#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 2.27 -0.18 0.03 -0.14 -0.18 -4.94 119.74 116.62 2rcf s LYS 2 Ca 0.00 -0.90 -0.16 0.00 -1.36 0.00 0.00 55.97 53.55 2rcf s LYS 2 Cb 0.00 -2.35 -0.04 0.00 -1.68 0.00 0.00 37.83 33.76 2rcf s LYS 2 CO 0.00 0.55 0.42 0.42 -0.76 0.00 0.00 175.35 175.98 2rcf s ILE 3 N -1.05 5.20 0.06 2.17 1.01 -1.26 -0.93 121.20 126.40 2rcf s ILE 3 Ca 0.18 0.78 -0.04 0.00 0.00 0.00 0.00 60.65 61.56 2rcf s ILE 3 Cb -0.11 -3.75 -0.02 0.00 0.01 0.00 0.00 42.46 38.59 2rcf s ILE 3 CO 0.09 0.27 0.06 -0.04 0.00 0.00 0.00 174.94 175.33 2rcf s MET 4 N 1.11 0.69 -0.08 2.79 -1.94 -0.36 -4.54 119.30 116.97 2rcf s MET 4 Ca 0.21 -1.07 -0.02 0.00 -1.71 0.00 0.00 55.69 53.10 2rcf s MET 4 Cb -0.15 0.26 -0.03 0.00 2.01 0.00 0.00 34.83 36.92 2rcf s MET 4 CO 0.08 -0.17 0.02 -1.14 -0.01 0.00 0.00 175.02 173.80 2rcf s GLN 5 N -3.74 3.03 -0.16 2.03 0.74 0.82 0.53 119.66 122.90 2rcf s GLN 5 Ca 0.05 -0.39 -0.29 0.00 0.05 0.00 0.00 55.36 54.78 2rcf s GLN 5 Cb 0.06 -2.83 -0.00 0.00 1.10 0.00 0.00 33.01 31.33 2rcf s GLN 5 CO -0.10 0.71 1.06 0.08 -0.55 0.00 0.00 175.29 176.49 2rcf s VAL 6 N -0.92 4.65 -0.18 1.34 1.01 -0.29 -1.89 120.40 124.13 2rcf s VAL 6 Ca 0.14 1.96 -0.16 0.00 0.00 0.00 0.00 61.98 63.92 2rcf s VAL 6 Cb -0.11 -4.26 -0.12 0.00 0.00 0.00 0.00 36.38 31.88 2rcf s VAL 6 CO 0.03 -0.09 0.06 -0.08 0.00 0.00 0.00 175.10 175.02 2rcf h GLU 7 N 7.38 0.00 -2.61 2.72 4.81 -1.22 -0.99 114.58 124.67 2rcf h GLU 7 Ca -0.25 0.00 0.13 0.00 -0.13 0.00 0.00 59.36 59.11 2rcf h GLU 7 Cb 1.10 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.42 2rcf h GLU 7 CO 0.92 0.57 0.39 -1.59 -0.73 0.00 0.00 179.01 178.58 2rcf s LYS 8 N -2.29 1.46 0.27 1.92 -2.85 -1.21 -4.71 119.74 112.33 2rcf s LYS 8 Ca -0.22 -0.82 -0.29 0.00 -1.00 0.00 0.00 55.97 53.63 2rcf s LYS 8 Cb 0.04 0.49 -0.09 0.00 -2.06 0.00 0.00 37.83 36.20 2rcf s LYS 8 CO 0.43 -0.67 1.02 0.99 0.10 0.00 0.00 175.35 177.21 2rcf s THR 9 N -3.40 3.80 -0.34 3.79 2.01 -1.26 0.52 115.64 120.75 2rcf s THR 9 Ca 0.13 1.76 -0.16 0.00 0.31 0.00 0.00 61.69 63.73 2rcf s THR 9 Cb -0.03 -4.10 -0.01 0.00 0.01 0.00 0.00 72.50 68.37 2rcf s THR 9 CO 0.05 0.38 0.40 -0.22 -0.69 0.00 0.00 174.62 174.54 2rcf s LEU 10 N -1.45 4.42 -0.41 4.42 1.98 -0.25 -4.72 118.68 122.67 2rcf s LEU 10 Ca 0.44 -0.18 -0.20 0.00 -2.89 0.00 0.00 54.13 51.30 2rcf s LEU 10 Cb -0.28 -2.40 0.02 0.00 0.66 0.00 0.00 46.19 44.19 2rcf s LEU 10 CO 0.35 -0.37 0.60 -0.69 -1.89 0.00 0.00 176.35 174.35 2rcf