#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 -2.22 -1.69 1.98 0.00 -1.26 -4.99 121.76 113.59 2bo5 s ALA 2 Ca 0.00 0.62 -0.01 0.00 0.00 0.00 0.00 51.96 52.57 2bo5 s ALA 2 Cb 0.00 0.40 0.00 0.00 0.00 0.00 0.00 23.12 23.53 2bo5 s ALA 2 CO 0.00 -1.06 0.18 1.63 0.00 0.00 0.00 175.76 176.51 2bo5 n LYS 3 N -0.51 -2.58 -2.26 0.00 5.02 -1.26 -4.31 118.16 112.26 2bo5 n LYS 3 Ca -0.08 0.97 0.00 0.00 -2.02 0.00 0.00 58.31 57.18 2bo5 n LYS 3 Cb 0.63 -5.66 0.00 0.00 -0.02 0.00 0.00 35.03 29.97 2bo5 n LYS 3 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2bo5 n LEU 4 N -3.24 -6.42 0.06 -0.35 4.77 -1.26 -5.05 117.00 105.51 2bo5 n LEU 4 Ca -0.21 2.87 0.00 0.00 -0.03 0.00 0.00 56.01 58.64 2bo5 n LEU 4 Cb 0.67 -3.18 0.00 0.00 -2.33 0.00 0.00 43.42 38.58 2bo5 n LEU 4 CO 0.34 -2.62 -0.08 0.52 -1.33 0.00 0.00 177.39 174.22 2bo5 n VAL 5 N 1.80 0.64 -1.44 4.08 0.31 -1.26 -5.16 118.33 117.30 2bo5 n VAL 5 Ca 0.00 0.21 0.00 0.00 -0.01 0.00 0.00 64.34 64.54 2bo5 n VAL 5 Cb 0.00 -1.21 0.00 0.00 -0.91 0.00 0.00 33.84 31.72 2bo5 n VAL 5 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2bo5 n ARG 6 N -3.35 -3.79 -1.71 5.55 5.12 -1.26 -4.90 116.66 112.33 2bo5 n ARG 6 Ca 0.00 2.93 -0.33 0.00 -1.93 0.00 0.00 57.85 58.53 2bo5 n ARG 6 Cb 0.08 -3.65 0.05 0.00 -1.16 0.00 0.00 32.46 27.78 2bo5 n ARG 6 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2bo5 s PRO 7 N -5.23 2.79 0.04 5.56 0.04 -1.26 -4.99 135.00 131.96 2bo5 s PRO 7 Ca 0.00 1.30 -0.20 0.00 0.04 0.00 0.00 61.00 62.14 2bo5 s PRO 7 Cb 0.00 -1.96 -0.14 0.00 0.04 0.00 0.00 34.50 32.44 2bo5 s PRO 7 CO 0.00 -1.24 1.34 -1.00 0.04 0.00 0.00 177.00 176.14 2bo5 h PRO 8 N -0.15 0.39 -6.51 0.56 0.13 -2.07 -3.43 132.00 120.92 2bo5 h PRO 8 Ca -0.46 -0.21 -0.53 0.00 -0.87 0.00 0.00 66.00 63.93 2bo5 h PRO 8 Cb 1.24 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 2bo5 h PRO 8 CO 0.54 0.78 0.46 0.14 -0.23 0.00 0.00 178.00 179.68 2bo5 s VAL 9 N -4.27 4.32 -0.30 1.56 -7.23 -1.26 -5.00 120.40 108.22 2bo5 s VAL 9 Ca -0.14 1.76 -0.18 0.00 -1.81 0.00 0.00 61.98 61.61 2bo5 s VAL 9 Cb 0.05 -4.13 0.19 0.00 0.56 0.00 0.00 36.38 33.05 2bo5 s VAL 9 CO 0.76 0.19 1.24 0.00 -0.31 0.00 0.00 175.10 176.98 2bo5 s GLN 10 N 0.60 0.06 0.36 4.82 -2.07 -1.26 -5.05 119.66 117.11 2bo5 s GLN 10 Ca 0.53 0.15 0.00 0.00 -1.82 0.00 0.00 55.36 54.22 2bo5 s GLN 10 Cb -0.26 0.09 0.00 0.00 -1.09 0.00 0.00 33.01 31.75 2bo5 s GLN 10 CO 0.30 -0.03 0.00 1.51 -1.32 0.00 0.00 175.29 175.75 2bo5 n ILE 11 N 4.79 -3.59 0.04 3.63 0.13 -1.26 -5.06 119.36 118.04 2bo5 n ILE 11 Ca -0.07 1.65 0.00 0.00 -1.10 0.00 0.00 62.75 63.23 2bo5 n ILE 11 Cb 0.55 -2.27 0.00 0.00 -0.84 0.00 0.00 39.64 37.08 2bo5 n ILE 11 CO 0.00 0.00 0.00 -1.22 2.80 0.00 0.00 176.55 178.13 2bo5 n TYR 12 N -0.86 -1.96 0.00 9.51 4.02 -1.26 -5.06 117.16 121.55 2bo5 n TYR 12 Ca 0.00 0.25 0.00 0.00 -0.01 0.00 0.00 57.90 58.14 2bo5 n TYR 12 Cb 0.00 0.96 0.00 0.00 -0.02 0.00 0.00 39.34 40.28 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 -1.58 0.26 2.72 0.00 -1.26 -4.93 105.19 100.17 2bo5 n GLY 13 Ca 0.00 0.56 0.03 0.00 0.00 0.00 0.00 46.02 46.61 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 0.68 -0.00 -0.61 6.09 -2.01 0.91 117.51 122.58 2bo5 h ILE 14 Ca 0.00 -0.14 -0.14 0.00 -1.37 0.00 0.00 64.86 63.22 2bo5 h ILE 14 Cb 0.00 0.26 -0.02 0.00 0.47 0.00 0.00 36.82 37.53 2bo5 h ILE 14 CO 0.00 0.07 -0.65 -0.33 -3.07 0.00 0.00 178.15 174.17 2bo5 h GLU 15 N 0.39 0.02 0.00 2.19 5.08 -1.99 -2.78 114.58 117.49 2bo5 h GLU 15 Ca 0.36 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.59 2bo5 h GLU 15 Cb 0.52 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 2bo5 h GLU 15 CO -0.38 0.66 -0.56 0.78 -1.00 0.00 0.00 179.01 178.51 2bo5 h GLY 16 N 1.91 0.00 1.87 -3.84 0.00 -1.27 -3.22 103.07 98.52 2bo5 h GLY 16 Ca -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.13 2bo5 h GLY 16 CO 0.09 0.00 -0.86 -0.09 0.00 0.00 0.00 176.54 175.67 2bo5 h ARG 17 N 0.00 0.12 -1.07 4.80 1.12 0.86 -3.20 114.38 117.01 2bo5 h ARG 17 Ca -0.01 -0.13 0.29 0.00 -1.11 0.00 0.00 59.98 59.02 2bo5 h ARG 17 Cb 1.33 0.04 -0.11 0.00 -0.01 0.00 0.00 29.97 31.22 2bo5 h ARG 17 CO 0.07 0.90 0.67 1.88 -3.11 0.00 0.00 179.97 180.39 2bo5 h TYR 18 N 0.06 0.74 -0.00 2.20 -1.99 -1.50 1.69 116.97 118.17 2bo5 h TYR 18 Ca -0.03 0.03 -0.16 0.00 2.00 0.00 0.00 58.73 60.56 2bo5 h TYR 18 Cb 1.49 -0.21 0.01 0.00 2.00 0.00 0.00 36.73 40.03 2bo5 h TYR 18 CO 0.02 -0.01 -0.64 0.00 -0.00 0.00 0.00 178.16 177.53 2bo5 h ALA 19 N 1.67 0.08 0.00 3.88 0.00 -1.72 -2.53 119.26 120.64 2bo5 h ALA 19 Ca 0.65 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2bo5 h ALA 19 Cb 1.62 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.45 2bo5 h ALA 19 CO -0.39 0.38 0.00 1.79 0.00 0.00 0.00 179.25 181.04 2bo5 h THR 20 N -0.05 0.00 -0.02 0.00 1.35 -0.58 0.90 112.91 114.51 2bo5 h THR 20 Ca -0.08 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 65.18 2bo5 h THR 20 Cb 1.35 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 69.35 2bo5 h THR 20 CO 0.13 0.00 -0.04 0.00 -0.25 0.00 0.00 175.52 175.36 2bo5 n ALA 21 N -2.06 2.60 -0.03 6.62 0.00 0.54 -2.03 120.51 126.15 2bo5 n ALA 21 Ca 0.02 -0.56 -0.06 0.00 0.00 0.00 0.00 53.44 52.84 2bo5 n ALA 21 Cb 0.36 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.79 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 0.62 1.16 0.21 0.00 -0.00 -0.91 -4.54 117.00 113.54 2bo5 n LEU 22 Ca 0.16 0.04 0.15 0.00 -0.00 0.00 0.00 56.01 56.36 2bo5 n LEU 22 Cb 0.46 -0.18 0.52 0.00 -0.00 0.00 0.00 43.42 44.22 2bo5 n LEU 22 CO 0.17 0.26 0.92 0.10 -0.00 0.00 0.00 177.39 178.84 2bo5 h TYR 23 N -0.16 0.00 -0.92 1.96 -0.00 0.65 -2.81 116.97 115.70 2bo5 h TYR 23 Ca -0.15 0.00 0.20 0.00 0.00 0.00 0.00 58.73 58.79 2bo5 h TYR 23 Cb 1.15 0.00 -0.07 0.00 0.00 0.00 0.00 36.73 37.81 2bo5 h TYR 23 CO -0.01 0.00 0.60 0.66 -0.00 0.00 0.00 178.16 179.41 2bo5 h SER 24 N 0.00 0.46 0.15 0.10 4.64 -1.54 2.71 113.55 120.07 2bo5 h SER 24 Ca 0.00 0.05 -0.25 0.00 -0.47 0.00 0.00 61.79 61.12 2bo5 h SER 24 Cb 0.59 -0.03 0.01 0.00 -0.31 0.00 0.00 62.40 62.66 2bo5 h SER 24 CO 0.00 0.18 -1.02 0.00 -0.87 0.00 0.00 176.83 175.12 2bo5 h ALA 25 N 1.61 0.21 0.00 5.18 0.00 -1.78 -2.94 119.26 121.54 2bo5 h ALA 25 Ca 0.49 -0.71 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 2bo5 h ALA 25 Cb 1.14 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2bo5 h ALA 25 CO -0.20 0.74 -0.23 0.00 0.00 0.00 0.00 179.25 179.56 2bo5 h ALA 26 N 0.53 1.17 -0.08 0.00 0.00 0.78 -2.98 119.26 118.68 2bo5 h ALA 26 Ca -0.11 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.55 2bo5 h ALA 26 Cb 1.67 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.42 2bo5 h ALA 26 CO 0.19 0.29 -0.07 0.66 0.00 0.00 0.00 179.25 180.32 2bo5 h SER 27 N 0.00 0.21 -0.77 0.00 4.64 0.44 0.32 113.55 118.39 2bo5 h SER 27 Ca -0.00 -0.47 0.21 0.00 -0.47 0.00 0.00 61.79 61.06 2bo5 h SER 27 Cb 0.60 -0.06 -0.04 0.00 -0.31 0.00 0.00 62.40 62.59 2bo5 h SER 27 CO 0.03 0.64 0.55 0.11 -0.87 0.00 0.00 176.83 177.28 2bo5 h LYS 28 N -0.22 0.06 0.15 4.77 1.57 -1.36 0.14 116.57 121.68 2bo5 h LYS 28 Ca 0.01 -0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.45 2bo5 h LYS 28 Cb 0.57 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.87 2bo5 h LYS 28 CO 0.02 0.04 -1.71 0.37 -0.57 0.00 0.00 179.45 177.61 2bo5 h GLN 29 N 0.07 0.31 0.00 3.15 5.75 -1.47 -3.48 115.11 119.44 2bo5 h GLN 29 Ca 0.37 -0.54 0.00 0.00 -0.15 0.00 0.00 58.65 58.33 2bo5 h GLN 29 Cb 1.38 0.20 0.00 0.00 1.07 0.00 0.00 27.48 30.13 2bo5 h GLN 29 CO -0.03 1.20 0.00 0.09 -2.65 0.00 0.00 178.83 177.44 2bo5 n ASN 30 N -3.51 -0.75 -1.56 -0.69 4.13 0.10 -4.97 115.26 108.02 2bo5 n ASN 30 Ca -0.22 0.00 0.03 0.00 1.68 0.00 0.00 54.58 56.07 2bo5 n ASN 30 Cb 1.06 -0.29 0.29 0.00 -1.54 0.00 0.00 39.78 39.30 2bo5 n ASN 30 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2bo5 n LYS 31 N -1.24 3.75 -0.21 3.52 4.76 -0.72 -4.46 118.16 123.56 2bo5 n LYS 31 Ca 0.00 -2.32 0.28 0.00 -2.87 0.00 0.00 58.31 53.40 2bo5 n LYS 31 Cb 0.24 -2.06 0.70 0.00 -1.84 