#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k52 s ASP 2 N 0.00 3.93 -0.12 6.12 2.15 -1.26 -5.11 116.67 122.38 2k52 s ASP 2 Ca 0.00 -0.38 -0.21 0.00 0.43 0.00 0.00 52.55 52.39 2k52 s ASP 2 Cb 0.00 -1.61 -0.03 0.00 -0.30 0.00 0.00 42.92 40.97 2k52 s ASP 2 CO 0.00 0.12 0.61 -0.69 -0.17 0.00 0.00 175.17 175.04 2k52 s VAL 3 N 0.63 5.08 -0.05 1.11 1.01 -1.26 -5.07 120.40 121.85 2k52 s VAL 3 Ca -0.07 1.21 0.04 0.00 0.00 0.00 0.00 61.98 63.16 2k52 s VAL 3 Cb -0.15 -3.94 -0.02 0.00 0.00 0.00 0.00 36.38 32.26 2k52 s VAL 3 CO 0.03 0.23 -0.17 -1.61 0.00 0.00 0.00 175.10 173.58 2k52 s GLU 4 N 1.10 2.46 -0.68 2.72 2.02 -1.26 -4.99 118.70 120.06 2k52 s GLU 4 Ca 0.31 -0.75 -0.26 0.00 0.02 0.00 0.00 54.97 54.29 2k52 s GLU 4 Cb -0.16 -2.31 -0.09 0.00 0.10 0.00 0.00 34.13 31.66 2k52 s GLU 4 CO 0.13 0.58 2.32 -2.14 0.02 0.00 0.00 175.26 176.17 2k52 s PRO 5 N -0.63 1.95 0.00 0.39 0.02 -1.26 -1.95 135.00 133.51 2k52 s PRO 5 Ca 0.10 0.74 0.00 0.00 0.02 0.00 0.00 61.00 61.85 2k52 s PRO 5 Cb -0.11 -4.71 0.00 0.00 0.02 0.00 0.00 34.50 29.70 2k52 s PRO 5 CO 0.01 -3.80 0.00 0.41 -0.33 0.00 0.00 177.00 173.28 2k52 n GLY 6 N 6.45 0.68 3.82 0.52 0.00 0.32 -4.91 105.19 112.07 2k52 n GLY 6 Ca 0.40 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.09 2k52 n GLY 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k52 s LYS 7 N 0.00 4.16 -0.11 1.61 -0.14 -0.82 -4.77 119.74 119.67 2k52 s LYS 7 Ca 0.00 1.14 -0.17 0.00 -1.36 0.00 0.00 55.97 55.58 2k52 s LYS 7 Cb 0.00 -2.17 -0.04 0.00 -1.68 0.00 0.00 37.83 33.94 2k52 s LYS 7 CO 0.00 -0.10 0.45 -0.06 -0.76 0.00 0.00 175.35 174.88 2k52 s PHE 8 N -2.18 3.53 0.14 3.18 0.40 -1.26 -1.24 117.98 120.56 2k52 s PHE 8 Ca 0.63 0.86 -0.01 0.00 -0.60 0.00 0.00 56.93 57.81 2k52 s PHE 8 Cb -0.10 -2.50 -0.04 0.00 0.51 0.00 0.00 43.02 40.89 2k52 s PHE 8 CO 0.15 0.22 0.05 0.71 0.70 0.00 0.00 175.22 177.05 2k52 s TYR 9 N 0.43 0.93 -0.22 0.36 2.02 -0.45 -4.99 117.35 115.43 2k52 s TYR 9 Ca 0.24 -1.21 -0.06 0.00 -0.37 0.00 0.00 57.07 55.68 2k52 s TYR 9 Cb -0.15 -0.52 -0.02 0.00 -0.40 0.00 0.00 41.96 40.87 2k52 s TYR 9 CO 0.10 -0.47 0.02 0.21 -1.57 0.00 0.00 175.55 173.83 2k52 s LYS 10 N -4.03 3.60 0.29 -0.62 2.20 -1.26 -0.16 119.74 119.76 2k52 s LYS 10 Ca 0.25 -0.52 0.06 0.00 -0.36 0.00 0.00 55.97 55.40 2k52 s LYS 10 Cb 0.07 -3.15 -0.06 0.00 -1.51 0.00 0.00 37.83 33.18 2k52 s LYS 10 CO 0.02 -0.08 -0.03 0.20 -0.36 0.00 0.00 175.35 175.11 2k52 s GLY 11 N 