#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d7n s SER 2 N 0.00 6.70 -0.20 1.61 0.01 -1.26 -4.92 113.70 115.65 2d7n s SER 2 Ca 0.00 0.77 -0.09 0.00 1.31 0.00 0.00 55.95 57.94 2d7n s SER 2 Cb 0.00 -2.41 -0.20 0.00 0.21 0.00 0.00 66.02 63.62 2d7n s SER 2 CO 0.00 -0.57 0.08 -1.54 0.41 0.00 0.00 173.24 171.62 2d7n n SER 3 N 6.13 2.01 0.00 2.44 3.41 -1.26 -5.03 113.62 121.32 2d7n n SER 3 Ca 0.04 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.84 2d7n n SER 3 Cb 0.48 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.66 2d7n n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d7n n GLY 4 N 1.83 3.46 2.80 5.00 0.00 -1.26 -5.15 105.19 111.88 2d7n n GLY 4 Ca -0.39 -0.65 -0.21 0.00 0.00 0.00 0.00 46.02 44.77 2d7n n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d7n s SER 5 N 1.00 1.23 0.97 1.61 0.01 -1.26 -5.14 113.70 112.13 2d7n s SER 5 Ca 0.00 -0.08 -0.13 0.00 1.31 0.00 0.00 55.95 57.05 2d7n s SER 5 Cb 0.00 -0.40 0.05 0.00 0.21 0.00 0.00 66.02 65.88 2d7n s SER 5 CO 0.00 -0.15 0.39 -1.54 0.41 0.00 0.00 173.24 172.35 2d7n n SER 6 N 4.73 -2.04 -3.15 2.44 3.41 -1.26 -5.03 113.62 112.72 2d7n n SER 6 Ca -0.14 0.28 0.05 0.00 -0.26 0.00 0.00 58.87 58.80 2d7n n SER 6 Cb 0.50 -1.19 -0.01 0.00 -0.26 0.00 0.00 64.21 63.25 2d7n n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2d7n s GLY 7 N -2.02 -0.39 -0.06 5.00 0.00 -1.26 -5.08 107.32 103.51 2d7n s GLY 7 Ca 0.57 2.74 -0.00 0.00 0.00 0.00 0.00 44.72 48.03 2d7n s GLY 7 CO 0.67 3.90 -0.02 1.08 0.00 0.00 0.00 173.10 178.72 2d7n s LEU 8 N 2.96 0.96 0.35 0.66 1.43 -1.26 -1.63 118.68 122.15 2d7n s LEU 8 Ca 0.02 -0.11 -0.26 0.00 -1.03 0.00 0.00 54.13 52.74 2d7n s LEU 8 Cb -0.08 -0.46 -0.13 0.00 0.03 0.00 0.00 46.19 45.55 2d7n s LEU 8 CO -0.12 -0.13 1.00 0.54 0.23 0.00 0.00 176.35 177.87 2d7n n ARG 9 N 4.63 1.37 -1.19 1.70 1.74 -1.26 -4.71 116.66 118.94 2d7n n ARG 9 Ca -0.16 0.48 -0.29 0.00 -0.77 0.00 0.00 57.85 57.11 2d7n n ARG 9 Cb 0.50 -1.93 0.15 0.00 -1.02 0.00 0.00 32.46 30.17 2d7n n ARG 9 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2d7n s PRO 10 N -1.74 0.92 -0.42 5.56 0.04 -1.26 -4.67 135.00 133.43 2d7n s PRO 10 Ca 0.60 0.70 -0.07 0.00 0.04 0.00 0.00 61.00 62.27 2d7n s PRO 10 Cb -0.63 -1.78 0.09 0.00 0.04 0.00 0.00 34.50 32.22 2d7n s PRO 10 CO 0.59 -2.44 0.24 0.12 0.04 0.00 0.00 177.00 175.55 2d7n s PHE 11 N -2.95 3.40 -0.23 0.56 5.36 -0.28 -4.97 117.98 118.87 2d7n s PHE 11 Ca 0.64 -1.81 0.02 0.00 -0.96 0.00 0.00 56.93 54.82 2d7n s PHE 11 Cb -0.18 -3.04 0.04 0.00 -0.34 0.00 0.00 43.02 39.50 2d7n s PHE 11 CO 0.57 -0.90 -0.13 0.54 -1.46 0.00 0.00 175.22 173.84 2d7n s ASN 12 N 2.09 4.01 -0.02 6.13 4.22 -1.26 -2.34 114.94 127.77 2d7n s ASN 12 Ca 0.04 -1.09 -0.05 0.00 -2.14 0.00 0.00 52.86 49.62 2d7n s ASN 12 Cb -0.23 -1.54 0.00 0.00 1.28 0.00 0.00 41.25 40.76 2d7n s ASN 12 CO -0.00 -0.12 0.12 -0.22 -2.04 0.00 0.00 177.10 174.84 2d7n s LEU 13 N 1.19 1.59 -0.22 3.54 2.96 -1.13 -4.98 118.68 121.64 2d7n s LEU 13 Ca -0.03 -0.03 -0.04 0.00 -0.22 0.00 0.00 54.13 53.82 2d7n s LEU 13 Cb -0.17 0.52 -0.01 0.00 0.50 0.00 0.00 46.19 47.03 2d7n s LEU 13 CO -0.08 -0.22 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.00 2d7n s VAL 14 N -0.75 3.36 -0.17 1.68 1.01 -1.26 -0.24 120.40 124.02 2d7n s VAL 14 Ca -0.08 -0.50 -0.07 0.00 0.00 0.00 0.00 61.98 61.32 2d7n s VAL 14 Cb -0.05 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 2d7n s VAL 14 CO 0.01 0.43 0.06 -0.63 0.00 0.00 0.00 175.10 174.97 2d7n s ILE 15 N 1.41 4.81 -1.12 2.22 1.01 -0.30 -4.93 121.20 124.30 2d7n s ILE 15 Ca 0.05 -0.03 -0.23 0.00 0.00 0.00 0.00 60.65 60.44 2d7n s ILE 15 Cb -0.14 -3.16 -0.08 0.00 0.01 0.00 0.00 42.46 39.09 2d7n s ILE 15 CO -0.03 0.48 1.94 -2.16 0.00 0.00 0.00 174.94 175.16 2d7n s PRO 16 N 0.22 2.51 -0.18 2.79 0.04 -1.26 -1.75 135.00 137.37 2d7n s PRO 16 Ca 0.04 -0.97 -0.05 0.00 0.04 0.00 0.00 61.00 60.06 2d7n s PRO 16 Cb -0.12 -5.20 0.09 0.00 0.04 0.00 0.00 34.50 29.30 2d7n s PRO 16 CO 0.00 -3.85 0.34 0.12 0.04 0.00 0.00 177.00 173.65 2d7n s PHE 17 N 10.81 -0.61 0.56 0.56 5.36 -1.08 -4.97 117.98 128.61 2d7n s PHE 17 Ca 0.69 1.10 -0.17 0.00 -0.96 0.00 0.00 56.93 57.59 2d7n s PHE 17 Cb -0.02 0.08 -0.05 0.00 -0.34 0.00 0.00 43.02 42.68 2d7n s PHE 17 CO 0.10 -0.47 1.04 0.00 -1.46 0.00 0.00 175.22 174.43 2d7n s ALA 18 N 2.50 2.83 -0.15 11.12 0.00 -1.11 -3.50 121.76 133.45 2d7n s ALA 18 Ca 0.02 0.40 -0.07 0.00 0.00 0.00 0.00 51.96 52.31 2d7n s ALA 18 Cb -0.13 -3.21 0.06 0.00 0.00 0.00 0.00 23.12 19.84 2d7n s ALA 18 CO -0.11 -0.60 0.35 0.08 0.00 0.00 0.00 175.76 175.48 2d7n s VAL 19 N -2.39 -0.23 0.00 0.00 1.01 -1.26 -4.96 120.40 112.57 2d7n s VAL 19 Ca 0.63 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.77 2d7n s VAL 19 Cb -0.15 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 35.69 2d7n s VAL 19 CO 0.32 0.06 0.00 0.00 0.00 0.00 0.00 175.10 175.49 2d7n n GLN 20 N 4.68 0.00 -0.10 2.72 1.13 -1.26 -4.50 117.38 120.06 2d7n n GLN 20 Ca -0.18 0.00 -0.16 0.00 -1.94 0.00 0.00 57.00 54.73 2d7n n GLN 20 Cb 0.53 -0.02 -0.05 0.00 0.11 0.00 0.00 30.24 30.81 2d7n n GLN 20 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2d7n n LYS 21 N -2.50 0.51 -0.94 -1.09 5.02 -1.26 -5.02 118.16 112.89 2d7n n LYS 21 Ca 0.00 0.21 -0.30 0.00 -2.02 0.00 0.00 58.31 56.20 2d7n n LYS 21 Cb 0.00 -1.38 0.02 0.00 -0.02 0.00 0.00 35.03 33.65 2d7n n LYS 21 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2d7n n GLY 22 N 1.53 -2.92 3.77 0.72 0.00 -1.26 -4.92 105.19 102.12 2d7n n GLY 22 Ca -0.27 -0.29 -0.36 0.00 0.00 0.00 0.00 46.02 45.10 2d7n n GLY 22 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2d7n s GLU 23 N -1.04 3.80 -0.28 1.61 2.12 -1.26 -4.89 118.70 118.76 2d7n s GLU 23 Ca 0.42 -0.22 -0.09 0.00 0.36 0.00 0.00 54.97 55.44 2d7n s GLU 23 Cb -0.32 -3.26 -0.02 0.00 0.26 0.00 0.00 34.13 30.78 2d7n s GLU 23 CO 0.57 0.50 0.12 -1.17 -0.54 0.00 0.00 175.26 174.74 2d7n s LEU 24 N -0.24 3.80 0.24 2.70 2.96 -1.26 -0.79 118.68 126.10 2d7n s LEU 24 Ca 0.10 -0.33 0.05 0.00 -0.22 0.00 0.00 54.13 53.73 2d7n s LEU 24 Cb -0.12 -1.98 -0.05 0.00 0.50 0.00 0.00 46.19 44.54 