0.00 0.00 35.03 32.08 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 2.81 0.05 -0.94 -0.35 -0.00 -1.93 1.83 115.31 116.79 2bo5 h LEU 32 Ca 0.04 0.01 -0.11 0.00 -0.00 0.00 0.00 57.88 57.82 2bo5 h LEU 32 Cb 1.66 -0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 42.30 2bo5 h LEU 32 CO 0.40 0.02 -0.50 -0.08 -0.00 0.00 0.00 178.44 178.28 2bo5 h GLU 33 N 0.05 0.00 -0.02 1.13 4.81 -1.96 2.02 114.58 120.60 2bo5 h GLU 33 Ca 0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.68 2bo5 h GLU 33 Cb 1.73 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.11 2bo5 h GLU 33 CO -0.03 0.50 -0.07 0.94 -0.73 0.00 0.00 179.01 179.62 2bo5 n GLN 34 N -3.81 1.97 0.00 1.92 -0.06 0.55 -3.77 117.38 114.18 2bo5 n GLN 34 Ca -0.01 -1.52 0.00 0.00 -2.00 0.00 0.00 57.00 53.47 2bo5 n GLN 34 Cb 0.54 -1.47 0.00 0.00 -4.06 0.00 0.00 30.24 25.25 2bo5 n GLN 34 CO 0.00 0.00 0.00 1.55 -0.20 0.00 0.00 177.06 178.41 2bo5 n VAL 35 N 0.81 0.00 -0.12 1.69 3.14 0.29 -4.40 118.33 119.74 2bo5 n VAL 35 Ca 0.15 -0.25 -0.15 0.00 -2.96 0.00 0.00 64.34 61.13 2bo5 n VAL 35 Cb 0.51 1.35 -0.13 0.00 -1.06 0.00 0.00 33.84 34.51 2bo5 n VAL 35 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 2bo5 n GLU 36 N -0.16 0.68 0.03 1.45 2.13 0.68 -3.88 120.64 121.58 2bo5 n GLU 36 Ca 0.00 0.09 -0.19 0.00 0.66 0.00 0.00 57.16 57.72 2bo5 n GLU 36 Cb 0.09 -1.51 -0.09 0.00 0.27 0.00 0.00 31.44 30.20 2bo5 n GLU 36 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 2bo5 h LYS 37 N 0.00 0.70 -0.34 5.31 1.79 -1.69 -3.25 116.57 119.10 2bo5 h LYS 37 Ca -0.56 -0.71 0.02 0.00 -2.18 0.00 0.00 60.65 57.22 2bo5 h LYS 37 Cb 2.00 0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 32.81 2bo5 h LYS 37 CO -0.05 1.29 0.19 0.93 -1.08 0.00 0.00 179.45 180.74 2bo5 h GLU 38 N 0.42 0.38 -1.09 3.15 3.07 -1.78 -1.91 114.58 116.82 2bo5 h GLU 38 Ca -0.11 -0.02 0.30 0.00 -0.50 0.00 0.00 59.36 59.03 2bo5 h GLU 38 Cb 1.62 -0.09 -0.10 0.00 -0.84 0.00 0.00 28.75 29.34 2bo5 h GLU 38 CO 0.19 0.25 0.70 -0.07 -1.40 0.00 0.00 179.01 178.68 2bo5 h LEU 39 N 0.39 0.42 -2.44 1.33 3.38 -1.67 1.32 115.31 118.05 2bo5 h LEU 39 Ca 0.13 0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.20 2bo5 h LEU 39 Cb 0.01 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 2bo5 h LEU 39 CO -0.07 0.03 -0.00 -0.07 0.09 0.00 0.00 178.44 178.42 2bo5 h LEU 40 N 0.34 0.00 -0.35 1.67 3.38 -1.40 -1.27 115.31 117.68 2bo5 h LEU 40 Ca 0.64 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.43 2bo5 h LEU 40 Cb 1.70 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.45 2bo5 h LEU 40 CO -0.34 0.00 -0.53 0.03 0.09 0.00 0.00 178.44 177.69 2bo5 h ARG 41 N 0.00 0.83 -0.05 1.13 2.47 0.17 -2.96 114.38 115.97 2bo5 h ARG 41 Ca -0.00 -0.52 0.02 0.00 -1.26 0.00 0.00 59.98 58.22 2bo5 h ARG 41 Cb 0.00 0.06 -0.00 0.00 -1.65 0.00 0.00 29.97 28.38 2bo5 h ARG 41 CO 0.00 1.15 0.04 0.28 0.56 0.00 0.00 179.97 182.00 2bo5 h VAL 42 N 0.64 0.97 -0.16 2.04 2.07 -1.18 -1.76 116.25 118.86 2bo5 h VAL 42 Ca 0.02 0.00 -0.19 0.00 0.82 0.00 0.00 66.70 67.35 2bo5 h VAL 42 Cb 1.13 0.97 0.01 0.00 -1.52 0.00 0.00 31.29 31.88 2bo5 h VAL 42 CO 0.12 0.00 -0.62 1.23 0.02 0.00 0.00 177.57 178.32 2bo5 h GLY 43 N 0.00 0.78 1.98 2.17 0.00 -1.46 -3.14 103.07 103.40 2bo5 h GLY 43 Ca 0.02 -1.05 -0.06 0.00 0.00 0.00 0.00 47.33 46.24 2bo5 h GLY 43 CO -0.00 0.94 -0.29 1.46 0.00 0.00 0.00 176.54 178.64 2bo5 h GLN 44 N 0.40 0.03 -0.00 4.80 1.08 -1.29 -2.32 115.11 117.82 2bo5 h GLN 44 Ca -0.03 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.15 2bo5 h GLN 44 Cb 1.25 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.68 2bo5 h GLN 44 CO 0.13 0.32 -0.03 0.82 -0.95 0.00 0.00 178.83 179.12 2bo5 h ILE 45 N 0.02 1.02 0.00 2.54 2.04 -1.29 -0.75 117.51 121.10 2bo5 h ILE 45 Ca 0.00 -0.10 -0.19 0.00 1.00 0.00 0.00 64.86 65.57 2bo5 h ILE 45 Cb 0.53 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 2bo5 h ILE 45 CO 0.04 0.03 -0.92 -0.07 0.00 0.00 0.00 178.15 177.22 2bo5 h LEU 46 N 0.01 0.00 -0.39 1.44 3.38 -1.46 -3.23 115.31 