1.25 1.90 -0.10 5.54 0.00 0.13 -4.72 107.32 111.32 2k52 s GLY 11 Ca 0.04 -1.95 0.00 0.00 0.00 0.00 0.00 44.72 42.81 2k52 s GLY 11 CO 0.02 -1.84 -0.10 0.54 0.00 0.00 0.00 173.10 171.71 2k52 s VAL 12 N -3.07 3.34 -0.05 1.40 0.11 -0.32 -0.00 120.40 121.80 2k52 s VAL 12 Ca 0.31 -0.59 -0.30 0.00 -2.93 0.00 0.00 61.98 58.48 2k52 s VAL 12 Cb 0.05 -2.38 -0.05 0.00 -1.53 0.00 0.00 36.38 32.47 2k52 s VAL 12 CO 0.13 0.55 1.56 -0.69 -3.33 0.00 0.00 175.10 173.32 2k52 s VAL 13 N -0.18 3.66 -0.26 2.04 1.01 -0.65 -1.23 120.40 124.80 2k52 s VAL 13 Ca 0.01 0.87 -0.09 0.00 0.00 0.00 0.00 61.98 62.78 2k52 s VAL 13 Cb -0.13 -3.56 -0.15 0.00 0.00 0.00 0.00 36.38 32.54 2k52 s VAL 13 CO 0.03 -0.06 -0.24 0.35 0.00 0.00 0.00 175.10 175.18 2k52 n THR 14 N 5.27 1.53 -3.80 3.92 -2.24 0.57 -0.58 114.28 118.95 2k52 n THR 14 Ca 0.16 -0.44 -0.12 0.00 -2.27 0.00 0.00 64.05 61.37 2k52 n THR 14 Cb 0.43 -1.72 -0.11 0.00 -2.10 0.00 0.00 70.33 66.83 2k52 n THR 14 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k52 s ARG 15 N -2.51 0.42 -0.36 -0.78 1.70 -1.21 -4.80 118.95 111.41 2k52 s ARG 15 Ca -0.36 0.05 -0.16 0.00 -0.47 0.00 0.00 55.73 54.79 2k52 s ARG 15 Cb 0.12 0.19 -0.00 0.00 -0.57 0.00 0.00 34.95 34.68 2k52 s ARG 15 CO 0.55 -0.09 0.41 0.42 -1.08 0.00 0.00 175.30 175.51 2k52 s ILE 16 N -0.54 5.12 0.16 4.99 -1.09 -1.26 -1.52 121.20 127.05 2k52 s ILE 16 Ca -0.06 0.03 0.06 0.00 -2.23 0.00 0.00 60.65 58.44 2k52 s ILE 16 Cb -0.04 -3.89 -0.04 0.00 -1.58 0.00 0.00 42.46 36.91 2k52 s ILE 16 CO 0.01 -0.18 0.07 -1.61 -1.23 0.00 0.00 174.94 172.00 2k52 s GLU 17 N 2.12 2.68 0.00 2.79 0.41 0.27 -5.00 118.70 121.97 2k52 s GLU 17 Ca 0.13 -0.94 0.10 0.00 -0.41 0.00 0.00 54.97 53.85 2k52 s GLU 17 Cb -0.16 -2.53 0.53 0.00 -1.78 0.00 0.00 34.13 30.19 2k52 s GLU 17 CO 0.12 0.48 1.19 1.63 -0.49 0.00 0.00 175.26 178.19 2k52 n LYS 18 N -0.12 0.17 -0.06 1.61 5.02 -1.26 -1.46 118.16 122.06 2k52 n LYS 18 Ca -0.09 0.16 0.04 0.00 -2.02 0.00 0.00 58.31 56.40 2k52 n LYS 18 Cb 0.54 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 34.11 2k52 n LYS 18 CO 0.00 0.00 0.00 2.48 -0.52 0.00 0.00 177.40 179.36 2k52 n TYR 19 N -1.24 0.00 0.00 2.13 4.11 -1.26 -5.05 117.16 115.86 2k52 n TYR 19 Ca 0.05 -0.65 0.00 0.00 -0.00 0.00 0.00 57.90 57.30 2k52 n TYR 19 Cb 0.07 -0.09 0.00 0.00 -0.00 0.00 0.00 39.34 39.32 2k52 n TYR 19 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2k52 n GLY 20 N -0.84 3.50 3.50 -7.48 0.00 -0.54 -4.60 105.19 98.73 2k52 n GLY 20 Ca 0.07 -1.71 -0.35 0.00 0.00 0.00 0.00 46.02 44.03 2k52 n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k52 s ALA 21 N -2.03 3.12 0.10 4.61 0.00 0.10 -0.56 121.76 127.10 2k52 s ALA 21 Ca 0.00 -0.92 -0.30 0.00 0.00 0.00 0.00 51.96 50.74 2k52 s ALA 21 Cb 0.00 -1.79 -0.06 0.00 0.00 0.00 0.00 23.12 21.27 2k52 s ALA 21 CO 0.00 -0.04 1.05 -0.06 0.00 0.00 0.00 175.76 176.71 2k52 s PHE 22 N 0.80 3.64 -0.02 0.00 0.40 -0.58 -0.42 117.98 121.80 2k52 s PHE 22 Ca 0.01 1.62 0.05 0.00 -0.60 0.00 0.00 56.93 58.02 2k52 s PHE 22 Cb -0.14 -3.21 -0.01 0.00 0.51 0.00 0.00 43.02 40.17 2k52 s PHE 22 CO 0.02 -0.37 -0.18 0.42 0.70 0.00 0.00 175.22 175.81 2k52 s ILE 23 N 0.33 1.43 -0.25 0.64 1.01 -0.11 -0.31 121.20 123.93 2k52 s ILE 23 Ca 0.51 -0.76 -0.13 0.00 0.00 0.00 0.00 60.65 60.27 2k52 s ILE 23 Cb -0.26 -1.20 -0.04 0.00 0.01 0.00 0.00 42.46 40.97 2k52 s ILE 23 CO 0.31 0.41 0.27 0.20 0.00 0.00 0.00 174.94 176.12 2k52 s ASN 24 N -0.33 6.19 -0.02 3.58 0.01 -0.36 -0.85 114.94 123.16 2k52 s ASN 24 Ca 0.05 0.21 0.01 0.00 -0.71 0.00 0.00 52.86 52.41 2k52 s ASN 24 Cb -0.08 -2.16 -0.26 0.00 0.41 0.00 0.00 41.25 39.16 2k52 s ASN 24 CO -0.00 -0.05 0.77 -0.07 -1.51 0.00 0.00 177.10 176.24 2k52 h LEU 25 N 7.98 0.28 -7.55 0.60 3.38 -1.58 -0.85 115.31 117.57 2k52 h LEU 25 Ca -0.35 -0.44 -0.01 0.00 0.09 0.00 0.00 57.88 57.17 2k52 h LEU 25 Cb 1.17 -0.09 -0.10 0.00 0.09 0.00 0.00 40.66 41.73 2k52 h LEU 25 CO 0.64 1.38 0.11 0.21 0.09 0.00 0.00 178.44 180.87 2k52 s ASN 26 N -6.77 -0.34 0.22 -0.43 2.47 -1.16 -4.90 114.94 104.04 2k52 s ASN 26 Ca -0.09 -0.38 -0.13 0.00 0.42 0.00 0.00 52.86 52.68 2k52 s ASN 26 Cb 0.07 0.61 0.27 0.00 -1.45 0.00 0.00 41.25 40.75 2k52 s ASN 26 CO 0.83 -1.08 1.61 -0.08 -3.72 0.00 0.00 177.10 174.66 2k52 h GLU 27 N 2.12 -0.02 -0.00 0.43 4.81 -2.02 0.11 114.58 120.00 2k52 h GLU 27 Ca -0.28 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 2k52 h GLU 27 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.66 2k52 h GLU 27 CO 0.35 -0.01 -0.05 1.04 -0.73 0.00 0.00 179.01 179.61 2k52 n GLN 28 N -5.47 0.90 -4.02 1.92 1.13 -1.26 -4.70 117.38 105.87 2k52 n GLN 28 Ca 0.09 -0.27 -0.31 0.00 -1.94 0.00 0.00 57.00 54.57 2k52 n GLN 28 Cb 0.37 -1.49 -0.15 0.00 0.11 0.00 0.00 30.24 29.07 2k52 n GLN 28 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2k52 s VAL 29 N -2.28 2.09 -0.06 5.09 1.01 0.36 -5.09 120.40 121.53 2k52 s VAL 29 Ca 