#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d7n n SER 2 N 0.00 1.93 -0.17 1.61 3.41 -1.26 -4.61 113.62 114.52 2d7n n SER 2 Ca 0.00 0.36 -0.08 0.00 -0.26 0.00 0.00 58.87 58.89 2d7n n SER 2 Cb 0.00 -0.77 0.01 0.00 -0.26 0.00 0.00 64.21 63.20 2d7n n SER 2 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2d7n h SER 3 N -1.00 0.66 0.00 4.04 0.87 -2.13 -3.48 113.55 112.51 2d7n h SER 3 Ca -0.10 -0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 2d7n h SER 3 Cb 1.05 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.84 2d7n h SER 3 CO -0.06 0.61 0.00 0.61 -0.53 0.00 0.00 176.83 177.45 2d7n n GLY 4 N -0.90 1.40 3.11 5.77 0.00 -1.26 -5.13 105.19 108.18 2d7n n GLY 4 Ca 0.02 -0.66 -0.33 0.00 0.00 0.00 0.00 46.02 45.05 2d7n n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d7n s SER 5 N 0.00 3.06 -0.30 1.61 0.15 -1.26 -5.08 113.70 111.87 2d7n s SER 5 Ca 0.00 -0.62 -0.12 0.00 0.70 0.00 0.00 55.95 55.91 2d7n s SER 5 Cb 0.00 -1.43 -0.04 0.00 -1.71 0.00 0.00 66.02 62.84 2d7n s SER 5 CO 0.00 -0.01 0.21 -0.44 1.20 0.00 0.00 173.24 174.20 2d7n s SER 6 N 1.31 6.01 0.24 5.45 0.01 -1.26 -4.85 113.70 120.61 2d7n s SER 6 Ca 0.05 -0.19 -0.30 0.00 1.31 0.00 0.00 55.95 56.82 2d7n s SER 6 Cb -0.13 -2.12 -0.09 0.00 0.21 0.00 0.00 66.02 63.89 2d7n s SER 6 CO -0.12 -0.13 1.00 -0.83 0.41 0.00 0.00 173.24 173.56 2d7n s GLY 7 N 1.74 3.08 -0.02 3.44 0.00 -1.26 -4.90 107.32 109.40 2d7n s GLY 7 Ca 0.07 0.71 0.01 0.00 0.00 0.00 0.00 44.72 45.50 2d7n s GLY 7 CO 0.11 1.33 -0.03 1.08 0.00 0.00 0.00 173.10 175.58 2d7n s LEU 8 N -1.12 1.61 0.53 0.66 1.43 -1.26 -1.70 118.68 118.83 2d7n s LEU 8 Ca 0.43 -0.07 -0.22 0.00 -1.03 0.00 0.00 54.13 53.24 2d7n s LEU 8 Cb -0.28 -0.26 -0.05 0.00 0.03 0.00 0.00 46.19 45.63 2d7n s LEU 8 CO 0.35 -0.02 1.37 -0.13 0.23 0.00 0.00 176.35 178.15 2d7n s ARG 9 N 0.44 3.24 1.05 1.70 0.52 -1.23 -4.80 118.95 119.88 2d7n s ARG 9 Ca -0.05 2.27 -0.14 0.00 -0.52 0.00 0.00 55.73 57.30 2d7n s ARG 9 Cb -0.08 -2.33 0.22 0.00 0.52 0.00 0.00 34.95 33.27 2d7n s ARG 9 CO -0.01 -1.12 1.10 -1.25 0.02 0.00 0.00 175.30 174.04 2d7n s PRO 10 N -2.82 0.00 -0.49 3.54 0.04 -1.26 -4.64 135.00 129.36 2d7n s PRO 10 Ca 0.70 0.38 -0.01 0.00 0.04 0.00 0.00 61.00 62.10 2d7n s PRO 10 Cb -0.41 -1.70 0.13 0.00 0.04 0.00 0.00 34.50 32.56 2d7n s PRO 10 CO 0.49 -2.99 0.28 0.12 0.04 0.00 0.00 177.00 174.94 2d7n s PHE 11 N -2.97 3.50 -0.29 0.56 5.36 -0.18 -4.98 117.98 118.98 