#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b5s s ILE 1 N 0.00 0.18 0.27 1.12 -5.25 -1.26 -5.03 121.20 111.23 2b5s s ILE 1 Ca 0.00 -1.48 0.10 0.00 -0.99 0.00 0.00 60.65 58.28 2b5s s ILE 1 Cb 0.00 -1.28 -0.04 0.00 2.95 0.00 0.00 42.46 44.09 2b5s s ILE 1 CO 0.00 -0.82 -0.06 0.42 -1.79 0.00 0.00 174.94 172.70 2b5s s THR 2 N -3.49 3.20 -0.00 8.37 -4.23 -1.26 -5.00 115.64 113.23 2b5s s THR 2 Ca 0.03 -2.03 0.32 0.00 -1.18 0.00 0.00 61.69 58.82 2b5s s THR 2 Cb 0.04 -2.70 0.36 0.00 1.34 0.00 0.00 72.50 71.55 2b5s s THR 2 CO -0.09 -0.37 1.94 0.00 -0.54 0.00 0.00 174.62 175.56 2b5s h GLY 4 N 2.00 0.29 1.20 0.00 0.00 -1.99 -1.44 103.07 103.13 2b5s h GLY 4 Ca 0.00 -0.35 -0.14 0.00 0.00 0.00 0.00 47.33 46.84 2b5s h GLY 4 CO 0.00 0.31 -0.29 1.46 0.00 0.00 0.00 176.54 178.02 2b5s h GLN 5 N 0.20 0.90 -0.04 4.80 4.20 -1.86 -1.03 115.11 122.29 2b5s h GLN 5 Ca -0.00 -0.42 -0.01 0.00 0.06 0.00 0.00 58.65 58.29 2b5s h GLN 5 Cb 1.08 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.84 2b5s h GLN 5 CO 0.09 1.07 0.00 0.28 -0.67 0.00 0.00 178.83 179.60 2b5s h VAL 6 N 0.76 1.23 -0.21 -0.54 2.07 -1.43 -1.32 116.25 116.81 2b5s h VAL 6 Ca 0.08 -0.69 -0.14 0.00 0.82 0.00 0.00 66.70 66.78 2b5s h VAL 6 Cb 0.86 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 2b5s h VAL 6 CO 0.08 0.19 -0.44 0.77 0.02 0.00 0.00 177.57 178.18 2b5s h SER 7 N -0.21 0.55 -0.55 0.57 4.64 -1.28 0.91 113.55 118.18 2b5s h SER 7 Ca 0.01 -0.25 -0.01 0.00 -0.47 0.00 0.00 61.79 61.07 2b5s h SER 7 Cb 0.30 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.21 2b5s h SER 7 CO 0.00 0.92 0.30 0.28 -0.87 0.00 0.00 176.83 177.46 2b5s h SER 8 N 0.42 0.69 -0.15 4.97 0.02 -1.17 -0.07 113.55 118.26 2b5s h SER 8 Ca 0.03 -0.09 -0.05 0.00 -0.84 0.00 0.00 61.79 60.84 2b5s h SER 8 Cb 0.94 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.30 2b5s h SER 8 CO 0.08 0.58 -0.10 0.28 -1.14 0.00 0.00 176.83 176.53 2b5s h SER 9 N 0.74 0.35 1.14 3.07 0.02 -0.97 -3.34 113.55 114.56 2b5s h SER 9 Ca 0.19 -0.45 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 2b5s h SER 9 Cb 0.05 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2b5s h SER 9 CO -0.03 0.72 -0.31 0.18 -1.14 0.00 0.00 176.83 176.24 2b5s n LEU 10 N -4.61 0.72 -0.30 5.07 4.77 0.29 -4.16 117.00 118.78 2b5s n LEU 10 Ca -0.06 0.39 0.12 0.00 -0.03 0.00 0.00 56.01 56.43 2b5s n LEU 10 Cb 0.33 -0.26 0.25 0.00 -2.33 0.00 0.00 43.42 41.41 2b5s n LEU 10 CO 0.38 -0.10 0.85 0.00 -1.33 0.00 0.00 177.39 177.19 2b5s h ALA 11 N 2.55 1.09 0.00 -1.18 0.00 -1.12 0.36 119.26 120.97 2b5s h ALA 11 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2b5s h ALA 11 Cb 0.73 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2b5s h ALA 11 CO 0.00 -0.50 0.07 -2.30 0.00 0.00 0.00 179.25 176.52 2b5s n PRO 12 N -5.37 0.07 0.03 0.00 -0.02 -1.26 -1.01 135.00 127.44 2b5s n PRO 12 Ca 0.20 0.54 0.12 0.00 -2.02 0.00 0.00 63.50 62.34 2b5s n PRO 12 Cb 0.66 -1.80 0.19 0.00 -0.02 0.00 0.00 33.50 32.53 2b5s n PRO 12 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b5s h ILE 14 N 0.00 0.41 -0.61 0.00 2.04 -1.16 -2.14 117.51 116.05 2b5s h ILE 14 Ca 0.00 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.99 2b5s h ILE 14 Cb 0.64 0.41 -0.11 0.00 -0.74 0.00 0.00 36.82 37.03 2b5s h ILE 14 CO 0.00 0.00 -0.03 -0.65 0.00 0.00 0.00 178.15 177.47 2b5s h PRO 15 N -0.21 0.09 -0.57 2.37 0.11 -1.80 -1.81 132.00 130.17 2b5s h PRO 15 Ca 0.15 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.23 2b5s h PRO 15 Cb 0.44 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 31.50 2b5s h PRO 15 CO -0.40 0.06 0.26 -0.92 -0.21 0.00 0.00 178.00 176.79 2b5s h TYR 16 N 0.09 0.84 0.00 0.65 3.20 -1.65 0.24 116.97 120.34 2b5s h TYR 16 Ca 0.31 -0.05 -0.06 0.00 3.14 0.00 0.00 58.73 62.08 2b5s h TYR 16 Cb 0.50 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 2b5s h TYR 16 CO -0.39 0.66 -0.27 -0.39 -1.64 0.00 0.00 178.16 176.13 2b5s h VAL 17 N 0.78 0.84 0.11 1.81 -1.51 -0.97 0.45 116.25 117.76 2b5s h VAL 17 Ca 0.20 -1.05 -0.32 0.00 -1.23 0.00 0.00 66.70 64.29 2b5s h VAL 17 Cb 0.15 1.63 -0.01 0.00 -2.13 0.00 0.00 31.29 30.93 2b5s h VAL 17 CO -0.02 0.26 -1.71 0.03 -1.23 0.00 0.00 177.57 174.90 2b5s h ARG 18 N 0.00 0.23 0.00 5.19 3.08 -0.88 0.16 114.38 122.16 2b5s h ARG 18 Ca -0.00 -0.40 0.00 0.00 0.07 0.00 0.00 59.98 59.65 2b5s h ARG 18 Cb 0.61 0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.81 2b5s h ARG 18 CO 0.03 1.07 0.00 0.41 -1.07 0.00 0.00 179.97 180.41 2b5s n GLY 19 N 1.76 -2.03 7.00 0.04 0.00 0.82 -4.62 105.19 108.16 2b5s n GLY 19 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.81 2b5s n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b5s n GLY 20 N -0.06 -0.74 0.19 -0.02 0.00 0.16 -4.96 105.19 99.76 2b5s n GLY 20 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.02 2b5s n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b5s n GLY 21 N 0.00 0.95 3.76 -0.02 0.00 -1.26 -4.51 105.19 104.11 2b5s n GLY 21 Ca 0.00 -1.15 -0.41 0.00 0.00 0.00 0.00 46.02 44.46 2b5s n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b5s s ALA 22 N -2.00 3.45 -0.52 4.61 0.00 -1.26 -5.00 121.76 121.05 2b5s s ALA 22 Ca 0.00 1.04 0.04 0.00 0.00 0.00 0.00 51.96 53.04 2b5s s ALA 22 Cb 0.00 -3.40 0.13 0.00 0.00 0.00 0.00 23.12 19.85 2b5s s ALA 22 CO 0.00 -0.38 0.26 0.08 0.00 0.00 0.00 175.76 175.72 2b5s s VAL 23 N -0.83 2.45 0.70 0.00 1.01 -1.26 -4.51 120.40 117.96 2b5s s VAL 23 Ca 0.49 -3.26 -0.14 0.00 0.00 0.00 0.00 61.98 59.06 2b5s s VAL 23 Cb -0.35 -2.70 0.02 0.00 0.00 0.00 0.00 36.38 33.36 2b5s s VAL 23 CO 0.44 -0.82 1.14 -2.16 0.00 0.00 0.00 175.10 173.70 2b5s s PRO 24 N -0.25 2.48 