#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rcf s LYS 2 N 0.00 2.35 -0.27 0.03 -0.14 -0.02 -4.93 119.74 116.76 2rcf s LYS 2 Ca 0.00 -0.84 -0.16 0.00 -1.36 0.00 0.00 55.97 53.61 2rcf s LYS 2 Cb 0.00 -2.37 -0.03 0.00 -1.68 0.00 0.00 37.83 33.74 2rcf s LYS 2 CO 0.00 0.57 0.44 0.42 -0.76 0.00 0.00 175.35 176.03 2rcf s ILE 3 N -0.98 5.12 0.10 2.17 1.01 -1.26 -0.84 121.20 126.52 2rcf s ILE 3 Ca 0.16 0.72 0.01 0.00 0.00 0.00 0.00 60.65 61.55 2rcf s ILE 3 Cb -0.11 -3.76 -0.04 0.00 0.01 0.00 0.00 42.46 38.56 2rcf s ILE 3 CO 0.07 0.12 -0.05 -0.04 0.00 0.00 0.00 174.94 175.05 2rcf s MET 4 N 2.19 0.82 -0.07 2.79 -1.94 -0.58 -4.53 119.30 117.98 2rcf s MET 4 Ca 0.18 -1.34 0.01 0.00 -1.71 0.00 0.00 55.69 52.83 2rcf s MET 4 Cb -0.16 -0.11 -0.03 0.00 2.01 0.00 0.00 34.83 36.54 2rcf s MET 4 CO 0.10 -0.06 -0.07 -1.14 -0.01 0.00 0.00 175.02 173.83 2rcf s GLN 5 N -3.87 2.77 -0.08 2.03 0.74 0.11 0.01 119.66 121.36 2rcf s GLN 5 Ca 0.13 -0.56 -0.30 0.00 0.05 0.00 0.00 55.36 54.68 2rcf s GLN 5 Cb 0.06 -2.59 -0.03 0.00 1.10 0.00 0.00 33.01 31.56 2rcf s GLN 5 CO -0.05 0.64 1.18 0.08 -0.55 0.00 0.00 175.29 176.60 2rcf s VAL 6 N -0.76 4.34 -0.20 1.34 1.01 -0.25 -2.03 120.40 123.85 2rcf s VAL 6 Ca 0.12 1.65 -0.17 0.00 0.00 0.00 0.00 61.98 63.58 2rcf s VAL 6 Cb -0.11 -4.06 -0.13 0.00 0.00 0.00 0.00 36.38 32.07 2rcf s VAL 6 CO 0.01 -0.03 0.01 1.21 0.00 0.00 0.00 175.10 176.31 2rcf n GLU 7 N 5.42 0.54 -3.81 2.72 2.13 0.21 -0.73 120.64 127.11 2rcf n GLU 7 Ca 0.11 0.51 -0.05 0.00 0.66 0.00 0.00 57.16 58.39 2rcf n GLU 7 Cb 0.46 -1.69 -0.01 0.00 0.27 0.00 0.00 31.44 30.48 2rcf n GLU 7 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 2rcf s LYS 8 N -2.37 1.51 0.27 5.31 -2.85 -1.21 -4.67 119.74 115.72 2rcf s LYS 8 Ca -0.26 -0.87 -0.29 0.00 -1.00 0.00 0.00 55.97 53.55 2rcf s LYS 8 Cb 0.06 0.49 -0.09 0.00 -2.06 0.00 0.00 37.83 36.22 2rcf s LYS 8 CO 0.47 -0.69 1.02 0.99 0.10 0.00 0.00 175.35 177.24 2rcf s THR 9 N -3.25 3.79 -0.27 3.79 2.01 -1.26 0.15 115.64 120.59 2rcf s THR 9 Ca 0.13 1.77 -0.12 0.00 0.31 0.00 0.00 61.69 63.78 2rcf s THR 9 Cb -0.03 -4.11 -0.05 0.00 0.01 0.00 0.00 72.50 68.32 2rcf s THR 9 CO 0.05 0.40 0.26 -0.22 -0.69 0.00 0.00 174.62 174.42 2rcf s LEU 10 N -1.40 4.04 -0.30 4.42 1.98 -0.37 -4.73 118.68 122.32 2rcf s LEU 10 Ca 0.44 0.13 -0.14 0.00 -2.89 0.00 0.00 54.13 51.66 2rcf s LEU 10 Cb -0.28 -2.24 -0.03 0.00 0.66 0.00 0.00 46.19 44.30 2rcf s LEU 10 CO 0.36 -0.09 0.32 -0.69 -1.89 0.00 0.00 176.35 174.36 2rcf s VAL 11 N 1.78 5.21 -0.39 1.68 1.01 -1.26 -4.46 120.40 123.97 2rcf s VAL 11 Ca 0.10 0.27 0.01 0.00 0.00 0.00 0.00 61.98 