#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cpw s SER 2 N 0.00 0.31 -0.28 1.61 0.01 -1.26 -5.15 113.70 108.94 2cpw s SER 2 Ca 0.00 -0.20 -0.27 0.00 1.31 0.00 0.00 55.95 56.78 2cpw s SER 2 Cb 0.00 0.01 0.19 0.00 0.21 0.00 0.00 66.02 66.43 2cpw s SER 2 CO 0.00 -0.08 1.36 -0.55 0.41 0.00 0.00 173.24 174.38 2cpw s SER 3 N -0.56 -0.08 -0.04 2.44 0.15 -1.26 -5.18 113.70 109.17 2cpw s SER 3 Ca -0.04 0.11 -0.27 0.00 0.70 0.00 0.00 55.95 56.45 2cpw s SER 3 Cb -0.04 0.10 0.06 0.00 -1.71 0.00 0.00 66.02 64.43 2cpw s SER 3 CO -0.00 -0.05 0.59 -0.83 1.20 0.00 0.00 173.24 174.15 2cpw s GLY 4 N -0.59 -0.48 0.09 9.45 0.00 -1.26 -5.14 107.32 109.39 2cpw s GLY 4 Ca 0.07 1.10 -0.31 0.00 0.00 0.00 0.00 44.72 45.58 2cpw s GLY 4 CO -0.10 0.77 1.26 -0.45 0.00 0.00 0.00 173.10 174.58 2cpw s SER 5 N -1.20 6.99 -0.08 1.64 0.15 -1.26 -5.02 113.70 114.93 2cpw s SER 5 Ca -0.11 2.14 0.01 0.00 0.70 0.00 0.00 55.95 58.69 2cpw s SER 5 Cb -0.01 -2.58 0.02 0.00 -1.71 0.00 0.00 66.02 61.73 2cpw s SER 5 CO 0.09 -0.52 -0.11 -0.55 1.20 0.00 0.00 173.24 173.34 2cpw s SER 6 N 0.99 1.95 0.00 5.45 0.15 -1.26 -5.00 113.70 115.98 2cpw s SER 6 Ca 0.60 -0.31 0.00 0.00 0.70 0.00 0.00 55.95 56.94 2cpw s SER 6 Cb -0.32 -0.86 0.00 0.00 -1.71 0.00 0.00 66.02 63.13 2cpw s SER 6 CO 0.30 -0.01 0.00 0.61 1.20 0.00 0.00 173.24 175.34 2cpw n GLY 7 N 4.16 0.96 3.65 9.45 0.00 -1.26 -5.19 105.19 116.96 2cpw n GLY 7 Ca -0.20 -0.08 -0.02 0.00 0.00 0.00 0.00 46.02 45.72 2cpw n GLY 7 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2cpw s ARG 8 N 0.00 0.01 -0.22 1.61 1.70 -1.26 -5.14 118.95 115.64 2cpw s ARG 8 Ca 0.00 -0.00 -0.00 0.00 -0.47 0.00 0.00 55.73 55.26 2cpw s ARG 8 Cb 0.00 0.00 0.03 0.00 -0.57 0.00 0.00 34.95 34.41 2cpw s ARG 8 CO 0.00 -0.00 -0.11 1.21 -1.08 0.00 0.00 175.30 175.31 2cpw s ASN 9 N -1.81 3.93 -0.55 -2.89 2.47 -1.26 -5.05 114.94 109.79 2cpw s ASN 9 Ca 0.12 -0.84 -0.30 0.00 0.42 0.00 0.00 52.86 52.26 2cpw s ASN 9 Cb -0.01 -1.59 -0.11 0.00 -1.45 0.00 0.00 41.25 38.09 2cpw s ASN 9 CO -0.03 -0.08 2.41 -1.14 -3.72 0.00 0.00 177.10 174.53 2cpw n ARG 10 N 4.63 0.88 -3.24 0.43 0.63 -1.26 -4.82 116.66 113.91 2cpw n ARG 10 Ca -0.18 0.11 -0.05 0.00 -0.92 0.00 0.00 57.85 56.82 2cpw n ARG 10 Cb 0.48 -2.73 -0.03 0.00 0.45 0.00 0.00 32.46 30.62 2cpw n ARG 10 CO 0.00 0.00 0.00 -1.14 -2.51 0.00 0.00 177.63 