0.35 -1.88 0.01 0.00 0.00 0.00 0.00 61.98 60.46 2k52 s VAL 29 Cb 0.21 -2.38 0.02 0.00 0.00 0.00 0.00 36.38 34.23 2k52 s VAL 29 CO 0.42 -0.30 -0.07 -0.60 0.00 0.00 0.00 175.10 174.55 2k52 s ARG 30 N 1.07 1.16 0.00 2.72 3.52 -1.26 -1.58 118.95 124.58 2k52 s ARG 30 Ca 0.00 -0.21 0.00 0.00 -0.13 0.00 0.00 55.73 55.39 2k52 s ARG 30 Cb -0.19 -1.08 0.00 0.00 -1.56 0.00 0.00 34.95 32.11 2k52 s ARG 30 CO -0.07 -0.06 0.00 0.41 -0.81 0.00 0.00 175.30 174.76 2k52 n GLY 31 N 4.06 5.56 3.05 8.12 0.00 -0.03 -4.61 105.19 121.34 2k52 n GLY 31 Ca -0.23 -1.66 -0.24 0.00 0.00 0.00 0.00 46.02 43.89 2k52 n GLY 31 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k52 s LEU 32 N 0.00 1.76 -0.30 0.99 2.96 0.49 -0.94 118.68 123.65 2k52 s LEU 32 Ca 0.00 -0.29 -0.06 0.00 -0.22 0.00 0.00 54.13 53.56 2k52 s LEU 32 Cb 0.00 -0.81 0.02 0.00 0.50 0.00 0.00 46.19 45.90 2k52 s LEU 32 CO 0.00 0.08 0.06 -0.22 -1.32 0.00 0.00 176.35 174.94 2k52 s LEU 33 N 0.37 3.84 0.20 -0.68 2.96 0.44 -0.65 118.68 125.16 2k52 s LEU 33 Ca -0.09 -0.86 -0.02 0.00 -0.22 0.00 0.00 54.13 52.94 2k52 s LEU 33 Cb -0.13 -1.83 -0.05 0.00 0.50 0.00 0.00 46.19 44.68 2k52 s LEU 33 CO 0.03 -0.21 0.41 -0.13 -1.32 0.00 0.00 176.35 175.12 2k52 s ARG 34 N 1.44 3.55 0.41 1.98 0.52 -1.26 0.03 118.95 125.62 2k52 s ARG 34 Ca 0.01 -0.25 0.08 0.00 -0.52 0.00 0.00 55.73 55.06 2k52 s ARG 34 Cb -0.18 -2.82 0.89 0.00 0.52 0.00 0.00 34.95 33.36 2k52 s ARG 34 CO 0.01 0.39 2.04 -1.00 0.02 0.00 0.00 175.30 176.76 2k52 h PRO 35 N 2.13 0.52 0.00 3.54 0.13 -1.96 -0.34 132.00 136.02 2k52 h PRO 35 Ca -0.47 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 64.58 2k52 h PRO 35 Cb 1.18 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 2k52 h PRO 35 CO 0.69 0.35 -0.20 0.00 -0.23 0.00 0.00 178.00 178.61 2k52 h ARG 36 N 0.54 0.00 -0.24 0.86 3.08 -1.96 -2.30 114.38 114.36 2k52 h ARG 36 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.24 2k52 h ARG 36 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 2k52 h ARG 36 CO -0.05 0.20 0.00 -0.25 -1.07 0.00 0.00 179.97 178.80 2k52 n ASP 37 N -3.49 2.06 -4.85 7.04 8.00 -0.16 -4.91 116.55 120.24 2k52 n ASP 37 Ca -0.01 -1.80 -0.36 0.00 0.71 0.00 0.00 54.79 53.33 2k52 n ASP 37 Cb 0.36 -0.15 -0.06 0.00 -0.02 0.00 0.00 41.12 41.25 2k52 n ASP 37 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2k52 s MET 38 N -1.69 3.83 0.00 -1.24 -1.94 -0.87 -0.58 119.30 116.82 2k52 s MET 38 Ca 0.33 0.29 0.00 