#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 0.00 -0.44 3.13 0.00 -1.26 -3.94 120.51 118.01 2bo5 n ALA 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2bo5 n ALA 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.00 0.00 0.00 0.00 5.02 -1.26 -5.05 118.16 116.87 2bo5 n LYS 3 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2bo5 n LYS 3 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2bo5 n LYS 3 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2bo5 n LEU 4 N -1.84 0.00 -2.62 -0.35 7.94 -1.25 -4.78 117.00 114.09 2bo5 n LEU 4 Ca 0.00 0.00 -0.05 0.00 -1.11 0.00 0.00 56.01 54.85 2bo5 n LEU 4 Cb 0.00 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 43.91 2bo5 n LEU 4 CO 0.00 0.00 -0.65 0.52 -1.11 0.00 0.00 177.39 176.15 2bo5 n VAL 5 N 0.00-12.89 -3.99 1.96 0.31 -1.26 -5.07 118.33 97.39 2bo5 n VAL 5 Ca 0.00 2.67 -0.10 0.00 -0.01 0.00 0.00 64.34 66.90 2bo5 n VAL 5 Cb 0.00 -6.65 -0.11 0.00 -0.91 0.00 0.00 33.84 26.17 2bo5 n VAL 5 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2bo5 s ARG 6 N -0.83 0.34 0.96 5.55 0.52 -1.26 -5.16 118.95 119.06 2bo5 s ARG 6 Ca -0.25 -0.62 -0.12 0.00 -0.52 0.00 0.00 55.73 54.22 2bo5 s ARG 6 Cb 0.02 0.06 0.17 0.00 0.52 0.00 0.00 34.95 35.71 2bo5 s ARG 6 CO 0.80 -0.04 1.09 -1.25 0.02 0.00 0.00 175.30 175.93 2bo5 s PRO 7 N -1.46 0.73 -1.12 3.54 0.04 -1.26 -4.88 135.00 130.60 2bo5 s PRO 7 Ca -0.15 0.60 -0.23 0.00 0.04 0.00 0.00 61.00 61.26 2bo5 s PRO 7 Cb -0.10 -1.77 -0.07 0.00 0.04 0.00 0.00 34.50 32.61 2bo5 s PRO 7 CO -0.01 -2.54 1.92 -1.25 0.04 0.00 0.00 177.00 175.16 2bo5 s PRO 8 N -4.97 2.58 0.29 0.56 0.04 -1.26 -4.94 135.00 127.30 2bo5 s PRO 8 Ca 0.65 -0.98 0.06 0.00 0.04 0.00 0.00 61.00 60.77 2bo5 s PRO 8 Cb -0.18 -5.21 -0.02 0.00 0.04 0.00 0.00 34.50 29.13 2bo5 s PRO 8 CO 0.57 -3.75 0.42 0.14 0.04 0.00 0.00 177.00 174.42 2bo5 s VAL 9 N 10.48 4.57 0.05 -0.36 -7.23 -1.26 -4.55 120.40 122.10 2bo5 s VAL 9 Ca 0.68 -1.00 0.00 0.00 -1.81 0.00 0.00 61.98 59.85 2bo5 s VAL 9 Cb -0.02 -3.60 0.00 0.00 0.56 0.00 0.00 36.38 33.32 2bo5 s VAL 9 CO 0.09 -0.23 0.00 0.00 -0.31 0.00 0.00 175.10 174.65 2bo5 n GLN 10 N -1.54 -5.12 0.00 4.82 6.02 -1.26 -4.25 117.38 116.04 2bo5 n GLN 10 Ca -0.04 3.72 0.00 0.00 -0.01 0.00 0.00 57.00 60.67 2bo5 n GLN 10 Cb 0.58 -4.53 0.00 0.00 1.02 0.00 0.00 30.24 27.31 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 1.79 0.00 -3.03 5.09 2.08 -1.26 -4.81 119.36 119.21 2bo5 n ILE 11 Ca 0.00 0.00 -0.02 0.00 0.56 0.00 0.00 62.75 63.29 2bo5 n ILE 11 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 38.89 2bo5 n ILE 11 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2bo5 n TYR 12 N 0.00 -1.63 0.00 1.39 4.11 -1.26 -4.41 117.16 115.36 2bo5 n TYR 12 Ca 0.00 0.72 0.00 0.00 -0.00 0.00 0.00 57.90 58.62 2bo5 n TYR 12 Cb 0.00 -2.18 0.00 0.00 -0.00 0.00 0.00 39.34 37.16 2bo5 n TYR 12 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2bo5 n GLY 13 N 0.97 2.76 0.37 -7.48 0.00 -1.26 -4.81 105.19 95.74 2bo5 n GLY 13 Ca -0.00 -0.95 0.07 0.00 0.00 0.00 0.00 46.02 45.14 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 0.95 -0.53 -0.61 -0.00 -1.99 -0.25 117.51 115.09 2bo5 h ILE 14 Ca 0.00 -0.34 0.05 0.00 -0.00 0.00 0.00 64.86 64.57 2bo5 h ILE 14 Cb 0.00 -0.14 -0.03 0.00 -0.00 0.00 0.00 36.82 36.65 2bo5 h ILE 14 CO 0.00 0.18 0.35 1.05 -0.00 0.00 0.00 178.15 179.74 2bo5 h GLU 15 N 1.00 0.51 -0.96 2.19 4.11 -1.97 -1.71 114.58 117.75 2bo5 h GLU 15 Ca 0.47 -0.03 0.04 0.00 0.07 0.00 0.00 59.36 59.91 2bo5 h GLU 15 Cb 0.43 -0.12 -0.06 0.00 0.50 0.00 0.00 28.75 29.51 2bo5 h GLU 15 CO -0.23 0.34 0.63 0.78 0.07 0.00 0.00 179.01 180.59 2bo5 h GLY 16 N 0.53 1.40 2.00 1.06 0.00 -1.28 -0.17 103.07 106.61 2bo5 h GLY 16 Ca 0.22 -0.47 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 2bo5 h GLY 16 CO -0.06 0.40 -0.00 -0.09 0.00 0.00 0.00 176.54 176.78 2bo5 h ARG 17 N 1.20 0.00 0.72 4.80 2.43 -1.33 -2.37 114.38 119.82 2bo5 h ARG 17 Ca 0.39 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.52 2bo5 h ARG 17 Cb 0.03 