#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x41 s SER 2 N 0.00 1.91 -0.29 1.61 0.01 -1.26 -5.14 113.70 110.54 1x41 s SER 2 Ca 0.00 -0.61 -0.16 0.00 1.31 0.00 0.00 55.95 56.50 1x41 s SER 2 Cb 0.00 -0.09 0.14 0.00 0.21 0.00 0.00 66.02 66.29 1x41 s SER 2 CO 0.00 -0.02 0.96 -0.55 0.41 0.00 0.00 173.24 174.04 1x41 s SER 3 N -1.67 -0.54 0.00 2.44 0.15 -1.26 -5.18 113.70 107.64 1x41 s SER 3 Ca 0.01 0.85 0.00 0.00 0.70 0.00 0.00 55.95 57.51 1x41 s SER 3 Cb -0.10 1.25 0.00 0.00 -1.71 0.00 0.00 66.02 65.46 1x41 s SER 3 CO 0.03 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 174.94 1x41 n GLY 4 N 3.82 4.42 3.69 9.45 0.00 -1.26 -5.17 105.19 120.14 1x41 n GLY 4 Ca -0.18 -1.65 -0.29 0.00 0.00 0.00 0.00 46.02 43.90 1x41 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x41 s SER 5 N -0.46 4.98 0.02 1.61 0.01 -1.26 -5.13 113.70 113.47 1x41 s SER 5 Ca 0.00 -0.24 0.05 0.00 1.31 0.00 0.00 55.95 57.07 1x41 s SER 5 Cb 0.00 -1.16 -0.02 0.00 0.21 0.00 0.00 66.02 65.05 1x41 s SER 5 CO 0.00 0.14 -0.15 -0.44 0.41 0.00 0.00 173.24 173.20 1x41 s SER 6 N -2.54 1.76 -0.38 2.44 0.01 -1.26 -5.05 113.70 108.69 1x41 s SER 6 Ca 0.26 -0.40 0.06 0.00 1.31 0.00 0.00 55.95 57.18 1x41 s SER 6 Cb -0.11 -0.14 0.28 0.00 0.21 0.00 0.00 66.02 66.26 1x41 s SER 6 CO 0.19 0.09 1.25 0.61 0.41 0.00 0.00 173.24 175.79 1x41 n GLY 7 N 2.15 0.45 3.20 3.44 0.00 -1.26 -5.09 105.19 108.09 1x41 n GLY 7 Ca -0.17 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 1x41 n GLY 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x41 s ASP 8 N -0.84 5.83 0.00 1.61 1.01 -1.26 -4.91 116.67 118.11 1x41 s ASP 8 Ca 0.16 -2.50 0.11 0.00 0.71 0.00 0.00 52.55 51.03 1x41 s ASP 8 Cb 0.28 -2.01 0.63 0.00 1.01 0.00 0.00 42.92 42.83 1x41 s ASP 8 CO -0.07 -0.53 1.07 -0.81 0.21 0.00 0.00 175.17 175.03 1x41 n PRO 9 N 4.09 0.49 -0.02 8.23 -0.04 -1.26 -3.40 135.00 143.10 1x41 n PRO 9 Ca 0.04 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.44 1x41 n PRO 9 Cb 0.41 -1.34 -0.02 0.00 -0.04 0.00 0.00 33.50 32.52 1x41 n PRO 9 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x41 n SER 10 N -0.84 0.99 -4.83 3.54 2.88 -1.26 -5.07 113.62 109.03 1x41 n SER 10 Ca 0.08 0.15 -0.22 0.00 -1.33 0.00 0.00 58.87 57.55 1x41 n SER 10 Cb 0.04 -0.36 0.08 0.00 -0.75 0.00 0.00 64.21 63.22 1x41 n SER 10 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 1x41 s TRP 11 N -2.22 1.89 0.22 0.66 0.52 -1.22 -5.13 118.94 113.66 1x41 s TRP 11 Ca -0.11 -0.31 0.08 0.00 0.02 0.00 0.00 56.10 55.78 1x41 s TRP 11 Cb 0.03 -2.76 -0.05 0.00 -1.15 0.00 0.00 33.47 29.54 1x41 s TRP 11 CO 0.14 -1.36 -0.14 0.95 0.02 0.00 0.00 176.95 176.56 1x41 s THR 12 N -2.93 1.81 0.26 2.01 -4.23 -1.26 -4.71 115.64 106.60 1x41 s THR 12 Ca 0.63 -2.23 -0.01 0.00 -1.18 0.00 0.00 61.69 58.90 1x41 s THR 12 Cb -0.07 -2.12 0.25 0.00 1.34 0.00 0.00 72.50 71.90 1x41 s THR 12 CO 0.41 -0.54 1.79 0.00 -0.54 0.00 0.00 174.62 175.74 1x41 h ALA 13 N 2.50 1.33 -0.64 3.99 0.00 -2.00 -1.06 119.26 123.37 1x41 h ALA 13 Ca -0.38 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 1x41 h ALA 13 Cb 1.23 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 1x41 h ALA 13 CO 0.62 0.03 0.39 1.96 0.00 0.00 0.00 179.25 182.25 1x41 h GLN 14 N 0.75 0.86 -0.73 0.00 4.20 -2.00 -2.56 115.11 115.63 1x41 h GLN 14 Ca 0.46 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 59.12 1x41 h GLN 14 Cb 0.56 -0.18 -0.04 0.00 0.30 0.00 0.00 27.48 28.11 1x41 h GLN 14 CO -0.31 0.61 0.47 0.93 -0.67 0.00 0.00 178.83 179.85 1x41 h GLU 15 N 0.87 0.90 0.56 1.46 3.07 -1.61 0.61 114.58 120.43 1x41 h GLU 15 Ca 0.23 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 59.02 1x41 h GLU 15 Cb -0.04 -0.20 -0.02 0.00 -0.84 0.00 0.00 28.75 27.65 1x41 h GLU 15 CO -0.04 0.59 -0.46 0.93 -1.40 0.00 0.00 179.01 178.63 1x41 h GLU 16 N 0.93 -0.96 -0.31 2.33 5.08 -1.02 0.29 114.58 120.91 1x41 h GLU 16 Ca 0.29 0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.73 1x41 h GLU 16 Cb -0.02 0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 1x41 h GLU 16 CO -0.10 -0.64 0.16 0.52 -1.00 0.00 0.00 179.01 177.95 1x41 h MET 17 N -1.00 0.32 -0.18 2.33 2.86 -1.35 -1.28 114.93 116.64 1x41 h MET 17 Ca -0.07 -0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.61 1x41 h MET 17 Cb 0.85 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.43 1x41 h MET 17 CO -0.01 0.21 0.17 0.00 1.06 0.00 0.00 176.91 178.35 1x41 h ALA 18 N 1.16 1.88 -0.10 6.32 0.00 -0.70 -0.91 119.26 126.90 1x41 h ALA 18 Ca 0.13 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.79 1x41 h ALA 18 Cb 0.04 0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.85 1x41 h ALA 18 CO -0.08 -0.26 -0.87 1.25 0.00 0.00 0.00 179.25 179.29 1x41 h LEU 19 N 0.00 0.94 0.39 0.00 5.85 0.25 -2.42 115.31 120.31 1x41 h LEU 19 Ca 0.08 -0.67 -0.02 0.00 0.84 0.00 0.00 57.88 58.12 1x41 h LEU 19 Cb 0.42 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.18 1x41 h LEU 19 CO -0.00 1.46 -0.19 -0.07 -0.34 0.00 0.00 178.44 179.31 1x41 h LEU 20 N 0.48 -0.44 -0.59 2.25 3.38 -0.80 0.11 115.31 119.71 1x41 h LEU 