0.00 -1.71 0.00 0.00 55.69 54.59 2k52 s MET 38 Cb 0.18 -3.11 0.00 0.00 2.01 0.00 0.00 34.83 33.91 2k52 s MET 38 CO 0.26 0.63 0.00 -0.89 -0.01 0.00 0.00 175.02 175.01 2k52 n ILE 39 N 1.38 0.00 -0.03 2.53 2.08 -1.26 -4.93 119.36 119.13 2k52 n ILE 39 Ca -0.11 0.00 -0.07 0.00 0.56 0.00 0.00 62.75 63.13 2k52 n ILE 39 Cb 0.52 -0.87 -0.06 0.00 -0.75 0.00 0.00 39.64 38.49 2k52 n ILE 39 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 2k52 h SER 40 N 0.00 -0.06 -3.78 4.38 0.02 -1.96 -3.46 113.55 108.69 2k52 h SER 40 Ca 0.00 -0.39 -0.48 0.00 -0.84 0.00 0.00 61.79 60.08 2k52 h SER 40 Cb 0.00 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.53 2k52 h SER 40 CO 0.00 0.61 0.33 -0.76 -1.14 0.00 0.00 176.83 175.87 2k52 s LEU 41 N -8.55 4.50 0.31 5.07 1.43 -1.26 -5.09 118.68 115.09 2k52 s LEU 41 Ca -0.09 1.86 0.09 0.00 -1.03 0.00 0.00 54.13 54.96 2k52 s LEU 41 Cb -0.01 -3.76 -0.05 0.00 0.03 0.00 0.00 46.19 42.40 2k52 s LEU 41 CO 0.32 0.06 -0.00 -0.13 0.23 0.00 0.00 176.35 176.83 2k52 s ARG 42 N -1.58 2.12 0.54 1.70 1.81 -1.26 -4.76 118.95 117.52 2k52 s ARG 42 Ca 0.45 -1.64 0.33 0.00 -1.72 0.00 0.00 55.73 53.15 2k52 s ARG 42 Cb -0.22 -2.00 1.51 0.00 -0.45 0.00 0.00 34.95 33.78 2k52 s ARG 42 CO 0.28 0.22 1.86 -0.07 -0.68 0.00 0.00 175.30 176.90 2k52 h LEU 43 N 1.85 0.00 -1.67 2.53 3.38 -1.96 -1.32 115.31 118.13 2k52 h LEU 43 Ca -0.43 0.00 0.12 0.00 0.09 0.00 0.00 57.88 57.66 2k52 h LEU 43 Cb 1.25 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.96 2k52 h LEU 43 CO 0.64 0.00 0.43 -0.33 0.09 0.00 0.00 178.44 179.27 2k52 h GLU 44 N 0.00 0.35 -0.28 1.13 5.08 -2.00 -2.75 114.58 116.12 2k52 h GLU 44 Ca 0.48 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.81 2k52 h GLU 44 Cb 1.91 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 31.08 2k52 h GLU 44 CO -0.01 0.23 0.00 0.09 -1.00 0.00 0.00 179.01 178.32 2k52 n ASN 45 N -4.46 2.95 -4.80 1.42 3.02 -0.50 -5.00 115.26 107.89 2k52 n ASN 45 Ca 0.11 -2.21 -0.38 0.00 -0.03 0.00 0.00 54.58 52.07 2k52 n ASN 45 Cb 0.45 -0.26 -0.06 0.00 -0.61 0.00 0.00 39.78 39.30 2k52 n ASN 45 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2k52 s LEU 46 N -1.37 4.43 0.09 3.41 1.43 -1.04 -5.00 118.68 120.64 2k52 s LEU 46 Ca 0.24 0.97 0.08 0.00 -1.03 0.00 0.00 54.13 54.39 2k52 s LEU 46 Cb 0.15 -2.67 -0.03 0.00 0.03 0.00 0.00 46.19 43.67 2k52 s LEU 46 CO 0.12 0.23 -0.21 0.20 0.23 0.00 0.00 176.35 176.92 2k52 s ASN 47 N -0.64 2.60 -0.23 2.29 0.01 -1.26 -4.99 114.94 112.72 2k52 s ASN 47 Ca 0.25 -0.66 -0.29 0.00 -0.71 0.00 0.00 52.86 51.45 2k52 s ASN 47 Cb -0.17 -0.16 -0.03 0.00 0.41 0.00 0.00 41.25 41.30 2k52 s ASN 47 CO 0.13 0.09 1.82 -0.69 -1.51 0.00 0.00 177.10 176.94 2k52 s VAL 48 N -1.08 3.43 0.00 1.60 1.01 -1.26 -1.99 120.40 122.11 2k52 s VAL 48 Ca 0.07 0.47 0.00 0.00 0.00 0.00 0.00 61.98 62.52 2k52 s VAL 48 Cb -0.10 -3.50 0.00 0.00 0.00 0.00 0.00 36.38 32.79 2k52 s VAL 48 CO 0.04 -0.26 0.00 0.61 0.00 0.00 0.00 175.10 175.49 2k52 n GLY 49 N 5.12 1.18 3.62 4.51 0.00 0.25 -5.01 105.19 114.87 2k52 n GLY 49 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 2k52 n GLY 49 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k52 s ASP 50 N -1.82 6.60 -0.32 1.61 1.01 -0.84 -4.79 116.67 118.12 2k52 s ASP 50 Ca 0.00 1.15 -0.26 0.00 0.71 0.00 0.00 52.55 54.15 2k52 s ASP 50 Cb 0.00 -2.54 0.01 0.00 1.01 0.00 0.00 42.92 41.40 2k52 s ASP 50 CO 0.00 -1.15 0.91 -1.61 0.21 0.00 0.00 175.17 173.53 2k52 s GLU 51 N 4.33 3.99 0.10 8.23 2.02 -1.26 -1.63 118.70 134.48 2k52 s GLU 51 Ca 0.58 0.78 0.09 0.00 0.02 0.00 0.00 54.97 56.43 2k52 s GLU 51 Cb -0.16 -3.74 -0.03 0.00 0.10 0.00 0.00 34.13 30.29 2k52 s GLU 51 CO 0.25 -0.79 -0.22 0.42 0.02 0.00 0.00 175.26 174.95 2k52 s ILE 52 N 3.26 1.81 -0.42 -1.63 1.01 0.99 -4.94 121.20 121.29 2k52 s ILE 52 Ca 0.38 -1.54 -0.27 0.00 0.00 0.00 0.00 60.65 59.22 2k52 s ILE 52 Cb -0.13 -1.63 0.02 0.00 0.01 0.00 0.00 42.46 40.73 2k52 s ILE 52 CO 0.14 0.01 0.99 -0.63 0.00 0.00 0.00 174.94 175.44 2k52 s ILE 53 N -1.09 4.45 0.07 2.92 1.01 -1.26 -0.69 121.20 126.59 2k52 s ILE 53 Ca 0.08 1.09 0.07 0.00 0.00 0.00 0.00 60.65 61.89 2k52 s ILE 53 Cb -0.10 -4.44 -0.03 0.00 0.01 0.00 0.00 42.46 37.90 2k52 s ILE 53 CO 0.04 -0.75 -0.20 0.68 0.00 0.00 0.00 174.94 174.71 2k52 s VAL 54 N 3.83 1.58 -0.20 2.92 -7.23 0.77 -4.14 120.40 117.94 2k52 s VAL 54 Ca 0.41 -1.30 -0.12 0.00 -1.81 0.00 0.00 61.98 59.15 2k52 s VAL 54 Cb -0.10 -1.41 -0.05 0.00 0.56 0.00 0.00 36.38 35.38 2k52 s VAL 54 CO 0.24 0.06 0.23 -1.58 -0.31 0.00 0.00 175.10 173.75 2k52 s GLN 55 N -1.46 4.18 -0.32 4.82 0.74 -0.43 -1.35 119.66 125.84 2k52 s GLN 55 Ca 0.06 -0.06 -0.29 0.00 0.05 0.00 0.00 55.36 55.12 2k52 s GLN 55 Cb -0.09 -3.47 -0.01 0.00 1.10 0.00 0.00 33.01 30.54 2k52 s GLN 55 CO 0.03 0.17 1.65 0.00 -0.55 0.00 0.00 175.29 176.58 2k52 s ALA 56 N 0.71 3.03 -0.02 1.58 0.00 -0.37 -0.50 121.76 126.19 2k52 s ALA 56 Ca 