0.25 2.72 0.04 -1.26 -4.92 135.00 134.05 2b5s s PRO 24 Ca 0.17 1.50 -0.04 0.00 0.04 0.00 0.00 61.00 62.67 2b5s s PRO 24 Cb -0.25 -1.90 0.43 0.00 0.04 0.00 0.00 34.50 32.82 2b5s s PRO 24 CO -0.01 -1.52 1.77 -1.35 0.04 0.00 0.00 177.00 175.94 2b5s h PRO 25 N -0.23 0.61 -0.15 0.56 0.11 -1.99 -1.23 132.00 129.68 2b5s h PRO 25 Ca -0.47 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.64 2b5s h PRO 25 Cb 1.26 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2b5s h PRO 25 CO 0.52 0.40 0.11 0.00 -0.21 0.00 0.00 178.00 178.82 2b5s h ALA 26 N 1.49 2.05 -0.28 -0.75 0.00 -1.95 0.43 119.26 120.25 2b5s h ALA 26 Ca 0.41 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.20 2b5s h ALA 26 Cb 0.50 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2b5s h ALA 26 CO -0.31 -0.08 -0.26 0.00 0.00 0.00 0.00 179.25 178.60 2b5s h ASN 29 N 0.73 0.84 -0.15 0.00 2.35 -0.13 -1.23 115.58 117.99 2b5s h ASN 29 Ca 0.08 -0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.76 2b5s h ASN 29 Cb 0.85 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 39.01 2b5s h ASN 29 CO 0.07 0.63 -0.04 1.23 -1.65 0.00 0.00 177.43 177.68 2b5s h GLY 30 N 0.99 0.31 0.97 2.83 0.00 -0.87 0.12 103.07 107.42 2b5s h GLY 30 Ca 0.26 -0.26 0.01 0.00 0.00 0.00 0.00 47.33 47.34 2b5s h GLY 30 CO -0.05 0.23 0.37 -2.22 0.00 0.00 0.00 176.54 174.87 2b5s h ILE 31 N -0.02 1.13 -0.27 2.60 2.04 -1.07 -0.26 117.51 121.67 2b5s h ILE 31 Ca 0.04 -0.26 -0.08 0.00 1.00 0.00 0.00 64.86 65.56 2b5s h ILE 31 Cb 0.46 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 2b5s h ILE 31 CO 0.01 0.14 -0.16 0.03 0.00 0.00 0.00 178.15 178.17 2b5s h ARG 32 N 0.75 0.46 -0.25 2.37 3.08 -1.14 -2.08 114.38 117.57 2b5s h ARG 32 Ca 0.22 -0.14 -0.13 0.00 0.07 0.00 0.00 59.98 59.99 2b5s h ARG 32 Cb -0.06 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 2b5s h ARG 32 CO -0.06 0.62 -0.38 -0.97 -1.07 0.00 0.00 179.97 178.10 2b5s h ASN 33 N 0.43 0.60 -0.41 7.04 -1.24 0.26 -0.01 115.58 122.25 2b5s h ASN 33 Ca 0.08 -0.26 -0.13 0.00 0.71 0.00 0.00 56.30 56.70 2b5s h ASN 33 Cb 0.53 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 39.40 2b5s h ASN 33 CO 0.03 0.92 -0.26 0.58 -1.29 0.00 0.00 177.43 177.42 2b5s h VAL 34 N 0.47 1.28 -0.70 2.57 2.07 -0.87 0.14 116.25 121.21 2b5s h VAL 34 Ca 0.04 -1.41 -0.08 0.00 0.82 0.00 0.00 66.70 66.07 2b5s h VAL 34 Cb 0.88 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.92 2b5s h VAL 34 CO 0.08 0.48 0.14 -1.13 0.02 0.00 0.00 177.57 177.15 2b5s h ASN 35 N 0.71 1.08 0.84 0.57 -0.00 -1.17 -0.85 115.58 116.77 2b5s h ASN 35 Ca 0.08 -0.25 -0.14 0.00 -0.00 0.00 0.00 56.30 55.99 2b5s h ASN 35 Cb 0.83 -0.29 -0.02 0.00 -0.00 0.00 0.00 38.32 38.85 2b5s h ASN 35 CO 0.07 1.05 -0.67 0.78 -0.00 0.00 0.00 177.43 178.66 2b5s h ASN 36 N 1.06 0.00 -0.04 1.15 2.35 -0.86 -3.29 