115.06 2bo5 h LEU 46 Ca 0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 2bo5 h LEU 46 Cb 0.05 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2bo5 h LEU 46 CO 0.00 0.92 -0.58 0.50 0.09 0.00 0.00 178.44 179.38 2bo5 h LYS 47 N 0.00 0.00 -6.08 1.13 3.64 -1.18 -3.42 116.57 110.65 2bo5 h LYS 47 Ca -0.01 0.00 -0.58 0.00 -1.27 0.00 0.00 60.65 58.79 2bo5 h LYS 47 Cb 1.69 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.51 2bo5 h LYS 47 CO 0.12 0.58 1.42 -1.21 -2.27 0.00 0.00 179.45 178.09 2bo5 s GLU 48 N -3.19 3.30 0.28 1.90 0.41 -0.40 -4.86 118.70 116.15 2bo5 s GLU 48 Ca 0.02 1.99 0.02 0.00 -0.41 0.00 0.00 54.97 56.59 2bo5 s GLU 48 Cb 0.10 -4.31 0.65 0.00 -1.78 0.00 0.00 34.13 28.79 2bo5 s GLU 48 CO 0.74 -1.91 1.74 -1.35 -0.49 0.00 0.00 175.26 174.00 2bo5 h PRO 49 N 14.07 0.56 -0.01 0.39 0.11 -1.89 0.27 132.00 145.50 2bo5 h PRO 49 Ca -0.41 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.59 2bo5 h PRO 49 Cb 1.22 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2bo5 h PRO 49 CO 0.97 0.37 -0.38 -0.22 -0.21 0.00 0.00 178.00 178.53 2bo5 h LYS 50 N 0.58 0.01 -0.01 1.05 1.63 -1.94 -2.90 116.57 114.99 2bo5 h LYS 50 Ca 0.52 -0.00 -0.24 0.00 -0.85 0.00 0.00 60.65 60.08 2bo5 h LYS 50 Cb 0.85 -0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.49 2bo5 h LYS 50 CO -0.42 0.39 -0.96 0.52 -3.45 0.00 0.00 179.45 175.53 2bo5 h MET 51 N 0.01 0.50 -0.32 1.90 2.86 -0.81 -3.18 114.93 115.90 2bo5 h MET 51 Ca -0.00 -0.53 0.09 0.00 -2.06 0.00 0.00 59.70 57.20 2bo5 h MET 51 Cb 0.68 0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.47 2bo5 h MET 51 CO 0.05 1.17 0.26 0.00 1.06 0.00 0.00 176.91 179.44 2bo5 h ALA 52 N 0.65 2.18 0.00 6.32 0.00 -0.79 0.61 119.26 128.23 2bo5 h ALA 52 Ca -0.09 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 2bo5 h ALA 52 Cb 1.59 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.39 2bo5 h ALA 52 CO 0.17 -0.42 -0.45 0.00 0.00 0.00 0.00 179.25 178.55 2bo5 h ALA 53 N 1.79 1.05 0.04 0.00 0.00 -1.55 -2.94 119.26 117.64 2bo5 h ALA 53 Ca 0.15 -0.41 -0.38 0.00 0.00 0.00 0.00 54.91 54.26 2bo5 h ALA 53 Cb 0.66 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 2bo5 h ALA 53 CO -0.00 0.57 -2.32 0.43 0.00 0.00 0.00 179.25 177.93 2bo5 n SER 54 N -3.71 2.02 0.25 0.00 7.64 0.32 -3.53 113.62 116.62 2bo5 n SER 54 Ca -0.01 0.00 0.17 0.00 1.01 0.00 0.00 58.87 60.05 2bo5 n SER 54 Cb 0.53 -0.58 0.90 0.00 -1.01 0.00 0.00 64.21 64.05 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 -0.06 0.00 -3.79 -3.43 3.38 0.01 -1.88 115.31 109.53 2bo5 h LEU 55 Ca -0.54 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.11 2bo5 h LEU 55 Cb 1.91 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 42.34 2bo5 h LEU 55 CO -0.06 0.00 -0.81 -0.11 0.09 0.00 0.00 178.44 177.54 2bo5 n LEU 56 N -3.65 3.39 -4.23 1.67 -0.00 -1.11 -4.99 117.00 108.09 2bo5 n LEU 56 Ca -0.00 -3.96 -0.37 0.00 -0.00 0.00 0.00 56.01 51.67 2bo5 n LEU 56 Cb 0.24 -0.21 -0.13 0.00 -0.00 0.00 0.00 43.42 43.33 2bo5 n LEU 56 CO 0.25 1.59 -0.28 0.21 -0.00 0.00 0.00 177.39 179.16 2bo5 s ASN 57 N -3.39 5.19 0.31 1.96 2.47 -0.71 -4.96 114.94 115.81 2bo5 s ASN 57 Ca 0.42 -1.26 0.17 0.00 0.42 0.00 0.00 52.86 52.61 2bo5 s ASN 57 Cb 0.38 -1.82 0.93 0.00 -1.45 0.00 0.00 41.25 39.29 2bo5 s ASN 57 CO -0.02 -0.33 1.47 -2.65 -3.72 0.00 0.00 177.10 171.85 2bo5 n PRO 58 N 4.74 0.11 0.10 0.43 -0.02 -1.26 -0.58 135.00 138.52 2bo5 n PRO 58 Ca -0.12 0.60 -0.03 0.00 -2.02 0.00 0.00 63.50 61.93 2bo5 n PRO 58 Cb 0.44 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 2bo5 n PRO 58 CO 0.00 0.00 0.00 1.88 1.98 0.00 0.00 175.50 179.36 2bo5 h TYR 59 N 0.00 0.00 0.00 6.00 -1.99 -1.94 -3.14 116.97 115.90 2bo5 h TYR 59 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2bo5 h TYR 59 Cb 0.27 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.00 2bo5 h TYR 59 CO 0.00 0.80 0.00 0.28 -0.00 0.00 0.00 178.16 179.24 2bo5 h VAL 60 N 0.00 0.00 -2.19 -2.88 2.07 -1.15 -3.48 116.25 108.62 2bo5 h VAL 60 Ca -0.01 -0.26 0.18 0.00 