s VAL 11 N 2.11 4.90 -0.45 1.68 1.01 -1.26 -4.51 120.40 123.87 2rcf s VAL 11 Ca 0.13 0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.30 2rcf s VAL 11 Cb -0.16 -4.13 0.15 0.00 0.00 0.00 0.00 36.38 32.23 2rcf s VAL 11 CO 0.12 -0.47 0.28 -0.55 0.00 0.00 0.00 175.10 174.47 2rcf s SER 12 N 1.91 3.29 0.20 3.32 0.15 -1.26 -4.99 113.70 116.32 2rcf s SER 12 Ca 0.21 -2.74 -0.06 0.00 0.70 0.00 0.00 55.95 54.06 2rcf s SER 12 Cb -0.15 -0.88 0.15 0.00 -1.71 0.00 0.00 66.02 63.43 2rcf s SER 12 CO 0.17 -0.24 1.63 0.00 1.20 0.00 0.00 173.24 176.00 2rcf h THR 13 N 5.02 1.27 -3.46 6.45 1.03 -2.05 -3.34 112.91 117.83 2rcf h THR 13 Ca 0.06 -1.29 -0.77 0.00 -0.01 0.00 0.00 66.41 64.41 2rcf h THR 13 Cb 0.91 1.10 -0.24 0.00 -1.07 0.00 0.00 68.15 68.85 2rcf h THR 13 CO 0.45 0.44 0.34 0.21 -0.01 0.00 0.00 175.52 176.95 2rcf s ASN 14 N -6.71 6.85 0.10 0.00 3.84 -1.26 -5.00 114.94 112.76 2rcf s ASN 14 Ca -0.10 -2.75 0.03 0.00 0.21 0.00 0.00 52.86 50.25 2rcf s ASN 14 Cb 0.13 -2.25 -0.04 0.00 -0.55 0.00 0.00 41.25 38.54 2rcf s ASN 14 CO 0.84 -0.62 -0.08 0.00 -2.79 0.00 0.00 177.10 174.45 2rcf s ARG 15 N 0.43 0.87 0.57 0.43 1.70 -1.26 -5.14 118.95 116.56 2rcf s ARG 15 Ca 0.24 -1.27 -0.21 0.00 -0.47 0.00 0.00 55.73 54.02 2rcf s ARG 15 Cb -0.09 -0.40 -0.04 0.00 -0.57 0.00 0.00 34.95 33.85 2rcf s ARG 15 CO -0.09 0.04 1.35 0.44 -1.08 0.00 0.00 175.30 175.96 2rcf n ILE 16 N 0.20 4.16 0.19 4.99 -5.35 -1.26 -4.90 119.36 117.39 2rcf n ILE 16 Ca -0.14 -0.50 0.04 0.00 -0.27 0.00 0.00 62.75 61.88 2rcf n ILE 16 Cb 0.59 -1.63 0.45 0.00 -1.74 0.00 0.00 39.64 37.31 2rcf n ILE 16 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2rcf h ALA 17 N 1.20 1.59 0.00 -1.28 0.00 -2.00 -2.71 119.26 116.05 2rcf h ALA 17 Ca -0.51 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.19 2rcf h ALA 17 Cb 1.31 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2rcf h ALA 17 CO 0.56 0.30 0.11 -0.25 0.00 0.00 0.00 179.25 179.98 2rcf n ASP 18 N -4.27 0.46 0.23 0.00 10.43 -1.26 -1.48 116.55 120.66 2rcf n ASP 18 Ca -0.02 0.68 0.15 0.00 2.57 0.00 0.00 54.79 58.16 2rcf n ASP 18 Cb 0.28 -0.70 0.47 0.00 1.84 0.00 0.00 41.12 43.01 2rcf n ASP 18 CO 0.00 0.00 0.00 0.24 -1.07 0.00 0.00 177.20 176.37 2rcf h MET 19 N 0.00 0.00 0.00 -1.24 2.86 -1.85 -3.42 114.93 111.28 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 0.23 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.89 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 0.51 2.21 0.98 8.32 0.00 -0.55 -3.28 105.19 113.37 2rcf n GLY 20 Ca 0.02 -0.51 0.08 0.00 0.00 0.00 0.00 46.02 45.61 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 11.19 0.95 -1.88 1.61 8.25 -1.26 -5.03 115.22 129.05 2rcf n HIS 21 Ca 0.00 -0.71 -0.42 0.00 -0.26 0.00 0.00 57.72 56.34 2rcf n HIS 21 Cb 0.00 -0.23 -0.02 0.00 1.12 0.00 0.00 29.99 30.86 2rcf n HIS 21 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2rcf s LYS 22 N -2.10 4.19 0.33 -0.41 -0.14 -1.21 -4.96 119.74 115.44 2rcf s LYS 22 Ca 0.38 2.45 -0.29 0.00 -1.36 0.00 0.00 55.97 57.16 2rcf s LYS 22 Cb 0.28 -3.08 -0.10 0.00 -1.68 0.00 0.00 37.83 33.24 2rcf s LYS 22 CO 0.14 -0.58 1.28 -2.14 -0.76 0.00 0.00 175.35 173.30 2rcf s PRO 23 N 0.07 4.39 -0.10 -1.68 0.02 -1.26 -4.91 135.00 131.53 2rcf s PRO 23 Ca 0.65 2.17 -0.02 0.00 0.02 0.00 0.00 61.00 63.82 2rcf s PRO 23 Cb -0.45 -3.08 -0.03 0.00 0.02 0.00 0.00 34.50 30.95 2rcf s PRO 23 CO 0.41 -0.14 -0.02 -0.51 -0.33 0.00 0.00 177.00 176.41 2rcf s LEU 24 N -1.76 3.42 -0.02 -5.54 1.43 -1.26 -1.00 118.68 113.95 2rcf s LEU 24 Ca 0.48 0.05 0.05 0.00 -1.03 0.00 0.00 54.13 53.68 2rcf s LEU 24 Cb -0.39 -1.78 -0.01 0.00 0.03 0.00 0.00 46.19 44.04 2rcf s LEU 24 CO 0.52 0.32 -0.16 -0.76 0.23 0.00 0.00 176.35 176.50 2rcf s LEU 25 N -0.57 2.00 0.00 1.79 1.43 -0.28 -1.09 118.68 121.97 2rcf s LEU 25 Ca 0.09 -0.30 -0.30 0.00 -1.03 0.00 0.00 54.13 52.59 2rcf s LEU 25 Cb -0.12 -0.86 -0.03 0.00 0.03 0.00 0.00 46.19 45.20 2rcf s LEU 25 CO 0.02 0.19 1.04 -0.69 0.23 0.00 0.00 176.35 177.14 2rcf s VAL 26 N -0.29 4.64 0.07 -1.59 1.01 0.18 -1.39 120.40 123.03 2rcf s VAL 26 Ca 0.04 1.90 0.03 0.00 0.00 0.00 0.00 61.98 63.95 2rcf s VAL 26 Cb -0.07 -4.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 2rcf s VAL 26 CO -0.00 0.13 -0.10 0.68 0.00 0.00 0.00 175.10 175.81 2rcf s VAL 27 N 1.15 0.81 0.04 2.92 -7.23 0.36 -0.62 120.40 117.83 2rcf s VAL 27 Ca 0.53 -1.31 -0.11 0.00 -1.81 0.00 0.00 61.98 59.29 2rcf s VAL 27 Cb -0.23 -0.96 0.01 0.00 0.56 0.00 0.00 36.38 35.76 2rcf s VAL 27 CO 0.27 -0.39 0.24 -1.66 -0.31 0.00 0.00 175.10 173.25 2rcf s TRP 28 N -1.67 -0.00 0.32 2.82 -2.14 -0.79 -0.56 118.94 116.91 2rcf s TRP 28 Ca -0.03 -0.20 0.04 0.00 2.66 0.00 0.00 56.10 58.58 2rcf s TRP 28 Cb -0.08 0.02 0.55 0.00 -3.10 0.00 0.00 33.47 30.86 2rcf s TRP 28 CO 0.01 -0.47 1.82 0.93 -2.66 0.00 0.00 176.95 176.58 2rcf h GLU 29 N 3.32 0.46 -3.18 3.25 5.08 -1.81 0.23 114.58 121.93 2rcf h GLU 29 Ca -0.32 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 