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.59 2bo5 h ARG 17 CO -0.12 0.00 -0.34 1.88 -1.51 0.00 0.00 179.97 179.88 2bo5 h TYR 18 N 0.00 -0.89 -0.66 2.20 0.05 -1.05 1.53 116.97 118.15 2bo5 h TYR 18 Ca -0.00 -0.02 -0.04 0.00 0.05 0.00 0.00 58.73 58.71 2bo5 h TYR 18 Cb 0.13 0.29 -0.03 0.00 1.01 0.00 0.00 36.73 38.13 2bo5 h TYR 18 CO 0.00 -0.54 0.23 0.00 -1.05 0.00 0.00 178.16 176.81 2bo5 h ALA 19 N -0.79 1.17 -0.03 3.88 0.00 -1.57 -0.47 119.26 121.44 2bo5 h ALA 19 Ca -0.10 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.46 2bo5 h ALA 19 Cb 0.75 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2bo5 h ALA 19 CO 0.16 0.59 -0.70 1.15 0.00 0.00 0.00 179.25 180.45 2bo5 h THR 20 N 0.96 1.44 -0.01 0.00 2.02 -1.29 0.86 112.91 116.89 2bo5 h THR 20 Ca 0.22 -2.24 0.00 0.00 0.77 0.00 0.00 66.41 65.16 2bo5 h THR 20 Cb 0.23 2.19 0.00 0.00 -1.74 0.00 0.00 68.15 68.84 2bo5 h THR 20 CO -0.01 0.65 -0.05 0.00 0.37 0.00 0.00 175.52 176.48 2bo5 n ALA 21 N -2.45 2.69 -0.06 6.16 0.00 0.52 -2.65 120.51 124.72 2bo5 n ALA 21 Ca -0.02 -0.30 -0.07 0.00 0.00 0.00 0.00 53.44 53.05 2bo5 n ALA 21 Cb 0.68 -1.33 -0.09 0.00 0.00 0.00 0.00 19.45 18.71 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 0.52 0.20 0.00 0.00 -0.23 -4.33 117.00 112.54 2bo5 n LEU 22 Ca 0.18 -0.01 0.14 0.00 0.00 0.00 0.00 56.01 56.32 2bo5 n LEU 22 Cb 0.25 0.15 0.44 0.00 0.00 0.00 0.00 43.42 44.27 2bo5 n LEU 22 CO 0.20 0.37 0.90 0.10 0.00 0.00 0.00 177.39 178.96 2bo5 h TYR 23 N 0.00 0.00 -0.93 1.96 -0.00 -0.87 -3.13 116.97 114.01 2bo5 h TYR 23 Ca -0.32 0.00 0.23 0.00 0.00 0.00 0.00 58.73 58.64 2bo5 h TYR 23 Cb 1.69 0.00 -0.13 0.00 0.00 0.00 0.00 36.73 38.30 2bo5 h TYR 23 CO 0.00 0.00 0.45 0.66 -0.00 0.00 0.00 178.16 179.27 2bo5 h SER 24 N 0.00 0.41 0.34 0.10 4.64 -1.70 1.95 113.55 119.30 2bo5 h SER 24 Ca 0.00 0.15 -0.23 0.00 -0.47 0.00 0.00 61.79 61.24 2bo5 h SER 24 Cb 0.68 0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 2bo5 h SER 24 CO 0.00 0.01 -0.97 0.00 -0.87 0.00 0.00 176.83 175.01 2bo5 h ALA 25 N 1.72 0.33 -0.34 5.18 0.00 -1.83 -3.11 119.26 121.22 2bo5 h ALA 25 Ca 0.59 -0.72 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 2bo5 h ALA 25 Cb 1.13 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 2bo5 h ALA 25 CO -0.52 0.82 0.13 0.00 0.00 0.00 0.00 179.25 179.68 2bo5 h ALA 26 N 0.71 1.60 0.09 0.00 0.00 0.12 -2.71 119.26 119.07 2bo5 h ALA 26 Ca -0.09 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2bo5 h ALA 26 Cb 1.61 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.26 2bo5 h ALA 26 CO 0.17 0.31 -0.04 1.03 0.00 0.00 0.00 179.25 180.72 2bo5 h SER 27 N 0.47 -0.10 -0.93 0.00 0.87 0.26 1.42 113.55 115.54 2bo5 h SER 27 Ca 0.12 -0.06 0.20 0.00 -1.23 0.00 0.00 61.79 60.82 2bo5 h SER 27 Cb 0.10 0.03 -0.08 0.00 -0.44 0.00 0.00 62.40 62.01 2bo5 h SER 27 CO -0.01 -0.01 0.60 0.50 -0.53 0.00 0.00 176.83 177.38 2bo5 h LYS 28 N -0.19 0.50 0.14 2.24 3.64 -1.51 0.17 116.57 121.56 2bo5 h LYS 28 Ca -0.01 -0.03 -0.31 0.00 -1.27 0.00 0.00 60.65 59.02 2bo5 h LYS 28 Cb 0.15 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 2bo5 h LYS 28 CO 0.02 0.33 -1.55 1.96 -2.27 0.00 0.00 179.45 177.94 2bo5 h GLN 29 N 0.52 0.30 -0.11 1.90 4.20 -1.28 -3.48 115.11 117.15 2bo5 h GLN 29 Ca 0.50 -0.51 0.00 0.00 0.06 0.00 0.00 58.65 58.70 2bo5 h GLN 29 Cb 1.08 0.19 0.00 0.00 0.30 0.00 0.00 27.48 29.05 2bo5 h GLN 29 CO -0.23 1.18 0.00 0.09 -0.67 0.00 0.00 178.83 179.20 2bo5 n ASN 30 N -3.50 -0.52 -0.51 1.46 3.02 0.47 -4.98 115.26 110.70 2bo5 n ASN 30 Ca -0.18 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.43 2bo5 n ASN 30 Cb 1.05 -0.20 0.19 0.00 -0.61 0.00 0.00 39.78 40.21 2bo5 n ASN 30 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2bo5 n LYS 31 N -0.78 1.65 -0.42 3.52 4.76 0.01 -4.29 118.16 122.60 2bo5 n LYS 31 Ca 0.00 -1.00 0.40 0.00 -2.87 0.00 0.00 58.31 54.84 2bo5 n LYS 31 Cb 0.20 -1.26 0.74 0.00 -1.84 0.00 0.00 35.03 32.87 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 1.71 0.00 -0.15 -0.35 -0.00 -1.92 