#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 1.43 -0.16 0.03 1.02 -0.56 -4.95 119.74 116.55 2rcf s LYS 2 Ca 0.00 -1.32 -0.17 0.00 0.02 0.00 0.00 55.97 54.50 2rcf s LYS 2 Cb 0.00 -1.89 -0.04 0.00 -0.52 0.00 0.00 37.83 35.38 2rcf s LYS 2 CO 0.00 0.45 0.45 0.42 -0.92 0.00 0.00 175.35 175.76 2rcf s ILE 3 N -1.04 5.18 0.08 2.17 1.01 -1.26 -1.38 121.20 125.96 2rcf s ILE 3 Ca 0.14 0.86 -0.05 0.00 0.00 0.00 0.00 60.65 61.60 2rcf s ILE 3 Cb -0.10 -3.79 -0.02 0.00 0.01 0.00 0.00 42.46 38.56 2rcf s ILE 3 CO 0.06 0.27 0.09 -0.04 0.00 0.00 0.00 174.94 175.32 2rcf s MET 4 N 1.04 0.78 -0.07 2.79 -1.94 -0.30 -4.52 119.30 117.08 2rcf s MET 4 Ca 0.23 -1.12 0.02 0.00 -1.71 0.00 0.00 55.69 53.10 2rcf s MET 4 Cb -0.15 0.28 -0.03 0.00 2.01 0.00 0.00 34.83 36.95 2rcf s MET 4 CO 0.09 -0.21 -0.11 -1.14 -0.01 0.00 0.00 175.02 173.64 2rcf s GLN 5 N -3.91 2.76 -0.05 2.03 0.74 0.93 0.69 119.66 122.84 2rcf s GLN 5 Ca 0.08 -0.63 -0.30 0.00 0.05 0.00 0.00 55.36 54.57 2rcf s GLN 5 Cb 0.06 -2.52 -0.03 0.00 1.10 0.00 0.00 33.01 31.62 2rcf s GLN 5 CO -0.09 0.58 1.22 0.08 -0.55 0.00 0.00 175.29 176.53 2rcf s VAL 6 N -0.59 4.20 -0.21 1.34 1.01 -0.32 -1.90 120.40 123.93 2rcf s VAL 6 Ca 0.09 1.53 -0.19 0.00 0.00 0.00 0.00 61.98 63.41 2rcf s VAL 6 Cb -0.11 -3.98 -0.15 0.00 0.00 0.00 0.00 36.38 32.13 2rcf s VAL 6 CO 0.02 -0.01 0.07 1.21 0.00 0.00 0.00 175.10 176.39 2rcf n GLU 7 N 5.25 0.55 -3.73 2.72 2.13 0.08 -0.95 120.64 126.69 2rcf n GLU 7 Ca 0.11 0.53 -0.03 0.00 0.66 0.00 0.00 57.16 58.43 2rcf n GLU 7 Cb 0.46 -1.70 -0.01 0.00 0.27 0.00 0.00 31.44 30.45 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 1.08 0.26 5.31 -2.85 -1.21 -4.68 119.74 115.27 2rcf s LYS 8 Ca -0.28 -0.59 -0.30 0.00 -1.00 0.00 0.00 55.97 53.81 2rcf s LYS 8 Cb 0.06 0.37 -0.09 0.00 -2.06 0.00 0.00 37.83 36.11 2rcf s LYS 8 CO 0.52 -0.49 1.06 0.99 0.10 0.00 0.00 175.35 177.52 2rcf s THR 9 N -3.16 3.66 -0.32 3.79 2.01 -1.26 -0.00 115.64 120.35 2rcf s THR 9 Ca 0.12 1.65 -0.17 0.00 0.31 0.00 0.00 61.69 63.60 2rcf s THR 9 Cb -0.01 -4.05 -0.01 0.00 0.01 0.00 0.00 72.50 68.44 2rcf s THR 9 CO 0.01 0.38 0.49 -0.22 -0.69 0.00 0.00 174.62 174.59 2rcf s LEU 10 N -1.26 4.26 -0.38 4.42 1.98 0.31 -4.74 118.68 123.28 2rcf s LEU 10 Ca 0.44 0.09 -0.17 0.00 -2.89 0.00 0.00 54.13 51.61 2rcf s LEU 10 Cb -0.30 -2.56 0.00 0.00 0.66 0.00 0.00 46.19 43.99 2rcf s LEU 10 CO 0.38 -0.40 0.43 -0.69 -1.89 0.00 0.00 176.35 174.18 2rcf s VAL 11 N 2.32 5.09 -0.35 1.68 1.01 -1.26 -4.54 120.40 