173.98 2cpw s GLN 11 N 7.77 0.78 -0.14 -0.14 0.74 -1.26 -5.02 119.66 122.39 2cpw s GLN 11 Ca 1.10 -0.49 -0.14 0.00 0.05 0.00 0.00 55.36 55.87 2cpw s GLN 11 Cb -0.61 -0.17 -0.05 0.00 1.10 0.00 0.00 33.01 33.28 2cpw s GLN 11 CO 0.38 -1.20 -0.28 1.04 -0.55 0.00 0.00 175.29 174.68 2cpw n GLN 12 N 4.29 0.43 -4.00 1.67 6.02 -1.26 -5.02 117.38 119.52 2cpw n GLN 12 Ca 0.12 0.17 -0.31 0.00 -0.01 0.00 0.00 57.00 56.97 2cpw n GLN 12 Cb 0.53 -1.26 -0.05 0.00 1.02 0.00 0.00 30.24 30.48 2cpw n GLN 12 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 2cpw s ARG 13 N -2.71 3.13 -1.06 -1.09 3.03 -1.26 -5.02 118.95 113.97 2cpw s ARG 13 Ca -0.24 -0.57 -0.23 0.00 2.03 0.00 0.00 55.73 56.73 2cpw s ARG 13 Cb 0.04 -2.87 0.00 0.00 -1.03 0.00 0.00 34.95 31.09 2cpw s ARG 13 CO 0.35 0.59 1.74 -1.25 -1.13 0.00 0.00 175.30 175.60 2cpw s PRO 14 N -2.38 3.15 0.00 3.89 0.04 -1.26 -4.74 135.00 133.70 2cpw s PRO 14 Ca 0.31 -1.02 0.00 0.00 0.04 0.00 0.00 61.00 60.33 2cpw s PRO 14 Cb -0.13 -5.28 0.00 0.00 0.04 0.00 0.00 34.50 29.14 2cpw s PRO 14 CO 0.24 -2.88 0.00 0.41 0.04 0.00 0.00 177.00 174.81 2cpw n GLY 15 N 6.44 3.10 2.69 0.56 0.00 -1.26 -5.01 105.19 111.72 2cpw n GLY 15 Ca 0.40 -1.88 -0.06 0.00 0.00 0.00 0.00 46.02 44.48 2cpw n GLY 15 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2cpw n THR 16 N -1.55 0.00 -3.92 2.61 5.66 -1.26 -4.99 114.28 110.83 2cpw n THR 16 Ca 0.00 -1.12 -0.35 0.00 -3.05 0.00 0.00 64.05 59.54 2cpw n THR 16 Cb 0.00 1.10 0.01 0.00 -1.55 0.00 0.00 70.33 69.89 2cpw n THR 16 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 175.07 174.32 2cpw n ILE 17 N 0.01 -3.08 0.13 1.09 -5.35 -1.26 -4.78 119.36 106.11 2cpw n ILE 17 Ca -0.05 -0.28 0.00 0.00 -0.27 0.00 0.00 62.75 62.15 2cpw n ILE 17 Cb 0.74 -2.66 0.00 0.00 -1.74 0.00 0.00 39.64 35.98 2cpw n ILE 17 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2cpw n LYS 18 N -3.71 0.00 -3.65 6.28 5.02 -1.26 -5.13 118.16 115.71 2cpw n LYS 18 Ca -0.23 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.00 2cpw n LYS 18 Cb 0.64 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 35.57 2cpw n LYS 18 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2cpw s HIS 19 N -1.59 -1.01 0.00 2.13 5.04 -1.26 -5.05 115.29 113.54 2cpw s HIS 19 Ca 0.00 1.96 0.00 0.00 -1.54 0.00 0.00 55.06 55.48 2cpw s HIS 19 Cb 0.00 0.57 0.00 0.00 0.04 