2d7n s PHE 11 Ca 0.67 -2.68 -0.05 0.00 -0.96 0.00 0.00 56.93 53.91 2d7n s PHE 11 Cb -0.17 -3.14 0.02 0.00 -0.34 0.00 0.00 43.02 39.40 2d7n s PHE 11 CO 0.57 -0.90 0.03 0.54 -1.46 0.00 0.00 175.22 174.01 2d7n s ASN 12 N 1.06 4.88 0.03 6.13 4.22 -1.26 -2.49 114.94 127.51 2d7n s ASN 12 Ca 0.13 -0.87 -0.04 0.00 -2.14 0.00 0.00 52.86 49.93 2d7n s ASN 12 Cb -0.22 -1.80 -0.01 0.00 1.28 0.00 0.00 41.25 40.50 2d7n s ASN 12 CO -0.04 -0.20 0.06 -0.22 -2.04 0.00 0.00 177.10 174.66 2d7n s LEU 13 N 1.41 1.93 -0.26 3.54 2.96 -1.01 -4.99 118.68 122.25 2d7n s LEU 13 Ca 0.00 -0.49 0.02 0.00 -0.22 0.00 0.00 54.13 53.44 2d7n s LEU 13 Cb -0.18 0.45 0.06 0.00 0.50 0.00 0.00 46.19 47.02 2d7n s LEU 13 CO 0.00 -0.43 -0.09 -0.69 -1.32 0.00 0.00 176.35 173.82 2d7n s VAL 14 N -2.14 1.98 -0.12 1.68 1.01 -1.26 -0.35 120.40 121.20 2d7n s VAL 14 Ca -0.09 -1.54 -0.15 0.00 0.00 0.00 0.00 61.98 60.19 2d7n s VAL 14 Cb -0.04 -2.15 -0.05 0.00 0.00 0.00 0.00 36.38 34.14 2d7n s VAL 14 CO -0.03 -0.08 0.38 -0.63 0.00 0.00 0.00 175.10 174.74 2d7n s ILE 15 N 1.18 5.23 -1.14 2.22 1.01 -0.21 -4.88 121.20 124.60 2d7n s ILE 15 Ca -0.07 0.74 -0.23 0.00 0.00 0.00 0.00 60.65 61.09 2d7n s ILE 15 Cb -0.20 -3.71 -0.08 0.00 0.01 0.00 0.00 42.46 38.48 2d7n s ILE 15 CO -0.06 0.40 1.94 -2.16 0.00 0.00 0.00 174.94 175.06 2d7n s PRO 16 N 0.27 2.50 -0.16 2.79 0.04 -1.26 -1.22 135.00 137.97 2d7n s PRO 16 Ca 0.21 -1.04 -0.04 0.00 0.04 0.00 0.00 61.00 60.17 2d7n s PRO 16 Cb -0.14 -5.22 0.08 0.00 0.04 0.00 0.00 34.50 29.25 2d7n s PRO 16 CO 0.08 -3.90 0.22 0.12 0.04 0.00 0.00 177.00 173.56 2d7n s PHE 17 N 10.89 -0.29 0.24 0.56 5.36 -1.05 -4.96 117.98 128.72 2d7n s PHE 17 Ca 0.69 0.50 -0.30 0.00 -0.96 0.00 0.00 56.93 56.86 2d7n s PHE 17 Cb -0.02 -0.26 -0.09 0.00 -0.34 0.00 0.00 43.02 42.32 2d7n s PHE 17 CO 0.11 -0.46 1.09 0.00 -1.46 0.00 0.00 175.22 174.50 2d7n s ALA 18 N 2.34 3.39 -0.30 11.12 0.00 -0.83 -3.81 121.76 133.69 2d7n s ALA 18 Ca 0.05 0.85 0.01 0.00 0.00 0.00 0.00 51.96 52.86 2d7n s ALA 18 Cb -0.14 -3.33 0.09 0.00 0.00 0.00 0.00 23.12 19.74 2d7n s ALA 18 CO -0.10 -0.15 0.06 0.08 0.00 0.00 0.00 175.76 175.65 2d7n s VAL 19 N -0.82 1.31 0.00 0.00 1.01 -1.26 -5.01 120.40 115.63 2d7n s VAL 19 Ca 0.46 -1.55 0.00 0.00 0.00 0.00 0.00 61.98 60.90 2d7n s VAL 19 Cb -0.31 -1.90 0.00 0.00 0.00 0.00 0.00 36.38 34.18 2d7n s VAL 19 CO 0.38 -0.53 0.00 0.00 0.00 0.00 0.00 175.10 174.95 2d7n n GLN 20 N 4.68 0.00 -0.02 