62.36 2rcf s VAL 11 Cb -0.16 -3.70 0.14 0.00 0.00 0.00 0.00 36.38 32.66 2rcf s VAL 11 CO 0.10 0.09 0.23 -0.55 0.00 0.00 0.00 175.10 174.97 2rcf s SER 12 N 1.70 3.21 0.14 3.32 0.15 -1.26 -5.00 113.70 115.96 2rcf s SER 12 Ca 0.12 -2.38 -0.13 0.00 0.70 0.00 0.00 55.95 54.25 2rcf s SER 12 Cb -0.16 -0.65 0.01 0.00 -1.71 0.00 0.00 66.02 63.50 2rcf s SER 12 CO 0.11 -0.29 1.60 0.71 1.20 0.00 0.00 173.24 176.57 2rcf h THR 13 N 5.10 1.26 -2.60 6.45 1.35 -2.05 -3.33 112.91 119.09 2rcf h THR 13 Ca 0.04 -1.02 -0.71 0.00 -0.55 0.00 0.00 66.41 64.17 2rcf h THR 13 Cb 0.95 1.00 -0.19 0.00 -1.73 0.00 0.00 68.15 68.18 2rcf h THR 13 CO 0.35 0.35 0.80 0.21 -0.25 0.00 0.00 175.52 176.99 2rcf s ASN 14 N -6.28 6.74 0.16 5.36 3.84 -1.26 -4.98 114.94 118.52 2rcf s ASN 14 Ca -0.13 -2.33 0.04 0.00 0.21 0.00 0.00 52.86 50.66 2rcf s ASN 14 Cb 0.11 -2.37 -0.05 0.00 -0.55 0.00 0.00 41.25 38.40 2rcf s ASN 14 CO 0.81 -0.92 -0.07 0.00 -2.79 0.00 0.00 177.10 174.12 2rcf s ARG 15 N 2.05 1.09 0.63 0.43 1.70 -1.25 -5.14 118.95 118.47 2rcf s ARG 15 Ca 0.32 -1.49 -0.18 0.00 -0.47 0.00 0.00 55.73 53.91 2rcf s ARG 15 Cb -0.05 -0.55 -0.02 0.00 -0.57 0.00 0.00 34.95 33.76 2rcf s ARG 15 CO -0.08 0.01 1.26 0.96 -1.08 0.00 0.00 175.30 176.37 2rcf s ILE 16 N -3.40 2.25 0.41 4.99 -4.36 -1.26 -4.90 121.20 114.93 2rcf s ILE 16 Ca 0.19 0.15 0.21 0.00 -0.26 0.00 0.00 60.65 60.94 2rcf s ILE 16 Cb 0.04 -3.04 0.23 0.00 1.25 0.00 0.00 42.46 40.94 2rcf s ILE 16 CO 0.02 -0.04 2.00 0.00 0.24 0.00 0.00 174.94 177.17 2rcf h ALA 17 N 0.60 1.42 0.00 2.27 0.00 -2.00 -2.82 119.26 118.72 2rcf h ALA 17 Ca -0.51 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.24 2rcf h ALA 17 Cb 1.32 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2rcf h ALA 17 CO 0.54 0.23 0.00 -0.44 0.00 0.00 0.00 179.25 179.57 2rcf h ASP 18 N 0.00 0.00 1.08 0.00 3.45 -1.98 -2.32 116.42 116.65 2rcf h ASP 18 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2rcf h ASP 18 Cb 0.39 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.16 2rcf h ASP 18 CO 0.02 0.00 0.00 0.24 -1.57 0.00 0.00 179.24 177.93 2rcf h MET 19 N 0.00 0.00 0.00 3.56 2.86 -1.87 -3.42 114.93 116.06 2rcf h MET 19 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2rcf h MET 19 Cb 0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.79 2rcf h MET 19 CO 0.00 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.38 2rcf n GLY 20 N 0.35 3.17 0.83 8.32 0.00 -0.87 -3.16 105.19 113.83 2rcf n GLY 20 Ca 0.02 -0.28 0.07 0.00 0.00 0.00 0.00 46.02 45.83 2rcf n GLY 20 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2rcf n HIS 21 N 14.00 0.66 -1.74 1.61 8.25 -1.26 -5.03 115.22 131.71 2rcf n HIS 21 Ca 0.00 -0.55 -0.42 0.00 -0.26 0.00 0.00 57.72 56.49 2rcf n HIS 21 Cb 0.00 -0.07 -0.02 0.00 1.12 0.00 0.00 29.99 31.02 2rcf n HIS 21 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2rcf n LYS 22 N 0.59 2.68 -2.48 -0.41 4.01 -1.19 -4.96 118.16 116.40 2rcf n LYS 22 Ca 0.15 0.95 -0.38 0.00 -0.51 0.00 0.00 58.31 58.53 2rcf n LYS 22 Cb 0.54 -2.73 -0.04 0.00 -0.51 0.00 0.00 35.03 32.29 2rcf n LYS 22 CO 0.00 0.00 0.00 -2.14 -1.11 0.00 0.00 177.40 174.15 2rcf s PRO 23 N -0.51 4.29 -0.09 1.97 0.02 -1.26 -4.92 135.00 134.49 2rcf s PRO 23 Ca 0.64 1.66 -0.01 0.00 0.02 0.00 0.00 61.00 63.31 2rcf s PRO 23 Cb -0.50 -2.76 -0.03 0.00 0.02 0.00 0.00 34.50 31.23 2rcf s PRO 23 CO 0.49 -0.06 -0.05 -0.51 -0.33 0.00 0.00 177.00 176.53 2rcf s LEU 24 N -2.25 3.25 -0.01 -5.54 1.43 -1.26 -0.72 118.68 113.57 2rcf s LEU 24 Ca 0.54 -0.02 0.06 0.00 -1.03 0.00 0.00 54.13 53.67 2rcf s LEU 24 Cb -0.27 -1.73 -0.01 0.00 0.03 0.00 0.00 46.19 44.21 2rcf s LEU 24 CO 0.34 0.32 -0.18 -0.76 0.23 0.00 0.00 176.35 176.29 2rcf s LEU 25 N -0.57 2.04 -0.16 1.79 1.43 -0.09 -1.24 118.68 121.89 2rcf s LEU 25 Ca 0.09 -0.34 -0.28 0.00 -1.03 0.00 0.00 54.13 52.56 2rcf s LEU 25 Cb -0.12 -0.94 -0.01 0.00 0.03 0.00 0.00 46.19 45.15 2rcf s LEU 25 CO 0.02 0.22 0.96 -0.69 0.23 0.00 0.00 176.35 177.09 2rcf s VAL 26 N -0.46 4.79 0.12 -1.59 1.01 0.12 -1.52 120.40 122.88 2rcf s VAL 26 Ca 0.07 1.91 0.06 0.00 0.00 0.00 0.00 61.98 64.02 2rcf s VAL 26 Cb -0.07 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.02 2rcf s VAL 26 CO -0.01 -0.03 -0.15 0.68 0.00 0.00 0.00 175.10 175.59 2rcf s VAL 27 N 2.35 1.37 0.06 2.92 -7.23 -0.02 -0.62 120.40 119.23 2rcf s VAL 27 Ca 0.44 -1.67 -0.11 0.00 -1.81 0.00 0.00 61.98 58.83 2rcf s VAL 27 Cb -0.17 -1.50 0.01 0.00 0.56 0.00 0.00 36.38 35.28 2rcf s VAL 27 CO 0.13 -0.36 0.24 -1.66 -0.31 0.00 0.00 175.10 173.15 2rcf s TRP 28 N -1.94 0.02 0.35 2.82 -2.14 -0.86 -0.27 118.94 116.91 2rcf s TRP 28 Ca 0.08 -0.28 0.16 0.00 2.66 0.00 0.00 56.10 58.72 2rcf s TRP 28 Cb -0.06 0.02 0.85 0.00 -3.10 0.00 0.00 33.47 31.18 2rcf s TRP 28 CO 0.03 -0.50 1.86 0.93 -2.66 0.00 0.00 176.95 176.61 2rcf h GLU 29 N 3.11 0.00 -2.67 3.25 5.08 -1.81 0.32 114.58 121.86 2rcf h GLU 29 Ca -0.33 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.13 2rcf h GLU 29 Cb 1.20 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.36 2rcf h GLU 29 CO 0.50 0.32 0.35 -1.59 -1.00 0.00 0.00 179.01 177.59 2rcf s LYS 30 N -4.12 1.33 0.24 2.33 -2.85 -1.26 -4.55 119.74 110.87 2rcf s LYS 30 Ca -0.02 -0.66 -0.31 0.00 -1.00 0.00 0.00 