2.57 115.31 117.16 2bo5 h LEU 32 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 57.88 57.65 2bo5 h LEU 32 Cb 0.39 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.04 2bo5 h LEU 32 CO 0.00 0.00 -0.98 -0.08 -0.00 0.00 0.00 178.44 177.38 2bo5 h GLU 33 N 0.00 0.31 0.00 1.13 4.57 -1.96 0.93 114.58 119.55 2bo5 h GLU 33 Ca 0.67 -0.37 0.00 0.00 -1.18 0.00 0.00 59.36 58.48 2bo5 h GLU 33 Cb 2.84 0.11 0.00 0.00 -0.16 0.00 0.00 28.75 31.54 2bo5 h GLU 33 CO -0.01 1.08 -0.31 0.94 -1.18 0.00 0.00 179.01 179.53 2bo5 n GLN 34 N -3.67 0.09 -0.08 1.92 -0.06 0.80 -2.62 117.38 113.76 2bo5 n GLN 34 Ca -0.06 0.04 -0.10 0.00 -2.00 0.00 0.00 57.00 54.89 2bo5 n GLN 34 Cb 0.86 -1.58 -0.09 0.00 -4.06 0.00 0.00 30.24 25.38 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 -1.72 0.95 -0.04 1.69 0.31 0.25 -3.86 118.33 115.92 2bo5 n VAL 35 Ca 0.06 -0.45 -0.14 0.00 -0.01 0.00 0.00 64.34 63.80 2bo5 n VAL 35 Cb 0.37 -0.93 -0.09 0.00 -0.91 0.00 0.00 33.84 32.28 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 0.22 0.00 5.55 4.22 0.77 -1.67 114.58 123.67 2bo5 h GLU 36 Ca -0.37 -0.15 -0.04 0.00 0.08 0.00 0.00 59.36 58.88 2bo5 h GLU 36 Cb 1.68 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.94 2bo5 h GLU 36 CO -0.03 0.74 -0.20 -0.22 -2.18 0.00 0.00 179.01 177.12 2bo5 h LYS 37 N -0.27 0.00 -0.57 1.92 3.11 -1.65 0.47 116.57 119.58 2bo5 h LYS 37 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 2bo5 h LYS 37 Cb 0.74 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.97 2bo5 h LYS 37 CO 0.03 0.20 0.00 0.39 -2.81 0.00 0.00 179.45 177.27 2bo5 n GLU 38 N -3.92 2.36 -0.04 1.90 4.71 -1.08 -3.48 120.64 121.09 2bo5 n GLU 38 Ca -0.02 -1.42 -0.05 0.00 -0.01 0.00 0.00 57.16 55.66 2bo5 n GLU 38 Cb 0.29 -1.57 -0.05 0.00 -1.01 0.00 0.00 31.44 29.10 2bo5 n GLU 38 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2bo5 n LEU 39 N 0.44 1.43 0.16 -4.62 4.32 0.12 -4.45 117.00 114.41 2bo5 n LEU 39 Ca 0.13 -0.02 0.03 0.00 -0.02 0.00 0.00 56.01 56.12 2bo5 n LEU 39 Cb 0.51 -0.06 0.22 0.00 -1.62 0.00 0.00 43.42 42.47 2bo5 n LEU 39 CO 0.12 0.40 0.57 0.25 -1.22 0.00 0.00 177.39 177.51 2bo5 h LEU 40 N 0.00 0.00 -0.54 2.23 5.85 -1.54 -3.10 115.31 118.20 2bo5 h LEU 40 Ca -0.19 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.45 2bo5 h LEU 40 Cb 1.37 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.38 2bo5 h LEU 40 CO -0.01 0.49 0.04 0.03 -0.34 0.00 0.00 178.44 178.66 2bo5 h ARG 41 N 0.00 0.93 -0.06 1.25 2.47 -1.79 -2.13 114.38 115.05 2bo5 h ARG 41 Ca -0.00 -0.27 0.02 0.00 -1.26 0.00 0.00 59.98 58.46 2bo5 h ARG 41 Cb 1.07 -0.10 -0.00 0.00 -1.65 0.00 0.00 29.97 29.29 2bo5 h ARG 41 CO 0.06 0.92 0.05 0.28 0.56 0.00 0.00 179.97 181.84 2bo5 h VAL 42 N 0.81 0.74 0.13 2.04 2.07 -1.75 -0.47 116.25 119.82 2bo5 h VAL 42 Ca 0.16 0.00 -0.28 0.00 0.82 0.00 0.00 66.70 67.40 2bo5 h VAL 42 Cb 0.47 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 2bo5 h VAL 42 CO 0.02 0.00 -1.27 1.23 0.02 0.00 0.00 177.57 177.57 2bo5 h GLY 43 N 0.00 0.31 1.98 2.17 0.00 -1.47 -3.26 103.07 102.80 2bo5 h GLY 43 Ca 0.03 -0.80 -0.11 0.00 0.00 0.00 0.00 47.33 46.45 2bo5 h GLY 43 CO -0.00 0.70 -0.52 -1.61 0.00 0.00 0.00 176.54 175.11 2bo5 h GLN 44 N 0.07 0.02 -0.39 4.80 4.15 -0.61 -2.74 115.11 120.42 2bo5 h GLN 44 Ca -0.14 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.27 2bo5 h GLN 44 Cb 1.98 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 29.65 2bo5 h GLN 44 CO 0.20 0.53 0.25 0.82 -1.93 0.00 0.00 178.83 178.70 2bo5 h ILE 45 N 0.01 1.10 0.00 2.39 2.04 -1.18 0.23 117.51 122.11 2bo5 h ILE 45 Ca -0.00 -0.20 -0.18 0.00 1.00 0.00 0.00 64.86 65.47 2bo5 h ILE 45 Cb 0.93 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 2bo5 h ILE 45 CO 0.07 0.10 -0.93 -0.07 0.00 0.00 0.00 178.15 177.32 2bo5 h LEU 46 N 0.53 0.00 -0.45 1.44 3.38 -1.59 -3.24 115.31 115.38 2bo5 h LEU 46 Ca 0.14 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.97 2bo5 h LEU 46 Cb -0.05 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2bo5 h LEU 46 CO -0.03 