124.35 2rcf s VAL 11 Ca 0.18 -0.04 -0.01 0.00 0.00 0.00 0.00 61.98 62.12 2rcf s VAL 11 Cb -0.16 -3.95 0.12 0.00 0.00 0.00 0.00 36.38 32.40 2rcf s VAL 11 CO 0.12 -0.26 0.18 -0.55 0.00 0.00 0.00 175.10 174.59 2rcf s SER 12 N 1.78 3.44 0.01 3.32 0.15 -1.26 -5.00 113.70 116.14 2rcf s SER 12 Ca 0.14 -1.97 -0.24 0.00 0.70 0.00 0.00 55.95 54.58 2rcf s SER 12 Cb -0.16 -0.61 -0.17 0.00 -1.71 0.00 0.00 66.02 63.36 2rcf s SER 12 CO 0.13 -0.35 1.35 0.74 1.20 0.00 0.00 173.24 176.31 2rcf h THR 13 N 5.66 1.33 -1.90 6.45 2.02 -2.05 -3.37 112.91 121.05 2rcf h THR 13 Ca -0.05 -1.06 -0.65 0.00 0.77 0.00 0.00 66.41 65.42 2rcf h THR 13 Cb 0.98 1.92 -0.14 0.00 -1.74 0.00 0.00 68.15 69.17 2rcf h THR 13 CO 0.39 0.29 1.09 0.21 0.37 0.00 0.00 175.52 177.87 2rcf s ASN 14 N -5.78 6.54 0.13 4.18 2.47 -1.26 -4.96 114.94 116.26 2rcf s ASN 14 Ca -0.15 -1.70 -0.00 0.00 0.42 0.00 0.00 52.86 51.43 2rcf s ASN 14 Cb 0.03 -2.47 -0.04 0.00 -1.45 0.00 0.00 41.25 37.32 2rcf s ASN 14 CO 0.70 -1.29 0.02 0.00 -3.72 0.00 0.00 177.10 172.81 2rcf s ARG 15 N 3.77 0.92 0.66 0.43 1.70 -1.26 -5.15 118.95 120.02 2rcf s ARG 15 Ca 0.37 -1.43 -0.17 0.00 -0.47 0.00 0.00 55.73 54.04 2rcf s ARG 15 Cb -0.04 0.08 -0.00 0.00 -0.57 0.00 0.00 34.95 34.42 2rcf s ARG 15 CO -0.08 -0.19 1.19 0.96 -1.08 0.00 0.00 175.30 176.10 2rcf s ILE 16 N -3.90 2.61 0.35 4.99 -4.36 -1.26 -4.92 121.20 114.71 2rcf s ILE 16 Ca 0.21 0.33 0.06 0.00 -0.26 0.00 0.00 60.65 60.99 2rcf s ILE 16 Cb 0.07 -2.98 0.16 0.00 1.25 0.00 0.00 42.46 40.96 2rcf s ILE 16 CO 0.00 -0.13 1.89 0.00 0.24 0.00 0.00 174.94 176.94 2rcf h ALA 17 N 0.28 1.42 -0.02 2.27 0.00 -2.01 -2.79 119.26 118.41 2rcf h ALA 17 Ca -0.49 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.23 2rcf h ALA 17 Cb 1.29 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 2rcf h ALA 17 CO 0.53 0.40 0.20 -0.44 0.00 0.00 0.00 179.25 179.94 2rcf h ASP 18 N 0.42 0.00 0.97 0.00 3.45 -1.99 -1.96 116.42 117.30 2rcf h ASP 18 Ca 0.09 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.55 2rcf h ASP 18 Cb 0.33 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.10 2rcf h ASP 18 CO 0.01 0.00 0.00 0.24 -1.57 0.00 0.00 179.24 177.92 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 0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2rcf h MET 19 Cb 0.41 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.07 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 0.23 2.75 0.52 8.32 0.00 -0.74 -3.38 105.19 112.89 2rcf n GLY 20 Ca 0.02 -0.36 