55.97 53.97 2rcf s LYS 30 Cb 0.14 0.50 -0.12 0.00 -2.06 0.00 0.00 37.83 36.29 2rcf s LYS 30 CO 0.70 -0.60 1.58 -2.30 0.10 0.00 0.00 175.35 174.82 2rcf n PRO 31 N -0.41 2.49 0.00 1.78 -0.02 -1.26 -1.80 135.00 135.78 2rcf n PRO 31 Ca -0.08 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 2rcf n PRO 31 Cb 0.61 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 2rcf n PRO 31 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2rcf n GLY 32 N 2.72 3.40 3.82 -1.23 0.00 -1.26 -5.07 105.19 107.56 2rcf n GLY 32 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2rcf n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rcf s ALA 33 N -2.79 2.59 0.15 4.61 0.00 -0.74 -4.95 121.76 120.63 2rcf s ALA 33 Ca 0.00 -0.00 -0.34 0.00 0.00 0.00 0.00 51.96 51.62 2rcf s ALA 33 Cb 0.00 -3.15 -0.15 0.00 0.00 0.00 0.00 23.12 19.81 2rcf s ALA 33 CO 0.00 -1.33 1.35 -2.30 0.00 0.00 0.00 175.76 173.48 2rcf n PRO 34 N -3.19 1.48 -2.48 0.00 -0.02 -1.26 -4.86 135.00 124.68 2rcf n PRO 34 Ca 0.07 0.53 -0.40 0.00 -2.02 0.00 0.00 63.50 61.69 2rcf n PRO 34 Cb 0.54 -2.16 -0.04 0.00 -0.02 0.00 0.00 33.50 31.82 2rcf n PRO 34 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2rcf s ARG 35 N 0.19 4.57 0.36 -0.52 0.52 -1.26 -4.58 118.95 118.22 2rcf s ARG 35 Ca 0.78 1.77 0.04 0.00 -0.52 0.00 0.00 55.73 57.79 2rcf s ARG 35 Cb -0.83 -3.10 -0.05 0.00 0.52 0.00 0.00 34.95 31.50 2rcf s ARG 35 CO 0.47 0.15 0.08 -0.65 0.02 0.00 0.00 175.30 175.37 2rcf s GLN 36 N -1.60 1.75 -0.06 3.54 -0.21 0.62 -4.99 119.66 118.73 2rcf s GLN 36 Ca 0.46 -2.01 0.05 0.00 0.02 0.00 0.00 55.36 53.88 2rcf s GLN 36 Cb -0.31 -0.81 -0.00 0.00 1.00 0.00 0.00 33.01 32.89 2rcf s GLN 36 CO 0.39 -0.29 -0.20 0.08 -2.12 0.00 0.00 175.29 173.16 2rcf s VAL 37 N -3.26 1.64 0.05 1.09 1.01 -1.26 -0.84 120.40 118.82 2rcf s VAL 37 Ca 0.31 -0.82 0.06 0.00 0.00 0.00 0.00 61.98 61.53 2rcf s VAL 37 Cb 0.07 -1.41 -0.02 0.00 0.00 0.00 0.00 36.38 35.01 2rcf s VAL 37 CO 0.15 0.47 -0.17 0.00 0.00 0.00 0.00 175.10 175.54 2rcf s ALA 38 N 0.08 1.42 0.20 5.51 0.00 -0.57 -4.68 121.76 123.72 2rcf s ALA 38 Ca -0.07 -0.95 -0.30 0.00 0.00 0.00 0.00 51.96 50.64 2rcf s ALA 38 Cb -0.13 -0.23 -0.08 0.00 0.00 0.00 0.00 23.12 22.67 2rcf s ALA 38 CO 0.04 0.28 1.09 0.54 0.00 0.00 0.00 175.76 177.71 2rcf s VAL 39 N -0.90 3.80 -0.47 0.00 0.11 -0.71 -0.92 120.40 121.32 2rcf s VAL 39 Ca 0.04 1.62 -0.22 0.00 -2.93 0.00 0.00 61.98 60.49 2rcf s VAL 39 Cb -0.08 -4.04 0.03 0.00 -1.53 0.00 0.00 36.38 30.76 2rcf s VAL 39 CO 0.02 0.31 0.73 -0.62 -3.33 0.00 0.00 175.10 172.21 2rcf s ASP 40 N -0.35 6.34 -0.04 3.54 2.15 0.10 -1.12 