0.82 0.00 0.00 66.70 67.43 2bo5 h VAL 60 Cb 1.50 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 32.48 2bo5 h VAL 60 CO 0.10 0.00 -0.23 1.17 0.02 0.00 0.00 177.57 178.63 2bo5 n LYS 61 N -3.08 -1.31 -0.09 1.57 4.81 -1.19 -1.76 118.16 117.11 2bo5 n LYS 61 Ca -0.01 0.86 -0.10 0.00 -0.87 0.00 0.00 58.31 58.19 2bo5 n LYS 61 Cb 0.19 -1.59 -0.04 0.00 0.02 0.00 0.00 35.03 33.61 2bo5 n LYS 61 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 2bo5 n ARG 62 N -2.69 0.50 0.07 1.64 0.00 -1.26 -3.62 116.66 111.30 2bo5 n ARG 62 Ca 0.00 0.39 -0.13 0.00 -0.00 0.00 0.00 57.85 58.11 2bo5 n ARG 62 Cb 0.30 -1.58 -0.07 0.00 0.00 0.00 0.00 32.46 31.10 2bo5 n ARG 62 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2bo5 h SER 63 N -1.00 -0.07 -0.85 6.15 0.87 -1.94 -2.43 113.55 114.29 2bo5 h SER 63 Ca -0.09 -0.00 0.05 0.00 -1.23 0.00 0.00 61.79 60.52 2bo5 h SER 63 Cb 0.87 0.02 -0.06 0.00 -0.44 0.00 0.00 62.40 62.79 2bo5 h SER 63 CO -0.06 -0.05 0.53 0.58 -0.53 0.00 0.00 176.83 177.31 2bo5 h VAL 64 N -0.09 1.07 -0.42 2.23 2.07 -1.81 -0.85 116.25 118.45 2bo5 h VAL 64 Ca -0.01 -0.34 0.07 0.00 0.82 0.00 0.00 66.70 67.24 2bo5 h VAL 64 Cb 0.07 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 29.81 2bo5 h VAL 64 CO 0.01 0.18 0.28 0.50 0.02 0.00 0.00 177.57 178.57 2bo5 h LYS 65 N 0.99 0.28 -0.51 1.57 1.63 -1.01 -1.81 116.57 117.70 2bo5 h LYS 65 Ca 0.36 -0.02 0.02 0.00 -0.85 0.00 0.00 60.65 60.16 2bo5 h LYS 65 Cb 0.12 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 31.66 2bo5 h LYS 65 CO -0.16 0.18 0.32 0.28 -3.45 0.00 0.00 179.45 176.63 2bo5 h VAL 66 N 0.28 1.09 -0.72 2.00 2.07 -0.67 -1.95 116.25 118.34 2bo5 h VAL 66 Ca 0.19 -0.22 -0.05 0.00 0.82 0.00 0.00 66.70 67.44 2bo5 h VAL 66 Cb 0.37 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 2bo5 h VAL 66 CO -0.04 0.12 0.26 0.50 0.02 0.00 0.00 177.57 178.43 2bo5 h LYS 67 N 0.64 1.09 0.00 1.57 3.64 -1.33 -2.15 116.57 120.04 2bo5 h LYS 67 Ca 0.20 -0.21 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 2bo5 h LYS 67 Cb -0.02 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 31.62 2bo5 h LYS 67 CO -0.07 0.91 -0.15 0.66 -2.27 0.00 0.00 179.45 178.52 2bo5 h SER 68 N 1.06 0.00 -0.40 4.20 4.64 -1.20 -2.17 113.55 119.68 2bo5 h SER 68 Ca 0.24 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.52 2bo5 h SER 68 Cb 0.24 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 2bo5 h SER 68 CO -0.02 0.15 0.13 -0.07 -0.87 0.00 0.00 176.83 176.16 2bo5 h LEU 69 N 0.00 0.63 -0.71 5.97 3.38 -0.68 -2.45 115.31 121.46 2bo5 h LEU 69 Ca -0.00 -0.09 0.06 0.00 0.09 0.00 0.00 57.88 57.93 2bo5 h LEU 69 Cb 0.28 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 2bo5 h LEU 69 CO 0.02 0.62 0.42 0.28 0.09 0.00 0.00 178.44 179.86 2bo5 h SER 70 N 0.67 0.64 -0.01 -0.43 0.02 -1.38 0.65 113.55 113.71 2bo5 h SER 70 Ca 0.16 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2bo5 h SER 70 Cb 0.22 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.66 2bo5 h SER 70 CO -0.01 0.41 0.00 0.47 -1.14 0.00 0.00 176.83 176.57 2bo5 n ASP 71 N -4.73 0.46 -0.08 3.07 8.00 -1.00 -2.76 116.55 119.50 2bo5 n ASP 71 Ca 0.09 -1.21 -0.09 0.00 0.71 0.00 0.00 54.79 54.29 2bo5 n ASP 71 Cb 0.16 -0.01 -0.12 0.00 -0.02 0.00 0.00 41.12 41.14 2bo5 n ASP 71 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 2bo5 n MET 72 N -0.61 1.24 0.11 -1.24 1.56 0.25 -4.23 117.12 114.19 2bo5 n MET 72 Ca 0.21 0.02 -0.04 0.00 -0.27 0.00 0.00 57.70 57.62 2bo5 n MET 72 Cb 0.18 -1.40 0.08 0.00 2.15 0.00 0.00 33.22 34.23 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 1.49 0.00 1.12 2.02 0.19 -2.60 112.91 115.13 2bo5 h THR 73 Ca -0.43 -2.40 0.00 0.00 0.77 0.00 0.00 66.41 64.35 2bo5 h THR 73 Cb 1.90 2.29 0.00 0.00 -1.74 0.00 0.00 68.15 70.60 2bo5 h THR 73 CO 0.00 0.69 0.00 0.00 0.37 0.00 0.00 175.52 176.58 2bo5 h ALA 74 N 1.21 1.00 -0.10 6.16 0.00 -1.72 -2.59 119.26 123.22 2bo5 h ALA 74 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2bo5 h ALA 74 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2bo5 