0.09 0.00 0.00 0.00 0.00 46.02 45.77 2rcf n GLY 20 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2rcf n HIS 21 N 13.55 0.51 -2.20 1.61 1.44 -1.26 -5.04 115.22 123.83 2rcf n HIS 21 Ca 0.00 -0.90 -0.41 0.00 -2.01 0.00 0.00 57.72 54.40 2rcf n HIS 21 Cb 0.00 -0.23 -0.03 0.00 0.12 0.00 0.00 29.99 29.85 2rcf n HIS 21 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 2rcf s LYS 22 N -2.71 4.38 0.36 -1.40 1.02 -1.22 -4.96 119.74 115.21 2rcf s LYS 22 Ca 0.36 2.08 -0.27 0.00 0.02 0.00 0.00 55.97 58.15 2rcf s LYS 22 Cb 0.30 -3.18 -0.09 0.00 -0.52 0.00 0.00 37.83 34.34 2rcf s LYS 22 CO 0.06 -0.25 1.22 -1.25 -0.92 0.00 0.00 175.35 174.22 2rcf s PRO 23 N -0.31 4.23 -0.12 -1.68 0.04 -1.26 -4.90 135.00 131.01 2rcf s PRO 23 Ca 0.56 2.00 -0.01 0.00 0.04 0.00 0.00 61.00 63.59 2rcf s PRO 23 Cb -0.37 -2.90 -0.02 0.00 0.04 0.00 0.00 34.50 31.25 2rcf s PRO 23 CO 0.40 -0.21 -0.09 -0.51 0.04 0.00 0.00 177.00 176.62 2rcf s LEU 24 N -2.09 2.95 -0.00 -3.56 1.43 -1.26 -0.86 118.68 115.29 2rcf s LEU 24 Ca 0.52 -0.20 0.07 0.00 -1.03 0.00 0.00 54.13 53.49 2rcf s LEU 24 Cb -0.35 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.18 2rcf s LEU 24 CO 0.45 0.22 -0.21 -0.76 0.23 0.00 0.00 176.35 176.27 2rcf s LEU 25 N 0.06 2.07 -0.03 1.79 1.43 -0.11 -0.53 118.68 123.37 2rcf s LEU 25 Ca -0.03 -0.42 -0.30 0.00 -1.03 0.00 0.00 54.13 52.35 2rcf s LEU 25 Cb -0.14 -1.09 -0.03 0.00 0.03 0.00 0.00 46.19 44.97 2rcf s LEU 25 CO 0.04 0.24 0.97 -0.69 0.23 0.00 0.00 176.35 177.14 2rcf s VAL 26 N -0.57 4.86 0.12 -1.59 1.01 1.00 -1.09 120.40 124.13 2rcf s VAL 26 Ca 0.08 2.03 0.04 0.00 0.00 0.00 0.00 61.98 64.14 2rcf s VAL 26 Cb -0.08 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.95 2rcf s VAL 26 CO -0.00 0.13 -0.10 0.68 0.00 0.00 0.00 175.10 175.80 2rcf s VAL 27 N 1.23 1.06 0.05 2.92 -7.23 0.49 -0.74 120.40 118.17 2rcf s VAL 27 Ca 0.51 -1.82 -0.14 0.00 -1.81 0.00 0.00 61.98 58.71 2rcf s VAL 27 Cb -0.20 -1.58 0.02 0.00 0.56 0.00 0.00 36.38 35.18 2rcf s VAL 27 CO 0.25 -0.62 0.32 -1.66 -0.31 0.00 0.00 175.10 173.08 2rcf s TRP 28 N -2.78 -0.13 0.38 2.82 -2.14 -0.80 -0.96 118.94 115.33 2rcf s TRP 28 Ca 0.10 -0.00 0.12 0.00 2.66 0.00 0.00 56.10 58.98 2rcf s TRP 28 Cb -0.01 0.12 0.76 0.00 -3.10 0.00 0.00 33.47 31.24 2rcf s TRP 28 CO 0.00 -0.52 1.86 0.93 -2.66 0.00 0.00 176.95 176.56 2rcf h GLU 29 N 3.15 0.07 -2.47 3.25 5.08 -1.82 0.27 114.58 122.11 2rcf h GLU 29 Ca -0.32 -0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.12 2rcf h GLU 