0.12 0.21 -0.03 0.00 0.00 0.00 0.00 51.96 52.27 2k52 s ALA 56 Cb -0.13 -3.95 -0.01 0.00 0.00 0.00 0.00 23.12 19.03 2k52 s ALA 56 CO 0.03 -2.38 0.23 0.82 0.00 0.00 0.00 175.76 174.46 2k52 h ILE 57 N 6.54 0.00 -4.04 0.00 2.04 -0.95 0.92 117.51 122.02 2k52 h ILE 57 Ca -0.32 -0.28 -0.45 0.00 1.00 0.00 0.00 64.86 64.81 2k52 h ILE 57 Cb 1.15 0.00 -0.25 0.00 -0.74 0.00 0.00 36.82 36.98 2k52 h ILE 57 CO 1.04 0.00 -0.79 -1.81 0.00 0.00 0.00 178.15 176.58 2k52 s ASP 58 N -3.66 1.69 -0.30 1.72 1.01 -1.25 -3.84 116.67 112.05 2k52 s ASP 58 Ca -0.01 -0.47 0.03 0.00 0.71 0.00 0.00 52.55 52.81 2k52 s ASP 58 Cb 0.00 -0.11 0.08 0.00 1.01 0.00 0.00 42.92 43.91 2k52 s ASP 58 CO 0.04 0.03 -0.01 -0.69 0.21 0.00 0.00 175.17 174.75 2k52 s VAL 59 N -0.87 2.05 -0.48 -1.27 1.01 -1.26 -1.24 120.40 118.33 2k52 s VAL 59 Ca 0.02 -1.91 -0.09 0.00 0.00 0.00 0.00 61.98 59.99 2k52 s VAL 59 Cb -0.08 -2.37 0.12 0.00 0.00 0.00 0.00 36.38 34.05 2k52 s VAL 59 CO 0.01 -0.36 0.35 -0.13 0.00 0.00 0.00 175.10 174.97 2k52 s ARG 60 N 1.08 2.49 0.03 2.72 0.52 0.74 -4.98 118.95 121.55 2k52 s ARG 60 Ca 0.02 -1.77 -0.26 0.00 -0.52 0.00 0.00 55.73 53.20 2k52 s ARG 60 Cb -0.19 -3.94 -0.17 0.00 0.52 0.00 0.00 34.95 31.17 2k52 s ARG 60 CO -0.08 -1.20 1.41 -1.35 0.02 0.00 0.00 175.30 174.10 2k52 h PRO 61 N 8.45 -0.41 -0.43 3.54 0.11 -1.96 0.23 132.00 141.53 2k52 h PRO 61 Ca -0.21 0.03 0.03 0.00 0.11 0.00 0.00 66.00 65.96 2k52 h PRO 61 Cb 1.07 0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 2k52 h PRO 61 CO 0.86 -0.14 0.28 1.05 -0.21 0.00 0.00 178.00 179.85 2k52 h GLU 62 N -0.65 0.45 0.00 1.05 4.11 -1.97 -2.15 114.58 115.42 2k52 h GLU 62 Ca -0.04 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.36 2k52 h GLU 62 Cb 0.46 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2k52 h GLU 62 CO 0.07 0.30 -0.87 1.63 0.07 0.00 0.00 179.01 180.20 2k52 n LYS 63 N -4.48 0.29 -2.67 1.06 4.76 -1.18 -4.97 118.16 110.97 2k52 n LYS 63 Ca 0.04 0.03 -0.19 0.00 -2.87 0.00 0.00 58.31 55.33 2k52 n LYS 63 Cb 0.15 -1.63 0.01 0.00 -1.84 0.00 0.00 35.03 31.73 2k52 n LYS 63 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2k52 n ARG 64 N -2.03 -3.08 -5.02 1.97 1.74 0.73 -5.01 116.66 105.96 2k52 n ARG 64 Ca 0.02 0.84 -0.32 0.00 -0.77 0.00 0.00 57.85 57.62 2k52 n ARG 64 Cb 0.44 -5.42 -0.14 0.00 -1.02 0.00 0.00 32.46 26.31 2k52 n ARG 64 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2k52 s GLU 65 N -5.28 2.59 -0.21 