2d7n s LEU 24 CO 0.01 -0.11 -0.05 0.42 -1.32 0.00 0.00 176.35 175.30 2d7n s THR 25 N 1.63 1.38 0.31 3.68 -4.23 -0.41 -4.98 115.64 113.02 2d7n s THR 25 Ca 0.06 -2.09 -0.18 0.00 -1.18 0.00 0.00 61.69 58.29 2d7n s THR 25 Cb -0.16 -2.33 0.06 0.00 1.34 0.00 0.00 72.50 71.41 2d7n s THR 25 CO 0.06 -0.37 0.86 -0.83 -0.54 0.00 0.00 174.62 173.79 2d7n s GLY 26 N -3.36 0.22 -0.12 3.99 0.00 -1.26 -0.08 107.32 106.71 2d7n s GLY 26 Ca 0.27 -0.55 -0.27 0.00 0.00 0.00 0.00 44.72 44.17 2d7n s GLY 26 CO 0.09 0.42 0.66 1.85 0.00 0.00 0.00 173.10 176.12 2d7n s GLU 27 N -2.50 0.95 -0.01 2.90 2.12 -0.96 -4.46 118.70 116.74 2d7n s GLU 27 Ca 0.16 0.46 0.08 0.00 0.36 0.00 0.00 54.97 56.03 2d7n s GLU 27 Cb -0.04 0.45 -0.02 0.00 0.26 0.00 0.00 34.13 34.78 2d7n s GLU 27 CO 0.09 -0.24 -0.25 0.08 -0.54 0.00 0.00 175.26 174.39 2d7n s VAL 28 N -0.69 1.99 -0.16 3.70 1.01 0.26 -1.90 120.40 124.61 2d7n s VAL 28 Ca -0.08 -1.10 0.02 0.00 0.00 0.00 0.00 61.98 60.82 2d7n s VAL 28 Cb -0.02 -1.65 0.01 0.00 0.00 0.00 0.00 36.38 34.72 2d7n s VAL 28 CO 0.07 0.54 -0.20 -0.60 0.00 0.00 0.00 175.10 174.90 2d7n s ARG 29 N -0.65 3.02 0.25 2.72 3.00 -0.78 -0.25 118.95 126.27 2d7n s ARG 29 Ca 0.10 -0.83 -0.07 0.00 -1.00 0.00 0.00 55.73 53.92 2d7n s ARG 29 Cb -0.10 -2.51 -0.06 0.00 0.00 0.00 0.00 34.95 32.28 2d7n s ARG 29 CO -0.01 -0.10 0.54 0.00 0.00 0.00 0.00 175.30 175.73 2d7n s MET 30 N 1.03 3.71 0.07 5.12 0.23 -0.87 -3.02 119.30 125.58 2d7n s MET 30 Ca -0.01 0.13 0.17 0.00 -1.03 0.00 0.00 55.69 54.95 2d7n s MET 30 Cb -0.14 -2.66 0.71 0.00 -1.53 0.00 0.00 34.83 31.21 2d7n s MET 30 CO -0.07 0.28 1.53 -0.35 -2.03 0.00 0.00 175.02 174.38 2d7n n PRO 31 N -0.49 0.05 -0.13 3.16 -0.04 -1.26 -2.86 135.00 133.43 2d7n n PRO 31 Ca -0.01 0.30 -0.07 0.00 -0.04 0.00 0.00 63.50 63.69 2d7n n PRO 31 Cb 0.53 -1.60 0.10 0.00 -0.04 0.00 0.00 33.50 32.49 2d7n n PRO 31 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2d7n h SER 32 N 0.00 0.85 0.00 3.54 0.02 -1.93 -3.46 113.55 112.56 2d7n h SER 32 Ca 0.00 -0.24 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2d7n h SER 32 Cb 0.28 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.59 2d7n h SER 32 CO 0.00 0.95 0.00 0.61 -1.14 0.00 0.00 176.83 177.25 2d7n n GLY 33 N -0.46 1.15 2.12 -3.77 0.00 -1.14 -5.15 105.19 97.95 2d7n n GLY 33 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.91 2d7n n GLY 33 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2d7n n LYS 34 N 0.00 0.27 -4.10 1.61 5.02 -1.25 -5.05 118.16 114.66 2d7n n LYS 34 Ca 0.00 -2.20 -0.11 0.00 -2.02 0.00 0.00 58.31 53.98 2d7n n LYS 34 Cb 0.00 1.81 -0.11 0.00 -0.02 0.00 0.00 35.03 36.71 2d7n n LYS 34 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2d7n s THR 35 N -2.89 0.52 -0.10 -0.18 -4.23 -1.26 -2.04 115.64 105.45 2d7n s THR 35 Ca 0.26 -1.46 -0.07 0.00 -1.18 0.00 0.00 61.69 59.24 2d7n s THR 35 Cb 0.01 -1.07 0.04 0.00 1.34 0.00 0.00 72.50 72.82 2d7n s THR 35 CO 0.19 -0.64 0.25 0.00 -0.54 0.00 0.00 174.62 173.88 2d7n s ALA 36 N -2.49 -0.61 -0.19 3.99 0.00 0.66 -4.97 121.76 118.14 2d7n