29 Cb 1.20 -0.01 -0.13 0.00 0.50 0.00 0.00 28.75 30.32 2rcf h GLU 29 CO 0.46 0.36 0.42 -1.59 -1.00 0.00 0.00 179.01 177.66 2rcf s LYS 30 N -4.38 1.04 0.18 2.33 -2.85 -1.26 -4.58 119.74 110.22 2rcf s LYS 30 Ca -0.04 -0.45 -0.33 0.00 -1.00 0.00 0.00 55.97 54.16 2rcf s LYS 30 Cb 0.15 0.44 -0.15 0.00 -2.06 0.00 0.00 37.83 36.20 2rcf s LYS 30 CO 0.73 -0.46 1.31 -2.30 0.10 0.00 0.00 175.35 174.72 2rcf n PRO 31 N -0.33 1.53 0.00 1.78 -0.02 -1.26 -1.43 135.00 135.27 2rcf n PRO 31 Ca -0.09 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 2rcf n PRO 31 Cb 0.62 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 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 2.28 2.32 3.86 -1.23 0.00 -1.26 -5.05 105.19 106.10 2rcf n GLY 32 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.28 2.93 0.19 4.61 0.00 -0.52 -4.97 121.76 121.71 2rcf s ALA 33 Ca 0.00 -0.11 -0.33 0.00 0.00 0.00 0.00 51.96 51.52 2rcf s ALA 33 Cb 0.00 -3.09 -0.14 0.00 0.00 0.00 0.00 23.12 19.89 2rcf s ALA 33 CO 0.00 -0.94 1.52 -2.30 0.00 0.00 0.00 175.76 174.03 2rcf n PRO 34 N -2.92 2.10 -2.53 0.00 -0.02 -1.26 -4.85 135.00 125.52 2rcf n PRO 34 Ca 0.07 0.75 -0.39 0.00 -2.02 0.00 0.00 63.50 61.90 2rcf n PRO 34 Cb 0.55 -2.48 -0.04 0.00 -0.02 0.00 0.00 33.50 31.50 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 0.43 4.56 0.30 -0.52 0.52 -1.26 -4.63 118.95 118.34 2rcf s ARG 35 Ca 0.75 1.70 0.02 0.00 -0.52 0.00 0.00 55.73 57.68 2rcf s ARG 35 Cb -0.67 -3.05 -0.04 0.00 0.52 0.00 0.00 34.95 31.70 2rcf s ARG 35 CO 0.42 0.17 0.12 -0.65 0.02 0.00 0.00 175.30 175.38 2rcf s GLN 36 N -1.66 1.56 -0.06 3.54 -0.21 -0.13 -4.98 119.66 117.71 2rcf s GLN 36 Ca 0.47 -1.88 0.04 0.00 0.02 0.00 0.00 55.36 54.01 2rcf s GLN 36 Cb -0.29 -0.30 0.00 0.00 1.00 0.00 0.00 33.01 33.42 2rcf s GLN 36 CO 0.37 -0.36 -0.17 0.08 -2.12 0.00 0.00 175.29 173.08 2rcf s VAL 37 N -3.60 1.49 0.06 1.09 1.01 -1.26 -0.38 120.40 118.81 2rcf s VAL 37 Ca 0.35 -0.73 0.07 0.00 0.00 0.00 0.00 61.98 61.68 2rcf s VAL 37 Cb 0.06 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 35.12 2rcf s VAL 37 CO 0.15 0.43 -0.20 0.00 0.00 0.00 0.00 175.10 175.49 2rcf s ALA 38 N 0.22 1.67 0.15 5.51 0.00 -0.25 -4.69 121.76 124.37 2rcf s ALA 38 Ca -0.09 -1.06 -0.30 0.00 0.00 0.00 0.00 51.96 50.51 2rcf s ALA 38 Cb -0.14 -0.29 -0.07 0.00 0.00 0.00 0.00 23.12 22.62 2rcf s ALA 38 CO 0.04 0.36 1.02 0.54 0.00 0.00 0.00 175.76 177.71 2rcf s VAL 39 N -0.90 4.21 -0.52 0.00 0.11 -0.49 -0.94 120.40 121.87 2rcf s VAL 