5.56 2.02 -0.69 -5.00 118.70 117.69 2k52 s GLU 65 Ca 0.15 -0.78 -0.02 0.00 0.02 0.00 0.00 54.97 54.34 2k52 s GLU 65 Cb -0.07 -2.32 0.06 0.00 0.10 0.00 0.00 34.13 31.91 2k52 s GLU 65 CO 0.19 0.49 0.02 0.42 0.02 0.00 0.00 175.26 176.40 2k52 s ILE 66 N -0.41 0.71 0.19 -1.63 1.01 -1.26 -0.19 121.20 119.62 2k52 s ILE 66 Ca 0.04 -0.71 -0.20 0.00 0.00 0.00 0.00 60.65 59.78 2k52 s ILE 66 Cb -0.12 -1.19 -0.08 0.00 0.01 0.00 0.00 42.46 41.08 2k52 s ILE 66 CO 0.02 -0.21 0.71 -1.81 0.00 0.00 0.00 174.94 173.64 2k52 s ASP 67 N 1.77 7.11 0.14 3.58 1.01 -0.38 -0.38 116.67 129.53 2k52 s ASP 67 Ca -0.01 1.43 0.10 0.00 0.71 0.00 0.00 52.55 54.77 2k52 s ASP 67 Cb -0.17 -2.42 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 2k52 s ASP 67 CO -0.08 0.10 -0.23 -0.36 0.21 0.00 0.00 175.17 174.81 2k52 s PHE 68 N -1.39 2.06 0.01 4.23 0.08 0.18 -0.26 117.98 122.88 2k52 s PHE 68 Ca 0.39 -0.40 0.07 0.00 0.12 0.00 0.00 56.93 57.11 2k52 s PHE 68 Cb -0.18 -1.09 -0.02 0.00 -0.57 0.00 0.00 43.02 41.16 2k52 s PHE 68 CO 0.22 0.33 -0.21 0.21 -0.10 0.00 0.00 175.22 175.66 2k52 s LYS 69 N -2.25 1.61 -0.08 0.44 2.20 0.35 -4.21 119.74 117.80 2k52 s LYS 69 Ca 0.13 -0.83 -0.23 0.00 -0.36 0.00 0.00 55.97 54.68 2k52 s LYS 69 Cb -0.09 -1.62 -0.04 0.00 -1.51 0.00 0.00 37.83 34.57 2k52 s LYS 69 CO 0.06 0.43 0.68 -0.47 -0.36 0.00 0.00 175.35 175.70 2k52 s TYR 70 N -0.61 3.55 0.03 4.03 6.14 0.26 -1.32 117.35 129.43 2k52 s TYR 70 Ca 0.08 1.19 0.03 0.00 0.64 0.00 0.00 57.07 59.02 2k52 s TYR 70 Cb -0.08 -2.79 -0.02 0.00 0.42 0.00 0.00 41.96 39.49 2k52 s TYR 70 CO 0.00 0.07 -0.11 0.96 0.64 0.00 0.00 175.55 177.11 2k52 s ILE 71 N 0.90 0.82 -0.63 3.14 -4.36 -1.26 -4.10 121.20 115.71 2k52 s ILE 71 Ca 0.36 -0.85 -0.26 0.00 -0.26 0.00 0.00 60.65 59.63 2k52 s ILE 71 Cb -0.17 -0.77 0.04 0.00 1.25 0.00 0.00 42.46 42.81 2k52 s ILE 71 CO 0.17 -0.07 1.12 -2.16 0.24 0.00 0.00 174.94 174.23 2k52 s PRO 72 N -1.03 3.31 0.07 0.37 0.04 -1.26 -4.95 135.00 131.54 2k52 s PRO 72 Ca -0.01 -0.20 -0.30 0.00 0.04 0.00 0.00 61.00 60.52 2k52 s PRO 72 Cb -0.07 -4.11 -0.09 0.00 0.04 0.00 0.00 34.50 30.27 2k52 s PRO 72 CO 0.01 -1.79 1.87 -1.17 0.04 0.00 0.00 177.00 175.95 2k52 s LEU 73 N 4.78 4.41 0.00 -3.56 2.96 -1.26 -5.22 118.68 120.79 2k52 s LEU 73 Ca 0.34 2.67 0.18 0.00 -0.22 0.00 0.00 54.13 57.10 2k52 s LEU 73 Cb -0.10 -3.55 0.14 0.00 0.50 0.00 0.00 46.19 43.18 2k52 s LEU 73 CO 0.18 -1.01 1.07 -1.84 -1.32 0.00 0.00 176.35 173.43