57.89 2rcf h GLU 29 Cb 1.20 -0.05 -0.11 0.00 0.50 0.00 0.00 28.75 30.29 2rcf h GLU 29 CO 0.48 0.59 0.09 -1.59 -1.00 0.00 0.00 179.01 177.58 2rcf s LYS 30 N -4.73 1.31 0.14 2.33 -2.85 -1.26 -4.52 119.74 110.16 2rcf s LYS 30 Ca -0.07 -0.69 -0.34 0.00 -1.00 0.00 0.00 55.97 53.86 2rcf s LYS 30 Cb 0.15 0.54 -0.15 0.00 -2.06 0.00 0.00 37.83 36.32 2rcf s LYS 30 CO 0.77 -0.56 1.51 -2.30 0.10 0.00 0.00 175.35 174.87 2rcf n PRO 31 N -0.34 1.89 0.00 1.78 -0.02 -1.26 -1.44 135.00 135.61 2rcf n PRO 31 Ca -0.13 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 2rcf n PRO 31 Cb 0.63 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 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 3.15 3.17 3.78 -1.23 0.00 -1.26 -5.06 105.19 107.74 2rcf n GLY 32 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.59 2.30 0.23 4.61 0.00 -0.52 -4.95 121.76 120.84 2rcf s ALA 33 Ca 0.00 0.09 -0.32 0.00 0.00 0.00 0.00 51.96 51.73 2rcf s ALA 33 Cb 0.00 -3.20 -0.13 0.00 0.00 0.00 0.00 23.12 19.78 2rcf s ALA 33 CO 0.00 -1.65 1.46 -2.30 0.00 0.00 0.00 175.76 173.27 2rcf n PRO 34 N -3.42 2.11 -2.58 0.00 -0.02 -1.26 -4.87 135.00 124.96 2rcf n PRO 34 Ca 0.08 0.75 -0.40 0.00 -2.02 0.00 0.00 63.50 61.91 2rcf n PRO 34 Cb 0.54 -2.44 -0.05 0.00 -0.02 0.00 0.00 33.50 31.53 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 -0.12 4.69 0.37 -0.52 0.52 -1.26 -4.61 118.95 118.02 2rcf s ARG 35 Ca 0.70 1.67 0.04 0.00 -0.52 0.00 0.00 55.73 57.62 2rcf s ARG 35 Cb -0.65 -3.26 -0.06 0.00 0.52 0.00 0.00 34.95 31.51 2rcf s ARG 35 CO 0.47 0.25 0.05 -0.65 0.02 0.00 0.00 175.30 175.43 2rcf s GLN 36 N -0.91 1.80 -0.08 3.54 -0.21 0.27 -4.98 119.66 119.08 2rcf s GLN 36 Ca 0.45 -2.03 0.03 0.00 0.02 0.00 0.00 55.36 53.84 2rcf s GLN 36 Cb -0.29 -1.08 0.01 0.00 1.00 0.00 0.00 33.01 32.64 2rcf s GLN 36 CO 0.36 -0.19 -0.17 0.08 -2.12 0.00 0.00 175.29 173.24 2rcf s VAL 37 N -3.11 1.54 0.11 1.09 1.01 -1.26 -0.49 120.40 119.29 2rcf s VAL 37 Ca 0.33 -0.72 0.10 0.00 0.00 0.00 0.00 61.98 61.69 2rcf s VAL 37 Cb 0.08 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 2rcf s VAL 37 CO 0.15 0.44 -0.24 0.00 0.00 0.00 0.00 175.10 175.45 2rcf s ALA 38 N 0.49 2.11 0.04 5.51 0.00 -0.48 -4.67 121.76 124.76 2rcf s ALA 38 Ca -0.16 -1.36 -0.27 0.00 0.00 0.00 0.00 51.96 50.18 2rcf s ALA 38 Cb -0.16 -0.33 -0.05 0.00 0.00 0.00 0.00 23.12 22.58 2rcf s ALA 38 CO 0.06 0.46 0.85 0.54 0.00 0.00 0.00 175.76 177.67 2rcf s VAL 39 N -1.09 4.72 -0.51 0.00 0.11 -0.40 -1.12 120.40 