39 Ca 0.06 1.89 -0.20 0.00 -2.93 0.00 0.00 61.98 60.80 2rcf s VAL 39 Cb -0.09 -4.21 0.06 0.00 -1.53 0.00 0.00 36.38 30.61 2rcf s VAL 39 CO 0.02 0.32 0.68 -0.62 -3.33 0.00 0.00 175.10 172.18 2rcf s ASP 40 N -0.15 6.24 0.00 3.54 2.15 -0.04 -0.80 116.67 127.61 2rcf s ASP 40 Ca 0.47 -0.84 0.22 0.00 0.43 0.00 0.00 52.55 52.83 2rcf s ASP 40 Cb -0.26 -2.32 0.51 0.00 -0.30 0.00 0.00 42.92 40.55 2rcf s ASP 40 CO 0.32 -0.96 1.44 0.00 -0.17 0.00 0.00 175.17 175.80 2rcf n ALA 41 N 6.41 2.43 -0.03 3.66 0.00 -1.07 -4.47 120.51 127.45 2rcf n ALA 41 Ca -0.05 -0.94 -0.06 0.00 0.00 0.00 0.00 53.44 52.39 2rcf n ALA 41 Cb 0.46 -0.93 -0.02 0.00 0.00 0.00 0.00 19.45 18.95 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 1.26 0.33 0.00 0.00 2.08 -1.26 -4.98 119.36 116.80 2rcf n ILE 42 Ca 0.19 -0.10 0.00 0.00 0.56 0.00 0.00 62.75 63.41 2rcf n ILE 42 Cb 0.54 -1.34 0.00 0.00 -0.75 0.00 0.00 39.64 38.10 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 2.79 0.77 3.62 7.39 0.00 -1.26 -5.10 105.19 113.39 2rcf n GLY 43 Ca -0.11 -0.62 -0.23 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.37 1.62 0.28 0.00 -4.36 -1.26 -5.09 121.20 110.01 2rcf s ILE 45 Ca 0.32 -2.16 -0.29 0.00 -0.26 0.00 0.00 60.65 58.25 2rcf s ILE 45 Cb -0.06 -2.22 -0.13 0.00 1.25 0.00 0.00 42.46 41.30 2rcf s ILE 45 CO 0.19 -0.46 1.23 -2.65 0.24 0.00 0.00 174.94 173.49 2rcf n PRO 46 N -0.46 1.77 0.00 0.37 -0.02 -1.26 -2.25 135.00 133.15 2rcf n PRO 46 Ca -0.07 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 2rcf n PRO 46 Cb 0.62 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 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 1.45 2.95 3.71 -1.23 0.00 -0.13 -5.00 105.19 106.93 2rcf n GLY 47 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 2rcf n GLY 47 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2rcf n ASP 48 N 0.00 3.28 -4.74 1.61 8.00 -0.95 -4.71 116.55 119.03 2rcf n ASP 48 Ca 0.00 1.15 -0.38 0.00 0.71 0.00 0.00 54.79 56.27 2rcf n ASP 48 Cb 0.00 -1.51 -0.06 0.00 -0.02 0.00 0.00 41.12 39.53 2rcf n ASP 48 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 2rcf s TRP 49 N -0.14 3.58 0.07 1.24 0.52 -1.26 -1.17 118.94 121.78 2rcf s TRP 49 Ca 0.65 1.01 0.03 0.00 0.02 0.00 0.00 56.10 57.80 2rcf s TRP 49 Cb -0.57 -2.56 -0.03 0.00 -1.15 0.00 0.00 33.47 29.16 2rcf s TRP 49 CO 0.50 0.26 -0.08 0.14 0.02 0.00 0.00 176.95 177.79 2rcf s VAL 50 N 0.26 0.70 -0.21 4.03 -7.23 0.22 -0.64 120.40 117.52 2rcf s VAL 50 Ca 0.28 -1.40 -0.12 0.00 -1.81 