0.82 -0.65 0.50 0.09 0.00 0.00 178.44 179.17 2bo5 h LYS 47 N 0.00 0.00 -6.01 1.13 1.63 -0.96 -3.38 116.57 108.98 2bo5 h LYS 47 Ca -0.04 0.00 -0.59 0.00 -0.85 0.00 0.00 60.65 59.17 2bo5 h LYS 47 Cb 1.66 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 33.29 2bo5 h LYS 47 CO 0.10 0.65 1.48 -1.21 -3.45 0.00 0.00 179.45 177.02 2bo5 s GLU 48 N -3.23 3.17 0.38 1.90 2.02 0.70 -4.84 118.70 118.79 2bo5 s GLU 48 Ca 0.01 2.03 0.12 0.00 0.02 0.00 0.00 54.97 57.15 2bo5 s GLU 48 Cb 0.11 -4.36 0.92 0.00 0.10 0.00 0.00 34.13 30.89 2bo5 s GLU 48 CO 0.76 -2.06 1.86 -1.35 0.02 0.00 0.00 175.26 174.49 2bo5 h PRO 49 N 14.86 0.56 -0.04 0.39 0.11 -1.89 1.05 132.00 147.04 2bo5 h PRO 49 Ca -0.41 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2bo5 h PRO 49 Cb 1.24 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2bo5 h PRO 49 CO 0.96 0.37 0.00 1.17 -0.21 0.00 0.00 178.00 180.29 2bo5 n LYS 50 N -4.55 1.38 -0.01 1.05 0.00 -1.26 -3.77 118.16 110.99 2bo5 n LYS 50 Ca 0.18 -0.56 -0.01 0.00 0.00 0.00 0.00 58.31 57.92 2bo5 n LYS 50 Cb 0.55 -1.44 -0.02 0.00 0.00 0.00 0.00 35.03 34.12 2bo5 n LYS 50 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.40 177.28 2bo5 n MET 51 N -0.29 3.48 0.20 1.64 1.56 0.18 -4.59 117.12 119.30 2bo5 n MET 51 Ca 0.19 -0.00 -0.15 0.00 -0.27 0.00 0.00 57.70 57.47 2bo5 n MET 51 Cb 0.23 -1.08 -0.08 0.00 2.15 0.00 0.00 33.22 34.44 2bo5 n MET 51 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2bo5 h ALA 52 N 0.15 -0.47 -0.07 -5.12 0.00 0.74 0.34 119.26 114.83 2bo5 h ALA 52 Ca -0.08 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.71 2bo5 h ALA 52 Cb 1.18 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 2bo5 h ALA 52 CO 0.00 -0.70 0.16 0.00 0.00 0.00 0.00 179.25 178.71 2bo5 h ALA 53 N 0.02 1.42 0.00 0.00 0.00 -1.81 0.83 119.26 119.72 2bo5 h ALA 53 Ca -0.05 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 2bo5 h ALA 53 Cb 0.43 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2bo5 h ALA 53 CO 0.08 -0.19 -0.84 0.77 0.00 0.00 0.00 179.25 179.06 2bo5 h SER 54 N 0.00 0.00 0.41 0.00 0.02 -1.68 -2.97 113.55 109.33 2bo5 h SER 54 Ca 0.03 -0.39 -0.09 0.00 -0.84 0.00 0.00 61.79 60.51 2bo5 h SER 54 Cb 0.35 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 2bo5 h SER 54 CO -0.00 1.17 -0.41 0.25 -1.14 0.00 0.00 176.83 176.70 2bo5 h LEU 55 N -1.00 0.00 0.00 5.07 5.85 0.00 -2.63 115.31 122.60 2bo5 h LEU 55 Ca -0.19 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.53 2bo5 h LEU 55 Cb 0.97 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.00 2bo5 h LEU 55 CO -0.12 0.41 -0.29 0.25 -0.34 0.00 0.00 178.44 178.35 2bo5 h LEU 56 N 0.00 0.00 -9.79 2.25 6.46 0.51 -3.47 115.31 111.28 2bo5 h LEU 56 Ca -0.00 -0.00 -0.56 0.00 -0.12 0.00 0.00 57.88 57.19 2bo5 h LEU 56 Cb 0.73 0.00 0.12 0.00 -0.73 0.00 0.00 40.66 40.78 2bo5 h LEU 56 CO 0.05 0.00 0.50 -3.20 -0.62 0.00 0.00 178.44 175.18 2bo5 n ASN 57 N -2.94 2.67 0.00 1.25 5.15 -0.99 -4.87 115.26 115.53 2bo5 n ASN 57 Ca 0.03 1.16 0.13 0.00 -0.60 0.00 0.00 54.58 55.30 2bo5 n ASN 57 Cb 0.53 -1.49 0.77 0.00 -0.53 0.00 0.00 39.78 39.06 2bo5 n ASN 57 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2bo5 n PRO 58 N 0.32 0.94 0.00 1.20 -0.04 -1.26 -3.22 135.00 132.94 2bo5 n PRO 58 Ca 0.05 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.46 2bo5 n PRO 58 Cb 0.38 -1.43 -0.12 0.00 -0.04 0.00 0.00 33.50 32.29 2bo5 n PRO 58 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2bo5 h TYR 59 N 0.00 0.00 -0.28 0.54 -1.99 -1.91 -3.34 116.97 110.00 2bo5 h TYR 59 Ca 0.00 0.00 0.08 0.00 2.00 0.00 0.00 58.73 60.81 2bo5 h TYR 59 Cb 0.00 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.72 2bo5 h TYR 59 CO 0.00 0.83 0.26 -0.39 -0.00 0.00 0.00 178.16 178.86 2bo5 h VAL 60 N 0.00 0.56 -2.75 -2.88 -1.51 -1.82 -3.48 116.25 104.38 2bo5 h VAL 60 Ca -0.23 0.00 0.25 0.00 -1.23 0.00 0.00 66.70 65.49 2bo5 h VAL 60 Cb 1.84 0.80 -0.06 0.00 -2.13 0.00 0.00 31.29 31.74 2bo5 h VAL 60 CO 0.07 0.00 -0.33 0.29 -1.23 0.00 0.00 177.57 176.37 2bo5 