20 Ca -0.08 -0.12 0.10 0.00 0.09 0.00 0.00 57.88 57.87 1x41 h LEU 20 Cb 1.51 0.11 -0.08 0.00 0.09 0.00 0.00 40.66 42.30 1x41 h LEU 20 CO 0.18 -0.02 0.16 1.05 0.09 0.00 0.00 178.44 179.90 1x41 h GLU 21 N -0.97 0.30 0.02 1.13 4.11 -1.42 0.48 114.58 118.23 1x41 h GLU 21 Ca -0.05 -0.02 -0.00 0.00 0.07 0.00 0.00 59.36 59.36 1x41 h GLU 21 Cb 0.54 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1x41 h GLU 21 CO 0.09 0.20 -0.01 0.00 0.07 0.00 0.00 179.01 179.36 1x41 h ALA 22 N 1.44 -0.03 -0.35 1.06 0.00 -1.48 0.93 119.26 120.83 1x41 h ALA 22 Ca 0.30 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 55.15 1x41 h ALA 22 Cb 0.42 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1x41 h ALA 22 CO -0.35 -0.35 0.29 0.28 0.00 0.00 0.00 179.25 179.11 1x41 h VAL 23 N -0.35 0.67 0.00 0.00 2.07 -0.26 0.31 116.25 118.69 1x41 h VAL 23 Ca -0.00 0.00 -0.20 0.00 0.82 0.00 0.00 66.70 67.31 1x41 h VAL 23 Cb 0.34 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 1x41 h VAL 23 CO 0.00 0.00 -1.91 1.15 0.02 0.00 0.00 177.57 176.84 1x41 n MET 24 N -4.19 0.65 0.09 1.57 0.00 0.12 -2.22 117.12 113.14 1x41 n MET 24 Ca 0.06 0.04 -0.05 0.00 0.00 0.00 0.00 57.70 57.75 1x41 n MET 24 Cb 0.46 -1.64 0.01 0.00 0.00 0.00 0.00 33.22 32.05 1x41 n MET 24 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 1x41 h ASP 25 N 0.00 0.05 0.00 3.17 3.32 0.24 -3.40 116.42 119.80 1x41 h ASP 25 Ca -0.27 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.75 1x41 h ASP 25 Cb 1.69 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 41.23 1x41 h ASP 25 CO 0.03 0.86 -0.44 0.00 -1.72 0.00 0.00 179.24 177.97 1x41 n GLY 27 N 2.09 4.55 3.75 0.00 0.00 -0.94 -5.02 105.19 109.62 1x41 n GLY 27 Ca -0.06 -1.32 -0.36 0.00 0.00 0.00 0.00 46.02 44.28 1x41 n GLY 27 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1x41 s PHE 28 N -2.00 2.34 0.00 1.61 2.19 -1.25 -2.72 117.98 118.16 1x41 s PHE 28 Ca 0.00 1.51 0.00 0.00 0.33 0.00 0.00 56.93 58.77 1x41 s PHE 28 Cb 0.00 -3.51 0.00 0.00 -1.31 0.00 0.00 43.02 38.20 1x41 s PHE 28 CO 0.00 -2.31 0.00 0.41 1.83 0.00 0.00 175.22 175.15 1x41 n GLY 29 N 0.55 2.80 1.65 13.12 0.00 -1.26 -4.84 105.19 117.21 1x41 n GLY 29 Ca 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.12 1x41 n GLY 29 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1x41 n ASN 30 N 0.49 5.41 -0.57 1.61 3.02 -1.10 -4.57 115.26 119.54 1x41 n ASN 30 Ca 0.00 -2.48 0.46 0.00 -0.03 0.00 0.00 54.58 52.53 1x41 n ASN 30 Cb 0.00 -1.19 0.75 0.00 -0.61 0.00 0.00 39.78 38.73 1x41 n ASN 