0.00 0.00 61.98 58.93 2rcf s VAL 50 Cb -0.16 -1.03 -0.05 0.00 0.56 0.00 0.00 36.38 35.70 2rcf s VAL 50 CO 0.13 -0.51 0.24 -0.22 -0.31 0.00 0.00 175.10 174.42 2rcf s LEU 51 N -2.09 4.16 -0.05 1.32 2.96 -0.05 -1.14 118.68 123.78 2rcf s LEU 51 Ca -0.01 0.29 0.05 0.00 -0.22 0.00 0.00 54.13 54.24 2rcf s LEU 51 Cb -0.05 -2.25 -0.01 0.00 0.50 0.00 0.00 46.19 44.38 2rcf s LEU 51 CO -0.01 0.05 -0.22 0.00 -1.32 0.00 0.00 176.35 174.85 2rcf s VAL 53 N -0.09 3.52 0.00 0.00 0.11 -0.05 -1.50 120.40 122.40 2rcf s VAL 53 Ca -0.04 -0.86 0.00 0.00 -2.93 0.00 0.00 61.98 58.15 2rcf s VAL 53 Cb -0.13 -2.54 0.00 0.00 -1.53 0.00 0.00 36.38 32.18 2rcf s VAL 53 CO 0.03 0.36 0.00 0.61 -3.33 0.00 0.00 175.10 172.78 2rcf n GLY 54 N 1.48 6.26 7.00 6.54 0.00 -1.26 -0.93 105.19 124.29 2rcf n GLY 54 Ca -0.15 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 43.85 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 -1.00 0.23 1.61 2.88 -1.24 -2.91 113.62 113.19 2rcf n SER 55 Ca 0.00 0.00 0.10 0.00 -1.33 0.00 0.00 58.87 57.64 2rcf n SER 55 Cb 0.00 0.00 0.51 0.00 -0.75 0.00 0.00 64.21 63.97 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 5.97 0.00 0.14 -3.46 4.64 -1.94 -3.06 113.55 115.84 2rcf h SER 56 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 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 0.22 -0.10 0.00 -0.87 0.00 0.00 176.83 176.08 2rcf h ALA 57 N 1.78 1.67 0.00 5.18 0.00 -1.93 -2.86 119.26 123.10 2rcf h ALA 57 Ca -0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2rcf h ALA 57 Cb 0.67 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 2rcf h ALA 57 CO 0.03 0.13 -0.03 0.00 0.00 0.00 0.00 179.25 179.38 2rcf h ALA 58 N 1.90 1.95 0.39 0.00 0.00 -1.42 -1.58 119.26 120.50 2rcf h ALA 58 Ca -0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2rcf h ALA 58 Cb 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2rcf h ALA 58 CO 0.01 0.03 -0.19 0.00 0.00 0.00 0.00 179.25 179.11 2rcf h ARG 59 N 0.00 -0.50 -0.33 0.00 3.08 -1.59 -1.46 114.38 113.58 2rcf h ARG 59 Ca -0.00 0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 2rcf h ARG 59 Cb 0.05 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 2rcf h ARG 59 CO 0.00 -0.31 -0.01 1.49 -1.07 0.00 0.00 179.97 180.06 2rcf h GLU 60 N -1.13 0.51 -0.73 0.04 4.81 -1.51 -0.98 114.58 115.59 2rcf h GLU 60 Ca -0.05 -0.11 0.06 0.00 -0.13 0.00 0.00 59.36 59.12 2rcf h GLU 60 Cb 0.42 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.68 2rcf h GLU 60 CO 0.09 0.55 