115.58 115.96 2b5s h ASN 36 Ca 0.21 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.80 2b5s h ASN 36 Cb 0.41 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.79 2b5s h ASN 36 CO 0.01 0.67 -0.60 0.25 -1.65 0.00 0.00 177.43 176.11 2b5s h LEU 37 N 0.00 0.59 -8.33 1.61 5.85 -0.42 -3.41 115.31 111.20 2b5s h LEU 37 Ca -0.01 -0.72 -0.65 0.00 0.84 0.00 0.00 57.88 57.34 2b5s h LEU 37 Cb 1.27 -0.18 -0.16 0.00 0.37 0.00 0.00 40.66 41.97 2b5s h LEU 37 CO 0.09 1.22 0.34 0.00 -0.34 0.00 0.00 178.44 179.75 2b5s s ALA 38 N -3.38 3.25 -0.18 1.25 0.00 -0.35 -4.86 121.76 117.49 2b5s s ALA 38 Ca -0.13 -1.73 -0.09 0.00 0.00 0.00 0.00 51.96 50.01 2b5s s ALA 38 Cb 0.04 -3.63 -0.08 0.00 0.00 0.00 0.00 23.12 19.45 2b5s s ALA 38 CO 0.83 -2.40 -0.24 0.54 0.00 0.00 0.00 175.76 174.50 2b5s n ARG 39 N 6.99 0.39 -1.53 0.00 5.12 -1.26 -4.64 116.66 121.72 2b5s n ARG 39 Ca -0.04 0.17 -0.33 0.00 -1.93 0.00 0.00 57.85 55.72 2b5s n ARG 39 Cb 0.45 -1.15 0.08 0.00 -1.16 0.00 0.00 32.46 30.68 2b5s n ARG 39 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2b5s s THR 40 N -2.34 2.80 0.14 0.55 -4.23 -1.26 -4.78 115.64 106.51 2b5s s THR 40 Ca -0.25 0.37 -0.18 0.00 -1.18 0.00 0.00 61.69 60.44 2b5s s THR 40 Cb 0.10 -2.87 -0.02 0.00 1.34 0.00 0.00 72.50 71.04 2b5s s THR 40 CO 0.32 -0.24 1.78 0.74 -0.54 0.00 0.00 174.62 176.68 2b5s h THR 41 N -0.28 1.02 -0.97 3.99 2.02 -1.94 0.50 112.91 117.26 2b5s h THR 41 Ca -0.47 -0.12 0.04 0.00 0.77 0.00 0.00 66.41 66.64 2b5s h THR 41 Cb 1.27 0.65 -0.06 0.00 -1.74 0.00 0.00 68.15 68.27 2b5s h THR 41 CO 0.51 0.06 0.63 -0.65 0.37 0.00 0.00 175.52 176.45 2b5s h PRO 42 N 0.34 1.16 -0.44 6.66 0.11 -1.92 0.90 132.00 138.81 2b5s h PRO 42 Ca 0.12 -0.07 -0.13 0.00 0.11 0.00 0.00 66.00 66.03 2b5s h PRO 42 Cb 0.01 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 30.84 2b5s h PRO 42 CO -0.06 0.77 -0.23 -0.44 -0.21 0.00 0.00 178.00 177.83 2b5s h ASP 43 N 1.20 0.97 -0.13 -2.05 5.19 -1.80 0.46 116.42 120.26 2b5s h ASP 43 Ca 0.39 -0.41 -0.07 0.00 -0.62 0.00 0.00 57.03 56.33 2b5s h ASP 43 Cb 0.05 -0.27 -0.02 0.00 0.18 0.00 0.00 39.33 39.27 2b5s h ASP 43 CO -0.13 1.17 -0.12 0.03 -3.12 0.00 0.00 179.24 177.07 2b5s h ARG 44 N 0.78 0.49 -0.03 3.56 3.08 -0.16 0.10 114.38 122.21 2b5s h ARG 44 Ca 0.10 -0.14 -0.20 0.00 0.07 0.00 0.00 59.98 59.81 2b5s h ARG 44 Cb 0.81 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.80 2b5s h ARG 44 CO 0.07 0.61 -0.83 1.96 -1.07 0.00 0.00 179.97 180.71 2b5s h GLN 45 N 0.45 0.32 -0.52 0.04 4.20 -0.65 -1.63 115.11 117.33 2b5s h GLN 45 Ca 0.08 -0.31 -0.10 0.00 0.06 0.00 0.00 58.65 58.39 2b5s h GLN 45 Cb 0.48 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 2b5s h GLN 45 CO 0.03 0.98 -0.08 0.00 -0.67 0.00 0.00 178.83 179.10 2b5s h ALA 46 N 0.92 0.88 -0.25 3.87 0.00 -0.33 -1.65 119.26 122.69 2b5s h