s ALA 36 Ca -0.01 0.89 -0.29 0.00 0.00 0.00 0.00 51.96 52.56 2d7n s ALA 36 Cb -0.02 -0.55 -0.00 0.00 0.00 0.00 0.00 23.12 22.55 2d7n s ALA 36 CO -0.03 -0.17 1.08 0.50 0.00 0.00 0.00 175.76 177.15 2d7n s ARG 37 N 0.77 4.29 0.00 0.00 3.52 -1.26 -0.57 118.95 125.69 2d7n s ARG 37 Ca -0.05 1.43 0.00 0.00 -0.13 0.00 0.00 55.73 56.98 2d7n s ARG 37 Cb -0.06 -3.64 0.00 0.00 -1.56 0.00 0.00 34.95 29.68 2d7n s ARG 37 CO -0.05 -0.58 0.00 -0.35 -0.81 0.00 0.00 175.30 173.51 2d7n n PRO 38 N 6.09 0.24 -3.95 5.12 -0.04 -1.26 -4.93 135.00 136.26 2d7n n PRO 38 Ca 0.12 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.43 2d7n n PRO 38 Cb 0.46 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.77 2d7n n PRO 38 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2d7n s ASN 39 N -1.51 0.32 -0.09 3.54 -0.87 0.33 -4.99 114.94 111.67 2d7n s ASN 39 Ca 0.00 -0.03 0.01 0.00 -1.57 0.00 0.00 52.86 51.27 2d7n s ASN 39 Cb 0.00 -0.11 0.02 0.00 -0.02 0.00 0.00 41.25 41.13 2d7n s ASN 39 CO 0.00 -0.04 -0.12 -0.63 -2.57 0.00 0.00 177.10 173.75 2d7n s ILE 40 N 0.48 1.19 -0.67 0.60 1.01 -1.26 0.30 121.20 122.85 2d7n s ILE 40 Ca -0.04 -0.46 -0.11 0.00 0.00 0.00 0.00 60.65 60.03 2d7n s ILE 40 Cb -0.07 -1.12 0.17 0.00 0.01 0.00 0.00 42.46 41.45 2d7n s ILE 40 CO -0.01 0.38 0.57 -0.89 0.00 0.00 0.00 174.94 174.99 2d7n s THR 41 N 1.05 4.87 0.06 2.92 2.01 -0.12 -4.98 115.64 121.46 2d7n s THR 41 Ca -0.07 -2.28 -0.30 0.00 0.31 0.00 0.00 61.69 59.35 2d7n s THR 41 Cb -0.15 -4.09 -0.09 0.00 0.01 0.00 0.00 72.50 68.18 2d7n s THR 41 CO -0.01 -0.92 1.88 -0.62 -0.69 0.00 0.00 174.62 174.26 2d7n s ASP 42 N 2.20 6.46 0.13 3.53 -1.08 -1.26 -3.31 116.67 123.35 2d7n s ASP 42 Ca 0.13 2.66 0.23 0.00 -0.52 0.00 0.00 52.55 55.05 2d7n s ASP 42 Cb -0.19 -2.54 0.02 0.00 -1.46 0.00 0.00 42.92 38.75 2d7n s ASP 42 CO -0.04 -1.02 1.02 0.59 0.52 0.00 0.00 175.17 176.24 2d7n n ASN 43 N 6.75 0.69 -2.45 -0.34 3.02 -1.24 -4.96 115.26 116.73 2d7n n ASN 43 Ca 0.19 0.15 -0.18 0.00 -0.03 0.00 0.00 54.58 54.71 2d7n n ASN 43 Cb 0.40 0.64 -0.01 0.00 -0.61 0.00 0.00 39.78 40.21 2d7n n ASN 43 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2d7n n LYS 44 N -2.40 -2.04 0.00 3.52 4.76 -1.26 -4.81 118.16 115.93 2d7n n LYS 44 Ca 0.00 0.83 0.00 0.00 -2.87 0.00 0.00 58.31 56.28 2d7n n LYS 44 Cb 0.51 -5.48 0.00 0.00 -1.84 0.00 0.00 35.03 28.22 2d7n n LYS 44 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2d7n n ASP 45 N -1.95 1.44 0.00 4.39 -0.08 -1.26 -4.96 116.55 114.12 2d7n n ASP 45 Ca -0.20 -1.58 0.00 0.00 -1.51 0.00 0.00 54.79 51.50 2d7n n ASP 45 Cb 0.65 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.11 2d7n n ASP 45 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2d7n n GLY 46 N -0.29 0.72 3.21 0.27 0.00 -1.26 -5.02 105.19 102.82 2d7n n GLY 46 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2d7n n GLY 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2d7n s THR 47 N -2.00 0.16 0.02 2.61 -4.23 -1.23 -2.62 115.64 108.35 2d7n s THR 47 Ca 0.00 -1.98 0.00 0.00 -1.18 0.00 0.00 61.69 58.54 2d7n s