2.72 1.13 -1.26 -4.62 117.38 120.02 2d7n n GLN 20 Ca -0.03 0.30 -0.03 0.00 -1.94 0.00 0.00 57.00 55.30 2d7n n GLN 20 Cb 0.43 -0.78 -0.01 0.00 0.11 0.00 0.00 30.24 29.98 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 -1.89 0.08 -0.95 -1.09 4.76 -1.26 -5.06 118.16 112.74 2d7n n LYS 21 Ca 0.00 0.03 -0.30 0.00 -2.87 0.00 0.00 58.31 55.17 2d7n n LYS 21 Cb 0.00 -0.81 0.00 0.00 -1.84 0.00 0.00 35.03 32.39 2d7n n LYS 21 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2d7n n GLY 22 N 3.01 -2.29 3.73 0.72 0.00 -1.26 -4.87 105.19 104.24 2d7n n GLY 22 Ca -0.06 -0.09 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.75 4.36 -0.29 1.61 2.56 -1.26 -4.83 118.70 120.10 2d7n s GLU 23 Ca 0.44 0.66 -0.07 0.00 0.00 0.00 0.00 54.97 56.00 2d7n s GLU 23 Cb -0.41 -3.41 0.01 0.00 2.00 0.00 0.00 34.13 32.31 2d7n s GLU 23 CO 0.49 0.19 0.07 -1.17 -0.56 0.00 0.00 175.26 174.28 2d7n s LEU 24 N 0.44 3.78 0.32 2.70 2.96 -1.26 -1.10 118.68 126.53 2d7n s LEU 24 Ca 0.31 -0.67 0.03 0.00 -0.22 0.00 0.00 54.13 53.58 2d7n s LEU 24 Cb -0.17 -1.88 -0.05 0.00 0.50 0.00 0.00 46.19 44.60 2d7n s LEU 24 CO 0.15 -0.17 0.10 0.42 -1.32 0.00 0.00 176.35 175.52 2d7n s THR 25 N 1.50 0.72 0.18 3.68 -4.23 -0.74 -4.95 115.64 111.81 2d7n s THR 25 Ca 0.03 -2.00 -0.23 0.00 -1.18 0.00 0.00 61.69 58.31 2d7n s THR 25 Cb -0.17 -2.60 0.07 0.00 1.34 0.00 0.00 72.50 71.15 2d7n s THR 25 CO 0.02 0.00 1.02 -0.83 -0.54 0.00 0.00 174.62 174.29 2d7n s GLY 26 N -3.45 0.02 -0.22 3.99 0.00 -1.26 -0.30 107.32 106.11 2d7n s GLY 26 Ca 0.34 -0.20 -0.21 0.00 0.00 0.00 0.00 44.72 44.64 2d7n s GLY 26 CO 0.15 1.64 0.60 1.85 0.00 0.00 0.00 173.10 177.35 2d7n s GLU 27 N -2.46 0.71 -0.01 2.90 2.12 -1.03 -4.42 118.70 116.52 2d7n s GLU 27 Ca 0.19 0.80 0.01 0.00 0.36 0.00 0.00 54.97 56.33 2d7n s GLU 27 Cb -0.02 0.35 -0.04 0.00 0.26 0.00 0.00 34.13 34.68 2d7n s GLU 27 CO 0.04 -0.09 -0.00 0.08 -0.54 0.00 0.00 175.26 174.75 2d7n s VAL 28 N 0.24 4.13 -0.22 3.70 1.01 -0.00 -2.40 120.40 126.85 2d7n s VAL 28 Ca -0.01 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.40 2d7n s VAL 28 Cb -0.04 -2.83 0.05 0.00 0.00 0.00 0.00 36.38 33.56 2d7n s VAL 28 CO 0.01 0.40 -0.08 -0.60 0.00 0.00 0.00 175.10 174.83 2d7n s ARG 29 N -1.48 1.87 0.36 2.72 3.00 -0.59 -0.91 118.95 123.90 2d7n s ARG 29 Ca 0.19 -0.98 -0.16 0.00 -1.00 0.00 0.00 55.73 53.77 2d7n s ARG 29 Cb -0.11 -2.56 -0.09 0.00 0.00 0.00 0.00 34.95 32.18 2d7n s ARG 29 CO 0.09 -0.53 0.79 0.00 0.00 0.00 0.00 175.30 175.66 2d7n s MET 30 N 1.35 4.04 0.12 5.12 0.23 -0.94 -2.81 119.30 126.43 2d7n s MET 30 Ca -0.05 0.77 0.19 0.00 -1.03 0.00 0.00 55.69 55.57 2d7n s MET 30 Cb -0.18 -2.36 0.79 0.00 -1.53 0.00 0.00 34.83 31.55 2d7n s MET 30 CO -0.07 0.09 1.58 -0.35 -2.03 0.00 0.00 175.02 174.24 2d7n n PRO 31 N -0.51 0.09 -0.19 3.16 -0.04 -1.26 -3.00 135.00 133.25 2d7n n PRO 31 Ca 0.04 0.34 -0.08 0.00 -0.04 0.00 0.00 63.50 63.76 2d7n n PRO 31 Cb 0.53 -1.68 0.02 0.00 -0.04 0.00 0.00 33.50 32.33 2d7n n PRO 31 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2d7n h SER 32 N 0.00 0.80 0.00 3.54 0.87 -1.93 -3.46 113.55 113.37 2d7n h SER 32 Ca 0.00 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.34 2d7n h SER 32 Cb 0.30 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 2d7n h SER 32 CO 0.00 0.82 0.00 0.61 -0.53 0.00 0.00 176.83 177.73 2d7n n GLY 33 N -0.65 0.64 2.41 5.77 0.00 -1.16 -5.16 105.19 107.03 2d7n n GLY 33 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 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 0.43 -4.13 1.61 5.02 -1.25 -5.06 118.16 114.78 2d7n n LYS 34 Ca 0.00 -2.18 -0.15 0.00 -2.02 0.00 0.00 58.31 53.96 2d7n n LYS 34 Cb 0.00 1.97 -0.14 0.00 -0.02 0.00 0.00 35.03 36.85 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 -2.81 0.43 -0.05 -0.18 -4.23 -1.26 -2.22 115.64 105.31 2d7n s THR 35 Ca 0.24 -0.43 0.02 0.00 -1.18 0.00 0.00 61.69 60.34 2d7n s THR 35 Cb 0.00 -0.40 0.02 0.00 1.34 0.00 0.00 72.50 73.45 2d7n s THR 35 CO 0.17 -0.01 -0.09 0.00 -0.54 0.00 0.00 174.62 174.15 2d7n s ALA 36 N -0.43 0.99 -0.17 3.99 0.00 -0.09 -4.98 121.76 121.06 2d7n s ALA 36 Ca -0.01 -0.25 -0.29 0.00 0.00 0.00 0.00 51.96 51.41 2d7n s ALA 36 Cb -0.04 -0.49 -0.02 0.00 0.00 0.00 0.00 23.12 22.57 2d7n s ALA 36 CO -0.00 0.07 1.33 0.50 0.00 0.00 0.00 175.76 177.65 2d7n s ARG 37 N 0.74 4.18 0.00 0.00 3.52 -1.26 -0.82 118.95 125.31 2d7n s ARG 37 Ca -0.13 1.68 0.00 0.00 -0.13 0.00 0.00 55.73 57.15 2d7n s ARG 37 Cb -0.15 -3.81 0.00 0.00 -1.56 0.00 0.00 34.95 29.43 2d7n s ARG 37 CO 0.02 -0.79 0.00 -0.35 -0.81 0.00 0.00 175.30 173.37 2d7n n PRO 38 N 6.79 0.24 -3.95 5.12 -0.04 -1.26 -4.93 135.00 136.97 2d7n n PRO 38 Ca 0.15 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.44 2d7n n PRO 38 Cb 0.45 0.00 -0.16 0.00 -0.04 0.00 0.00 33.50 33.75 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 0.39 -0.14 3.54 0.01 -0.05 -4.99 