ALA 46 Ca -0.05 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 2b5s h ALA 46 Cb 1.43 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 2b5s h ALA 46 CO 0.14 0.65 0.09 0.00 0.00 0.00 0.00 179.25 180.12 2b5s h ALA 47 N 1.05 0.33 -0.57 0.00 0.00 -0.67 0.18 119.26 119.59 2b5s h ALA 47 Ca 0.14 -0.13 0.10 0.00 0.00 0.00 0.00 54.91 55.02 2b5s h ALA 47 Cb 0.61 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.22 2b5s h ALA 47 CO 0.04 -0.06 0.13 0.00 0.00 0.00 0.00 179.25 179.36 2b5s h ASN 49 N 0.27 0.92 -0.72 0.00 -0.73 -0.80 -2.04 115.58 112.47 2b5s h ASN 49 Ca 0.29 -0.18 -0.01 0.00 1.87 0.00 0.00 56.30 58.27 2b5s h ASN 49 Cb 0.41 -0.24 -0.04 0.00 0.27 0.00 0.00 38.32 38.73 2b5s h ASN 49 CO -0.37 0.85 0.41 0.00 -0.37 0.00 0.00 177.43 177.95 2b5s h LEU 51 N 1.02 0.90 -0.19 0.00 -0.00 -0.13 -0.07 115.31 116.84 2b5s h LEU 51 Ca 0.26 -0.01 -0.15 0.00 -0.00 0.00 0.00 57.88 57.98 2b5s h LEU 51 Cb 0.01 -0.20 0.00 0.00 -0.00 0.00 0.00 40.66 40.47 2b5s h LEU 51 CO -0.04 0.61 -0.46 0.11 -0.00 0.00 0.00 178.44 178.66 2b5s h LYS 52 N 1.04 0.65 -0.19 1.13 1.57 -1.01 -1.72 116.57 118.04 2b5s h LYS 52 Ca 0.34 -0.44 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 2b5s h LYS 52 Cb 0.06 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 2b5s h LYS 52 CO -0.11 1.06 0.13 1.96 -0.57 0.00 0.00 179.45 181.92 2b5s h GLN 53 N 0.33 0.25 -0.20 3.15 4.20 -0.94 -2.38 115.11 119.53 2b5s h GLN 53 Ca -0.00 -0.02 -0.10 0.00 0.06 0.00 0.00 58.65 58.59 2b5s h GLN 53 Cb 1.08 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.79 2b5s h GLN 53 CO 0.10 0.17 -0.31 -0.07 -0.67 0.00 0.00 178.83 178.05 2b5s h LEU 54 N 0.26 0.40 -0.29 1.46 3.38 -1.04 -2.80 115.31 116.68 2b5s h LEU 54 Ca 0.07 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 2b5s h LEU 54 Cb -0.02 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2b5s h LEU 54 CO -0.01 0.70 0.02 0.28 0.09 0.00 0.00 178.44 179.52 2b5s h SER 55 N 0.34 0.47 0.25 -0.43 0.02 -1.14 -1.61 113.55 111.46 2b5s h SER 55 Ca 0.04 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2b5s h SER 55 Cb 0.73 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.14 2b5s h SER 55 CO 0.06 0.64 0.00 0.00 -1.14 0.00 0.00 176.83 176.39 2b5s h ALA 56 N 0.85 1.00 0.00 3.77 0.00 -1.33 -1.24 119.26 122.31 2b5s h ALA 56 Ca 0.08 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.82 2b5s h ALA 56 Cb 0.38 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 2b5s h ALA 56 CO 0.01 0.00 -1.13 1.03 0.00 0.00 0.00 179.25 179.16 2b5s h SER 57 N 0.00 0.00 -3.29 0.00 0.87 -1.05 -3.45 113.55 106.63 2b5s h SER 57 Ca 0.00 0.00 -0.59 0.00 -1.23 0.00 0.00 61.79 59.97 2b5s h SER 57 Cb 0.13 0.00 -0.08 0.00 -0.44 0.00 0.00 62.40 62.01 2b5s h SER 57 CO 0.00 0.70 0.44 -0.69 -0.53 0.00 0.00 176.83 176.75 2b5s s VAL 58 N -2.84 4.85 -0.17 2.23 1.01 -0.47 -5.02 120.40 119.99 2b5s s VAL 58 Ca -0.01 1.60 -0.29 0.00 0.00 0.00 0.00 61.98 63.28 2b5s s VAL 58 Cb 0.08 -4.13 -0.01 0.00 0.00 0.00 0.00 36.38 32.33 2b5s s VAL 58 CO 0.80 -0.03 1.19 -2.16 0.00 0.00 0.00 175.10 174.89 2b5s s PRO 59 N 2.57 4.26 0.00 2.72 0.04 -1.26 -3.87 135.00 139.46 2b5s s PRO 59 Ca 0.36 1.58 0.00 0.00 0.04 0.00 0.00 61.00 62.98 2b5s s PRO 59 Cb -0.16 -3.70 0.00 0.00 0.04 0.00 0.00 34.50 30.68 2b5s s PRO 59 CO 0.09 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 176.90 2b5s n GLY 60 N 3.49 0.94 3.74 0.56 0.00 -1.26 -4.99 105.19 107.66 2b5s n GLY 60 Ca 0.13 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 45.16 2b5s n GLY 60 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2b5s s VAL 61 N -2.00 3.09 -0.43 1.61 -7.23 -1.25 -4.47 120.40 109.71 2b5s s VAL 61 Ca 0.00 0.90 -0.15 0.00 -1.81 0.00 0.00 61.98 60.92 2b5s s VAL 61 Cb 0.00 -3.58 0.04 0.00 0.56 0.00 0.00 36.38 33.40 2b5s s VAL 61 CO 0.00 0.14 0.35 0.21 -0.31 0.00 0.00 175.10 175.49 2b5s s ASN 62 N 0.32 6.13 0.29 4.85 3.04 0.56 -4.98 114.94 125.16 2b5s s ASN 62 Ca 0.57 -1.02 0.01 0.00 0.04 0.00 0.00 52.86 52.46 2b5s s ASN 62 Cb -0.38 -2.18 0.70 0.00 -1.54 0.00 0.00 41.25 37.86 2b5s s ASN 62 CO 0.39 -0.54 1.61 -0.65 -3.04 0.00 0.00 177.10 174.88 2b5s h PRO 63 N 8.69 0.10 -0.33 0.43 0.11 -1.94 -0.92 132.00 138.13 2b5s h PRO 63 Ca -0.27 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.72 2b5s h PRO 63 Cb 1.12 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2b5s h PRO 63 CO 0.79 0.06 -0.25 -0.91 -0.21 0.00 0.00 178.00 177.48 2b5s h ASN 64 N 0.10 0.68 -0.16 -2.05 2.35 -1.93 -1.94 115.58 112.63 2b5s h ASN 64 Ca 0.56 -0.25 -0.14 0.00 -0.55 0.00 0.00 56.30 55.92 2b5s h ASN 64 Cb 1.14 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 39.31 2b5s h ASN 64 CO -0.77 0.91 -0.38 0.78 -1.65 0.00 0.00 177.43 176.32 2b5s h ASN 65 N 0.58 0.72 -0.46 5.81 2.35 -1.49 -2.14 115.58 120.96 2b5s h ASN 65 Ca 0.08 -0.32 -0.10 0.00 -0.55 0.00 0.00 56.30 55.41 2b5s h ASN 65 Cb 0.74 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.88 2b5s h ASN 65 CO 0.06 1.03 -0.10 0.00 -1.65 0.00 0.00 177.43 176.77 2b5s h ALA 66 N 1.01 0.88 0.00 -0.83 0.00 -1.22 -2.67 119.26 116.42 2b5s h ALA 66 Ca 0.05 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 2b5s h ALA 66 Cb 0.91 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2b5s h ALA 66 CO 0.08 0.64 -0.48 0.00 0.00 0.00 0.00 179.25 179.49 2b5s h ALA 67 N 1.05 1.06 0.00 0.00 0.00 -1.22 -3.21 119.26 116.94 2b5s h ALA 67 Ca 0.14 -0.44 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 2b5s h ALA 67 Cb 0.63 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2b5s h ALA 67 CO 0.04 0.60 -0.61 0.00 0.00 0.00 0.00 179.25 179.28 2b5s h ALA 68 N 1.52 0.73 -0.24 0.00 0.00 -1.21 -3.39 119.26 