THR 47 Cb 0.00 -2.39 -0.02 0.00 1.34 0.00 0.00 72.50 71.43 2d7n s THR 47 CO 0.00 -0.14 -0.03 0.27 -0.54 0.00 0.00 174.62 174.18 2d7n s ILE 48 N -4.04 0.16 -0.15 2.99 -4.36 -0.72 -3.59 121.20 111.50 2d7n s ILE 48 Ca 0.34 -0.74 -0.00 0.00 -0.26 0.00 0.00 60.65 59.99 2d7n s ILE 48 Cb 0.07 -0.27 -0.01 0.00 1.25 0.00 0.00 42.46 43.51 2d7n s ILE 48 CO 0.09 -0.37 -0.13 -0.89 0.24 0.00 0.00 174.94 173.89 2d7n s THR 49 N -1.12 2.92 -0.07 8.37 2.01 -1.21 -1.15 115.64 125.38 2d7n s THR 49 Ca -0.11 -0.69 -0.05 0.00 0.31 0.00 0.00 61.69 61.15 2d7n s THR 49 Cb -0.08 -2.24 -0.04 0.00 0.01 0.00 0.00 72.50 70.15 2d7n s THR 49 CO -0.01 0.51 0.16 -0.69 -0.69 0.00 0.00 174.62 173.90 2d7n s VAL 50 N 0.69 5.45 -0.07 3.82 1.01 0.67 -0.94 120.40 131.03 2d7n s VAL 50 Ca -0.06 0.03 -0.03 0.00 0.00 0.00 0.00 61.98 61.92 2d7n s VAL 50 Cb -0.15 -3.45 0.04 0.00 0.00 0.00 0.00 36.38 32.81 2d7n s VAL 50 CO 0.02 0.48 0.13 -0.13 0.00 0.00 0.00 175.10 175.60 2d7n s ARG 51 N -1.46 0.03 -0.00 2.72 0.52 0.15 -2.83 118.95 118.08 2d7n s ARG 51 Ca 0.21 0.45 -0.04 0.00 -0.52 0.00 0.00 55.73 55.83 2d7n s ARG 51 Cb -0.12 -0.26 -0.00 0.00 0.52 0.00 0.00 34.95 35.08 2d7n s ARG 51 CO 0.11 -0.25 0.07 -0.47 0.02 0.00 0.00 175.30 174.78 2d7n s TYR 52 N 1.80 0.07 -0.47 -0.53 5.04 -0.99 -0.51 117.35 121.76 2d7n s TYR 52 Ca -0.02 -0.14 0.01 0.00 -2.44 0.00 0.00 57.07 54.49 2d7n s TYR 52 Cb -0.12 -0.07 0.12 0.00 0.35 0.00 0.00 41.96 42.25 2d7n s TYR 52 CO -0.05 -0.18 0.22 0.00 -1.34 0.00 0.00 175.55 174.21 2d7n s ALA 53 N -0.93 3.22 0.03 3.97 0.00 -1.26 -1.12 121.76 125.66 2d7n s ALA 53 Ca -0.10 -2.92 -0.30 0.00 0.00 0.00 0.00 51.96 48.63 2d7n s ALA 53 Cb -0.06 -2.25 -0.06 0.00 0.00 0.00 0.00 23.12 20.75 2d7n s ALA 53 CO 0.00 -1.90 1.42 -1.25 0.00 0.00 0.00 175.76 174.04 2d7n s PRO 54 N 0.36 4.28 0.06 0.00 0.04 -1.26 -4.92 135.00 133.56 2d7n s PRO 54 Ca 0.14 2.02 0.12 0.00 0.04 0.00 0.00 61.00 63.32 2d7n s PRO 54 Cb -0.22 -3.51 -0.18 0.00 0.04 0.00 0.00 34.50 30.63 2d7n s PRO 54 CO -0.04 -0.56 0.94 1.79 0.04 0.00 0.00 177.00 179.17 2d7n h THR 55 N 4.78 1.01 -1.45 1.26 1.35 -1.98 -3.41 112.91 114.47 2d7n h THR 55 Ca -0.39 -2.70 -0.62 0.00 -0.55 0.00 0.00 66.41 62.14 2d7n h THR 55 Cb 1.19 2.46 -0.13 0.00 -1.73 0.00 0.00 68.15 69.93 2d7n h THR 55 CO 0.90 0.58 -0.57 -1.61 -0.25 0.00 0.00 175.52 174.57 2d7n s GLU 56 N -2.73 2.00 0.11 4.72 0.41 -1.26 -4.86 118.70 117.08 2d7n s GLU 56 Ca -0.02 -2.19 0.02 0.00 -0.41 0.00 0.00 54.97 52.38 2d7n s GLU 56 Cb 0.09 -1.43 -0.04 0.00 -1.78 0.00 0.00 34.13 30.97 2d7n s GLU 56 CO 0.81 -0.20 0.20 -1.59 -0.49 0.00 0.00 175.26 173.99 2d7n s LYS 57 N -3.79 3.24 0.00 1.61 -2.85 -1.26 -4.85 119.74 111.84 2d7n s LYS 57 Ca 0.25 -0.62 0.00 0.00 -1.00 0.00 0.00 55.97 54.60 2d7n s LYS 57 Cb 0.07 -2.89 0.00 0.00 -2.06 0.00 0.00 37.83 32.95 2d7n s LYS 57 CO 0.12 0.55 0.00 0.41 0.10 0.00 0.00 175.35 176.53 2d7n n GLY 58 N -0.07 0.90 3.67 0.59 0.00 -0.98 -4.86 105.19 104.45 2d7n n GLY 58 Ca -0.07 -2.11 -0.42 0.00 0.00 0.00 0.00 46.02 43.42 2d7n n GLY 58 