#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e8p n SER 2 N 0.00 -5.00 -2.31 1.61 2.88 -1.26 -4.80 113.62 104.74 2e8p n SER 2 Ca 0.00 0.34 -0.14 0.00 -1.33 0.00 0.00 58.87 57.73 2e8p n SER 2 Cb 0.00 -0.98 -0.01 0.00 -0.75 0.00 0.00 64.21 62.46 2e8p n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2e8p n SER 3 N -3.58 -4.30 -3.71 -3.46 7.64 -1.26 -4.93 113.62 100.02 2e8p n SER 3 Ca 0.00 0.17 -0.13 0.00 1.01 0.00 0.00 58.87 59.93 2e8p n SER 3 Cb 0.14 -3.67 -0.13 0.00 -1.01 0.00 0.00 64.21 59.55 2e8p n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2e8p s GLY 4 N -2.06 -0.14 0.34 0.23 0.00 -1.26 -5.16 107.32 99.28 2e8p s GLY 4 Ca 0.00 1.01 0.03 0.00 0.00 0.00 0.00 44.72 45.77 2e8p s GLY 4 CO 0.00 1.46 0.38 -1.35 0.00 0.00 0.00 173.10 173.58 2e8p s SER 5 N 1.56 1.40 -0.04 1.64 1.04 -1.26 -5.18 113.70 112.85 2e8p s SER 5 Ca -0.07 -1.66 -0.14 0.00 0.48 0.00 0.00 55.95 54.56 2e8p s SER 5 Cb -0.11 0.62 0.03 0.00 0.10 0.00 0.00 66.02 66.66 2e8p s SER 5 CO -0.09 -1.19 0.33 -0.55 0.98 0.00 0.00 173.24 172.72 2e8p s SER 6 N -3.32 -0.24 0.00 7.02 0.15 -1.26 -5.16 113.70 110.89 2e8p s SER 6 Ca 0.36 0.25 0.00 0.00 0.70 0.00 0.00 55.95 57.27 2e8p s SER 6 Cb 0.01 0.42 0.00 0.00 -1.71 0.00 0.00 66.02 64.74 2e8p s SER 6 CO 0.25 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 174.94 2e8p n GLY 7 N 1.68 4.20 4.03 9.45 0.00 -1.26 -5.17 105.19 118.12 2e8p n GLY 7 Ca -0.19 -0.41 -0.19 0.00 0.00 0.00 0.00 46.02 45.22 2e8p n GLY 7 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2e8p s GLN 8 N -2.08 2.34 -1.79 1.61 0.74 -1.26 -4.53 119.66 114.68 2e8p s GLN 8 Ca 0.00 -1.62 0.00 0.00 0.05 0.00 0.00 55.36 53.79 2e8p s GLN 8 Cb 0.00 -2.66 0.00 0.00 1.10 0.00 0.00 33.01 31.45 2e8p s GLN 8 CO 0.00 -0.82 0.00 -0.12 -0.55 0.00 0.00 175.29 173.80 2e8p n MET 9 N -2.22 -1.69 -0.12 1.67 1.56 -1.26 -4.88 117.12 110.18 2e8p n MET 9 Ca 0.15 1.02 -0.27 0.00 -0.27 0.00 0.00 57.70 58.33 2e8p n MET 9 Cb 0.61 -5.67 -0.11 0.00 2.15 0.00 0.00 33.22 30.20 2e8p n MET 9 CO 0.00 0.00 0.00 0.43 -0.73 0.00 0.00 175.97 175.67 2e8p n SER 10 N -1.99 1.94 -4.89 6.12 7.64 -1.26 -4.96 113.62 116.21 2e8p n SER 10 Ca -0.25 0.33 -0.34 0.00 1.01 0.00 0.00 58.87 59.62 2e8p n SER 10 Cb 0.69 -0.84 -0.05 0.00 -1.01 0.00 0.00 64.21 63.00 2e8p n SER 10 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 2e8p s LEU 11 N -7.53 4.36 0.08 -3.43 2.34 -1.26 -5.01 118.68 108.24 2e8p s LEU 11 Ca -0.35 0.52 0.00 0.00 0.06 0.00 0.00 54.13 54.36 2e8p s LEU 11 Cb 0.12 -2.72 0.00 0.00 -0.56 0.00 0.00 46.19 43.03 2e8p s LEU 11 CO 0.54 0.24 0.00 1.21 -1.06 0.00 0.00 176.35 177.27 2e8p n GLU 12 N 0.99 0.00 0.00 1.48 4.07 -1.26 -5.17 120.64 120.75 2e8p n GLU 12 Ca -0.10 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.00 2e8p n GLU 12 Cb 0.53 -0.11 0.00 0.00 -0.06 0.00 0.00 31.44 31.80 2e8p n GLU 12 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2e8p n GLY 13 N 2.51 4.09 3.06 8.31 0.00 -1.26 -5.14 105.19 116.76 2e8p n GLY 13 