n LYS 61 N -3.98 -1.84 -0.10 5.19 4.76 -1.25 -1.76 118.16 119.17 2bo5 n LYS 61 Ca 0.04 1.21 -0.14 0.00 -2.87 0.00 0.00 58.31 56.55 2bo5 n LYS 61 Cb 0.41 -2.25 -0.06 0.00 -1.84 0.00 0.00 35.03 31.30 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 -3.39 0.52 0.03 1.97 0.63 -1.26 -3.65 116.66 111.51 2bo5 n ARG 62 Ca 0.01 0.39 -0.12 0.00 -0.92 0.00 0.00 57.85 57.21 2bo5 n ARG 62 Cb 0.42 -1.59 -0.08 0.00 0.45 0.00 0.00 32.46 31.66 2bo5 n ARG 62 CO 0.00 0.00 0.00 0.77 -2.51 0.00 0.00 177.63 175.89 2bo5 h SER 63 N -1.00 -0.02 -0.97 6.15 0.02 -1.89 -2.70 113.55 113.13 2bo5 h SER 63 Ca -0.21 -0.18 0.04 0.00 -0.84 0.00 0.00 61.79 60.60 2bo5 h SER 63 Cb 1.03 0.01 -0.06 0.00 0.14 0.00 0.00 62.40 63.52 2bo5 h SER 63 CO -0.13 0.16 0.64 0.58 -1.14 0.00 0.00 176.83 176.94 2bo5 h VAL 64 N -0.21 1.15 -0.09 2.27 2.07 -1.81 -0.88 116.25 118.74 2bo5 h VAL 64 Ca -0.00 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.10 2bo5 h VAL 64 Cb 0.20 -0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 29.80 2bo5 h VAL 64 CO 0.00 0.22 0.06 0.50 0.02 0.00 0.00 177.57 178.38 2bo5 h LYS 65 N 1.21 0.12 -0.16 1.57 1.63 -1.17 -2.04 116.57 117.73 2bo5 h LYS 65 Ca 0.39 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 60.18 2bo5 h LYS 65 Cb 0.04 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.64 2bo5 h LYS 65 CO -0.13 0.08 0.09 0.28 -3.45 0.00 0.00 179.45 176.32 2bo5 h VAL 66 N 0.12 1.09 -0.59 2.00 2.07 -0.83 0.23 116.25 120.34 2bo5 h VAL 66 Ca 0.03 -0.24 -0.10 0.00 0.82 0.00 0.00 66.70 67.22 2bo5 h VAL 66 Cb -0.01 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 2bo5 h VAL 66 CO -0.01 0.08 -0.01 0.50 0.02 0.00 0.00 177.57 178.16 2bo5 h LYS 67 N 0.16 1.04 0.00 1.57 3.64 -1.40 -2.53 116.57 119.05 2bo5 h LYS 67 Ca 0.06 -0.33 -0.08 0.00 -1.27 0.00 0.00 60.65 59.03 2bo5 h LYS 67 Cb 0.06 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 2bo5 h LYS 67 CO -0.01 1.02 -0.38 1.03 -2.27 0.00 0.00 179.45 178.84 2bo5 h SER 68 N 0.95 0.00 -0.41 4.20 0.87 -1.15 -2.79 113.55 115.21 2bo5 h SER 68 Ca 0.17 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.58 2bo5 h SER 68 Cb 0.56 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.51 2bo5 h SER 68 CO 0.03 0.38 -0.32 -0.07 -0.53 0.00 0.00 176.83 176.32 2bo5 h LEU 69 N 0.00 1.00 -1.29 2.23 3.38 -0.15 0.45 115.31 120.93 2bo5 h LEU 69 Ca -0.00 -0.44 -0.05 0.00 0.09 0.00 0.00 57.88 57.48 2bo5 h LEU 69 Cb 0.72 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2bo5 h LEU 69 CO 0.05 1.23 -0.21 0.28 0.09 0.00 0.00 178.44 179.87 2bo5 h SER 70 N 0.78 0.00 0.27 -0.43 0.02 -1.27 0.89 113.55 113.80 2bo5 h SER 70 Ca 0.08 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.69 2bo5 h SER 70 Cb 0.91 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.41 2bo5 h SER 70 CO 0.08 0.21 -1.95 -0.67 -1.14 0.00 0.00 176.83 173.37 2bo5 n ASP 71 N -3.46 1.27 0.10 3.07 -0.08 -1.07 -3.79 116.55 112.60 2bo5 n ASP 71 Ca -0.00 0.25 -0.02 0.00 -1.51 0.00 0.00 54.79 53.50 2bo5 n ASP 71 Cb 0.39 -0.23 -0.05 0.00 2.34 0.00 0.00 41.12 43.57 2bo5 n ASP 71 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2bo5 h MET 72 N 0.02 0.00 0.00 -0.67 -0.00 0.04 -3.12 114.93 111.21 2bo5 h MET 72 Ca -0.39 0.00 -0.06 0.00 -0.00 0.00 0.00 59.70 59.26 2bo5 h MET 72 Cb 2.04 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 33.63 2bo5 h MET 72 CO 0.06 0.75 -0.26 0.00 -0.00 0.00 0.00 176.91 177.46 2bo5 h THR 73 N 0.00 1.10 -0.83 -0.10 1.03 0.68 -1.41 112.91 113.38 2bo5 h THR 73 Ca -0.01 -0.92 0.24 0.00 -0.01 0.00 0.00 66.41 65.71 2bo5 h THR 73 Cb 1.58 1.51 -0.03 0.00 -1.07 0.00 0.00 68.15 70.14 2bo5 h THR 73 CO 0.10 0.26 0.68 0.00 -0.01 0.00 0.00 175.52 176.55 2bo5 h ALA 74 N 1.74 2.71 0.00 0.00 0.00 -1.63 0.58 119.26 122.65 2bo5 h ALA 74 Ca -0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2bo5 h ALA 74 Cb 0.49 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2bo5 h ALA 74 CO 0.03 -1.11 -1.96 1.63 0.00 0.00 0.00 179.25 177.84 2bo5 n LYS 75 N -3.99 0.66 0.08 0.00 5.02 -0.57 -4.58 