122.11 2rcf s VAL 39 Ca 0.11 1.81 -0.23 0.00 -2.93 0.00 0.00 61.98 60.73 2rcf s VAL 39 Cb -0.10 -4.20 0.04 0.00 -1.53 0.00 0.00 36.38 30.59 2rcf s VAL 39 CO 0.05 0.30 0.85 -0.62 -3.33 0.00 0.00 175.10 172.35 2rcf s ASP 40 N 0.23 6.34 0.00 3.54 2.15 -0.17 -0.49 116.67 128.27 2rcf s ASP 40 Ca 0.43 -0.36 0.24 0.00 0.43 0.00 0.00 52.55 53.29 2rcf s ASP 40 Cb -0.21 -2.40 0.21 0.00 -0.30 0.00 0.00 42.92 40.22 2rcf s ASP 40 CO 0.25 -1.08 1.26 0.00 -0.17 0.00 0.00 175.17 175.43 2rcf n ALA 41 N 7.04 2.65 -0.07 3.66 0.00 -1.03 -4.49 120.51 128.27 2rcf n ALA 41 Ca 0.01 -0.67 -0.12 0.00 0.00 0.00 0.00 53.44 52.66 2rcf n ALA 41 Cb 0.47 -0.83 -0.06 0.00 0.00 0.00 0.00 19.45 19.04 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 1.05 0.76 0.00 0.00 2.08 -1.25 -4.99 119.36 117.01 2rcf n ILE 42 Ca 0.13 -0.25 0.00 0.00 0.56 0.00 0.00 62.75 63.20 2rcf n ILE 42 Cb 0.56 -1.29 0.00 0.00 -0.75 0.00 0.00 39.64 38.16 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 2.53 0.64 3.52 7.39 0.00 -1.26 -5.12 105.19 112.89 2rcf n GLY 43 Ca -0.25 -0.67 -0.24 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.25 1.97 0.23 0.00 -4.36 -1.26 -5.09 121.20 110.44 2rcf s ILE 45 Ca 0.28 -2.11 -0.31 0.00 -0.26 0.00 0.00 60.65 58.25 2rcf s ILE 45 Cb -0.06 -2.02 -0.14 0.00 1.25 0.00 0.00 42.46 41.49 2rcf s ILE 45 CO 0.16 -0.40 1.25 -2.65 0.24 0.00 0.00 174.94 173.54 2rcf n PRO 46 N -0.09 1.64 0.00 0.37 -0.02 -1.26 -2.07 135.00 133.57 2rcf n PRO 46 Ca -0.10 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2rcf n PRO 46 Cb 0.58 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 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 1.85 3.23 3.76 -1.23 0.00 -0.38 -5.01 105.19 107.42 2rcf n GLY 47 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 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 3.87 -4.71 1.61 8.00 -0.88 -4.75 116.55 119.70 2rcf n ASP 48 Ca 0.00 1.19 -0.38 0.00 0.71 0.00 0.00 54.79 56.31 2rcf n ASP 48 Cb 0.00 -1.61 -0.06 0.00 -0.02 0.00 0.00 41.12 39.43 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 -0.56 3.50 0.11 1.24 0.52 -1.26 -1.13 118.94 121.35 2rcf s TRP 49 Ca 0.58 0.90 0.06 0.00 0.02 0.00 0.00 56.10 57.66 2rcf s TRP 49 Cb -0.48 -2.58 -0.04 0.00 -1.15 0.00 0.00 33.47 29.22 2rcf s TRP 49 CO 0.56 0.13 -0.15 0.14 0.02 0.00 0.00 176.95 177.65 2rcf s VAL 50 N 0.77 1.35 -0.24 4.03 -7.23 0.19 -0.75 120.40 118.53 2rcf s VAL 50 Ca 0.26 -1.60 -0.14 0.00 -1.81 0.00 0.00 61.98 58.69 2rcf s VAL 50 Cb -0.15 -1.44 -0.04 0.00 0.56 0.00 0.00 36.38 35.31 2rcf s VAL 50 CO 0.11 -0.31 0.33 -0.22 -0.31 0.00 0.00 175.10 174.69 2rcf s LEU 51 N -2.21 4.10 -0.06 1.32 2.96 0.01 -1.22 118.68 123.58 2rcf s LEU 51 Ca 0.06 0.34 0.05 0.00 -0.22 0.00 0.00 54.13 54.35 2rcf s LEU 51 Cb -0.07 -2.39 -0.02 0.00 0.50 0.00 0.00 46.19 44.22 2rcf s LEU 51 CO 0.03 -0.08 -0.20 0.00 -1.32 0.00 0.00 176.35 174.78 2rcf s VAL 53 N -0.35 2.82 0.00 0.00 0.11 -0.16 -1.01 120.40 121.81 2rcf s VAL 53 Ca 0.03 -0.99 0.00 0.00 -2.93 0.00 0.00 61.98 58.08 2rcf s VAL 53 Cb -0.12 -2.13 0.00 0.00 -1.53 0.00 0.00 36.38 32.59 2rcf s VAL 53 CO 0.02 0.47 0.00 0.61 -3.33 0.00 0.00 175.10 172.87 2rcf n GLY 54 N 1.95 5.01 7.00 6.54 0.00 -1.26 -0.58 105.19 123.85 2rcf n GLY 54 Ca -0.16 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 43.96 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 -0.40 0.19 1.61 2.88 -1.23 -2.50 113.62 114.17 2rcf n SER 55 Ca 0.00 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.60 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 6.02 0.00 0.12 -3.46 4.64 -1.94 -3.14 113.55 115.79 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 0.36 -0.11 0.00 -0.87 0.00 0.00 176.83 176.21 2rcf h ALA 57 N 1.64 1.78 -0.16 5.18 0.00 -1.92 -2.63 119.26 123.15 2rcf h ALA 57 Ca -0.00 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.85 2rcf h ALA 57 Cb 0.81 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2rcf h ALA 57 CO 0.05 0.14 0.13 0.00 0.00 0.00 0.00 179.25 179.56 2rcf h ALA 58 N 1.89 2.05 0.32 0.00 0.00 -1.43 -1.32 119.26 120.77 2rcf h ALA 58 Ca -0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2rcf h ALA 58 Cb 0.20 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2rcf h ALA 58 CO 0.01 -0.21 -0.16 0.00 0.00 0.00 0.00 179.25 178.90 2rcf h ARG 59 N 0.00 -0.42 -0.06 0.00 3.08 -1.56 -1.68 114.38 113.74 2rcf h ARG 59 Ca 0.08 0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 2rcf h ARG 59 Cb 0.33 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 2rcf h ARG 59 CO -0.00 -0.28 -0.20 1.49 -1.07 0.00 0.00 179.97 179.91 2rcf h GLU 60 N -0.92 0.09 -0.61 0.04 4.81 -1.51 -0.50 114.58 115.99 2rcf h GLU 60 Ca -0.04 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.20 2rcf h GLU 60 Cb 0.33 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.67 2rcf h GLU 60 CO 0.07 0.29 0.40 0.00 -0.73 0.00 0.00 179.01 179.05 2rcf h ALA 61 N 1.71 1.69 -0.00 2.92 0.00 -1.27 -2.12 119.26 122.19 2rcf h ALA 61 