Ca 0.00 -0.90 -0.01 0.00 0.00 0.00 0.00 46.02 45.11 2e8p n GLY 13 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2e8p s THR 14 N 0.00 -0.85 0.04 2.61 -4.23 -1.26 -5.16 115.64 106.79 2e8p s THR 14 Ca 0.00 -0.06 0.07 0.00 -1.18 0.00 0.00 61.69 60.52 2e8p s THR 14 Cb 0.00 -0.95 -0.03 0.00 1.34 0.00 0.00 72.50 72.85 2e8p s THR 14 CO 0.00 -0.07 -0.17 -1.61 -0.54 0.00 0.00 174.62 172.23 2e8p s GLU 15 N 2.73 2.12 0.29 3.99 2.02 -1.26 -5.14 118.70 123.45 2e8p s GLU 15 Ca 0.15 -0.96 0.04 0.00 0.02 0.00 0.00 54.97 54.23 2e8p s GLU 15 Cb -0.14 -2.22 0.04 0.00 0.10 0.00 0.00 34.13 31.92 2e8p s GLU 15 CO -0.22 0.54 0.37 1.17 0.02 0.00 0.00 175.26 177.15 2e8p n LYS 16 N 1.52 0.84 -3.65 1.61 3.00 -1.26 -5.14 118.16 115.09 2e8p n LYS 16 Ca -0.16 -1.60 -0.03 0.00 -0.00 0.00 0.00 58.31 56.53 2e8p n LYS 16 Cb 0.52 -0.07 -0.07 0.00 0.00 0.00 0.00 35.03 35.41 2e8p n LYS 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2e8p s ALA 17 N -2.36 -2.30 0.40 3.14 0.00 -1.26 -4.98 121.76 114.40 2e8p s ALA 17 Ca 0.28 1.86 0.39 0.00 0.00 0.00 0.00 51.96 54.49 2e8p s ALA 17 Cb -0.02 -1.77 2.04 0.00 0.00 0.00 0.00 23.12 23.36 2e8p s ALA 17 CO 0.18 -0.21 2.18 1.03 0.00 0.00 0.00 175.76 178.94 2e8p h SER 18 N 4.21 0.00 -0.29 0.00 0.87 -1.97 0.18 113.55 116.55 2e8p h SER 18 Ca -0.27 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 2e8p h SER 18 Cb 1.18 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 2e8p h SER 18 CO 0.18 0.00 0.00 -2.67 -0.53 0.00 0.00 176.83 173.81 2e8p n TRP 19 N -2.89 0.89 -3.68 2.24 4.27 -1.26 -4.94 117.44 112.07 2e8p n TRP 19 Ca -0.02 -0.79 -0.37 0.00 -3.89 0.00 0.00 57.50 52.42 2e8p n TRP 19 Cb 0.09 -0.26 -0.11 0.00 -1.36 0.00 0.00 31.31 29.67 2e8p n TRP 19 CO 0.00 0.00 0.00 -0.51 -2.29 0.00 0.00 177.69 174.89 2e8p s LEU 20 N -2.45 3.81 0.00 5.67 1.43 0.05 -4.29 118.68 122.90 2e8p s LEU 20 Ca 0.39 -0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.43 2e8p s LEU 20 Cb 0.30 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.48 2e8p s LEU 20 CO 0.11 -0.02 0.00 0.61 0.23 0.00 0.00 176.35 177.27 2e8p n GLY 21 N 4.87 2.35 3.29 -3.19 0.00 -1.26 -4.82 105.19 106.42 2e8p n GLY 21 Ca -0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 2e8p n GLY 21 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2e8p s GLU 22 N -0.23 1.67 0.93 1.61 2.56 -1.26 -5.13 118.70 118.86 2e8p s GLU 22 Ca 0.00 -0.97 -0.10 0.00 0.00 0.00 0.00 54.97 53.90 2e8p s GLU 22 Cb 0.00 -1.76 0.15 0.00 2.00 0.00 0.00 34.13 34.52 2e8p s GLU 22 CO 0.00 0.46 1.10 1.04 -0.56 0.00 0.00 175.26 177.30 2e8p n GLN 23 N 2.02 -0.54 0.00 4.30 6.02 -1.26 -4.87 117.38 123.04 2e8p n GLN 23 Ca -0.17 -0.09 0.07 0.00 -0.01 0.00 0.00 57.00 56.80 2e8p n GLN 23 Cb 0.52 -2.34 0.32 0.00 1.02 0.00 0.00 30.24 29.77 2e8p n GLN 23 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 2e8p n PRO 24 N -4.15 0.07 0.10 -1.09 -0.04 -1.26 -2.25 135.00 126.38 2e8p n PRO 24 Ca 0.11 0.22 0.04 0.00 -0.04 0.00 0.00 63.50 63.83 2e8p n PRO 24 