0.00 0.00 32.58 33.19 2cpw s HIS 19 CO 0.00 -0.52 0.00 0.41 -2.34 0.00 0.00 174.74 172.29 2cpw n GLY 20 N 4.62 0.67 3.87 1.59 0.00 -1.26 -4.73 105.19 109.94 2cpw n GLY 20 Ca -0.18 -0.53 -0.31 0.00 0.00 0.00 0.00 46.02 45.00 2cpw n GLY 20 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cpw s SER 21 N 0.00 6.59 0.35 1.61 1.04 -1.26 -4.84 113.70 117.19 2cpw s SER 21 Ca 0.00 1.08 0.15 0.00 0.48 0.00 0.00 55.95 57.66 2cpw s SER 21 Cb 0.00 -2.29 1.16 0.00 0.10 0.00 0.00 66.02 64.98 2cpw s SER 21 CO 0.00 -0.28 1.60 0.00 0.98 0.00 0.00 173.24 175.54 2cpw h ALA 22 N 1.74 1.90 0.44 5.32 0.00 -1.96 0.46 119.26 127.16 2cpw h ALA 22 Ca -0.47 0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2cpw h ALA 22 Cb 1.18 0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.32 2cpw h ALA 22 CO 0.65 -0.79 -0.21 1.25 0.00 0.00 0.00 179.25 180.15 2cpw h LEU 23 N 0.08 -0.51 -1.09 0.00 5.85 -1.94 -2.95 115.31 114.75 2cpw h LEU 23 Ca 0.77 -0.07 0.37 0.00 0.84 0.00 0.00 57.88 59.79 2cpw h LEU 23 Cb 1.89 0.13 -0.15 0.00 0.37 0.00 0.00 40.66 42.90 2cpw h LEU 23 CO -0.76 -0.09 0.62 -0.78 -0.34 0.00 0.00 178.44 177.10 2cpw h ASP 24 N -1.06 0.41 0.50 1.25 1.82 -0.74 0.31 116.42 118.90 2cpw h ASP 24 Ca -0.06 0.20 -0.02 0.00 -0.39 0.00 0.00 57.03 56.76 2cpw h ASP 24 Cb 0.54 0.17 -0.01 0.00 0.68 0.00 0.00 39.33 40.71 2cpw h ASP 24 CO 0.10 -0.22 -0.40 0.58 -1.61 0.00 0.00 179.24 177.69 2cpw h VAL 25 N 0.19 0.00 -1.01 2.25 2.07 -0.21 0.16 116.25 119.70 2cpw h VAL 25 Ca 0.78 0.00 0.22 0.00 0.82 0.00 0.00 66.70 68.52 2cpw h VAL 25 Cb 2.00 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 31.65 2cpw h VAL 25 CO -0.60 0.00 0.61 -0.07 0.02 0.00 0.00 177.57 177.52 2cpw h LEU 26 N -0.87 0.70 -1.00 2.57 3.38 -0.32 0.77 115.31 120.54 2cpw h LEU 26 Ca -0.06 0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.03 2cpw h LEU 26 Cb 0.73 -0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.43 2cpw h LEU 26 CO 0.00 0.18 0.65 -0.07 0.09 0.00 0.00 178.44 179.30 2cpw h LEU 27 N 0.65 1.15 -0.97 1.67 3.38 -0.14 -0.75 115.31 120.30 2cpw h LEU 27 Ca 0.61 -0.03 -0.10 0.00 0.09 0.00 0.00 57.88 58.44 2cpw h LEU 27 Cb 1.10 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 2cpw h LEU 27 CO -0.41 0.84 -0.37 -1.28 0.09 0.00 0.00 178.44 177.30 2cpw h SER 28 N 1.35 0.28 0.48 -0.43 0.87 0.33 -2.37 113.55 114.06 