0.48 0.00 -0.73 0.00 0.00 179.01 179.40 2rcf h ALA 61 N 1.50 1.67 0.00 2.92 0.00 -1.32 -0.89 119.26 123.14 2rcf h ALA 61 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2rcf h ALA 61 Cb 0.34 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2rcf h ALA 61 CO 0.01 0.23 0.00 0.00 0.00 0.00 0.00 179.25 179.49 2rcf n ALA 62 N -2.44 1.93 0.00 0.00 0.00 -0.40 -4.86 120.51 114.74 2rcf n ALA 62 Ca 0.10 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.59 2rcf n ALA 62 Cb 0.20 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.22 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 0.58 0.97 3.57 0.00 0.00 -0.34 -4.97 105.19 105.00 2rcf n GLY 63 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.95 -0.70 0.65 1.61 0.15 -1.06 -4.95 113.70 108.45 2rcf s SER 64 Ca 0.00 1.34 0.39 0.00 0.70 0.00 0.00 55.95 58.39 2rcf s SER 64 Cb 0.00 1.36 2.19 0.00 -1.71 0.00 0.00 66.02 67.86 2rcf s SER 64 CO 0.00 -0.23 2.28 0.11 1.20 0.00 0.00 173.24 176.60 2rcf h LYS 65 N 5.11 0.00 -0.22 5.44 1.57 -1.87 -0.67 116.57 125.93 2rcf h LYS 65 Ca -0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 2rcf h LYS 65 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.47 2rcf h LYS 65 CO 0.09 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 177.84 2rcf n SER 66 N -3.24 2.84 -4.73 0.86 3.41 -1.26 -4.75 113.62 106.75 2rcf n SER 66 Ca -0.03 -1.90 -0.41 0.00 -0.26 0.00 0.00 58.87 56.27 2rcf n SER 66 Cb 0.13 -0.13 -0.03 0.00 -0.26 0.00 0.00 64.21 63.91 2rcf n SER 66 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2rcf s TYR 67 N -1.74 3.40 -1.28 7.33 6.14 -0.28 -4.93 117.35 125.99 2rcf s TYR 67 Ca 0.35 1.36 -0.19 0.00 0.64 0.00 0.00 57.07 59.23 2rcf s TYR 67 Cb 0.21 -3.46 0.04 0.00 0.42 0.00 0.00 41.96 39.17 2rcf s TYR 67 CO 0.30 -1.35 1.78 -0.35 0.64 0.00 0.00 175.55 176.57 2rcf n PRO 68 N 2.76 2.90 -3.85 4.97 -0.04 -1.26 -4.57 135.00 135.92 2rcf n PRO 68 Ca 0.05 -3.13 -0.13 0.00 -0.04 0.00 0.00 63.50 60.26 2rcf n PRO 68 Cb 0.44 -3.54 -0.14 0.00 -0.04 0.00 0.00 33.50 30.22 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 4.64 0.01 -0.03 3.54 0.15 -1.26 -4.99 113.70 115.77 2rcf s SER 69 Ca 0.57 0.01 0.06 0.00 0.70 0.00 0.00 55.95 57.29 2rcf s SER 69 Cb 0.03 -0.01 0.13 0.00 -1.71 0.00 0.00 66.02 64.46 2rcf s SER 69 CO 0.09 -0.03 1.10 -0.90 1.20 0.00 0.00 173.24 174.70 2rcf n ASP 70 N 3.32 2.34 -3.37 5.45 3.85 -1.26 -3.78 116.55 123.10 2rcf n ASP 70 Ca -0.16 -2.22 0.00 0.00 -0.71 0.00 0.00 54.79 51.71 2rcf n ASP 