Cb 0.52 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.47 2e8p n PRO 24 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2e8p h GLN 25 N 0.00 0.00 -1.37 0.54 4.20 -1.90 -3.35 115.11 113.24 2e8p h GLN 25 Ca 0.00 0.00 -0.65 0.00 0.06 0.00 0.00 58.65 58.06 2e8p h GLN 25 Cb 0.21 0.00 -0.35 0.00 0.30 0.00 0.00 27.48 27.64 2e8p h GLN 25 CO 0.00 0.31 0.08 1.19 -0.67 0.00 0.00 178.83 179.74 2e8p n PHE 26 N -3.01 3.11 -3.66 2.96 3.01 -0.95 -2.82 117.46 116.10 2e8p n PHE 26 Ca -0.03 -2.68 -0.22 0.00 1.01 0.00 0.00 57.45 55.53 2e8p n PHE 26 Cb 0.73 -0.73 -0.01 0.00 -0.01 0.00 0.00 39.48 39.45 2e8p n PHE 26 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 2e8p s TRP 27 N -3.76 3.42 0.33 1.38 0.52 -1.25 -4.84 118.94 114.74 2e8p s TRP 27 Ca 0.53 0.10 0.07 0.00 0.02 0.00 0.00 56.10 56.83 2e8p s TRP 27 Cb 0.44 -1.77 -0.03 0.00 -1.15 0.00 0.00 33.47 30.96 2e8p s TRP 27 CO -0.16 0.24 0.30 0.45 0.02 0.00 0.00 176.95 177.79 2e8p s SER 28 N -4.03 5.32 0.58 2.95 0.15 -0.61 -2.93 113.70 115.12 2e8p s SER 28 Ca 0.38 -0.48 0.28 0.00 0.70 0.00 0.00 55.95 56.83 2e8p s SER 28 Cb -0.09 -0.99 1.55 0.00 -1.71 0.00 0.00 66.02 64.78 2e8p s SER 28 CO 0.32 -0.35 2.02 0.11 1.20 0.00 0.00 173.24 176.54 2e8p h LYS 29 N 1.24 0.00 0.11 5.44 1.57 -1.78 -1.53 116.57 121.61 2e8p h LYS 29 Ca -0.45 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.07 2e8p h LYS 29 Cb 1.25 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.56 2e8p h LYS 29 CO 0.58 0.00 -1.33 1.15 -0.57 0.00 0.00 179.45 179.29 2e8p h THR 30 N 0.00 1.08 -0.68 -0.16 2.02 -1.91 -3.34 112.91 109.92 2e8p h THR 30 Ca 0.15 -2.39 0.09 0.00 0.77 0.00 0.00 66.41 65.03 2e8p h THR 30 Cb 0.77 2.74 -0.07 0.00 -1.74 0.00 0.00 68.15 69.84 2e8p h THR 30 CO -0.00 0.68 0.31 1.56 0.37 0.00 0.00 175.52 178.45 2e8p h GLN 31 N -0.36 0.52 0.06 6.66 4.20 -1.63 -0.46 115.11 124.11 2e8p h GLN 31 Ca -0.29 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.39 2e8p h GLN 31 Cb 1.71 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 29.36 2e8p h GLN 31 CO 0.05 0.35 -0.17 0.28 -0.67 0.00 0.00 178.83 178.66 2e8p h VAL 32 N 0.54 0.00 -0.86 -0.54 2.07 -1.49 0.26 116.25 116.22 2e8p h VAL 32 Ca 0.34 0.00 0.16 0.00 0.82 0.00 0.00 66.70 68.01 2e8p h VAL 32 Cb 0.37 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.08 2e8p h VAL 32 CO -0.28 0.00 0.56 -0.07 0.02 0.00 0.00 177.57 177.80 2e8p h LEU 33 N -0.26 0.54 -1.34 2.57 3.38 -1.64 0.23 115.31 118.79 2e8p h LEU 33 Ca -0.01 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 2e8p h LEU 33 Cb 0.25 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 2e8p h LEU 33 CO -0.08 0.26 -0.29 0.44 0.09 0.00 0.00 178.44 178.86 2e8p h ASP 34 N 0.57 0.06 0.75 -0.43 5.19 -0.37 -2.62 116.42 119.57 2e8p h ASP 34 Ca 0.44 -0.02 -0.20 0.00 -0.62 0.00 0.00 57.03 56.63 2e8p h ASP 34 Cb 0.85 -0.02 -0.02 0.00 0.18 0.00 0.00 39.33 40.33 2e8p h ASP 34 CO -0.18 0.36 -0.93 -0.25 -3.12 0.00 0.00 179.24 175.11 2e8p h TRP 35 N 0.06 0.17 0.16 