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2d7n s LEU 59 N 0.00 4.16 0.04 0.99 2.96 -1.26 -1.84 118.68 123.73 2d7n s LEU 59 Ca 0.00 1.38 0.05 0.00 -0.22 0.00 0.00 54.13 55.33 2d7n s LEU 59 Cb 0.00 -3.47 -0.04 0.00 0.50 0.00 0.00 46.19 43.18 2d7n s LEU 59 CO 0.00 -0.54 -0.08 -1.00 -1.32 0.00 0.00 176.35 173.41 2d7n s HIS 60 N 2.60 2.84 -0.23 5.38 3.76 -0.87 -4.49 115.29 124.27 2d7n s HIS 60 Ca 0.44 -0.08 -0.07 0.00 -0.15 0.00 0.00 55.06 55.19 2d7n s HIS 60 Cb -0.16 -1.54 -0.03 0.00 1.11 0.00 0.00 32.58 31.95 2d7n s HIS 60 CO 0.11 0.39 0.06 -1.14 -0.85 0.00 0.00 174.74 173.32 2d7n s GLN 61 N -1.74 3.72 -0.23 1.40 0.74 -1.17 -2.97 119.66 119.41 2d7n s GLN 61 Ca 0.19 -0.45 -0.00 0.00 0.05 0.00 0.00 55.36 55.15 2d7n s GLN 61 Cb -0.11 -3.27 0.03 0.00 1.10 0.00 0.00 33.01 30.75 2d7n s GLN 61 CO 0.10 -0.06 -0.11 1.41 -0.55 0.00 0.00 175.29 176.08 2d7n s MET 62 N 1.27 2.79 -0.26 1.67 -2.45 -0.65 -1.86 119.30 119.82 2d7n s MET 62 Ca 0.05 -0.99 -0.04 0.00 -1.25 0.00 0.00 55.69 53.46 2d7n s MET 62 Cb -0.15 -2.84 0.01 0.00 1.25 0.00 0.00 34.83 33.10 2d7n s MET 62 CO 0.03 -0.37 -0.01 0.20 1.05 0.00 0.00 175.02 175.93 2d7n s GLY 63 N 1.28 1.68 0.13 2.11 0.00 -0.80 -0.36 107.32 111.35 2d7n s GLY 63 Ca 0.00 -1.41 0.03 0.00 0.00 0.00 0.00 44.72 43.34 2d7n s GLY 63 CO -0.07 0.55 0.20 -0.42 0.00 0.00 0.00 173.10 173.36 2d7n s ILE 64 N 1.41 5.01 0.01 0.90 -1.09 -1.26 -2.25 121.20 123.93 2d7n s ILE 64 Ca 0.02 -0.74 -0.06 0.00 -2.23 0.00 0.00 60.65 57.64 2d7n s ILE 64 Cb -0.16 -3.53 -0.00 0.00 -1.58 0.00 0.00 42.46 37.19 2d7n s ILE 64 CO -0.02 -0.02 0.10 -0.54 -1.23 0.00 0.00 174.94 173.24 2d7n s LYS 65 N -2.94 0.49 -0.33 2.79 -0.14 0.89 -3.80 119.74 116.70 2d7n s LYS 65 Ca 0.33 -0.52 0.01 0.00 -1.36 0.00 0.00 55.97 54.42 2d7n s LYS 65 Cb -0.11 0.20 0.10 0.00 -1.68 0.00 0.00 37.83 36.34 2d7n s LYS 65 CO 0.26 -0.12 0.10 -0.47 -0.76 0.00 0.00 175.35 174.37 2d7n s TYR 66 N -1.72 2.23 -1.62 3.18 5.04 -0.05 -1.29 117.35 123.12 2d7n s TYR 66 Ca -0.12 -2.12 0.00 0.00 -2.44 0.00 0.00 57.07 52.39 2d7n s TYR 66 Cb -0.06 -2.03 0.00 0.00 0.35 0.00 0.00 41.96 40.22 2d7n s TYR 66 CO -0.00 -0.88 0.00 -3.47 -1.34 0.00 0.00 175.55 169.85 2d7n n ASP 67 N 4.57 -4.97 -0.20 4.32 -0.08 0.03 -2.39 116.55 117.84 2d7n n ASP 67 Ca 0.00 0.19 0.00 0.00 -1.51 0.00 0.00 54.79 53.47 2d7n n ASP 67 Cb 0.41 -4.26 0.00 0.00 2.34 0.00 0.00 41.12 39.61 2d7n n ASP 67 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2d7n n GLY 68 N -0.73 0.83 3.37 0.27 0.00 -1.26 -4.99 105.19 102.67 2d7n n GLY 68 Ca -0.20 -0.18 -0.06 0.00 0.00 0.00 0.00 46.02 45.58 2d7n n GLY 68 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2d7n s ASN 69 N -2.07 -0.54 -0.61 1.61 2.47 -1.00 -5.09 114.94 109.71 2d7n s ASN 69 Ca 0.00 1.15 -0.26 0.00 0.42 0.00 0.00 52.86 54.17 2d7n s ASN 69 Cb 0.00 1.65 -0.10 0.00 -1.45 0.00 0.00 41.25 41.35 2d7n s ASN 69 CO 0.00 -0.23 2.44 1.41 -3.72 0.00 0.00 177.10 176.99 2d7n n HIS 70 N 5.41 1.27 -1.17 0.43 8.25 -1.26 -0.87 115.22 127.28 2d7n n HIS 70 Ca -0.09 0.11 -0.38 0.00 -0.26 0.00 0.00 57.72 57.10 2d7n