70 Cb 0.58 -0.14 -0.03 0.00 -1.35 0.00 0.00 41.12 40.17 2rcf n ASP 70 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.20 175.97 2rcf s LEU 71 N -1.39 -1.19 -0.04 -2.12 2.96 -1.25 -3.63 118.68 112.03 2rcf s LEU 71 Ca 0.12 1.06 0.02 0.00 -0.22 0.00 0.00 54.13 55.11 2rcf s LEU 71 Cb 0.09 2.06 0.01 0.00 0.50 0.00 0.00 46.19 48.84 2rcf s LEU 71 CO 0.04 -0.25 -0.10 -0.89 -1.32 0.00 0.00 176.35 173.84 2rcf s THR 72 N 2.83 0.87 -0.21 3.68 2.01 -0.10 -1.40 115.64 123.30 2rcf s THR 72 Ca 0.10 -0.37 -0.29 0.00 0.31 0.00 0.00 61.69 61.44 2rcf s THR 72 Cb -0.14 -0.79 -0.01 0.00 0.01 0.00 0.00 72.50 71.57 2rcf s THR 72 CO -0.19 0.28 1.24 -0.63 -0.69 0.00 0.00 174.62 174.63 2rcf s ILE 73 N 0.44 4.30 -0.58 1.82 1.01 0.02 -0.87 121.20 127.35 2rcf s ILE 73 Ca -0.08 1.55 0.05 0.00 0.00 0.00 0.00 60.65 62.17 2rcf s ILE 73 Cb -0.12 -4.09 0.03 0.00 0.01 0.00 0.00 42.46 38.29 2rcf s ILE 73 CO 0.01 -0.24 0.60 2.30 0.00 0.00 0.00 174.94 177.61 2rcf n ILE 74 N 5.60 0.00 -3.52 2.92 -5.35 0.01 -2.58 119.36 116.44 2rcf n ILE 74 Ca 0.14 -0.49 -0.10 0.00 -0.27 0.00 0.00 62.75 62.03 2rcf n ILE 74 Cb 0.45 1.09 -0.03 0.00 -1.74 0.00 0.00 39.64 39.41 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 -0.56 -0.42 -0.19 3.28 0.00 -1.17 -4.96 107.32 103.29 2rcf s GLY 75 Ca 0.05 1.34 -0.08 0.00 0.00 0.00 0.00 44.72 46.03 2rcf s GLY 75 CO 0.08 0.61 0.08 -0.42 0.00 0.00 0.00 173.10 173.45 2rcf s ILE 76 N -2.32 4.91 -0.12 0.90 1.01 -1.26 -0.87 121.20 123.45 2rcf s ILE 76 Ca 0.01 0.01 -0.27 0.00 0.00 0.00 0.00 60.65 60.40 2rcf s ILE 76 Cb -0.01 -3.23 -0.02 0.00 0.01 0.00 0.00 42.46 39.21 2rcf s ILE 76 CO -0.04 0.44 0.89 -0.63 0.00 0.00 0.00 174.94 175.60 2rcf s ILE 77 N 0.49 4.86 0.46 2.92 1.01 0.18 -4.92 121.20 126.22 2rcf s ILE 77 Ca 0.04 1.79 0.12 0.00 0.00 0.00 0.00 60.65 62.60 2rcf s ILE 77 Cb -0.12 -4.20 0.27 0.00 0.01 0.00 0.00 42.46 38.41 2rcf s ILE 77 CO 0.00 0.05 2.10 0.44 0.00 0.00 0.00 174.94 177.54 2rcf h ASP 78 N 7.14 0.24 -3.58 3.58 3.45 -1.98 -3.38 116.42 121.89 2rcf h ASP 78 Ca -0.32 -0.01 -0.58 0.00 0.43 0.00 0.00 57.03 56.55 2rcf h ASP 78 Cb 1.15 -0.06 -0.08 0.00 -0.56 0.00 0.00 39.33 39.78 2rcf h ASP 78 CO 0.83 0.17 0.75 -1.10 -1.57 0.00 0.00 179.24 178.32 2rcf s GLN 79 N -5.29 3.76 0.00 3.56 -1.52 -1.26 -5.11 119.66 113.80 2rcf s GLN 79 Ca -0.07 0.55 0.03 0.00 -1.95 0.00 0.00 55.36 53.93 2rcf s GLN 79 Cb 0.17 -3.86 0.03 0.00 -0.22 0.00 0.00 33.01 29.13 2rcf s GLN 79 CO 0.70 -1.16 0.60 0.91 -0.25 0.00 0.00 175.29 176.10