4.55 7.01 0.28 -3.30 115.95 124.88 2e8p h TRP 35 Ca 0.01 -0.11 -0.01 0.00 2.11 0.00 0.00 58.89 60.89 2e8p h TRP 35 Cb 0.55 -0.01 0.00 0.00 -2.10 0.00 0.00 29.16 27.60 2e8p h TRP 35 CO 0.00 0.97 -0.08 0.82 -2.79 0.00 0.00 178.44 177.37 2e8p h ILE 36 N 0.05 0.86 -0.96 2.65 2.04 -0.94 -2.51 117.51 118.70 2e8p h ILE 36 Ca -0.04 -0.08 0.21 0.00 1.00 0.00 0.00 64.86 65.95 2e8p h ILE 36 Cb 1.61 0.91 -0.08 0.00 -0.74 0.00 0.00 36.82 38.52 2e8p h ILE 36 CO 0.13 0.02 0.62 -1.28 0.00 0.00 0.00 178.15 177.64 2e8p h SER 37 N -0.25 0.53 -0.27 1.72 0.87 -1.62 0.30 113.55 114.81 2e8p h SER 37 Ca -0.02 0.06 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 2e8p h SER 37 Cb 0.20 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.11 2e8p h SER 37 CO 0.04 0.19 0.16 0.22 -0.53 0.00 0.00 176.83 176.90 2e8p h TYR 38 N 0.51 0.37 0.00 2.24 3.20 -1.54 0.11 116.97 121.87 2e8p h TYR 38 Ca 0.52 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.32 2e8p h TYR 38 Cb 1.15 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 39.29 2e8p h TYR 38 CO -0.00 0.30 -0.30 1.96 -1.64 0.00 0.00 178.16 178.47 2e8p h GLN 39 N 0.33 0.00 0.00 1.82 1.08 -0.86 -1.67 115.11 115.82 2e8p h GLN 39 Ca 0.10 0.00 -0.15 0.00 -1.45 0.00 0.00 58.65 57.15 2e8p h GLN 39 Cb 0.05 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.46 2e8p h GLN 39 CO -0.02 0.30 -0.69 0.28 -0.95 0.00 0.00 178.83 177.75 2e8p h VAL 40 N 0.00 1.24 0.00 -0.54 2.07 -0.05 -2.94 116.25 116.04 2e8p h VAL 40 Ca -0.00 -2.61 -0.18 0.00 0.82 0.00 0.00 66.70 64.73 2e8p h VAL 40 Cb 1.03 2.51 -0.03 0.00 -1.52 0.00 0.00 31.29 33.29 2e8p h VAL 40 CO 0.04 0.68 -1.52 1.21 0.02 0.00 0.00 177.57 178.00 2e8p n GLU 41 N -3.35 0.63 -0.02 1.57 4.07 0.34 -1.54 120.64 122.34 2e8p n GLU 41 Ca 0.01 0.19 -0.13 0.00 -0.06 0.00 0.00 57.16 57.17 2e8p n GLU 41 Cb 0.78 -1.78 -0.10 0.00 -0.06 0.00 0.00 31.44 30.28 2e8p n GLU 41 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 2e8p h LYS 42 N 0.00 -0.01 -0.00 5.31 6.56 -1.35 -3.10 116.57 123.97 2e8p h LYS 42 Ca -0.19 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.40 2e8p h LYS 42 Cb 1.62 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.29 2e8p h LYS 42 CO 0.04 0.54 -0.00 0.09 -2.06 0.00 0.00 179.45 178.06 2e8p n ASN 43 N -4.83 0.24 -1.43 0.86 3.02 -1.11 -4.88 115.26 107.14 2e8p n ASN 43 Ca -0.09 -1.02 -0.18 0.00 -0.03 0.00 0.00 54.58 53.27 2e8p n ASN 43 Cb 0.28 -0.02 -0.07 0.00 -0.61 0.00 0.00 39.78 39.37 2e8p n ASN 43 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2e8p n LYS 44 N -0.84 -1.25 -1.63 3.52 5.02 -1.17 -4.91 118.16 116.91 2e8p n LYS 44 Ca 0.22 1.09 -0.45 0.00 -2.02 0.00 0.00 58.31 57.15 2e8p n LYS 44 Cb 0.16 -5.36 -0.02 0.00 -0.02 0.00 0.00 35.03 29.78 2e8p n LYS 44 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 2e8p n TYR 45 N -2.68 1.71 -0.18 2.13 9.36 -0.59 -4.82 117.16 122.09 2e8p n TYR 45 Ca -0.18 0.59 0.23 0.00 3.32 0.00 0.00 57.90 61.86 2e8p n TYR 45 Cb 0.59 -2.35 0.63 0.00 -0.63 0.00 