 125.85 2bo5 h ILE 86 Ca -0.00 -0.88 -0.06 0.00 -0.12 0.00 0.00 64.86 63.80 2bo5 h ILE 86 Cb 0.38 1.26 -0.01 0.00 -3.03 0.00 0.00 36.82 35.43 2bo5 h ILE 86 CO 0.00 0.17 -0.31 0.78 -0.68 0.00 0.00 178.15 178.12 2bo5 h ASN 87 N -0.78 0.00 0.49 1.72 2.35 -1.79 -2.61 115.58 114.95 2bo5 h ASN 87 Ca -0.03 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.48 2bo5 h ASN 87 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 2bo5 h ASN 87 CO 0.05 0.31 -1.04 0.25 -1.65 0.00 0.00 177.43 175.35 2bo5 h LEU 88 N 0.00 0.45 -1.02 1.61 5.85 -1.16 -1.50 115.31 119.53 2bo5 h LEU 88 Ca -0.00 -0.40 -0.10 0.00 0.84 0.00 0.00 57.88 58.22 2bo5 h LEU 88 Cb 0.69 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 2bo5 h LEU 88 CO 0.04 1.24 -0.45 -0.07 -0.34 0.00 0.00 178.44 178.85 2bo5 h LEU 89 N 0.15 0.00 -3.34 2.25 3.38 -0.47 -2.90 115.31 114.38 2bo5 h LEU 89 Ca -0.09 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 2bo5 h LEU 89 Cb 1.71 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.40 2bo5 h LEU 89 CO 0.17 0.45 0.01 0.00 0.09 0.00 0.00 178.44 179.17 2bo5 n ALA 90 N -2.40 3.59 -0.09 1.53 0.00 -1.01 -3.42 120.51 118.72 2bo5 n ALA 90 Ca -0.01 -2.60 -0.12 0.00 0.00 0.00 0.00 53.44 50.70 2bo5 n ALA 90 Cb 0.50 -0.78 -0.04 0.00 0.00 0.00 0.00 19.45 19.13 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 -0.72 0.53 0.16 0.00 1.02 -0.57 -4.54 120.64 116.52 2bo5 n GLU 91 Ca 0.28 0.29 0.01 0.00 -0.02 0.00 0.00 57.16 57.72 2bo5 n GLU 91 Cb 0.99 -1.50 0.25 0.00 -0.02 0.00 0.00 31.44 31.16 2bo5 n GLU 91 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2bo5 h ASN 92 N -1.00 0.00 0.00 1.62 2.35 -1.82 -3.47 115.58 113.26 2bo5 h ASN 92 Ca -0.12 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.63 2bo5 h ASN 92 Cb 1.02 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.39 2bo5 h ASN 92 CO -0.07 0.51 0.00 0.61 -1.65 0.00 0.00 177.43 176.83 2bo5 n GLY 93 N 0.12 1.82 2.55 2.83 0.00 -1.26 -5.03 105.19 106.22 2bo5 n GLY 93 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.74 2.91 -1.11 1.61 0.63 -1.23 -4.65 116.66 114.08 2bo5 n ARG 94 Ca 0.00 -3.63 -0.22 0.00 -0.92 0.00 0.00 57.85 53.07 2bo5 n ARG 94 Cb 0.00 -2.28 0.15 0.00 0.45 0.00 0.00 32.46 30.79 2bo5 n ARG 94 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 2bo5 n LEU 95 N -0.69 6.45 -0.03 6.15 7.94 -1.22 -3.54 117.00 132.06 2bo5 n LEU 95 Ca 0.54 -3.45 -0.04 0.00 -1.11 0.00 0.00 56.01 51.96 2bo5 n LEU 95 Cb 0.53 -0.82 -0.03 0.00 0.53 0.00 0.00 43.42 43.63 2bo5 n LEU 95 CO 0.58 1.03 -0.67 0.35 -1.11 0.00 0.00 177.39 177.57 2bo5 n THR 96 N -0.95 0.31 -1.08 1.96 -2.24 -1.26 -4.70 114.28 106.33 2bo5 n THR 96 Ca 0.54 -0.12 0.08 0.00 -2.27 0.00 0.00 64.05 62.28 2bo5 n THR 96 Cb 1.47 -0.71 0.21 0.00 -2.10 0.00 0.00 70.33 69.20 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 -2.62 3.13 -0.26 3.42 3.02 -1.26 -4.77 115.26 115.93 2bo5 n ASN 97 Ca -0.09 -3.13 0.06 0.00 -0.03 0.00 0.00 54.58 51.39 2bo5 n ASN 97 Cb 0.60 -0.51 0.20 0.00 -0.61 0.00 0.00 39.78 39.46 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 1.04 0.55 -1.08 3.41 1.03 -1.84 -0.77 112.91 115.26 2bo5 h THR 98 Ca 0.02 -0.11 0.31 0.00 -0.01 0.00 0.00 66.41 66.62 2bo5 h THR 98 Cb 1.28 0.19 -0.04 0.00 -1.07 0.00 0.00 68.15 68.51 2bo5 h THR 98 CO 0.15 0.06 0.99 1.55 -0.01 0.00 0.00 175.52 178.26 2bo5 h PRO 99 N 0.33 0.00 -0.23 0.00 0.13 -1.86 0.77 132.00 131.15 2bo5 h PRO 99 Ca 0.43 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.46 2bo5 h PRO 99 Cb 0.72 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 2bo5 h PRO 99 CO -0.48 0.00 -0.30 0.00 -0.23 0.00 0.00 178.00 176.99 2bo5 h ALA 100 N 1.02 1.07 0.00 -0.56 0.00 -1.49 -2.66 119.26 116.64 2bo5 h ALA 100 Ca 0.51 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2bo5 h ALA 100 Cb 2.49 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 20.17 2bo5 h ALA 100 CO -0.01 0.57 -0.16 -0.24 0.00 0.00 0.00 179.25 179.42 2bo5 h VAL 101 N 0.40 0.54 -0.22 0.00 3.04 0.43 -2.72 116.25 117.72 2bo5 h VAL 101 Ca 0.05 -0.74 -0.13 0.00 -1.01 0.00 0.00 66.70 64.86 2bo5 h VAL 101 Cb 0.72 1.50 -0.01 0.00 -2.01 0.00 0.00 31.29 31.49 2bo5 h VAL 101 CO 0.06 0.15 -0.43 0.40 -1.01 0.00 0.00 177.57 176.74 2bo5 h ILE 102 N 0.00 1.31 -0.69 3.17 2.04 -1.48 -3.11 117.51 118.75 2bo5 h ILE 102 Ca -0.00 -1.60 0.04 0.00 1.00 0.00 0.00 64.86 64.29 2bo5 h ILE 102 Cb 0.48 1.60 -0.05 0.00 -0.74 0.00 0.00 36.82 38.12 2bo5 h ILE 102 CO 0.02 0.50 0.41 -1.28 0.00 0.00 0.00 178.15 177.81 2bo5 h SER 103 N 0.43 0.66 -0.17 1.72 0.87 -1.52 -1.18 113.55 114.37 2bo5 h SER 103 Ca 0.03 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.60 2bo5 h SER 103 Cb 0.93 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.75 2bo5 h SER 103 CO 0.08 0.45 0.10 0.00 -0.53 0.00 0.00 176.83 176.93 2bo5 h ALA 104 N 1.31 1.80 -0.08 6.23 0.00 -1.62 -1.25 119.26 125.66 2bo5 h ALA 104 Ca 0.29 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 2bo5 h ALA 104 Cb 0.08 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2bo5 h ALA 104 CO -0.13 0.17 -0.02 0.35 0.00 0.00 0.00 179.25 179.61 2bo5 h PHE 105 N 0.27 0.10 0.00 0.00 3.04 -1.20 0.98 116.94 120.13 2bo5 h PHE 105 Ca 0.07 -0.00 -0.02 0.00 3.98 0.00 0.00 57.97 62.00 2bo5 h PHE 105 Cb 0.03 -0.03 -0.00 0.00 2.56 0.00 0.00 35.95 38.50 2bo5 h PHE 105 CO 0.00 0.13 -0.27 1.03 -2.02 0.00 0.00 178.31 177.18 2bo5 h SER 106 N 0.11 0.00 0.08 0.41 0.87 -1.15 -1.31 113.55 112.55 2bo5 h SER 106 Ca 0.03 0.00 -0.29 0.00 -1.23 0.00 0.00 61.79 60.30 2bo5 h SER 106 Cb 0.11 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.02 2bo5 h SER 106 CO 0.00 0.09 -2.21 0.41 -0.53 0.00 0.00 176.83 174.60 2bo5 n THR 107 N -3.05 1.16 0.12 2.23 -1.04 -0.60 -4.15 114.28 108.96 2bo5 n THR 107 Ca 0.03 -0.78 0.05 0.00 -2.04 0.00 0.00 64.05 61.30 2bo5 n THR 107 Cb 0.57 -0.44 0.02 0.00 -1.82 0.00 0.00 70.33 68.66 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 -0.47 -2.82 2.07 0.87 -3.25 114.93 111.33 2bo5 h MET 108 Ca -0.41 0.00 -0.06 0.00 -2.07 0.00 0.00 59.70 57.16 2bo5 h MET 108 Cb 1.98 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 31.69 2bo5 h MET 108 CO 0.03 0.29 0.06 0.00 1.07 0.00 0.00 176.91 178.37 2bo5 h MET 109 N 0.00 0.73 -0.11 1.72 3.00 -1.40 -1.42 114.93 117.46 2bo5 h MET 109 Ca -0.04 -0.16 0.03 0.00 0.00 0.00 0.00 59.70 59.53 2bo5 h MET 109 Cb 1.31 -0.10 -0.00 0.00 0.00 0.00 0.00 31.60 32.80 2bo5 h MET 109 CO 0.04 0.70 0.21 0.77 0.00 0.00 0.00 176.91 178.63 2bo5 h SER 110 N 0.70 0.00 0.05 -0.10 0.02 -1.71 0.62 113.55 113.13 2bo5 h SER 110 Ca 0.15 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.88 2bo5 h SER 110 Cb 0.34 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.90 2bo5 h SER 110 CO 0.01 0.00 -0.90 0.58 -1.14 0.00 0.00 176.83 175.37 2bo5 h VAL 111 N 0.00 1.37 -0.01 2.27 2.07 -1.43 -1.41 116.25 119.11 2bo5 h VAL 111 Ca 0.05 -2.28 -0.17 0.00 0.82 0.00 0.00 66.70 65.12 2bo5 h VAL 111 Cb 0.47 2.67 -0.02 0.00 -1.52 0.00 0.00 31.29 32.89 2bo5 h VAL 111 CO -0.00 0.68 -0.76 1.12 0.02 0.00 0.00 177.57 178.63 2bo5 h HIS 112 N 0.07 0.13 0.00 1.57 -0.00 -1.12 -2.19 115.15 113.61 2bo5 h HIS 112 Ca -0.13 -0.07 -0.18 0.00 -0.00 0.00 0.00 60.37 59.99 2bo5 h HIS 112 Cb 1.61 -0.02 -0.03 0.00 -0.00 0.00 0.00 27.41 28.98 2bo5 h HIS 112 CO 0.14 0.82 -0.87 -0.09 -0.00 0.00 0.00 177.93 177.93 2bo5 h ARG 113 N 0.06 0.00 0.00 5.12 9.65 -1.02 -3.22 114.38 124.96 2bo5 h ARG 113 Ca -0.02 0.00 -0.18 0.00 -1.10 0.00 0.00 59.98 58.68 2bo5 h ARG 113 Cb 1.34 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.90 2bo5 h ARG 113 CO 0.11 0.87 -0.90 0.78 2.80 0.00 0.00 179.97 183.63 2bo5 h GLY 114 N 2.71 0.00 -3.94 2.80 0.00 -1.20 -3.27 103.07 100.17 2bo5 h GLY 114 Ca -0.01 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.78 2bo5 h GLY 114 CO 0.11 0.00 0.69 1.18 0.00 0.00 0.00 176.54 178.53 2bo5 n GLU 115 N -3.29 2.32 -2.40 4.80 4.71 -0.83 -4.99 120.64 120.97 2bo5 n GLU 115 Ca -0.00 -2.98 -0.34 0.00 -0.01 0.00 0.00 57.16 53.83 2bo5 n GLU 115 Cb 0.88 -2.17 -0.02 0.00 -1.01 0.00 0.00 31.44 29.13 2bo5 n GLU 115 CO 0.00 0.00 0.00 0.14 0.09 0.00 0.00 177.13 177.36 2bo5 s VAL 116 N -3.58 3.66 -0.86 2.62 -7.23 -1.22 -4.93 120.40 108.85 2bo5 s VAL 116 Ca 0.57 0.99 -0.25 0.00 -1.81 0.00 0.00 61.98 61.48 2bo5 s VAL 116 Cb 0.47 -3.40 -0.04 0.00 0.56 0.00 0.00 36.38 33.97 2bo5 s VAL 116 CO 0.07 -0.27 1.93 -2.16 -0.31 0.00 0.00 175.10 174.37 2bo5 s PRO 117 N -3.39 2.58 -0.30 4.82 0.04 -1.26 -4.95 135.00 132.55 2bo5 s PRO 117 Ca 0.68 -0.18 -0.16 0.00 0.04 0.00 0.00 61.00 61.38 2bo5 s PRO 117 Cb -0.18 -4.97 -0.02 0.00 0.04 0.00 0.00 34.50 29.36 2bo5 s PRO 117 CO 0.24 -3.27 0.41 0.00 0.04 0.00 0.00 177.00 174.42 2bo5 n THR 119 N 5.21 0.00 -1.01 0.00 5.66 -1.26 -5.28 114.28 117.61 2bo5 n THR 119 Ca -0.08 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.92 2bo5 n THR 119 Cb 0.50 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.28 2bo5 n THR 119 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 175.07 173.35