2cpw h SER 28 Ca 0.36 -0.11 -0.03 0.00 -1.23 0.00 0.00 61.79 60.78 2cpw h SER 28 Cb -0.15 -0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 61.73 2cpw h SER 28 CO -0.08 0.64 -0.13 0.24 -0.53 0.00 0.00 176.83 176.97 2cpw h MET 29 N 0.23 0.00 0.00 2.24 2.86 0.42 -3.45 114.93 117.24 2cpw h MET 29 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 2cpw h MET 29 Cb 0.77 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.43 2cpw h MET 29 CO 0.06 0.13 0.00 0.41 1.06 0.00 0.00 176.91 178.57 2cpw n GLY 30 N -0.52 1.91 3.65 8.32 0.00 -0.84 -5.09 105.19 112.61 2cpw n GLY 30 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 2cpw n GLY 30 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2cpw s PHE 31 N -2.00 2.99 0.16 1.61 0.40 -0.44 -5.01 117.98 115.69 2cpw s PHE 31 Ca 0.00 0.02 -0.30 0.00 -0.60 0.00 0.00 56.93 56.05 2cpw s PHE 31 Cb 0.00 -1.63 -0.07 0.00 0.51 0.00 0.00 43.02 41.83 2cpw s PHE 31 CO 0.00 0.43 1.12 -1.25 0.70 0.00 0.00 175.22 176.23 2cpw s PRO 32 N -1.62 4.56 0.31 0.24 0.04 -1.26 -3.88 135.00 133.38 2cpw s PRO 32 Ca 0.19 1.74 0.05 0.00 0.04 0.00 0.00 61.00 63.03 2cpw s PRO 32 Cb -0.11 -3.28 0.85 0.00 0.04 0.00 0.00 34.50 31.99 2cpw s PRO 32 CO 0.10 0.01 1.51 -2.13 0.04 0.00 0.00 177.00 176.54 2cpw n ARG 33 N 2.58 -0.07 0.10 4.56 0.63 -1.26 0.12 116.66 123.32 2cpw n ARG 33 Ca 0.04 1.42 -0.13 0.00 -0.92 0.00 0.00 57.85 58.26 2cpw n ARG 33 Cb 0.46 -2.31 -0.07 0.00 0.45 0.00 0.00 32.46 30.98 2cpw n ARG 33 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2cpw h ALA 34 N 1.92 -0.91 -0.49 5.13 0.00 -1.97 1.44 119.26 124.37 2cpw h ALA 34 Ca 0.63 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.52 2cpw h ALA 34 Cb 1.39 0.77 -0.10 0.00 0.00 0.00 0.00 17.79 19.85 2cpw h ALA 34 CO -0.87 -1.00 -0.46 0.00 0.00 0.00 0.00 179.25 176.92 2cpw h ARG 35 N -0.59 -0.28 -0.97 0.00 -0.00 -0.69 1.10 114.38 112.94 2cpw h ARG 35 Ca -0.01 0.02 0.09 0.00 -0.50 0.00 0.00 59.98 59.58 2cpw h ARG 35 Cb 0.58 0.06 -0.07 0.00 0.00 0.00 0.00 29.97 30.55 2cpw h ARG 35 CO -0.20 -0.19 0.63 0.00 0.00 0.00 0.00 179.97 180.21 2cpw h ALA 36 N 0.44 1.49 0.34 0.04 0.00 -0.83 0.58 119.26 121.32 2cpw h ALA 36 Ca 0.15 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2cpw h ALA 36 Cb 0.57 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2cpw h ALA 36 CO -0.63 0.33 -0.17 1.96 