n HIS 70 Cb 0.49 -2.57 0.02 0.00 1.12 0.00 0.00 29.99 29.06 2d7n n HIS 70 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 2d7n n ILE 71 N 8.08 0.16 -2.06 1.59 -5.35 -1.25 -4.69 119.36 115.85 2d7n n ILE 71 Ca 0.42 -0.49 -0.28 0.00 -0.27 0.00 0.00 62.75 62.13 2d7n n ILE 71 Cb 0.47 -0.07 -0.06 0.00 -1.74 0.00 0.00 39.64 38.25 2d7n n ILE 71 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2d7n s PRO 72 N -1.48 2.51 0.00 6.28 0.04 -1.26 -2.18 135.00 138.90 2d7n s PRO 72 Ca 0.52 -0.97 0.00 0.00 0.04 0.00 0.00 61.00 60.60 2d7n s PRO 72 Cb -0.38 -5.20 0.00 0.00 0.04 0.00 0.00 34.50 28.95 2d7n s PRO 72 CO 0.71 -3.85 0.00 0.41 0.04 0.00 0.00 177.00 174.31 2d7n n GLY 73 N 6.05 0.15 3.62 0.56 0.00 -1.26 -4.89 105.19 109.42 2d7n n GLY 73 Ca 0.44 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.20 2d7n n GLY 73 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d7n s SER 74 N 0.00 4.53 1.22 1.61 1.04 -0.93 -4.31 113.70 116.86 2d7n s SER 74 Ca 0.00 -0.51 -0.18 0.00 0.48 0.00 0.00 55.95 55.73 2d7n s SER 74 Cb 0.00 -0.87 0.27 0.00 0.10 0.00 0.00 66.02 65.52 2d7n s SER 74 CO 0.00 0.08 0.96 -0.81 0.98 0.00 0.00 173.24 174.45 2d7n n PRO 75 N -0.21 -2.90 -3.90 4.02 -0.04 -1.26 -4.74 135.00 125.97 2d7n n PRO 75 Ca -0.09 -1.54 -0.11 0.00 -0.04 0.00 0.00 63.50 61.72 2d7n n PRO 75 Cb 0.56 -1.44 -0.12 0.00 -0.04 0.00 0.00 33.50 32.45 2d7n n PRO 75 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2d7n s LEU 76 N 0.00 1.91 -0.10 1.53 0.05 0.51 -4.99 118.68 117.58 2d7n s LEU 76 Ca 0.63 -0.14 -0.00 0.00 0.05 0.00 0.00 54.13 54.66 2d7n s LEU 76 Cb -0.06 0.23 -0.02 0.00 -2.05 0.00 0.00 46.19 44.28 2d7n s LEU 76 CO 0.48 -0.17 -0.08 -1.10 -0.55 0.00 0.00 176.35 174.93 2d7n s GLN 77 N -0.68 3.11 -0.09 1.48 -0.21 -1.26 -1.63 119.66 120.38 2d7n s GLN 77 Ca -0.08 -0.59 -0.05 0.00 0.02 0.00 0.00 55.36 54.66 2d7n s GLN 77 Cb -0.05 -2.66 0.04 0.00 1.00 0.00 0.00 33.01 31.34 2d7n s GLN 77 CO -0.00 0.44 0.21 -0.59 -2.12 0.00 0.00 175.29 173.23 2d7n s PHE 78 N -0.22 -0.26 0.14 0.91 -0.71 -1.16 -5.01 117.98 111.67 2d7n s PHE 78 Ca 0.02 0.64 -0.13 0.00 -1.04 0.00 0.00 56.93 56.42 2d7n s PHE 78 Cb -0.13 0.02 -0.07 0.00 -1.21 0.00 0.00 43.02 41.63 2d7n s PHE 78 CO 0.03 -0.19 0.52 -0.47 -1.34 0.00 0.00 175.22 173.77 2d7n s TYR 79 N 0.97 3.59 -0.07 3.49 5.04 -1.26 -2.06 117.35 127.05 2d7n s TYR 79 Ca -0.07 0.99 0.04 0.00 -2.44 0.00 0.00 57.07 55.59 2d7n s TYR 79 Cb -0.09 -2.32 -0.02 0.00 0.35 0.00 0.00 41.96 39.89 2d7n s TYR 79 CO -0.06 0.44 -0.19 0.08 -1.34 0.00 0.00 175.55 174.48 2d7n s VAL 80 N -1.47 2.55 0.36 3.14 1.01 -0.77 -4.94 120.40 120.29 2d7n s VAL 80 Ca 0.37 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.51 2d7n s VAL 80 Cb -0.15 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 2d7n s VAL 80 CO 0.19 0.56 0.09 1.51 0.00 0.00 0.00 175.10 177.46 2d7n s ASP 81 N -0.16 2.48 0.21 3.32 -4.77 -1.26 -2.31 116.67 114.18 2d7n s ASP 81 Ca -0.02 -1.52 -0.30 0.00 -3.30 0.00 0.00 52.55 47.41 2d7n s ASP 81 Cb -0.14 0.23 -0.09 0.00 -1.09 0.00 0.00 42.92 41.83 2d7n