30 CO 0.00 0.00 0.00 -0.50 -2.62 0.00 0.00 177.26 174.14 1x41 h TRP 31 N 1.50 0.22 0.80 3.10 -0.00 -1.88 0.16 115.95 119.85 1x41 h TRP 31 Ca 0.07 0.01 -0.04 0.00 -0.00 0.00 0.00 58.89 58.93 1x41 h TRP 31 Cb 1.10 -0.05 0.01 0.00 -0.00 0.00 0.00 29.16 30.22 1x41 h TRP 31 CO 0.63 -0.10 -0.38 0.37 -0.00 0.00 0.00 178.44 178.95 1x41 h GLN 32 N 0.02 -1.03 -0.79 0.49 5.75 -1.93 -1.08 115.11 116.54 1x41 h GLN 32 Ca 0.87 0.07 0.08 0.00 -0.15 0.00 0.00 58.65 59.53 1x41 h GLN 32 Cb 3.20 0.23 -0.07 0.00 1.07 0.00 0.00 27.48 31.92 1x41 h GLN 32 CO -0.20 -0.69 0.45 0.22 -2.65 0.00 0.00 178.83 175.97 1x41 h ASP 33 N -1.24 0.65 -0.89 -0.69 3.58 -1.13 -1.41 116.42 115.29 1x41 h ASP 33 Ca -0.11 0.04 0.02 0.00 0.42 0.00 0.00 57.03 57.40 1x41 h ASP 33 Cb 0.82 -0.09 -0.05 0.00 1.72 0.00 0.00 39.33 41.74 1x41 h ASP 33 CO 0.18 0.39 0.59 0.58 -2.88 0.00 0.00 179.24 178.10 1x41 h VAL 34 N 0.78 1.21 0.00 2.25 2.07 -1.21 -1.20 116.25 120.15 1x41 h VAL 34 Ca 0.37 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1x41 h VAL 34 Cb 0.30 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 29.98 1x41 h VAL 34 CO -0.22 0.22 0.35 0.00 0.02 0.00 0.00 177.57 177.93 1x41 h ALA 35 N 1.45 1.29 0.18 1.67 0.00 -0.03 -2.37 119.26 121.46 1x41 h ALA 35 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1x41 h ALA 35 Cb -0.09 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1x41 h ALA 35 CO -0.08 -0.29 -0.44 -0.91 0.00 0.00 0.00 179.25 177.53 1x41 h ASN 36 N 0.00 -1.31 1.16 0.00 -0.26 -1.28 2.09 115.58 115.98 1x41 h ASN 36 Ca 0.00 0.13 0.00 0.00 -0.56 0.00 0.00 56.30 55.87 1x41 h ASN 36 Cb 0.70 0.47 0.00 0.00 -1.06 0.00 0.00 38.32 38.44 1x41 h ASN 36 CO 0.00 -0.50 -0.54 1.56 -1.06 0.00 0.00 177.43 176.90 1x41 h GLN 37 N -0.69 0.00 -0.02 0.81 4.20 -1.67 -3.25 115.11 114.50 1x41 h GLN 37 Ca -0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1x41 h GLN 37 Cb 0.67 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.45 1x41 h GLN 37 CO -0.20 0.00 -0.16 -1.33 -0.67 0.00 0.00 178.83 176.47 1x41 n MET 38 N -2.43 1.46 -0.45 1.46 2.81 -0.94 -4.43 117.12 114.59 1x41 n MET 38 Ca 0.03 -1.00 0.33 0.00 -1.81 0.00 0.00 57.70 55.25 1x41 n MET 38 Cb 0.48 -1.48 0.51 0.00 -0.71 0.00 0.00 33.22 32.03 1x41 n MET 38 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1x41 h THR 40 N 0.00 0.00 -3.20 0.00 1.35 -1.82 -3.41 112.91 105.82 1x41 h THR 40 Ca 0.59 0.00 -0.18 0.00 -0.55 0.00 0.00 66.41 66.27 1x41 h THR 40 Cb 2.37 0.23 -0.05 0.00 -1.73 0.00 0.00 68.15 68.97 1x41 h THR 40 CO -0.01 0.00 -0.13 0.29 -0.25 0.00 0.00 175.52 175.42 1x41 n LYS 41 N -2.09 0.32 -3.19 4.72 4.76 0.30 -5.15 118.16 117.84 1x41 n LYS 41 Ca -0.01 -1.56 -0.39 0.00 -2.87 0.00 0.00 58.31 53.48 1x41 n LYS 41 Cb 0.49 1.43 -0.05 0.00 -1.84 0.00 0.00 35.03 35.05 1x41 n LYS 41 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1x41 s THR 42 N -2.66 4.96 0.46 -0.18 -4.23 -1.26 -4.94 115.64 107.79 1x41 s THR 42 Ca 0.17 1.25 0.35 0.00 -1.18 0.00 0.00 61.69 62.29 1x41 s THR 42 Cb -0.00 -3.94 0.54 0.00 1.34 0.00 0.00 72.50 70.44 1x41 s THR 42 CO 0.12 0.38 1.58 0.07 -0.54 0.00 0.00 174.62 176.23 1x41 h LYS 43 N 5.92 0.01 -0.62 3.99 2.10 -1.91 1.53 116.57 127.58 1x41 h LYS 43 Ca -0.44 -0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.15 1x41 h LYS 43 Cb 1.20 -0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.50 1x41 h LYS 43 CO 0.71 0.00 0.17 0.93 -2.00 0.00 0.00 179.45 179.26 1x41 h GLU 44 N 0.01 0.99 -0.11 0.07 4.39 -1.92 -2.64 114.58 115.36 1x41 h GLU 44 Ca 0.89 -0.23 -0.14 0.00 0.34 0.00 0.00 59.36 60.23 1x41 h GLU 44 Cb 2.98 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 31.48 1x41 h GLU 44 CO -0.40 0.89 -0.53 0.93 -1.16 0.00 0.00 179.01 178.74 1x41 h GLU 45 N 0.91 0.30 -0.01 2.33 4.39 0.18 -2.79 114.58 119.89 1x41 h GLU 45 Ca 0.20 -0.18 -0.04 0.00 0.34 0.00 0.00 59.36 59.67 1x41 h GLU 45 Cb 0.33 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1x41 h GLU 45 CO -0.00 0.76 -0.19 0.00 -1.16 0.00 0.00 179.01 178.42 1x41 h GLU 47 N 0.02 -0.19 0.02 0.00 4.81 -1.28 -2.93 114.58 115.03 1x41 h GLU 47 Ca 0.00 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.27 1x41 h GLU 47 Cb 0.34 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.73 1x41 h GLU 47 CO 0.02 -0.07 -0.19 -0.22 -0.73 0.00 0.00 179.01 177.82 1x41 h LYS 48 N -1.04 -0.30 -0.97 1.92 3.64 -1.49 -0.84 116.57 117.49 1x41 h LYS 48 Ca -0.02 0.02 0.18 0.00 -1.27 0.00 0.00 60.65 59.56 1x41 h LYS 48 Cb 0.21 0.07 -0.10 0.00 -0.41 0.00 0.00 32.23 31.99 1x41 h LYS 48 CO 0.03 -0.20 0.57 1.25 -2.27 0.00 0.00 179.45 178.83 1x41 h HIS 49 N -0.32 1.00 0.49 1.91 2.76 -1.14 0.59 115.15 120.45 1x41 h HIS 49 Ca 0.05 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.23 1x41 h HIS 49 Cb 0.38 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 29.05 1x41 h HIS 49 CO -0.22 0.23 -0.24 -0.92 -1.30 0.00 0.00 177.93 175.48 1x41 h TYR 50 N 0.74 -0.61 0.00 5.26 5.03 -1.16 -1.34 116.97 124.88 1x41 h TYR 50 Ca 0.55 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.84 1x41 h TYR 50 Cb 0.82 0.20 -0.00 