0.00 39.34 37.57 2e8p n TYR 45 CO 0.00 0.00 0.00 0.22 0.22 0.00 0.00 176.86 177.30 2e8p h ASP 46 N 3.16 0.18 -1.43 2.98 3.58 -1.91 -3.45 116.42 119.53 2e8p h ASP 46 Ca -0.43 0.02 -0.35 0.00 0.42 0.00 0.00 57.03 56.69 2e8p h ASP 46 Cb 1.31 -0.01 -0.09 0.00 1.72 0.00 0.00 39.33 42.25 2e8p h ASP 46 CO 0.68 0.07 -0.36 0.00 -2.88 0.00 0.00 179.24 176.75 2e8p n ALA 47 N -2.62 -0.35 -1.20 -0.78 0.00 -1.26 -4.87 120.51 109.43 2e8p n ALA 47 Ca 0.18 0.22 -0.05 0.00 0.00 0.00 0.00 53.44 53.78 2e8p n ALA 47 Cb 0.79 -1.82 0.24 0.00 0.00 0.00 0.00 19.45 18.66 2e8p n ALA 47 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2e8p n SER 48 N -0.95 3.67 0.00 0.00 7.64 -1.26 -4.45 113.62 118.27 2e8p n SER 48 Ca -0.18 -3.43 0.00 0.00 1.01 0.00 0.00 58.87 56.26 2e8p n SER 48 Cb 0.60 -0.68 0.00 0.00 -1.01 0.00 0.00 64.21 63.11 2e8p n SER 48 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2e8p n ALA 49 N -0.73 1.95 -1.68 -0.43 0.00 -1.26 -5.05 120.51 113.32 2e8p n ALA 49 Ca 0.38 0.00 -0.47 0.00 0.00 0.00 0.00 53.44 53.35 2e8p n ALA 49 Cb 1.22 0.25 -0.04 0.00 0.00 0.00 0.00 19.45 20.88 2e8p n ALA 49 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2e8p n ILE 50 N -1.96 0.33 0.08 0.00 5.41 -1.26 -4.71 119.36 117.25 2e8p n ILE 50 Ca 0.00 -0.06 -0.06 0.00 1.00 0.00 0.00 62.75 63.63 2e8p n ILE 50 Cb 0.26 -1.77 0.10 0.00 -0.71 0.00 0.00 39.64 37.52 2e8p n ILE 50 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 2e8p h ASP 51 N 7.84 0.30 -2.40 4.38 3.58 -1.94 -3.47 116.42 124.72 2e8p h ASP 51 Ca -0.47 -0.18 -0.34 0.00 0.42 0.00 0.00 57.03 56.46 2e8p h ASP 51 Cb 1.26 -0.09 -0.07 0.00 1.72 0.00 0.00 39.33 42.15 2e8p h ASP 51 CO 0.92 0.86 -0.38 0.49 -2.88 0.00 0.00 179.24 178.25 2e8p n PHE 52 N -3.85 -0.74 0.00 0.28 3.72 -1.26 -4.72 117.46 110.88 2e8p n PHE 52 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 2e8p n PHE 52 Cb 0.64 -3.23 0.00 0.00 -0.94 0.00 0.00 39.48 35.95 2e8p n PHE 52 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2e8p n SER 53 N -1.47 2.62 0.19 4.37 7.64 -1.26 -4.76 113.62 120.95 2e8p n SER 53 Ca -0.19 0.00 0.07 0.00 1.01 0.00 0.00 58.87 59.77 2e8p n SER 53 Cb 0.61 0.05 0.23 0.00 -1.01 0.00 0.00 64.21 64.08 2e8p n SER 53 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2e8p h ARG 54 N 0.00 0.00 -5.04 1.43 3.08 -1.91 -3.39 114.38 108.55 2e8p h ARG 54 Ca 0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 2e8p h ARG 54 Cb 0.63 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.66 2e8p h ARG 54 CO 0.00 0.29 2.01 0.00 -1.07 0.00 0.00 179.97 181.21 2e8p n ASP 56 N 9.75 3.36 -4.69 0.00 8.00 -1.26 -4.94 116.55 126.77 2e8p n ASP 56 Ca 0.48 -1.99 -0.42 0.00 0.71 0.00 0.00 54.79 53.58 2e8p n ASP 56 Cb 0.43 -0.39 -0.03 0.00 -0.02 0.00 0.00 41.12 41.12 2e8p n ASP 56 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2e8p s MET 57 N -1.23 4.27 0.01 -1.24 -1.94 -1.26 -4.93 119.30 112.98 2e8p s MET 57 Ca 0.42 2.02 -0.20 0.00 -1.71 0.00 0.00 55.69 56.21 2e8p s MET 57 Cb 