116.67 127.29 2rcf s ASP 40 Ca 0.48 -0.35 0.17 0.00 0.43 0.00 0.00 52.55 53.27 2rcf s ASP 40 Cb -0.30 -2.35 0.52 0.00 -0.30 0.00 0.00 42.92 40.49 2rcf s ASP 40 CO 0.36 -0.91 1.44 0.00 -0.17 0.00 0.00 175.17 175.89 2rcf n ALA 41 N 6.58 2.49 0.00 3.66 0.00 -1.12 -4.44 120.51 127.69 2rcf n ALA 41 Ca -0.01 -1.39 0.00 0.00 0.00 0.00 0.00 53.44 52.05 2rcf n ALA 41 Cb 0.48 -0.73 0.00 0.00 0.00 0.00 0.00 19.45 19.19 2rcf n ALA 41 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2rcf n ILE 42 N 0.92 0.00 0.00 0.00 2.08 -1.26 -4.96 119.36 116.15 2rcf n ILE 42 Ca 0.20 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.51 2rcf n ILE 42 Cb 0.62 -1.43 0.00 0.00 -0.75 0.00 0.00 39.64 38.08 2rcf n ILE 42 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2rcf n GLY 43 N 2.95 0.92 3.58 7.39 0.00 -1.26 -5.13 105.19 113.64 2rcf n GLY 43 Ca 0.00 -0.62 -0.24 0.00 0.00 0.00 0.00 46.02 45.16 2rcf n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rcf s ILE 45 N -2.43 1.75 0.16 0.00 -4.36 -1.26 -5.09 121.20 109.97 2rcf s ILE 45 Ca 0.32 -2.09 -0.34 0.00 -0.26 0.00 0.00 60.65 58.28 2rcf s ILE 45 Cb -0.05 -1.95 -0.15 0.00 1.25 0.00 0.00 42.46 41.56 2rcf s ILE 45 CO 0.18 -0.49 1.29 -2.65 0.24 0.00 0.00 174.94 173.51 2rcf n PRO 46 N -0.11 1.39 0.00 0.37 -0.02 -1.26 -1.82 135.00 133.55 2rcf n PRO 46 Ca -0.10 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 2rcf n PRO 46 Cb 0.59 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 2rcf n PRO 46 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2rcf n GLY 47 N 2.31 3.44 3.75 -1.23 0.00 0.09 -5.00 105.19 108.54 2rcf n GLY 47 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 2rcf n GLY 47 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2rcf s ASP 48 N -0.80 6.58 -0.09 1.61 1.01 -0.76 -4.74 116.67 119.49 2rcf s ASP 48 Ca 0.00 2.74 -0.22 0.00 0.71 0.00 0.00 52.55 55.78 2rcf s ASP 48 Cb 0.00 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 2rcf s ASP 48 CO 0.00 -0.75 0.64 0.26 0.21 0.00 0.00 175.17 175.53 2rcf s TRP 49 N -0.01 3.55 0.06 4.23 0.52 -1.26 -1.09 118.94 124.93 2rcf s TRP 49 Ca 0.60 1.14 0.05 0.00 0.02 0.00 0.00 56.10 57.91 2rcf s TRP 49 Cb -0.43 -2.74 -0.03 0.00 -1.15 0.00 0.00 33.47 29.12 2rcf s TRP 49 CO 0.44 0.09 -0.13 0.14 0.02 0.00 0.00 176.95 177.51 2rcf s VAL 50 N 0.84 1.00 -0.24 4.03 -7.23 0.10 -0.35 120.40 118.55 2rcf s VAL 50 Ca 0.34 -1.25 -0.17 0.00 -1.81 0.00 0.00 61.98 59.10 2rcf s VAL 50 Cb -0.17 -0.98 -0.03 0.00 0.56 0.00 0.00 36.38 35.76 2rcf s VAL 50 CO 0.16 -0.24 0.44 -0.22 -0.31 0.00 0.00 175.10 174.93 2rcf s LEU 51 N -1.68 4.08 -0.10 1.32 2.96 