118.16 114.77 2bo5 n LYS 75 Ca 0.17 -0.16 -0.04 0.00 -2.02 0.00 0.00 58.31 56.26 2bo5 n LYS 75 Cb 0.98 -1.54 -0.02 0.00 -0.02 0.00 0.00 35.03 34.42 2bo5 n LYS 75 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2bo5 h GLU 76 N 0.00 -0.26 0.00 1.97 4.39 0.53 -3.49 114.58 117.72 2bo5 h GLU 76 Ca -0.05 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2bo5 h GLU 76 Cb 1.12 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.82 2bo5 h GLU 76 CO 0.00 -0.17 0.00 1.63 -1.16 0.00 0.00 179.01 179.31 2bo5 n LYS 77 N -4.11 0.00 -0.29 2.33 5.02 -0.10 -5.01 118.16 116.01 2bo5 n LYS 77 Ca -0.03 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.17 2bo5 n LYS 77 Cb 0.10 0.00 0.09 0.00 -0.02 0.00 0.00 35.03 35.20 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 -1.89 0.00 2.13 3.72 -1.25 -4.79 117.46 115.38 2bo5 n PHE 78 Ca 0.00 -0.03 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 2bo5 n PHE 78 Cb 0.00 -0.77 0.00 0.00 -0.94 0.00 0.00 39.48 37.77 2bo5 n PHE 78 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2bo5 n SER 79 N -1.40 0.00 -0.01 4.37 7.64 -1.26 -4.70 113.62 118.26 2bo5 n SER 79 Ca 0.04 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.91 2bo5 n SER 79 Cb 0.17 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.37 2bo5 n SER 79 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2bo5 n PRO 80 N 0.00 0.04 -0.27 1.43 -0.04 -1.26 -3.94 135.00 130.96 2bo5 n PRO 80 Ca 0.00 0.01 0.10 0.00 -0.04 0.00 0.00 63.50 63.58 2bo5 n PRO 80 Cb 0.00 -0.56 0.27 0.00 -0.04 0.00 0.00 33.50 33.17 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 -2.64 3.19 0.00 1.53 7.99 -1.26 -3.82 117.00 121.99 2bo5 n LEU 81 Ca -0.01 -1.54 0.00 0.00 -0.01 0.00 0.00 56.01 54.45 2bo5 n LEU 81 Cb 0.04 -0.35 0.00 0.00 -0.11 0.00 0.00 43.42 42.99 2bo5 n LEU 81 CO 0.01 0.77 0.16 0.41 -1.51 0.00 0.00 177.39 177.23 2bo5 n THR 82 N 1.26 0.05 -0.21 -5.08 -1.04 -1.26 -4.57 114.28 103.43 2bo5 n THR 82 Ca 0.20 -0.29 -0.12 0.00 -2.04 0.00 0.00 64.05 61.80 2bo5 n THR 82 Cb 0.52 1.40 0.10 0.00 -1.82 0.00 0.00 70.33 70.53 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 -0.03 3.42 0.00 8.00 2.88 -1.25 -1.91 113.62 124.73 2bo5 n SER 83 Ca 0.00 -2.86 0.00 0.00 -1.33 0.00 0.00 58.87 54.68 2bo5 n SER 83 Cb 0.14 -0.68 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 0.59 -1.23 0.00 0.00 175.04 174.40 2bo5 n ASN 84 N -0.37 0.00 0.26 -3.46 4.13 -1.26 -4.77 115.26 109.78 2bo5 n ASN 84 Ca 0.32 0.00 0.17 0.00 1.68 0.00 0.00 54.58 56.75 2bo5 n ASN 84 Cb 1.13 0.06 0.69 0.00 -1.54 0.00 0.00 39.78 40.12 2bo5 n ASN 84 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 2bo5 h LEU 85 N 0.00 0.00 -0.16 3.41 5.85 -1.80 -2.81 115.31 119.80 2bo5 h LEU 85 Ca 0.00 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 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 0.00 -0.06 0.40 -0.34 0.00 0.00 178.44 178.44 2bo5 h ILE 86 N 0.00 1.30 -0.24 4.05 5.03 -1.68 -1.96 117.51 124.01 2bo5 h ILE 86 Ca 0.00 -1.08 -0.08 0.00 -0.12 0.00 0.00 64.86 63.58 2bo5 h ILE 86 Cb 0.46 1.68 -0.01 0.00 -3.03 0.00 0.00 36.82 35.91 2bo5 h ILE 86 CO 0.00 0.32 -0.21 0.78 -0.68 0.00 0.00 178.15 178.36 2bo5 h ASN 87 N 0.01 0.43 -0.48 1.72 4.21 -1.78 -2.18 115.58 117.51 2bo5 h ASN 87 Ca 0.04 -0.13 -0.09 0.00 1.21 0.00 0.00 56.30 57.33 2bo5 h ASN 87 Cb 0.52 -0.12 -0.02 0.00 -1.12 0.00 0.00 38.32 37.59 2bo5 h ASN 87 CO 0.02 0.65 -0.02 0.25 -1.29 0.00 0.00 177.43 177.04 2bo5 h LEU 88 N 0.39 0.89 -0.77 1.61 7.12 -1.40 0.44 115.31 123.58 2bo5 h LEU 88 Ca 0.06 -0.24 -0.13 0.00 0.13 0.00 0.00 57.88 57.70 2bo5 h LEU 88 Cb 0.59 -0.24 -0.02 0.00 -0.53 0.00 0.00 40.66 40.47 2bo5 h LEU 88 CO 0.04 0.96 -0.61 -0.07 -0.13 0.00 0.00 178.44 178.63 2bo5 h LEU 89 N 0.84 0.01 -3.40 2.25 3.38 -1.07 -2.90 115.31 114.42 2bo5 h LEU 89 Ca 0.15 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2bo5 h LEU 89 Cb 0.52 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2bo5 h LEU 89 CO 0.03 0.62 0.00 0.00 0.09 0.00 0.00 178.44 179.18 2bo5 n ALA 90 N -2.43 