0.22 -3.56 -0.21 0.00 2.01 0.00 0.00 34.83 33.29 2e8p s MET 57 CO 0.29 -0.59 1.15 0.38 -0.01 0.00 0.00 175.02 176.24 2e8p h ASP 58 N 7.85 0.46 0.00 3.03 2.03 -1.85 -3.41 116.42 124.53 2e8p h ASP 58 Ca -0.39 -0.70 0.00 0.00 -0.73 0.00 0.00 57.03 55.22 2e8p h ASP 58 Cb 1.18 -0.14 0.00 0.00 -0.83 0.00 0.00 39.33 39.54 2e8p h ASP 58 CO 0.90 1.09 0.00 0.61 -1.03 0.00 0.00 179.24 180.81 2e8p n GLY 59 N 0.85 -0.67 0.20 7.15 0.00 -1.15 -1.57 105.19 110.01 2e8p n GLY 59 Ca -0.09 0.23 0.07 0.00 0.00 0.00 0.00 46.02 46.24 2e8p n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e8p h ALA 60 N 0.00 0.99 0.00 4.61 0.00 -1.68 -2.89 119.26 120.28 2e8p h ALA 60 Ca 0.00 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.52 2e8p h ALA 60 Cb 0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2e8p h ALA 60 CO 0.00 0.39 -0.50 1.15 0.00 0.00 0.00 179.25 180.29 2e8p h THR 61 N 0.00 0.89 0.05 0.00 2.02 -1.91 -2.86 112.91 111.10 2e8p h THR 61 Ca -0.00 -2.18 -0.00 0.00 0.77 0.00 0.00 66.41 64.99 2e8p h THR 61 Cb 0.86 2.38 0.00 0.00 -1.74 0.00 0.00 68.15 69.66 2e8p h THR 61 CO 0.04 0.49 -0.02 0.25 0.37 0.00 0.00 175.52 176.65 2e8p h LEU 62 N 0.00 -0.05 -2.01 2.58 5.85 -1.82 -2.09 115.31 117.77 2e8p h LEU 62 Ca -0.01 -0.61 -0.02 0.00 0.84 0.00 0.00 57.88 58.08 2e8p h LEU 62 Cb 1.34 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 42.38 2e8p h LEU 62 CO 0.07 0.67 -0.10 0.00 -0.34 0.00 0.00 178.44 178.74 2e8p h ASN 64 N 0.00 0.00 -2.34 0.00 4.21 -1.56 -3.47 115.58 112.43 2e8p h ASN 64 Ca -0.00 0.00 -0.46 0.00 1.21 0.00 0.00 56.30 57.05 2e8p h ASN 64 Cb 0.24 0.00 0.23 0.00 -1.12 0.00 0.00 38.32 37.68 2e8p h ASN 64 CO 0.01 0.62 -1.08 0.00 -1.29 0.00 0.00 177.43 175.69 2e8p s ALA 66 N -2.24 3.83 0.10 0.00 0.00 -1.26 -5.00 121.76 117.19 2e8p s ALA 66 Ca 0.56 -1.28 -0.34 0.00 0.00 0.00 0.00 51.96 50.90 2e8p s ALA 66 Cb -0.12 -1.61 -0.15 0.00 0.00 0.00 0.00 23.12 21.24 2e8p s ALA 66 CO 0.66 0.26 1.54 1.25 0.00 0.00 0.00 175.76 179.47 2e8p h LEU 67 N 1.31 -1.52 -0.94 0.00 5.85 -1.98 -1.61 115.31 116.42 2e8p h LEU 67 Ca -0.51 0.15 0.17 0.00 0.84 0.00 0.00 57.88 58.53 2e8p h LEU 67 Cb 1.23 0.55 -0.10 0.00 0.37 0.00 0.00 40.66 42.71 2e8p h LEU 67 CO 0.61 -0.57 0.54 1.05 -0.34 0.00 0.00 178.44 179.73 2e8p h GLU 68 N -0.80 0.69 0.11 1.25 4.11 -1.98 -1.83 114.58 116.14 2e8p h GLU 68 Ca -0.02 -0.04 0.02 0.00 0.07 0.00 0.00 59.36 59.39 2e8p h GLU 68 Cb 0.77 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.82 2e8p h GLU 68 CO -0.23 0.46 -0.33 0.93 0.07 0.00 0.00 179.01 179.90 2e8p h GLU 69 N 0.72 -0.53 -0.10 1.06 5.08 -1.72 -0.03 114.58 119.05 2e8p h GLU 69 Ca 0.53 0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.95 2e8p h GLU 69 Cb 0.77 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.14 2e8p h GLU 69 CO -0.37 -0.36 0.11 -0.07 -1.00 0.00 0.00 179.01 177.32 2e8p h LEU 70 N -0.55 0.00 -0.01 1.33 3.38 -0.53 0.18 115.31 119.10 2e8p h LEU 70 Ca 0.03 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2e8p