0.38 -1.53 118.68 124.11 2rcf s LEU 51 Ca -0.03 0.46 0.02 0.00 -0.22 0.00 0.00 54.13 54.36 2rcf s LEU 51 Cb -0.10 -2.56 -0.01 0.00 0.50 0.00 0.00 46.19 44.02 2rcf s LEU 51 CO 0.02 -0.19 -0.18 0.00 -1.32 0.00 0.00 176.35 174.68 2rcf s VAL 53 N 0.13 3.54 0.00 0.00 0.11 -0.00 -0.84 120.40 123.33 2rcf s VAL 53 Ca -0.09 -0.70 0.00 0.00 -2.93 0.00 0.00 61.98 58.26 2rcf s VAL 53 Cb -0.15 -2.49 0.00 0.00 -1.53 0.00 0.00 36.38 32.21 2rcf s VAL 53 CO 0.06 0.48 0.00 0.61 -3.33 0.00 0.00 175.10 172.92 2rcf n GLY 54 N 1.86 5.57 7.00 6.54 0.00 -1.26 -0.50 105.19 124.41 2rcf n GLY 54 Ca -0.16 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 43.91 2rcf n GLY 54 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2rcf n SER 55 N 0.00 -1.15 0.19 1.61 2.88 -1.23 -2.46 113.62 113.46 2rcf n SER 55 Ca 0.00 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.59 2rcf n SER 55 Cb 0.00 0.00 0.37 0.00 -0.75 0.00 0.00 64.21 63.83 2rcf n SER 55 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2rcf h SER 56 N 4.28 0.00 0.06 -3.46 4.64 -1.94 -2.92 113.55 114.22 2rcf h SER 56 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2rcf h SER 56 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2rcf h SER 56 CO 0.00 0.38 -0.03 0.00 -0.87 0.00 0.00 176.83 176.30 2rcf h ALA 57 N 1.62 1.64 -0.10 5.18 0.00 -1.93 -2.28 119.26 123.38 2rcf h ALA 57 Ca -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2rcf h ALA 57 Cb 0.77 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2rcf h ALA 57 CO 0.05 0.04 0.01 0.00 0.00 0.00 0.00 179.25 179.34 2rcf h ALA 58 N 1.97 1.82 0.45 0.00 0.00 -1.27 -2.28 119.26 119.95 2rcf h ALA 58 Ca -0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2rcf h ALA 58 Cb 0.07 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2rcf h ALA 58 CO 0.00 0.14 -0.22 0.00 0.00 0.00 0.00 179.25 179.18 2rcf h ARG 59 N 0.14 -0.58 -0.53 0.00 3.08 -1.51 -1.95 114.38 113.03 2rcf h ARG 59 Ca 0.04 0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 2rcf h ARG 59 Cb 0.09 0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 2rcf h ARG 59 CO 0.00 -0.39 0.27 1.49 -1.07 0.00 0.00 179.97 180.28 2rcf h GLU 60 N -0.93 0.73 -0.30 0.04 4.81 -1.49 -0.98 114.58 116.46 2rcf h GLU 60 Ca -0.06 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.08 2rcf h GLU 60 Cb 0.46 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.68 2rcf h GLU 60 CO 0.10 0.55 0.15 0.00 -0.73 0.00 0.00 179.01 179.08 2rcf h ALA 61 N 1.57 1.70 -0.00 2.92 0.00 -1.45 -0.73 119.26 123.26 2rcf h ALA 61 Ca 0.19 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2rcf h ALA 