h ALA 74 CO 0.10 0.00 0.00 1.17 0.00 0.00 0.00 179.25 180.52 2bo5 n LYS 75 N -2.66 2.08 0.05 0.00 4.81 -1.12 -4.74 118.16 116.58 2bo5 n LYS 75 Ca 0.02 -2.48 0.00 0.00 -0.87 0.00 0.00 58.31 54.98 2bo5 n LYS 75 Cb 0.33 -1.52 0.00 0.00 0.02 0.00 0.00 35.03 33.86 2bo5 n LYS 75 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2bo5 n GLU 76 N -0.92 0.00 0.00 1.64 4.71 -0.99 -5.05 120.64 120.03 2bo5 n GLU 76 Ca 0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.30 2bo5 n GLU 76 Cb 0.65 -0.39 0.00 0.00 -1.01 0.00 0.00 31.44 30.69 2bo5 n GLU 76 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2bo5 n LYS 77 N -3.27 0.00 -0.85 3.49 4.76 -0.99 -4.99 118.16 116.30 2bo5 n LYS 77 Ca 0.00 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.12 2bo5 n LYS 77 Cb 0.15 0.00 0.08 0.00 -1.84 0.00 0.00 35.03 33.41 2bo5 n LYS 77 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2bo5 n PHE 78 N 0.00 -1.39 0.00 2.13 3.72 -1.17 -4.75 117.46 116.00 2bo5 n PHE 78 Ca 0.00 0.48 0.00 0.00 -0.05 0.00 0.00 57.45 57.88 2bo5 n PHE 78 Cb 0.00 -1.43 0.00 0.00 -0.94 0.00 0.00 39.48 37.11 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 1.69 0.00 0.00 4.37 2.88 -1.26 -4.57 113.62 116.73 2bo5 n SER 79 Ca -0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 2bo5 n SER 79 Cb 0.63 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.09 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 -0.03 -1.46 -0.04 -1.26 -3.99 135.00 128.22 2bo5 n PRO 80 Ca 0.00 0.02 0.13 0.00 -0.04 0.00 0.00 63.50 63.60 2bo5 n PRO 80 Cb 0.00 -0.27 0.34 0.00 -0.04 0.00 0.00 33.50 33.53 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 -1.91 2.19 -0.11 1.53 7.99 -1.26 -3.67 117.00 121.76 2bo5 n LEU 81 Ca 0.00 -0.79 0.02 0.00 -0.01 0.00 0.00 56.01 55.23 2bo5 n LEU 81 Cb 0.00 -0.04 0.01 0.00 -0.11 0.00 0.00 43.42 43.27 2bo5 n LEU 81 CO 0.00 0.39 0.21 0.41 -1.51 0.00 0.00 177.39 176.90 2bo5 n THR 82 N 0.69 0.00 0.09 -5.08 -1.04 -1.26 -4.39 114.28 103.29 2bo5 n THR 82 Ca 0.17 -0.47 -0.09 0.00 -2.04 0.00 0.00 64.05 61.61 2bo5 n THR 82 Cb 0.45 1.06 0.06 0.00 -1.82 0.00 0.00 70.33 70.08 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 -0.18 3.50 0.00 8.00 2.88 -1.24 -1.79 113.62 124.80 2bo5 n SER 83 Ca 0.02 -2.63 0.00 0.00 -1.33 0.00 0.00 58.87 54.93 2bo5 n SER 83 Cb 0.09 -0.66 0.00 0.00 -0.75 0.00 0.00 64.21 62.89 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 -0.06 0.00 0.27 -3.46 3.02 -1.26 -4.77 115.26 109.00 2bo5 n ASN 84 Ca 0.23 0.00 0.14 0.00 -0.03 0.00 0.00 54.58 54.92 2bo5 n ASN 84 Cb 0.91 0.07 0.78 0.00 -0.61 0.00 0.00 39.78 40.92 2bo5 n ASN 84 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2bo5 h LEU 85 N 0.00 0.00 0.06 3.41 6.46 -1.76 -1.85 115.31 121.63 2bo5 h LEU 85 Ca 0.00 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2bo5 h LEU 85 Cb 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.93 2bo5 h LEU 85 CO 0.00 0.09 -0.03 0.40 -0.62 0.00 0.00 178.44 178.28 2bo5 h ILE 86 N 0.00 1.11 0.00 4.05 5.03 -1.65 0.13 117.51 126.17 2bo5 h ILE 86 Ca -0.00 -0.59 -0.08 0.00 -0.12 0.00 0.00 64.86 64.07 2bo5 h ILE 86 Cb 0.32 1.50 -0.01 0.00 -3.03 0.00 0.00 36.82 35.59 2bo5 h ILE 86 CO 0.01 0.15 -0.39 0.78 -0.68 0.00 0.00 178.15 178.02 2bo5 h ASN 87 N -0.34 0.00 0.29 1.72 2.35 -1.74 -0.86 115.58 116.99 2bo5 h ASN 87 Ca -0.01 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.58 2bo5 h ASN 87 Cb 0.30 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 2bo5 h ASN 87 CO 0.01 0.39 -0.64 0.25 -1.65 0.00 0.00 177.43 175.78 2bo5 h LEU 88 N 0.00 0.39 0.03 1.61 6.46 -1.16 0.79 115.31 123.42 2bo5 h LEU 88 Ca -0.00 -0.23 -0.23 0.00 -0.12 0.00 0.00 57.88 57.29 2bo5 h LEU 88 Cb 0.71 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 40.50 2bo5 h LEU 88 CO 0.05 0.93 -1.13 -0.07 -0.62 0.00 0.00 178.44 177.60 2bo5 h LEU 89 N 0.24 0.09 -0.17 2.25 3.38 -0.67 -1.85 115.31 118.57 2bo5 h LEU 89 Ca -0.01 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2bo5 h LEU 89 Cb 1.18 