h LEU 70 Cb 0.59 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 2e8p h LEU 70 CO -0.20 0.00 -0.12 0.03 0.09 0.00 0.00 178.44 178.23 2e8p h ARG 71 N 0.00 0.00 0.00 1.13 3.08 -0.46 -0.58 114.38 117.55 2e8p h ARG 71 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 2e8p h ARG 71 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 2e8p h ARG 71 CO -0.00 0.12 -1.04 1.28 -1.07 0.00 0.00 179.97 179.26 2e8p n LEU 72 N -3.13 0.63 -0.09 3.04 4.77 0.51 -2.05 117.00 120.68 2e8p n LEU 72 Ca 0.03 0.10 -0.08 0.00 -0.03 0.00 0.00 56.01 56.04 2e8p n LEU 72 Cb 0.58 -0.09 -0.15 0.00 -2.33 0.00 0.00 43.42 41.42 2e8p n LEU 72 CO 0.36 -0.03 -1.09 0.52 -1.33 0.00 0.00 177.39 175.81 2e8p n VAL 73 N -2.17 1.22 -1.28 4.08 0.31 -0.53 -4.48 118.33 115.47 2e8p n VAL 73 Ca 0.01 -0.78 0.08 0.00 -0.01 0.00 0.00 64.34 63.64 2e8p n VAL 73 Cb 0.47 -0.46 0.16 0.00 -0.91 0.00 0.00 33.84 33.11 2e8p n VAL 73 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2e8p n PHE 74 N -2.67 0.00 -4.92 3.52 3.72 -0.23 -3.52 117.46 113.35 2e8p n PHE 74 Ca -0.29 -1.18 0.00 0.00 -0.05 0.00 0.00 57.45 55.93 2e8p n PHE 74 Cb 1.08 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 39.43 2e8p n PHE 74 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2e8p n GLY 75 N -1.30 1.04 0.00 1.37 0.00 -0.87 -2.33 105.19 103.10 2e8p n GLY 75 Ca 0.17 -0.60 0.07 0.00 0.00 0.00 0.00 46.02 45.66 2e8p n GLY 75 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2e8p n PRO 76 N 0.00 0.16 0.18 1.61 -0.04 -1.26 -2.47 135.00 133.18 2e8p n PRO 76 Ca 0.00 0.17 0.06 0.00 -0.04 0.00 0.00 63.50 63.69 2e8p n PRO 76 Cb 0.00 -1.50 0.25 0.00 -0.04 0.00 0.00 33.50 32.21 2e8p n PRO 76 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2e8p h LEU 77 N 0.00 0.00 -0.87 1.53 5.85 -1.78 -3.24 115.31 116.79 2e8p h LEU 77 Ca 0.00 0.00 0.15 0.00 0.84 0.00 0.00 57.88 58.87 2e8p h LEU 77 Cb 0.17 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 41.10 2e8p h LEU 77 CO 0.00 0.38 0.46 1.23 -0.34 0.00 0.00 178.44 180.17 2e8p h GLY 78 N 2.62 1.44 0.38 3.75 0.00 -1.50 0.14 103.07 109.91 2e8p h GLY 78 Ca -0.00 -0.27 0.23 0.00 0.00 0.00 0.00 47.33 47.29 2e8p h GLY 78 CO 0.05 -0.04 0.58 -1.80 0.00 0.00 0.00 176.54 175.33 2e8p h ASP 79 N 0.64 0.02 0.41 0.19 3.58 -1.80 0.30 116.42 119.77 2e8p h ASP 79 Ca 0.48 0.00 -0.31 0.00 0.42 0.00 0.00 57.03 57.62 2e8p h ASP 79 Cb 0.69 -0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.71 2e8p h ASP 79 CO -0.37 0.01 -1.69 1.56 -2.88 0.00 0.00 179.24 175.87 2e8p h GLN 80 N 0.02 0.15 -0.27 0.28 4.20 -0.97 -3.32 115.11 115.21 2e8p h GLN 80 Ca 0.39 -0.25 -0.13 0.00 0.06 0.00 0.00 58.65 58.72 2e8p h GLN 80 Cb 1.52 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 29.38 2e8p h GLN 80 CO -0.01 0.90 -0.37 -0.07 -0.67 0.00 0.00 178.83 178.61 2e8p h LEU 81 N 0.04 0.63 -0.48 1.46 3.38 0.04 -3.11 115.31 117.27 2e8p h LEU 81 Ca -0.29 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.40 2e8p h LEU 81 Cb 2.01 