3.42 -0.06 1.53 0.00 -0.85 -0.74 120.51 121.40 2bo5 n ALA 90 Ca -0.01 -2.04 -0.21 0.00 0.00 0.00 0.00 53.44 51.18 2bo5 n ALA 90 Cb 0.61 -0.93 -0.12 0.00 0.00 0.00 0.00 19.45 19.00 2bo5 n ALA 90 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2bo5 h GLU 91 N 3.08 0.09 -0.32 0.00 4.57 0.10 -3.39 114.58 118.70 2bo5 h GLU 91 Ca 0.00 -0.16 0.00 0.00 -1.18 0.00 0.00 59.36 58.02 2bo5 h GLU 91 Cb 1.70 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 30.35 2bo5 h GLU 91 CO 0.35 1.08 0.00 0.09 -1.18 0.00 0.00 179.01 179.35 2bo5 n ASN 92 N -4.18 3.13 -0.67 1.04 3.02 -1.26 -4.96 115.26 111.38 2bo5 n ASN 92 Ca -0.29 -2.22 -0.02 0.00 -0.03 0.00 0.00 54.58 52.02 2bo5 n ASN 92 Cb 0.77 -0.30 0.00 0.00 -0.61 0.00 0.00 39.78 39.65 2bo5 n ASN 92 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bo5 n GLY 93 N 0.28 0.83 0.00 7.41 0.00 -1.26 -4.94 105.19 107.52 2bo5 n GLY 93 Ca 0.14 -0.63 0.13 0.00 0.00 0.00 0.00 46.02 45.66 2bo5 n GLY 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bo5 n ARG 94 N -0.81 0.49 -1.09 1.61 5.12 0.08 -4.45 116.66 117.61 2bo5 n ARG 94 Ca -0.00 0.03 -0.38 0.00 -1.93 0.00 0.00 57.85 55.56 2bo5 n ARG 94 Cb 0.50 -1.50 -0.04 0.00 -1.16 0.00 0.00 32.46 30.26 2bo5 n ARG 94 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2bo5 n LEU 95 N -1.22 4.48 0.00 0.55 4.77 -1.12 -2.39 117.00 122.06 2bo5 n LEU 95 Ca 0.15 -2.97 0.00 0.00 -0.03 0.00 0.00 56.01 53.15 2bo5 n LEU 95 Cb 0.19 -1.14 0.00 0.00 -2.33 0.00 0.00 43.42 40.13 2bo5 n LEU 95 CO 0.19 -0.03 0.00 0.35 -1.33 0.00 0.00 177.39 176.57 2bo5 n THR 96 N 5.52 0.00 -0.74 -5.08 -2.24 -1.26 -4.89 114.28 105.58 2bo5 n THR 96 Ca 0.49 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 62.34 2bo5 n THR 96 Cb 0.34 -0.00 0.22 0.00 -2.10 0.00 0.00 70.33 68.79 2bo5 n THR 96 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2bo5 n ASN 97 N -1.62 3.56 -0.35 3.42 5.03 -1.01 -4.77 115.26 119.52 2bo5 n ASN 97 Ca 0.00 -2.71 0.04 0.00 0.87 0.00 0.00 54.58 52.78 2bo5 n ASN 97 Cb 0.00 -0.44 0.10 0.00 -1.02 0.00 0.00 39.78 38.42 2bo5 n ASN 97 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 2bo5 n THR 98 N -0.22 -0.42 -0.34 3.41 -1.04 -1.17 0.43 114.28 114.92 2bo5 n THR 98 Ca 0.18 2.17 0.22 0.00 -2.04 0.00 0.00 64.05 64.57 2bo5 n THR 98 Cb 0.74 -2.96 0.45 0.00 -1.82 0.00 0.00 70.33 66.75 2bo5 n THR 98 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 2bo5 h PRO 99 N 0.00 0.43 0.00 -2.82 0.11 -1.91 0.98 132.00 128.79 2bo5 h PRO 99 Ca 0.41 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.45 2bo5 h PRO 99 Cb 0.65 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 2bo5 h PRO 99 CO -0.96 0.28 -0.23 0.00 -0.21 0.00 0.00 178.00 176.88 2bo5 h ALA 100 N 1.72 1.35 -0.36 -0.75 0.00 -0.41 -2.77 119.26 118.05 2bo5 h ALA 100 Ca 0.67 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 55.27 2bo5 h ALA 100 Cb 1.49 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 2bo5 h ALA 100 CO -0.46 0.29 -0.13 0.28 0.00 0.00 0.00 179.25 179.23 2bo5 h VAL 101 N 0.00 1.28 0.00 0.00 2.07 0.11 -2.75 116.25 116.96 2bo5 h VAL 101 Ca -0.00 -1.23 -0.00 0.00 0.82 0.00 0.00 66.70 66.28 2bo5 h VAL 101 Cb 0.50 1.33 -0.00 0.00 -1.52 0.00 0.00 31.29 31.59 2bo5 h VAL 101 CO 0.03 0.41 -0.01 0.40 0.02 0.00 0.00 177.57 178.41 2bo5 h ILE 102 N 0.51 0.10 -0.02 4.57 2.04 -1.21 -1.91 117.51 121.59 2bo5 h ILE 102 Ca 0.08 -0.19 -0.09 0.00 1.00 0.00 0.00 64.86 65.66 2bo5 h ILE 102 Cb 0.66 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 2bo5 h ILE 102 CO 0.04 0.01 -0.40 0.77 0.00 0.00 0.00 178.15 178.58 2bo5 h SER 103 N 0.00 0.04 1.08 1.72 4.64 -1.44 -2.50 113.55 117.09 2bo5 h SER 103 Ca -0.00 -0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 61.18 2bo5 h SER 103 Cb 0.17 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.23 2bo5 h SER 103 CO 0.00 0.44 -0.59 0.00 -0.87 0.00 0.00 176.83 175.81 2bo5 h ALA 104 N 1.56 0.73 -0.19 5.18 0.00 -1.43 -3.19 119.26 121.92 2bo5 h ALA 104 Ca 0.00 -0.54 -0.21 0.00 0.00 0.00 0.00 54.91 54.16 2bo5 h ALA 104 Cb 