114.94 112.18 2d7n s ASN 39 Ca 0.00 -0.03 0.01 0.00 -0.71 0.00 0.00 52.86 52.13 2d7n s ASN 39 Cb 0.00 -0.18 0.02 0.00 0.41 0.00 0.00 41.25 41.49 2d7n s ASN 39 CO 0.00 -0.07 -0.18 -0.63 -1.51 0.00 0.00 177.10 174.71 2d7n s ILE 40 N 0.79 1.77 -0.66 0.60 1.01 -1.26 -0.22 121.20 123.23 2d7n s ILE 40 Ca -0.08 -0.78 -0.12 0.00 0.00 0.00 0.00 60.65 59.67 2d7n s ILE 40 Cb -0.11 -1.61 0.17 0.00 0.01 0.00 0.00 42.46 40.92 2d7n s ILE 40 CO -0.01 0.49 0.57 -0.89 0.00 0.00 0.00 174.94 175.10 2d7n s THR 41 N 1.14 4.94 0.01 2.92 2.01 -0.10 -4.99 115.64 121.58 2d7n s THR 41 Ca -0.01 -2.18 -0.30 0.00 0.31 0.00 0.00 61.69 59.51 2d7n s THR 41 Cb -0.14 -4.14 -0.08 0.00 0.01 0.00 0.00 72.50 68.15 2d7n s THR 41 CO -0.06 -0.92 1.97 -0.62 -0.69 0.00 0.00 174.62 174.29 2d7n s ASP 42 N 2.37 6.39 0.12 3.53 2.15 -1.26 -3.24 116.67 126.74 2d7n s ASP 42 Ca 0.12 2.59 0.17 0.00 0.43 0.00 0.00 52.55 55.87 2d7n s ASP 42 Cb -0.20 -2.53 -0.08 0.00 -0.30 0.00 0.00 42.92 39.82 2d7n s ASP 42 CO -0.04 -1.11 0.97 0.78 -0.17 0.00 0.00 175.17 175.60 2d7n h ASN 43 N 10.84 0.00 -2.53 -0.34 2.35 -1.95 -3.48 115.58 120.48 2d7n h ASN 43 Ca -0.48 0.00 -0.42 0.00 -0.55 0.00 0.00 56.30 54.85 2d7n h ASN 43 Cb 1.23 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.55 2d7n h ASN 43 CO 0.94 0.47 -0.50 0.29 -1.65 0.00 0.00 177.43 176.98 2d7n n LYS 44 N -2.91 -1.64 -0.00 0.81 4.76 -1.26 -4.81 118.16 113.11 2d7n n LYS 44 Ca -0.06 1.06 0.01 0.00 -2.87 0.00 0.00 58.31 56.45 2d7n n LYS 44 Cb 0.77 -5.66 -0.02 0.00 -1.84 0.00 0.00 35.03 28.29 2d7n n LYS 44 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2d7n n ASP 45 N -1.85 4.00 0.00 4.39 8.00 -1.26 -5.00 116.55 124.83 2d7n n ASP 45 Ca -0.24 -0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.21 2d7n n ASP 45 Cb 0.69 1.10 0.00 0.00 -0.02 0.00 0.00 41.12 42.89 2d7n n ASP 45 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2d7n n GLY 46 N 2.23 0.68 3.49 0.44 0.00 -1.26 -5.04 105.19 105.73 2d7n n GLY 46 Ca -0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 0.00 0.98 -0.01 2.61 -4.23 -1.25 -1.96 115.64 111.79 2d7n s THR 47 Ca 0.00 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.53 2d7n s THR 47 Cb 0.00 -2.60 -0.00 0.00 1.34 0.00 0.00 72.50 71.24 2d7n s THR 47 CO 0.00 0.00 -0.06 0.27 -0.54 0.00 0.00 174.62 174.29 2d7n s ILE 48 N -3.24 0.45 -0.22 2.99 -4.36 -0.36 -3.81 121.20 112.66 2d7n s ILE 48 Ca 0.30 -0.24 -0.07 0.00 -0.26 0.00 0.00 