61 Cb 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2rcf h ALA 61 CO -0.03 0.25 -0.01 0.00 0.00 0.00 0.00 179.25 179.46 2rcf n ALA 62 N -2.49 2.49 0.00 0.00 0.00 -0.41 -4.86 120.51 115.23 2rcf n ALA 62 Ca 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.31 2rcf n ALA 62 Cb 0.11 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.09 2rcf n ALA 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rcf n GLY 63 N 1.33 0.60 3.63 0.00 0.00 -0.28 -5.03 105.19 105.43 2rcf n GLY 63 Ca 0.13 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.06 2rcf n GLY 63 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2rcf s SER 64 N -0.44 -0.40 0.64 1.61 0.15 -1.10 -4.97 113.70 109.19 2rcf s SER 64 Ca 0.00 0.74 0.39 0.00 0.70 0.00 0.00 55.95 57.78 2rcf s SER 64 Cb 0.00 0.74 2.21 0.00 -1.71 0.00 0.00 66.02 67.26 2rcf s SER 64 CO 0.00 -0.16 2.33 0.11 1.20 0.00 0.00 173.24 176.72 2rcf h LYS 65 N 3.91 0.00 -0.27 5.44 1.57 -1.87 -1.56 116.57 123.78 2rcf h LYS 65 Ca -0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 2rcf h LYS 65 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 2rcf h LYS 65 CO 0.14 0.00 0.00 0.43 -0.57 0.00 0.00 179.45 179.45 2rcf n SER 66 N -3.36 2.71 -4.73 0.86 7.64 -1.26 -4.75 113.62 110.73 2rcf n SER 66 Ca -0.03 -1.88 -0.41 0.00 1.01 0.00 0.00 58.87 57.56 2rcf n SER 66 Cb 0.08 -0.17 -0.03 0.00 -1.01 0.00 0.00 64.21 63.08 2rcf n SER 66 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2rcf s TYR 67 N -1.66 3.42 -1.27 1.43 6.14 -0.63 -4.94 117.35 119.85 2rcf s TYR 67 Ca 0.35 1.39 -0.18 0.00 0.64 0.00 0.00 57.07 59.27 2rcf s TYR 67 Cb 0.20 -3.44 0.01 0.00 0.42 0.00 0.00 41.96 39.16 2rcf s TYR 67 CO 0.29 -1.26 1.89 -0.35 0.64 0.00 0.00 175.55 176.76 2rcf n PRO 68 N 2.69 2.69 -3.84 4.97 -0.04 -1.26 -4.62 135.00 135.58 2rcf n PRO 68 Ca 0.05 -2.88 -0.13 0.00 -0.04 0.00 0.00 63.50 60.51 2rcf n PRO 68 Cb 0.45 -3.46 -0.14 0.00 -0.04 0.00 0.00 33.50 30.31 2rcf n PRO 68 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2rcf s SER 69 N 4.52 -0.00 -0.03 3.54 0.15 -1.26 -4.98 113.70 115.64 2rcf s SER 69 Ca 0.56 0.04 0.07 0.00 0.70 0.00 0.00 55.95 57.31 2rcf s SER 69 Cb 0.06 0.02 0.15 0.00 -1.71 0.00 0.00 66.02 64.53 2rcf s SER 69 CO 0.06 -0.03 1.11 -0.90 1.20 0.00 0.00 173.24 174.68 2rcf n ASP 70 N 3.31 2.38 -3.32 5.45 5.75 -1.26 -3.83 116.55 125.02 2rcf n ASP 70 Ca -0.15 -2.26 -0.01 0.00 -0.01 0.00 0.00 54.79 52.36 2rcf n ASP 70 Cb 0.58 -0.16 -0.04 0.00 -1.03 0.00 0.00 41.12 40.47 2rcf n ASP 70 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 2rcf s LEU 71 N -1.45 -1.11 -0.04 -2.12 2.96 -1.25 -3.58 