0.73 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.43 2bo5 h ALA 104 CO 0.05 0.74 -0.71 0.35 0.00 0.00 0.00 179.25 179.69 2bo5 h PHE 105 N 0.00 1.05 0.00 0.00 3.04 -1.48 -1.95 116.94 117.60 2bo5 h PHE 105 Ca -0.01 -0.43 0.00 0.00 3.98 0.00 0.00 57.97 61.51 2bo5 h PHE 105 Cb 1.29 -0.17 0.00 0.00 2.56 0.00 0.00 35.95 39.63 2bo5 h PHE 105 CO 0.00 1.26 0.00 0.43 -2.02 0.00 0.00 178.31 177.98 2bo5 n SER 106 N -3.95 0.00 -0.09 0.41 7.64 -0.98 -1.28 113.62 115.38 2bo5 n SER 106 Ca -0.06 -0.60 -0.13 0.00 1.01 0.00 0.00 58.87 59.10 2bo5 n SER 106 Cb 0.71 -0.10 -0.08 0.00 -1.01 0.00 0.00 64.21 63.73 2bo5 n SER 106 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2bo5 n THR 107 N -1.10 0.99 0.26 0.44 -1.04 -1.16 -4.39 114.28 108.28 2bo5 n THR 107 Ca 0.18 -0.37 0.15 0.00 -2.04 0.00 0.00 64.05 61.97 2bo5 n THR 107 Cb 0.13 -1.17 0.43 0.00 -1.82 0.00 0.00 70.33 67.91 2bo5 n THR 107 CO 0.00 0.00 0.00 -0.03 -0.64 0.00 0.00 175.07 174.40 2bo5 h MET 108 N -0.06 0.00 -0.94 -2.82 1.85 -1.36 -2.95 114.93 108.64 2bo5 h MET 108 Ca -0.39 0.00 0.03 0.00 -0.61 0.00 0.00 59.70 58.73 2bo5 h MET 108 Cb 1.58 0.00 -0.05 0.00 0.43 0.00 0.00 31.60 33.55 2bo5 h MET 108 CO -0.08 0.00 0.62 0.00 -0.40 0.00 0.00 176.91 177.05 2bo5 h MET 109 N 0.00 1.17 -0.05 0.39 3.00 -1.39 0.87 114.93 118.91 2bo5 h MET 109 Ca 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 59.70 59.65 2bo5 h MET 109 Cb 0.75 -0.26 -0.00 0.00 0.00 0.00 0.00 31.60 32.08 2bo5 h MET 109 CO 0.00 0.77 0.14 0.77 0.00 0.00 0.00 176.91 178.59 2bo5 h SER 110 N 1.20 0.00 0.14 -0.10 0.02 -1.73 0.42 113.55 113.50 2bo5 h SER 110 Ca 0.37 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 61.06 2bo5 h SER 110 Cb -0.01 0.00 0.03 0.00 0.14 0.00 0.00 62.40 62.55 2bo5 h SER 110 CO -0.11 0.00 -1.09 0.58 -1.14 0.00 0.00 176.83 175.07 2bo5 h VAL 111 N 0.00 1.37 -0.00 2.27 2.07 -0.98 -0.61 116.25 120.36 2bo5 h VAL 111 Ca 0.03 -2.48 -0.16 0.00 0.82 0.00 0.00 66.70 64.90 2bo5 h VAL 111 Cb 0.30 2.91 -0.02 0.00 -1.52 0.00 0.00 31.29 32.96 2bo5 h VAL 111 CO -0.00 0.73 -0.75 1.12 0.02 0.00 0.00 177.57 178.69 2bo5 h HIS 112 N 0.01 0.01 0.01 1.57 -0.00 -1.07 0.11 115.15 115.79 2bo5 h HIS 112 Ca -0.18 -0.00 -0.24 0.00 -0.00 0.00 0.00 60.37 59.95 2bo5 h HIS 112 Cb 1.82 -0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 29.20 2bo5 h HIS 112 CO 0.15 0.75 -1.25 -0.09 -0.00 0.00 0.00 177.93 177.49 2bo5 h ARG 113 N 0.00 0.02 0.00 5.12 2.43 -1.06 -3.26 114.38 117.63 2bo5 h ARG 113 Ca -0.01 -0.04 -0.21 0.00 -0.81 0.00 0.00 59.98 58.91 2bo5 h ARG 113 Cb 1.33 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.86 2bo5 h ARG 113 CO 0.10 0.86 -1.40 0.78 -1.51 0.00 0.00 179.97 178.80 2bo5 h GLY 114 N 3.04 0.00 -3.86 2.80 0.00 -1.10 -3.33 103.07 100.62 2bo5 h GLY 114 Ca -0.11 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.71 2bo5 h GLY 114 CO 0.12 0.00 0.64 1.18 0.00 0.00 0.00 176.54 178.48 2bo5 n GLU 115 N -3.03 2.22 -2.08 4.80 -0.58 0.36 -4.99 120.64 117.35 2bo5 n GLU 115 Ca -0.10 -2.82 -0.34 0.00 -0.42 0.00 0.00 57.16 53.47 2bo5 n GLU 115 Cb 0.92 -2.11 0.02 0.00 -0.57 0.00 0.00 31.44 29.70 2bo5 n GLU 115 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2bo5 s VAL 116 N -3.28 3.25 -0.40 2.62 -7.23 -1.23 -4.94 120.40 109.19 2bo5 s VAL 116 Ca 0.54 0.69 -0.28 0.00 -1.81 0.00 0.00 61.98 61.12 2bo5 s VAL 116 Cb 0.45 -3.23 -0.01 0.00 0.56 0.00 0.00 36.38 34.14 2bo5 s VAL 116 CO 0.08 -0.25 1.70 -2.16 -0.31 0.00 0.00 175.10 174.17 2bo5 s PRO 117 N -3.62 3.29 -0.21 4.82 0.04 -1.26 -4.82 135.00 133.24 2bo5 s PRO 117 Ca 0.70 1.17 -0.02 0.00 0.04 0.00 0.00 61.00 62.88 2bo5 s PRO 117 Cb -0.22 -4.18 -0.12 0.00 0.04 0.00 0.00 34.50 30.02 2bo5 s PRO 117 CO 0.32 -1.92 -0.21 0.00 0.04 0.00 0.00 177.00 175.24 2bo5 s THR 119 N -2.40 0.78 0.00 0.00 -4.23 -1.26 -5.33 115.64 103.19 2bo5 s THR 119 Ca -0.28 -0.51 0.00 0.00 -1.18 0.00 0.00 61.69 59.72 2bo5 s THR 119 Cb 0.08 -1.09 0.00 0.00 1.34 0.00 0.00 72.50 72.84 2bo5 s THR 119 CO 0.44 0.01 0.00 0.52 -0.54 0.00 0.00 174.62 175.05