0.00 0.00 0.00 179.25 180.74 2cpw h GLN 37 N 1.06 -0.45 -0.86 0.00 1.08 0.64 0.76 115.11 117.35 2cpw h GLN 37 Ca 0.44 0.03 0.20 0.00 -1.45 0.00 0.00 58.65 57.88 2cpw h GLN 37 Cb 0.30 0.10 -0.16 0.00 -0.05 0.00 0.00 27.48 27.68 2cpw h GLN 37 CO -0.20 -0.30 -0.03 -0.22 -0.95 0.00 0.00 178.83 177.13 2cpw h LYS 38 N -0.53 0.05 0.82 1.46 1.63 0.12 0.44 116.57 120.56 2cpw h LYS 38 Ca -0.05 -0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.71 2cpw h LYS 38 Cb 0.36 -0.01 0.01 0.00 -0.60 0.00 0.00 32.23 31.98 2cpw h LYS 38 CO 0.08 0.04 -0.40 0.00 -3.45 0.00 0.00 179.45 175.72 2cpw h ALA 39 N 1.83 -1.20 -0.88 5.00 0.00 -0.82 -1.30 119.26 121.89 2cpw h ALA 39 Ca 0.47 -0.24 0.09 0.00 0.00 0.00 0.00 54.91 55.23 2cpw h ALA 39 Cb 0.87 0.43 -0.12 0.00 0.00 0.00 0.00 17.79 18.97 2cpw h ALA 39 CO -0.80 -1.12 -0.56 -0.07 0.00 0.00 0.00 179.25 176.71 2cpw h LEU 40 N -1.19 -2.01 -0.28 0.00 3.38 0.25 0.20 115.31 115.66 2cpw h LEU 40 Ca -0.11 0.31 0.03 0.00 0.09 0.00 0.00 57.88 58.20 2cpw h LEU 40 Cb 0.85 0.89 -0.06 0.00 0.09 0.00 0.00 40.66 42.43 2cpw h LEU 40 CO 0.19 -0.27 -0.40 0.00 0.09 0.00 0.00 178.44 178.04 2cpw h ALA 41 N 0.51 -0.66 -0.83 1.53 0.00 -0.18 1.27 119.26 120.90 2cpw h ALA 41 Ca 0.17 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.17 2cpw h ALA 41 Cb 0.47 1.00 -0.12 0.00 0.00 0.00 0.00 17.79 19.14 2cpw h ALA 41 CO -0.88 -0.85 -0.51 0.77 0.00 0.00 0.00 179.25 177.78 2cpw h SER 42 N -0.30 -1.82 -0.54 0.00 0.02 0.25 1.21 113.55 112.37 2cpw h SER 42 Ca 0.05 0.30 -0.30 0.00 -0.84 0.00 0.00 61.79 60.99 2cpw h SER 42 Cb 0.44 0.83 -0.16 0.00 0.14 0.00 0.00 62.40 63.64 2cpw h SER 42 CO -0.42 -0.29 0.39 0.35 -1.14 0.00 0.00 176.83 175.72 2cpw n THR 43 N -5.35 2.38 0.00 -2.27 -2.24 0.47 -4.94 114.28 102.33 2cpw n THR 43 Ca 0.03 -1.24 0.00 0.00 -2.27 0.00 0.00 64.05 60.57 2cpw n THR 43 Cb 0.32 -0.88 0.00 0.00 -2.10 0.00 0.00 70.33 67.67 2cpw n THR 43 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cpw n GLY 44 N -0.23 0.62 0.00 3.38 0.00 0.42 -3.77 105.19 105.61 2cpw n GLY 44 Ca 0.33 0.64 0.00 0.00 0.00 0.00 0.00 46.02 46.99 2cpw n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cpw n GLY 45 N 0.00 -1.16 0.50 -0.02 0.00 -1.08 -3.26 105.19 100.17 2cpw n GLY 45 Ca 0.00 0.27 -0.09 0.00 0.00 0.00 0.00 46.02 46.20 2cpw n GLY 45 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2cpw