116.67 2b5s h ALA 68 Ca -0.00 -0.33 0.06 0.00 0.00 0.00 0.00 54.91 54.64 2b5s h ALA 68 Cb 0.94 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.67 2b5s h ALA 68 CO 0.06 0.41 -0.25 -0.07 0.00 0.00 0.00 179.25 179.40 2b5s h LEU 69 N 0.00 -0.80 -0.43 0.00 3.38 -1.48 -1.69 115.31 114.30 2b5s h LEU 69 Ca -0.03 0.14 0.08 0.00 0.09 0.00 0.00 57.88 58.16 2b5s h LEU 69 Cb 1.26 0.37 -0.09 0.00 0.09 0.00 0.00 40.66 42.29 2b5s h LEU 69 CO 0.03 -0.28 -0.33 -0.65 0.09 0.00 0.00 178.44 177.30 2b5s h PRO 70 N -0.26 -0.23 0.31 1.13 0.11 -1.78 0.24 132.00 131.52 2b5s h PRO 70 Ca 0.14 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.25 2b5s h PRO 70 Cb 0.47 0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.62 2b5s h PRO 70 CO -0.39 -0.16 -0.22 0.78 -0.21 0.00 0.00 178.00 177.81 2b5s h GLY 71 N -0.24 -0.54 0.21 -0.55 0.00 -1.66 -0.74 103.07 99.54 2b5s h GLY 71 Ca 0.18 0.24 0.24 0.00 0.00 0.00 0.00 47.33 47.99 2b5s h GLY 71 CO -0.56 -0.21 0.63 0.50 0.00 0.00 0.00 176.54 176.90 2b5s h LYS 72 N -0.52 0.14 -0.25 4.80 1.57 -0.69 0.60 116.57 122.23 2b5s h LYS 72 Ca -0.03 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2b5s h LYS 72 Cb 0.44 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.72 2b5s h LYS 72 CO 0.01 0.09 0.00 0.00 -0.57 0.00 0.00 179.45 178.99 2b5s n GLY 74 N 1.17 0.53 3.47 0.00 0.00 0.21 -4.99 105.19 105.57 2b5s n GLY 74 Ca 0.16 -0.35 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 2b5s n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b5s s VAL 75 N -2.60 4.57 -0.28 1.61 1.01 -0.33 -5.02 120.40 119.37 2b5s s VAL 75 Ca 0.00 -0.21 -0.29 0.00 0.00 0.00 0.00 61.98 61.47 2b5s s VAL 75 Cb 0.00 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.16 2b5s s VAL 75 CO 0.00 0.22 1.28 -0.44 0.00 0.00 0.00 175.10 176.16 2b5s s SER 76 N 1.64 6.73 -0.24 3.32 0.01 -1.26 -4.12 113.70 119.78 2b5s s SER 76 Ca 0.06 1.27 -0.04 0.00 1.31 0.00 0.00 55.95 58.55 2b5s s SER 76 Cb -0.16 -2.54 0.08 0.00 0.21 0.00 0.00 66.02 63.61 2b5s s SER 76 CO 0.06 -1.02 0.10 -0.63 0.41 0.00 0.00 173.24 172.16 2b5s s ILE 77 N 4.19 0.08 -1.41 1.44 1.01 -1.26 -5.03 121.20 120.22 2b5s s ILE 77 Ca 0.55 -0.58 0.00 0.00 0.00 0.00 0.00 60.65 60.63 2b5s s ILE 77 Cb -0.17 -0.90 0.00 0.00 0.01 0.00 0.00 42.46 41.40 2b5s s ILE 77 CO 0.21 -0.50 0.22 -2.65 0.00 0.00 0.00 174.94 172.23 2b5s n PRO 78 N 5.20 0.00 -4.22 2.79 -0.02 -1.26 -4.68 135.00 132.82 2b5s n PRO 78 Ca -0.06 0.00 -0.18 0.00 -2.02 0.00 0.00 63.50 61.24 2b5s n PRO 78 Cb 0.45 -1.32 -0.11 0.00 -0.02 0.00 0.00 33.50 32.50 2b5s n PRO 78 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2b5s s TYR 79 N -1.60 1.34 0.24 6.00 2.02 -1.26 -5.13 117.35 118.96 2b5s s TYR 79 Ca 0.00 -0.53 -0.25 0.00 -0.37 0.00 0.00 57.07 55.92 2b5s s TYR 79 Cb 0.00 -0.72 -0.09 0.00 -0.40 0.00 0.00 41.96 40.75 