118.68 112.08 2rcf s LEU 71 Ca 0.13 0.85 0.02 0.00 -0.22 0.00 0.00 54.13 54.92 2rcf s LEU 71 Cb 0.10 1.88 0.01 0.00 0.50 0.00 0.00 46.19 48.67 2rcf s LEU 71 CO 0.04 -0.26 -0.09 -0.89 -1.32 0.00 0.00 176.35 173.83 2rcf s THR 72 N 2.77 0.84 -0.17 3.68 2.01 0.35 -1.74 115.64 123.37 2rcf s THR 72 Ca 0.13 -0.36 -0.29 0.00 0.31 0.00 0.00 61.69 61.48 2rcf s THR 72 Cb -0.14 -0.77 -0.01 0.00 0.01 0.00 0.00 72.50 71.58 2rcf s THR 72 CO -0.19 0.27 1.30 -0.63 -0.69 0.00 0.00 174.62 174.68 2rcf s ILE 73 N 0.40 4.21 -0.41 1.82 1.01 -0.28 -0.82 121.20 127.14 2rcf s ILE 73 Ca -0.07 1.46 0.03 0.00 0.00 0.00 0.00 60.65 62.07 2rcf s ILE 73 Cb -0.11 -3.98 0.04 0.00 0.01 0.00 0.00 42.46 38.42 2rcf s ILE 73 CO 0.01 -0.17 0.67 2.30 0.00 0.00 0.00 174.94 177.75 2rcf n ILE 74 N 5.49 0.14 -3.57 2.92 -5.35 -0.12 -2.79 119.36 116.08 2rcf n ILE 74 Ca 0.14 -0.57 -0.08 0.00 -0.27 0.00 0.00 62.75 61.98 2rcf n ILE 74 Cb 0.45 0.99 -0.03 0.00 -1.74 0.00 0.00 39.64 39.31 2rcf n ILE 74 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2rcf s GLY 75 N -0.38 -0.30 -0.19 3.28 0.00 -1.21 -4.97 107.32 103.55 2rcf s GLY 75 Ca 0.04 1.72 -0.10 0.00 0.00 0.00 0.00 44.72 46.38 2rcf s GLY 75 CO 0.04 0.73 0.13 -0.42 0.00 0.00 0.00 173.10 173.59 2rcf s ILE 76 N -1.96 5.42 -0.21 0.90 1.01 -1.26 -0.47 121.20 124.62 2rcf s ILE 76 Ca 0.04 0.20 -0.23 0.00 0.00 0.00 0.00 60.65 60.66 2rcf s ILE 76 Cb -0.01 -3.47 -0.02 0.00 0.01 0.00 0.00 42.46 38.98 2rcf s ILE 76 CO -0.04 0.46 0.73 -0.63 0.00 0.00 0.00 174.94 175.46 2rcf s ILE 77 N 0.22 4.94 -0.85 2.92 1.01 0.53 -4.90 121.20 125.06 2rcf s ILE 77 Ca 0.09 1.38 -0.25 0.00 0.00 0.00 0.00 60.65 61.87 2rcf s ILE 77 Cb -0.11 -4.03 0.05 0.00 0.01 0.00 0.00 42.46 38.38 2rcf s ILE 77 CO -0.01 0.03 1.31 -1.81 0.00 0.00 0.00 174.94 174.46 2rcf s ASP 78 N 1.26 6.32 0.41 3.58 -0.00 -1.26 -4.62 116.67 122.37 2rcf s ASP 78 Ca 0.32 -0.98 0.22 0.00 -0.00 0.00 0.00 52.55 52.11 2rcf s ASP 78 Cb -0.16 -2.54 0.76 0.00 -0.00 0.00 0.00 42.92 40.98 2rcf s ASP 78 CO 0.10 -1.63 1.76 0.06 -0.00 0.00 0.00 175.17 175.46 2rcf h GLN 79 N 9.83 0.00 -2.86 8.23 -0.00 -1.95 -3.24 115.11 125.12 2rcf h GLN 79 Ca -0.07 0.00 -0.74 0.00 -0.00 0.00 0.00 58.65 57.84 2rcf h GLN 79 Cb 1.03 0.00 -0.33 0.00 -0.00 0.00 0.00 27.48 28.19 2rcf h GLN 79 CO 1.32 0.27 0.29 0.91 -0.00 0.00 0.00 178.83 181.62 2rcf n TRP 80 N -3.37 3.18 0.00 0.06 7.02 -1.26 -5.27 117.44 117.80 2rcf n TRP 80 Ca 0.00 -3.32 0.00 0.00 -1.02 0.00 0.00 57.50 53.16 2rcf n TRP 80 Cb 0.48 -1.11 0.00 0.00 -2.42 0.00 0.00 31.31 28.26 2rcf n TRP 80 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76