n ARG 46 N 0.00 0.32 -4.49 1.61 0.63 -1.25 -5.05 116.66 108.43 2cpw n ARG 46 Ca 0.00 0.13 -0.29 0.00 -0.92 0.00 0.00 57.85 56.77 2cpw n ARG 46 Cb 0.00 -1.05 -0.13 0.00 0.45 0.00 0.00 32.46 31.73 2cpw n ARG 46 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2cpw s SER 47 N -6.12 3.18 0.26 6.15 0.15 -1.26 -5.02 113.70 111.04 2cpw s SER 47 Ca -0.19 -0.70 0.20 0.00 0.70 0.00 0.00 55.95 55.96 2cpw s SER 47 Cb 0.04 -0.22 0.08 0.00 -1.71 0.00 0.00 66.02 64.21 2cpw s SER 47 CO 0.26 0.18 1.25 -0.37 1.20 0.00 0.00 173.24 175.76 2cpw h VAL 48 N 3.98 0.29 0.11 4.45 -1.51 -1.96 -3.26 116.25 118.35 2cpw h VAL 48 Ca -0.49 -1.47 -0.01 0.00 -1.23 0.00 0.00 66.70 63.50 2cpw h VAL 48 Cb 1.17 1.95 0.00 0.00 -2.13 0.00 0.00 31.29 32.28 2cpw h VAL 48 CO 0.40 0.17 -0.05 -0.61 -1.23 0.00 0.00 177.57 176.24 2cpw h GLN 49 N 0.00 -0.14 -0.19 5.19 -0.00 -1.98 -2.04 115.11 115.95 2cpw h GLN 49 Ca -0.03 0.01 0.04 0.00 -0.00 0.00 0.00 58.65 58.67 2cpw h GLN 49 Cb 1.20 0.03 -0.04 0.00 0.00 0.00 0.00 27.48 28.67 2cpw h GLN 49 CO 0.02 0.20 -0.09 1.15 0.00 0.00 0.00 178.83 180.12 2cpw h THR 50 N -0.51 0.71 -0.61 2.39 2.02 -2.00 -1.48 112.91 113.43 2cpw h THR 50 Ca -0.02 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.28 2cpw h THR 50 Cb 0.41 0.71 -0.09 0.00 -1.74 0.00 0.00 68.15 67.45 2cpw h THR 50 CO 0.02 0.00 0.14 0.00 0.37 0.00 0.00 175.52 176.06 2cpw h ALA 51 N 1.11 0.74 -0.22 6.16 0.00 -1.59 -0.61 119.26 124.84 2cpw h ALA 51 Ca 0.10 0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.20 2cpw h ALA 51 Cb 0.22 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.11 2cpw h ALA 51 CO -0.24 -0.30 -0.41 0.00 0.00 0.00 0.00 179.25 178.31 2cpw h ASP 53 N -0.43 -0.42 0.34 0.00 1.82 -0.49 0.13 116.42 117.37 2cpw h ASP 53 Ca 0.10 0.18 -0.01 0.00 -0.39 0.00 0.00 57.03 56.92 2cpw h ASP 53 Cb 0.60 0.35 -0.01 0.00 0.68 0.00 0.00 39.33 40.95 2cpw h ASP 53 CO -0.45 -0.17 -0.27 -0.25 -1.61 0.00 0.00 179.24 176.49 2cpw h TRP 54 N 0.07 -0.72 -0.14 0.28 7.01 0.24 0.60 115.95 123.30 2cpw h TRP 54 Ca 0.35 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.36 2cpw h TRP 54 Cb 0.58 0.27 -0.02 0.00 -2.10 0.00 0.00 29.16 27.89 2cpw h TRP 54 CO -0.45 -0.40 -0.10 -0.07 -2.79 0.00 0.00 178.44 174.64 2cpw h LEU 55 N -0.62 -0.35 0.01 0.65 3.38 0.28 -1.60 115.31 117.07 2cpw h LEU 55 Ca -0.03 0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.03 2cpw h LEU 55 Cb 0.54 0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.39 2cpw h LEU 55 CO -0.01 -0.05 -0.33 -0.26 0.09 0.00 0.00 178.44 177.88 2cpw h PHE 56 N -0.02 -0.91 -1.80 1.13 0.04 -0.91 -3.28 116.94 111.19 2cpw h PHE 56 Ca 0.02 0.03 -0.66 0.00 2.80 0.00 0.00 57.97 60.16 2cpw h PHE 56 Cb 0.08 0.40 -0.14 0.00 2.20 0.00 0.00 35.95 38.49 2cpw h PHE 56 CO -0.87 -0.42 1.24 -1.12 -0.60 0.00 0.00 178.31 176.54 2cpw s SER 57 N -4.83 6.65 -0.92 2.17 0.01 0.21 -4.93 113.70 112.05 2cpw s SER 57 Ca -0.16 -1.98 -0.25 0.00 1.31 0.00 0.00 55.95 54.88 2cpw s SER 57 Cb 0.09 -2.47 -0.07 0.00 0.21 0.00 0.00 66.02 63.77 2cpw s SER 57 CO 0.65 -1.19 2.03 -2.28 0.41 0.00 0.00 173.24 172.86 2cpw s HIS 58 N 3.48 1.68 0.21 2.43 2.46 -1.13 -4.46 115.29 119.97 2cpw s HIS 58 Ca 0.40 0.91 0.02 0.00 0.47 0.00 0.00 55.06 56.86 2cpw s HIS 58 Cb -0.02 -3.91 -0.05 0.00 -0.13 0.00 0.00 32.58 28.47 2cpw s HIS 58 CO -0.07 -1.61 0.04 -1.12 -2.47 0.00 0.00 174.74 169.50 2cpw s SER 59 N 8.38 1.24 0.00 9.88 0.01 -1.26 -4.96 113.70 127.00 2cpw s SER 59 Ca 0.74 -1.26 0.00 0.00 1.31 0.00 0.00 55.95 56.75 2cpw s SER 59 Cb -0.07 0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.29 2cpw s SER 59 CO 0.03 -0.63 0.00 0.61 0.41 0.00 0.00 173.24 173.66 2cpw n GLY 60 N -0.34 0.33 3.60 3.44 0.00 -1.26 -5.06 105.19 105.90 2cpw n GLY 60 Ca -0.04 -1.56 -0.43 0.00 0.00 0.00 0.00 46.02 43.99 2cpw n GLY 60 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cpw s PRO 61 N -2.00 3.59 0.04 1.61 0.04 -1.26 -4.48 135.00 132.54 2cpw s PRO 61 Ca 0.00 0.95 0.00 0.00 0.04 0.00 0.00 61.00 61.99 2cpw s PRO 61 Cb 0.00 -4.02 0.00 0.00 0.04 0.00 0.00 34.50 30.52 2cpw s PRO 61 CO 0.00 -1.54 0.00 0.45 0.04 0.00 0.00 177.00 175.95 2cpw n SER 62 N 8.75 -9.48 -4.13 6.66 2.88 -1.26 -4.90 113.62 112.14 2cpw n SER 62 Ca 0.16 1.84 -0.36 0.00 -1.33 0.00 0.00 58.87 59.19 2cpw n SER 62 Cb 0.48 -5.20 0.09 0.00 -0.75 0.00 0.00 64.21 58.82 2cpw n SER 62 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2cpw n SER 63 N 1.87 -3.09 0.00 -3.46 3.41 -1.26 -5.12 113.62 105.98 2cpw n SER 63 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2cpw n SER 63 Cb 0.00 -0.74 0.00 0.00 -0.26 0.00 0.00 64.21 63.21 2cpw n SER 63 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49