2b5s s TYR 79 CO 0.00 0.11 0.85 0.21 -1.57 0.00 0.00 175.55 175.15 2b5s s LYS 80 N -2.36 4.57 -1.26 -0.62 2.20 -1.26 -4.97 119.74 116.04 2b5s s LYS 80 Ca 0.05 1.22 -0.15 0.00 -0.36 0.00 0.00 55.97 56.74 2b5s s LYS 80 Cb -0.07 -3.05 0.13 0.00 -1.51 0.00 0.00 37.83 33.33 2b5s s LYS 80 CO 0.03 0.44 1.62 -0.89 -0.36 0.00 0.00 175.35 176.18 2b5s n ILE 81 N 1.09 4.11 -4.10 5.43 2.08 -1.26 -4.75 119.36 121.95 2b5s n ILE 81 Ca -0.02 -4.40 -0.11 0.00 0.56 0.00 0.00 62.75 58.78 2b5s n ILE 81 Cb 0.49 -2.42 -0.11 0.00 -0.75 0.00 0.00 39.64 36.85 2b5s n ILE 81 CO 0.00 0.00 0.00 -0.55 0.56 0.00 0.00 176.55 176.56 2b5s s SER 82 N 3.26 0.91 0.41 4.38 0.15 -1.26 -4.11 113.70 117.44 2b5s s SER 82 Ca 0.47 -0.78 0.29 0.00 0.70 0.00 0.00 55.95 56.64 2b5s s SER 82 Cb 0.01 0.08 1.26 0.00 -1.71 0.00 0.00 66.02 65.66 2b5s s SER 82 CO 0.03 -0.35 1.87 0.00 1.20 0.00 0.00 173.24 175.98 2b5s h ALA 83 N 3.75 1.00 0.00 5.45 0.00 -2.00 -2.09 119.26 125.38 2b5s h ALA 83 Ca -0.35 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 2b5s h ALA 83 Cb 1.18 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 2b5s h ALA 83 CO 0.53 0.00 -0.14 0.77 0.00 0.00 0.00 179.25 180.41 2b5s h SER 84 N 0.00 0.00 -2.80 0.00 0.02 -1.95 -3.45 113.55 105.37 2b5s h SER 84 Ca 0.00 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.43 2b5s h SER 84 Cb 0.37 0.00 0.04 0.00 0.14 0.00 0.00 62.40 62.96 2b5s h SER 84 CO 0.00 0.14 0.90 -0.89 -1.14 0.00 0.00 176.83 175.83 2b5s s THR 85 N -3.27 2.55 -0.44 -2.27 2.01 -0.79 -4.94 115.64 108.49 2b5s s THR 85 Ca 0.05 0.39 -0.24 0.00 0.31 0.00 0.00 61.69 62.20 2b5s s THR 85 Cb 0.07 -3.25 0.02 0.00 0.01 0.00 0.00 72.50 69.35 2b5s s THR 85 CO 0.66 0.03 0.84 0.21 -0.69 0.00 0.00 174.62 175.67 2b5s s ASN 86 N 1.17 6.47 0.61 3.53 2.47 -1.26 -4.92 114.94 123.01 2b5s s ASN 86 Ca 0.71 0.04 0.30 0.00 0.42 0.00 0.00 52.86 54.34 2b5s s ASN 86 Cb -0.44 -2.41 1.71 0.00 -1.45 0.00 0.00 41.25 38.65 2b5s s ASN 86 CO 0.31 -0.94 2.08 0.00 -3.72 0.00 0.00 177.10 174.83 2b5s n ALA 88 N -2.25 1.94 0.80 0.00 0.00 -1.26 -1.86 120.51 117.89 2b5s n ALA 88 Ca 0.01 -0.08 0.08 0.00 0.00 0.00 0.00 53.44 53.45 2b5s n ALA 88 Cb 0.35 -1.26 -0.08 0.00 0.00 0.00 0.00 19.45 18.46 2b5s n ALA 88 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2b5s n THR 89 N -1.19 0.00 -2.45 0.00 -2.24 -0.52 -4.96 114.28 102.91 2b5s n THR 89 Ca 0.09 -0.13 -0.41 0.00 -2.27 0.00 0.00 64.05 61.33 2b5s n THR 89 Cb 0.10 1.03 -0.04 0.00 -2.10 0.00 0.00 70.33 69.32 2b5s n THR 89 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2b5s s VAL 90 N -2.52 3.63 -0.42 2.28 1.01 -0.78 -5.13 120.40 118.48 2b5s s VAL 90 Ca 0.08 1.47 0.03 0.00 0.00 0.00 0.00 61.98 63.56 2b5s s VAL 90 Cb 0.13 -3.94 0.03 0.00 0.00 0.00 0.00 36.38 32.60 2b5s s VAL 90 CO 0.66 0.28 0.61 2.29 0.00 0.00 0.00 175.10 178.94