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2bo5 h LEU 89 CO 0.11 1.08 -0.35 0.00 0.09 0.00 0.00 178.44 179.37 2bo5 n ALA 90 N -2.41 3.23 -0.10 1.53 0.00 -0.35 -2.94 120.51 119.47 2bo5 n ALA 90 Ca -0.04 -0.34 -0.18 0.00 0.00 0.00 0.00 53.44 52.89 2bo5 n ALA 90 Cb 0.97 -1.17 -0.06 0.00 0.00 0.00 0.00 19.45 19.19 2bo5 n ALA 90 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2bo5 n GLU 91 N -1.19 0.49 0.16 0.00 2.13 0.27 -4.50 120.64 118.00 2bo5 n GLU 91 Ca 0.09 0.21 0.16 0.00 0.66 0.00 0.00 57.16 58.27 2bo5 n GLU 91 Cb 0.33 -1.34 0.74 0.00 0.27 0.00 0.00 31.44 31.44 2bo5 n GLU 91 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 2bo5 h ASN 92 N -0.88 0.00 0.00 4.31 4.21 -1.52 -3.46 115.58 118.25 2bo5 h ASN 92 Ca -0.34 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.17 2bo5 h ASN 92 Cb 1.24 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.44 2bo5 h ASN 92 CO -0.20 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.55 2bo5 n GLY 93 N -1.51 1.15 2.29 2.83 0.00 -1.23 -4.99 105.19 103.72 2bo5 n GLY 93 Ca 0.03 -0.41 -0.33 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.36 2.85 -1.02 1.61 3.00 -1.15 -4.59 116.66 115.99 2bo5 n ARG 94 Ca 0.00 -3.45 -0.16 0.00 -0.00 0.00 0.00 57.85 54.24 2bo5 n ARG 94 Cb 0.16 -2.29 0.19 0.00 0.00 0.00 0.00 32.46 30.53 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 -0.88 6.07 -0.02 6.15 4.77 -1.24 -3.02 117.00 128.83 2bo5 n LEU 95 Ca 0.60 -3.21 -0.03 0.00 -0.03 0.00 0.00 56.01 53.33 2bo5 n LEU 95 Cb 0.70 -0.77 -0.02 0.00 -2.33 0.00 0.00 43.42 41.00 2bo5 n LEU 95 CO 0.73 0.91 -0.66 0.35 -1.33 0.00 0.00 177.39 177.38 2bo5 n THR 96 N -0.68 0.29 -1.41 -5.08 -2.24 -1.26 -4.74 114.28 99.15 2bo5 n THR 96 Ca 0.47 -0.12 0.07 0.00 -2.27 0.00 0.00 64.05 62.20 2bo5 n THR 96 Cb 1.45 -0.71 0.12 0.00 -2.10 0.00 0.00 70.33 69.09 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 -2.58 1.74 -0.25 3.42 3.02 -1.26 -4.83 115.26 114.52 2bo5 n ASN 97 Ca -0.09 -2.99 0.03 0.00 -0.03 0.00 0.00 54.58 51.51 2bo5 n ASN 97 Cb 0.60 -0.40 0.16 0.00 -0.61 0.00 0.00 39.78 39.53 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 1.82 0.77 -1.01 3.41 1.03 -1.83 -1.33 112.91 115.78 2bo5 h THR 98 Ca -0.01 -0.19 0.29 0.00 -0.01 0.00 0.00 66.41 66.49 2bo5 h THR 98 Cb 1.12 0.18 -0.04 0.00 -1.07 0.00 0.00 68.15 68.34 2bo5 h THR 98 CO 0.01 0.10 0.83 1.55 -0.01 0.00 0.00 175.52 178.00 2bo5 h PRO 99 N 0.55 0.00 -0.03 0.00 0.13 -1.88 0.81 132.00 131.58 2bo5 h PRO 99 Ca 0.38 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.37 2bo5 h PRO 99 Cb 0.48 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.60 2bo5 h PRO 99 CO -0.32 0.00 -0.63 0.00 -0.23 0.00 0.00 178.00 176.82 2bo5 h ALA 100 N 1.28 0.89 0.00 -0.56 0.00 -1.64 -2.91 119.26 116.32 2bo5 h ALA 100 Ca 0.48 -0.57 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 2bo5 h ALA 100 Cb 2.14 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.83 2bo5 h ALA 100 CO -0.01 0.77 -0.23 0.28 0.00 0.00 0.00 179.25 180.06 2bo5 h VAL 101 N 0.08 0.62 -0.15 0.00 2.07 0.58 -2.88 116.25 116.57 2bo5 h VAL 101 Ca -0.01 -1.09 -0.12 0.00 0.82 0.00 0.00 66.70 66.30 2bo5 h VAL 101 Cb 1.13 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 32.61 2bo5 h VAL 101 CO 0.09 0.23 -0.44 0.40 0.02 0.00 0.00 177.57 177.87 2bo5 h ILE 102 N 0.00 1.32 -0.16 4.57 2.04 -1.35 -3.17 117.51 120.76 2bo5 h ILE 102 Ca -0.00 -1.61 0.03 0.00 1.00 0.00 0.00 64.86 64.27 2bo5 h ILE 102 Cb 0.70 1.69 -0.02 0.00 -0.74 0.00 0.00 36.82 38.44 2bo5 h ILE 102 CO 0.03 0.49 -0.00 -1.28 0.00 0.00 0.00 178.15 177.39 2bo5 h SER 103 N 0.29 -0.06 -0.36 1.72 0.87 -1.56 -0.65 113.55 113.79 2bo5 h SER 103 Ca 0.02 0.04 0.11 0.00 -1.23 0.00 0.00 61.79 60.72 2bo5 h SER 103 Cb 0.89 0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.90 2bo5 h SER 103 CO 0.07 -0.01 0.33 0.00 -0.53 0.00 0.00 176.83 176.70 2bo5 h ALA 104 N 1.14 2.14 -0.07 6.23 0.00 -1.65 -1.22 119.26 125.83 2bo5 h ALA 104 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2bo5 h ALA 104 Cb 0.09 