s ASP 81 CO 0.04 -0.78 1.29 0.00 0.70 0.00 0.00 175.17 176.42 2d7n s ALA 82 N -3.30 3.51 -0.77 2.11 0.00 -1.26 -4.07 121.76 117.98 2d7n s ALA 82 Ca 0.30 1.10 -0.25 0.00 0.00 0.00 0.00 51.96 53.11 2d7n s ALA 82 Cb 0.06 -3.47 -0.15 0.00 0.00 0.00 0.00 23.12 19.56 2d7n s ALA 82 CO 0.15 -0.51 2.40 -0.89 0.00 0.00 0.00 175.76 176.90 2d7n n ILE 83 N 2.40 -0.01 -2.32 0.00 5.41 -0.64 -4.85 119.36 119.35 2d7n n ILE 83 Ca 0.05 -0.53 -0.36 0.00 1.00 0.00 0.00 62.75 62.91 2d7n n ILE 83 Cb 0.43 -1.90 -0.04 0.00 -0.71 0.00 0.00 39.64 37.42 2d7n n ILE 83 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 2d7n s ASN 84 N 10.11 5.85 0.21 4.38 3.84 -1.26 -4.91 114.94 133.15 2d7n s ASN 84 Ca 0.98 -0.82 -0.07 0.00 0.21 0.00 0.00 52.86 53.15 2d7n s ASN 84 Cb -0.21 -2.56 -0.02 0.00 -0.55 0.00 0.00 41.25 37.91 2d7n s ASN 84 CO 0.15 -2.08 0.29 -0.55 -2.79 0.00 0.00 177.10 172.13 2d7n s SER 85 N 6.19 0.04 -0.15 -4.21 0.15 -1.26 -5.08 113.70 109.38 2d7n s SER 85 Ca 0.55 -1.08 -0.01 0.00 0.70 0.00 0.00 55.95 56.11 2d7n s SER 85 Cb -0.05 0.47 -0.09 0.00 -1.71 0.00 0.00 66.02 64.64 2d7n s SER 85 CO 0.01 -0.96 -0.15 0.54 1.20 0.00 0.00 173.24 173.88 2d7n n ARG 86 N -0.29 0.36 -0.59 5.44 1.74 -1.26 -4.58 116.66 117.48 2d7n n ARG 86 Ca -0.02 0.10 -0.04 0.00 -0.77 0.00 0.00 57.85 57.12 2d7n n ARG 86 Cb 0.64 -1.24 0.01 0.00 -1.02 0.00 0.00 32.46 30.84 2d7n n ARG 86 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 2d7n n HIS 87 N -3.10 0.34 -1.53 -1.55 -0.00 -1.26 -4.87 115.22 103.25 2d7n n HIS 87 Ca -0.27 -1.22 -0.14 0.00 0.46 0.00 0.00 57.72 56.55 2d7n n HIS 87 Cb 0.77 -0.61 -0.10 0.00 -0.12 0.00 0.00 29.99 29.92 2d7n n HIS 87 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2d7n n SER 88 N 1.26 0.98 0.00 0.26 2.88 -1.26 -4.56 113.62 113.16 2d7n n SER 88 Ca 0.07 -1.44 0.00 0.00 -1.33 0.00 0.00 58.87 56.17 2d7n n SER 88 Cb 0.52 -1.42 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 2d7n n SER 88 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d7n n GLY 89 N 6.39 -0.63 3.68 0.46 0.00 -1.26 -5.16 105.19 108.68 2d7n n GLY 89 Ca 0.49 -0.59 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 2d7n n GLY 89 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d7n s PRO 90 N -0.98 0.50 0.22 1.61 0.04 -1.26 -5.06 135.00 130.07 2d7n s PRO 90 Ca 0.00 0.55 0.03 0.00 0.04 0.00 0.00 61.00 61.62 2d7n s PRO 90 Cb 0.00 -1.74 -0.03 0.00 0.04 0.00 0.00 34.50 32.76 2d7n s PRO 90 CO 0.00 -2.69 0.36 -1.12 0.04 0.00 0.00 177.00 173.59 2d7n s SER 91 N -3.45 6.33 0.01 6.66 0.01 -1.26 -5.09 113.70 116.91 2d7n s SER 91 Ca 0.65 0.19 0.03 0.00 1.31 0.00 0.00 55.95 58.13 2d7n s SER 91 Cb -0.19 -1.92 -0.04 0.00 0.21 0.00 0.00 66.02 64.09 2d7n s SER 91 CO 0.58 -0.06 -0.04 -0.55 0.41 0.00 0.00 173.24 173.58 2d7n s SER 92 N -3.65 4.84 0.00 2.44 0.15 -1.26 -5.30 113.70 110.92 2d7n s SER 92 Ca 0.35 -0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.90 2d7n s SER 92 Cb -0.10 -1.18 0.00 0.00 -1.71 0.00 0.00 66.02 63.03 2d7n s SER 92 CO 0.30 0.27 0.10 0.61 1.20 0.00 0.00 173.24 175.71