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2rcf h ALA 61 Cb 0.41 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2rcf h ALA 61 CO 0.03 0.25 -0.06 0.00 0.00 0.00 0.00 179.25 179.46 2rcf n ALA 62 N -2.46 2.60 0.00 0.00 0.00 -0.22 -4.87 120.51 115.56 2rcf n ALA 62 Ca 0.07 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2rcf n ALA 62 Cb 0.14 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.17 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 1.31 3.59 0.00 0.00 -0.80 -5.00 105.19 105.62 2rcf n GLY 63 Ca 0.13 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.72 0.64 1.61 0.15 -1.11 -4.95 113.70 108.37 2rcf s SER 64 Ca 0.00 1.29 0.38 0.00 0.70 0.00 0.00 55.95 58.32 2rcf s SER 64 Cb 0.00 1.28 2.06 0.00 -1.71 0.00 0.00 66.02 67.65 2rcf s SER 64 CO 0.00 -0.30 2.16 0.11 1.20 0.00 0.00 173.24 176.40 2rcf h LYS 65 N 4.70 0.00 -0.02 5.44 1.57 -1.87 -0.90 116.57 125.48 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 0.12 0.00 -0.03 0.43 -0.57 0.00 0.00 179.45 179.39 2rcf n SER 66 N -2.94 2.26 -4.72 0.86 7.64 -1.26 -4.76 113.62 110.69 2rcf n SER 66 Ca -0.03 -1.73 -0.42 0.00 1.01 0.00 0.00 58.87 57.71 2rcf n SER 66 Cb 0.18 0.03 -0.03 0.00 -1.01 0.00 0.00 64.21 63.37 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 -2.04 3.36 -1.27 1.43 6.14 -0.37 -4.92 117.35 119.68 2rcf s TYR 67 Ca 0.32 1.24 -0.19 0.00 0.64 0.00 0.00 57.07 59.08 2rcf s TYR 67 Cb 0.20 -3.51 0.03 0.00 0.42 0.00 0.00 41.96 39.10 2rcf s TYR 67 CO 0.34 -1.60 1.79 -1.25 0.64 0.00 0.00 175.55 175.47 2rcf s PRO 68 N 0.51 3.57 -0.06 4.97 0.04 -1.26 -4.61 135.00 138.16 2rcf s PRO 68 Ca 0.58 -1.77 -0.04 0.00 0.04 0.00 0.00 61.00 59.81 2rcf s PRO 68 Cb -0.33 -5.46 0.02 0.00 0.04 0.00 0.00 34.50 28.77 2rcf s PRO 68 CO 0.33 -2.75 0.14 0.45 0.04 0.00 0.00 177.00 175.22 2rcf s SER 69 N 4.86 -0.14 0.00 6.66 0.15 -1.26 -4.98 113.70 118.98 2rcf s SER 69 Ca 0.58 0.29 0.01 0.00 0.70 0.00 0.00 55.95 57.53 2rcf s SER 69 Cb 0.03 0.26 0.01 0.00 -1.71 0.00 0.00 66.02 64.62 2rcf s SER 69 CO 0.09 -0.08 0.92 -0.90 1.20 0.00 0.00 173.24 174.48 2rcf n ASP 70 N 3.34 1.87 -3.47 5.45 3.85 -1.26 -3.80 116.55 122.53 2rcf n ASP 70 Ca -0.16 -1.82 -0.08 0.00 -0.71 0.00 0.00 54.79 52.01 2rcf n ASP 70 Cb 0.57 -0.01 -0.08 0.00 -1.35 0.00 0.00 41.12 40.25 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 -0.83 -0.67 -0.03 -2.12 2.96 -1.26 -3.51 118.68 113.22 2rcf s LEU 71 Ca 0.01 0.57 0.03 0.00 -0.22 0.00 0.00 54.13 54.52 2rcf s LEU 71 Cb 0.01 1.26 0.01 