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2bo5 h ALA 104 CO -0.13 -0.52 0.04 0.35 0.00 0.00 0.00 179.25 178.99 2bo5 h PHE 105 N 0.00 0.08 0.00 0.00 3.57 -1.15 0.95 116.94 120.39 2bo5 h PHE 105 Ca 0.17 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.68 2bo5 h PHE 105 Cb 0.83 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.55 2bo5 h PHE 105 CO 0.00 0.05 0.00 1.03 -2.23 0.00 0.00 178.31 177.16 2bo5 h SER 106 N 0.09 0.00 0.05 0.41 0.87 -1.18 0.83 113.55 114.62 2bo5 h SER 106 Ca 0.03 0.00 -0.37 0.00 -1.23 0.00 0.00 61.79 60.22 2bo5 h SER 106 Cb -0.00 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 61.89 2bo5 h SER 106 CO -0.02 0.00 -2.34 0.41 -0.53 0.00 0.00 176.83 174.36 2bo5 n THR 107 N -2.65 1.49 0.16 2.23 -1.04 -0.75 -4.13 114.28 109.58 2bo5 n THR 107 Ca -0.00 -0.71 0.04 0.00 -2.04 0.00 0.00 64.05 61.34 2bo5 n THR 107 Cb 0.18 -1.03 0.09 0.00 -1.82 0.00 0.00 70.33 67.75 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 0.01 0.00 -0.65 -2.82 2.07 0.12 -3.14 114.93 110.52 2bo5 h MET 108 Ca -0.53 0.00 -0.02 0.00 -2.07 0.00 0.00 59.70 57.08 2bo5 h MET 108 Cb 2.06 0.00 -0.03 0.00 -1.87 0.00 0.00 31.60 31.76 2bo5 h MET 108 CO -0.01 0.43 0.33 0.00 1.07 0.00 0.00 176.91 178.72 2bo5 h MET 109 N 0.00 0.90 -0.06 1.72 -0.00 0.51 -0.55 114.93 117.45 2bo5 h MET 109 Ca -0.00 -0.11 0.02 0.00 -0.00 0.00 0.00 59.70 59.60 2bo5 h MET 109 Cb 1.27 -0.18 -0.00 0.00 -0.00 0.00 0.00 31.60 32.70 2bo5 h MET 109 CO 0.06 0.69 0.13 0.77 -0.00 0.00 0.00 176.91 178.56 2bo5 h SER 110 N 0.91 0.00 0.04 -0.10 0.02 -1.70 -0.90 113.55 111.82 2bo5 h SER 110 Ca 0.23 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.97 2bo5 h SER 110 Cb 0.07 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.62 2bo5 h SER 110 CO -0.03 0.00 -0.83 0.58 -1.14 0.00 0.00 176.83 175.41 2bo5 h VAL 111 N 0.00 1.39 -0.05 2.27 2.07 -1.25 -2.76 116.25 117.92 2bo5 h VAL 111 Ca 0.03 -2.24 -0.12 0.00 0.82 0.00 0.00 66.70 65.18 2bo5 h VAL 111 Cb 0.29 2.67 -0.01 0.00 -1.52 0.00 0.00 31.29 32.72 2bo5 h VAL 111 CO -0.00 0.66 -0.54 1.12 0.02 0.00 0.00 177.57 178.84 2bo5 h HIS 112 N 0.01 0.18 -0.04 1.57 -0.00 -1.18 -2.90 115.15 112.79 2bo5 h HIS 112 Ca -0.12 -0.06 -0.12 0.00 -0.00 0.00 0.00 60.37 60.07 2bo5 h HIS 112 Cb 1.54 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 28.90 2bo5 h HIS 112 CO 0.14 0.65 -0.52 -0.09 -0.00 0.00 0.00 177.93 178.11 2bo5 h ARG 113 N 0.12 0.11 0.00 5.12 2.43 -1.29 -2.96 114.38 117.91 2bo5 h ARG 113 Ca 0.00 -0.07 -0.09 0.00 -0.81 0.00 0.00 59.98 59.01 2bo5 h ARG 113 Cb 0.98 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.53 2bo5 h ARG 113 CO 0.08 0.61 -0.43 0.78 -1.51 0.00 0.00 179.97 179.50 2bo5 h GLY 114 N 1.47 0.00 -3.86 2.80 0.00 -1.28 -3.04 103.07 99.16 2bo5 h GLY 114 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.76 2bo5 h GLY 114 CO 0.07 0.00 0.74 -1.84 0.00 0.00 0.00 176.54 175.51 2bo5 n GLU 115 N -3.72 2.41 -3.71 4.80 0.28 -1.12 -4.91 120.64 114.67 2bo5 n GLU 115 Ca -0.01 -2.86 -0.14 0.00 -0.16 0.00 0.00 57.16 54.00 2bo5 n GLU 115 Cb 0.50 -2.12 -0.08 0.00 1.43 0.00 0.00 31.44 31.17 2bo5 n GLU 115 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 2bo5 s VAL 116 N -3.97 0.05 0.17 3.84 -7.23 -1.15 -5.04 120.40 107.07 2bo5 s VAL 116 Ca 0.56 -0.44 -0.16 0.00 -1.81 0.00 0.00 61.98 60.13 2bo5 s VAL 116 Cb 0.45 -0.77 0.10 0.00 0.56 0.00 0.00 36.38 36.72 2bo5 s VAL 116 CO 0.02 -0.24 1.68 -0.65 -0.31 0.00 0.00 175.10 175.59 2bo5 h PRO 117 N 3.52 0.04 -5.10 4.82 0.11 -1.91 -3.48 132.00 129.99 2bo5 h PRO 117 Ca -0.30 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2bo5 h PRO 117 Cb 1.18 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2bo5 h PRO 117 CO 0.41 0.03 -0.83 0.00 -0.21 0.00 0.00 178.00 177.40 2bo5 s THR 119 N -1.85 5.30 -2.00 0.00 2.01 -1.26 -5.23 115.64 112.61 2bo5 s THR 119 Ca 0.07 0.06 0.01 0.00 0.31 0.00 0.00 61.69 62.14 2bo5 s THR 119 Cb -0.02 -3.58 0.03 0.00 0.01 0.00 0.00 72.50 68.94 2bo5 s THR 119 CO 0.76 0.28 0.55 0.55 -0.69 0.00 0.00 174.62 176.07