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 42.56 2e8p h LEU 81 CO 0.11 0.94 0.27 -0.74 0.09 0.00 0.00 178.44 179.11 2e8p h HIS 82 N 0.50 0.65 -0.81 1.13 2.76 -0.66 -1.88 115.15 116.85 2e8p h HIS 82 Ca 0.05 -0.01 0.14 0.00 -2.20 0.00 0.00 60.37 58.35 2e8p h HIS 82 Cb 0.87 -0.21 -0.09 0.00 1.55 0.00 0.00 27.41 29.52 2e8p h HIS 82 CO 0.04 0.48 0.38 0.00 -1.30 0.00 0.00 177.93 177.53 2e8p h ALA 83 N 1.11 1.18 0.33 5.26 0.00 -1.63 0.15 119.26 125.67 2e8p h ALA 83 Ca 0.17 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 2e8p h ALA 83 Cb 0.04 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2e8p h ALA 83 CO -0.03 -0.14 -0.16 1.96 0.00 0.00 0.00 179.25 180.88 2e8p h GLN 84 N 0.55 -0.43 -0.46 0.00 1.08 -1.50 -2.79 115.11 111.56 2e8p h GLN 84 Ca 0.44 0.03 0.13 0.00 -1.45 0.00 0.00 58.65 57.80 2e8p h GLN 84 Cb 0.64 0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 28.15 2e8p h GLN 84 CO -0.38 -0.10 0.39 -0.07 -0.95 0.00 0.00 178.83 177.72 2e8p h LEU 85 N -0.86 0.00 -0.34 1.46 3.38 -0.93 0.10 115.31 118.12 2e8p h LEU 85 Ca -0.05 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.75 2e8p h LEU 85 Cb 0.53 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 2e8p h LEU 85 CO 0.07 0.00 -0.51 0.03 0.09 0.00 0.00 178.44 178.12 2e8p h ARG 86 N 0.00 0.87 0.02 1.13 3.08 -0.59 -2.62 114.38 116.26 2e8p h ARG 86 Ca 0.22 -0.53 -0.21 0.00 0.07 0.00 0.00 59.98 59.53 2e8p h ARG 86 Cb 1.00 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.09 2e8p h ARG 86 CO -0.00 1.16 -0.93 -0.44 -1.07 0.00 0.00 179.97 178.69 2e8p h ASP 87 N 0.67 0.28 -0.73 7.04 3.32 -0.63 -1.74 116.42 124.63 2e8p h ASP 87 Ca 0.02 -0.24 -0.06 0.00 0.02 0.00 0.00 57.03 56.78 2e8p h ASP 87 Cb 1.11 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.54 2e8p h ASP 87 CO 0.11 1.07 0.23 -0.07 -1.72 0.00 0.00 179.24 178.86 2e8p h LEU 88 N 0.10 1.06 0.00 1.55 3.38 -0.99 -3.33 115.31 117.09 2e8p h LEU 88 Ca -0.05 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2e8p h LEU 88 Cb 1.58 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 42.06 2e8p h LEU 88 CO 0.14 0.98 -0.02 0.71 0.09 0.00 0.00 178.44 180.35 2e8p h THR 89 N 1.08 0.00 -3.90 0.22 1.35 -1.50 -3.45 112.91 106.71 2e8p h THR 89 Ca 0.24 -0.58 -0.35 0.00 -0.55 0.00 0.00 66.41 65.17 2e8p h THR 89 Cb 0.30 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 66.71 2e8p h THR 89 CO -0.01 0.00 -0.48 -1.20 -0.25 0.00 0.00 175.52 173.58 2e8p n SER 90 N -3.61 -5.00 -1.28 5.36 7.64 -0.66 -4.62 113.62 111.46 2e8p n SER 90 Ca -0.00 -0.05 0.16 0.00 1.01 0.00 0.00 58.87 59.99 2e8p n SER 90 Cb 0.01 -4.16 -0.07 0.00 -1.01 0.00 0.00 64.21 58.98 2e8p n SER 90 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2e8p n SER 91 N -2.08 -7.42 0.00 6.43 2.88 -1.26 -5.13 113.62 107.03 2e8p n SER 91 Ca -0.16 1.06 0.00 0.00 -1.33 0.00 0.00 58.87 58.44 2e8p n SER 91 Cb 0.63 -4.24 0.00 0.00 -0.75 0.00 0.00 64.21 59.85 2e8p n SER 91 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27