0.00 0.50 0.00 0.00 46.19 47.96 2rcf s LEU 71 CO 0.01 -0.27 -0.10 -0.89 -1.32 0.00 0.00 176.35 173.78 2rcf s THR 72 N 2.59 0.89 -0.24 3.68 2.01 0.26 -1.28 115.64 123.54 2rcf s THR 72 Ca 0.07 -0.40 -0.29 0.00 0.31 0.00 0.00 61.69 61.38 2rcf s THR 72 Cb -0.14 -0.80 0.00 0.00 0.01 0.00 0.00 72.50 71.58 2rcf s THR 72 CO -0.15 0.28 1.13 -0.63 -0.69 0.00 0.00 174.62 174.56 2rcf s ILE 73 N 0.29 4.48 -0.33 1.82 1.01 0.35 -0.98 121.20 127.83 2rcf s ILE 73 Ca -0.05 1.76 0.03 0.00 0.00 0.00 0.00 60.65 62.38 2rcf s ILE 73 Cb -0.10 -4.24 0.02 0.00 0.01 0.00 0.00 42.46 38.14 2rcf s ILE 73 CO 0.01 -0.28 0.58 2.30 0.00 0.00 0.00 174.94 177.55 2rcf n ILE 74 N 5.57 0.00 -3.55 2.92 -5.35 -0.36 -2.46 119.36 116.14 2rcf n ILE 74 Ca 0.13 -0.50 -0.10 0.00 -0.27 0.00 0.00 62.75 62.01 2rcf n ILE 74 Cb 0.46 1.05 -0.04 0.00 -1.74 0.00 0.00 39.64 39.38 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 -0.23 -0.35 -0.17 3.28 0.00 -1.20 -4.96 107.32 103.70 2rcf s GLY 75 Ca 0.03 1.65 -0.06 0.00 0.00 0.00 0.00 44.72 46.34 2rcf s GLY 75 CO 0.03 0.78 0.04 -0.42 0.00 0.00 0.00 173.10 173.53 2rcf s ILE 76 N -1.83 4.58 -0.09 0.90 1.01 -1.26 -0.81 121.20 123.70 2rcf s ILE 76 Ca 0.01 -0.11 -0.26 0.00 0.00 0.00 0.00 60.65 60.29 2rcf s ILE 76 Cb -0.01 -3.04 -0.03 0.00 0.01 0.00 0.00 42.46 39.40 2rcf s ILE 76 CO -0.02 0.48 0.81 -0.63 0.00 0.00 0.00 174.94 175.59 2rcf s ILE 77 N 0.24 4.94 0.02 2.92 1.01 0.07 -4.92 121.20 125.49 2rcf s ILE 77 Ca 0.02 1.65 -0.08 0.00 0.00 0.00 0.00 60.65 62.25 2rcf s ILE 77 Cb -0.13 -4.14 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 2rcf s ILE 77 CO 0.01 0.14 1.12 0.44 0.00 0.00 0.00 174.94 176.65 2rcf h ASP 78 N 6.99 -0.32 -3.13 3.58 3.45 -1.98 -3.39 116.42 121.61 2rcf h ASP 78 Ca -0.36 0.03 -0.57 0.00 0.43 0.00 0.00 57.03 56.56 2rcf h ASP 78 Cb 1.18 0.11 -0.40 0.00 -0.56 0.00 0.00 39.33 39.66 2rcf h ASP 78 CO 0.79 -0.14 -0.76 -1.10 -1.57 0.00 0.00 179.24 176.45 2rcf s GLN 79 N -3.62 0.64 -0.13 3.56 -0.21 -1.26 -5.08 119.66 113.57 2rcf s GLN 79 Ca -0.04 -0.89 -0.01 0.00 0.02 0.00 0.00 55.36 54.44 2rcf s GLN 79 Cb 0.01 -1.90 -0.02 0.00 1.00 0.00 0.00 33.01 32.10 2rcf s GLN 79 CO 0.13 -0.93 -0.09 -0.46 -2.12 0.00 0.00 175.29 171.82 2rcf s TRP 80 N 1.72 2.90 -2.00 0.91 -0.11 -1.26 -5.20 118.94 115.90 2rcf s TRP 80 Ca 0.08 -0.42 0.07 0.00 1.22 0.00 0.00 56.10 57.04 2rcf s TRP 80 Cb -0.17 -1.86 0.39 0.00 -1.50 0.00 0.00 33.47 30.33 2rcf s TRP 80 CO -0.24 -0.07 0.86 0.09 -4.62 0.00 0.00 176.95 172.96