0.00 1.55 0.00 0.00 36.73 39.31 1x41 h TYR 50 CO -0.03 -0.29 -0.03 0.52 -1.32 0.00 0.00 178.16 177.01 1x41 h MET 51 N -0.92 0.00 0.19 1.82 0.00 -0.58 0.16 114.93 115.60 1x41 h MET 51 Ca -0.07 0.00 -0.01 0.00 0.00 0.00 0.00 59.70 59.62 1x41 h MET 51 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.20 1x41 h MET 51 CO 0.11 0.03 -0.09 -0.22 0.00 0.00 0.00 176.91 176.74 1x41 h LYS 52 N 0.00 -0.25 0.23 1.72 3.11 0.39 -2.90 116.57 118.87 1x41 h LYS 52 Ca -0.00 0.02 -0.01 0.00 -2.81 0.00 0.00 60.65 57.85 1x41 h LYS 52 Cb 0.21 0.06 0.00 0.00 -1.00 0.00 0.00 32.23 31.49 1x41 h LYS 52 CO 0.00 -0.17 -0.11 1.88 -2.81 0.00 0.00 179.45 178.25 1x41 h TYR 53 N -0.70 -0.29 0.06 1.91 -1.99 -1.20 -2.83 116.97 111.94 1x41 h TYR 53 Ca -0.03 -0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.69 1x41 h TYR 53 Cb 0.20 0.09 -0.00 0.00 2.00 0.00 0.00 36.73 39.02 1x41 h TYR 53 CO 0.03 -0.18 -0.04 0.74 -0.00 0.00 0.00 178.16 178.71 1x41 h PHE 54 N -0.55 -0.10 0.00 4.88 0.04 -1.17 -2.94 116.94 117.10 1x41 h PHE 54 Ca -0.03 -0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.62 1x41 h PHE 54 Cb 0.24 0.04 -0.04 0.00 2.20 0.00 0.00 35.95 38.38 1x41 h PHE 54 CO 0.06 -0.06 -0.22 0.45 -0.60 0.00 0.00 178.31 177.95 1x41 n SER 55 N -2.39 4.88 -0.57 2.17 2.88 -0.97 -4.81 113.62 114.81 1x41 n SER 55 Ca -0.01 -2.37 0.00 0.00 -1.33 0.00 0.00 58.87 55.16 1x41 n SER 55 Cb 0.04 -1.22 0.00 0.00 -0.75 0.00 0.00 64.21 62.27 1x41 n SER 55 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x41 n GLY 56 N 2.21 5.59 3.65 0.46 0.00 -1.07 -4.46 105.19 111.57 1x41 n GLY 56 Ca 0.27 -2.08 -0.29 0.00 0.00 0.00 0.00 46.02 43.92 1x41 n GLY 56 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x41 s PRO 57 N 0.51 -0.20 -0.10 1.61 0.04 -1.26 -5.03 135.00 130.56 1x41 s PRO 57 Ca 0.00 0.30 -0.02 0.00 0.04 0.00 0.00 61.00 61.32 1x41 s PRO 57 Cb 0.00 -1.68 -0.06 0.00 0.04 0.00 0.00 34.50 32.80 1x41 s PRO 57 CO 0.00 -3.11 -0.11 0.45 0.04 0.00 0.00 177.00 174.27 1x41 n SER 58 N -4.40 2.09 -4.82 6.66 2.88 -1.26 -5.01 113.62 109.76 1x41 n SER 58 Ca 0.08 0.03 -0.38 0.00 -1.33 0.00 0.00 58.87 57.27 1x41 n SER 58 Cb 0.58 -0.23 -0.06 0.00 -0.75 0.00 0.00 64.21 63.75 1x41 n SER 58 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1x41 s SER 59 N -5.43 6.71 0.00 -3.46 0.01 -1.26 -5.30 113.70 104.97 1x41 s SER 59 Ca -0.14 0.84 0.00 0.00 1.31 0.00 0.00 55.95 57.96 1x41 s SER 59 Cb 0.05 -2.22 0.00 0.00 0.21 0.00 0.00 66.02 64.05 1x41 s SER 59 CO 0.21 0.29 0.00 0.61 0.41 0.00 0.00 173.24 174.76