60.65 60.38 2d7n s ILE 48 Cb 0.06 -0.39 -0.03 0.00 1.25 0.00 0.00 42.46 43.35 2d7n s ILE 48 CO 0.14 0.13 0.07 -0.89 0.24 0.00 0.00 174.94 174.63 2d7n s THR 49 N -0.10 4.50 -0.15 8.37 2.01 -1.20 -1.04 115.64 128.03 2d7n s THR 49 Ca 0.02 -0.12 -0.06 0.00 0.31 0.00 0.00 61.69 61.84 2d7n s THR 49 Cb -0.03 -3.07 -0.04 0.00 0.01 0.00 0.00 72.50 69.37 2d7n s THR 49 CO -0.00 0.39 0.05 -0.69 -0.69 0.00 0.00 174.62 173.68 2d7n s VAL 50 N 1.08 4.71 -0.08 3.82 1.01 0.52 -0.92 120.40 130.54 2d7n s VAL 50 Ca 0.04 -0.07 -0.01 0.00 0.00 0.00 0.00 61.98 61.94 2d7n s VAL 50 Cb -0.14 -3.08 0.03 0.00 0.00 0.00 0.00 36.38 33.18 2d7n s VAL 50 CO 0.03 0.51 -0.03 -0.13 0.00 0.00 0.00 175.10 175.48 2d7n s ARG 51 N -0.04 0.98 0.02 2.72 0.52 0.69 -2.41 118.95 121.44 2d7n s ARG 51 Ca 0.06 -0.06 0.01 0.00 -0.52 0.00 0.00 55.73 55.22 2d7n s ARG 51 Cb -0.12 -1.17 -0.02 0.00 0.52 0.00 0.00 34.95 34.16 2d7n s ARG 51 CO 0.01 -0.25 -0.04 -0.47 0.02 0.00 0.00 175.30 174.57 2d7n s TYR 52 N 1.69 0.38 -0.44 -0.53 5.04 -1.04 -0.88 117.35 121.58 2d7n s TYR 52 Ca 0.02 -0.39 0.02 0.00 -2.44 0.00 0.00 57.07 54.28 2d7n s TYR 52 Cb -0.13 -0.25 0.12 0.00 0.35 0.00 0.00 41.96 42.05 2d7n s TYR 52 CO -0.05 -0.11 0.19 0.00 -1.34 0.00 0.00 175.55 174.24 2d7n s ALA 53 N -1.07 3.15 0.01 3.97 0.00 -1.26 -1.01 121.76 125.56 2d7n s ALA 53 Ca -0.10 -2.85 -0.30 0.00 0.00 0.00 0.00 51.96 48.71 2d7n s ALA 53 Cb -0.08 -2.19 -0.06 0.00 0.00 0.00 0.00 23.12 20.80 2d7n s ALA 53 CO -0.00 -1.86 1.44 -1.25 0.00 0.00 0.00 175.76 174.09 2d7n s PRO 54 N 0.45 4.27 0.26 0.00 0.04 -1.26 -4.91 135.00 133.85 2d7n s PRO 54 Ca 0.13 2.02 0.23 0.00 0.04 0.00 0.00 61.00 63.42 2d7n s PRO 54 Cb -0.22 -3.58 0.14 0.00 0.04 0.00 0.00 34.50 30.88 2d7n s PRO 54 CO -0.04 -0.60 1.24 1.15 0.04 0.00 0.00 177.00 178.78 2d7n h THR 55 N 4.91 0.00 -3.63 1.26 2.02 -1.95 -3.42 112.91 112.10 2d7n h THR 55 Ca -0.39 -0.95 -0.34 0.00 0.77 0.00 0.00 66.41 65.51 2d7n h THR 55 Cb 1.18 1.60 -0.17 0.00 -1.74 0.00 0.00 68.15 69.02 2d7n h THR 55 CO 0.91 0.00 -0.73 -1.61 0.37 0.00 0.00 175.52 174.46 2d7n s GLU 56 N -3.30 0.93 0.28 6.66 8.01 -1.26 -4.87 118.70 125.15 2d7n s GLU 56 Ca 0.02 -1.24 -0.11 0.00 0.01 0.00 0.00 54.97 53.65 2d7n s GLU 56 Cb 0.09 -0.61 -0.08 0.00 -4.31 0.00 0.00 34.13 29.22 2d7n s GLU 56 CO 0.75 0.09 0.63 -1.59 0.01 0.00 0.00 175.26 175.15 2d7n s LYS 57 N -3.00 3.85 0.00 1.61 -2.85 -1.26 -4.85 119.74 113.24 2d7n s LYS 57 Ca 0.09 0.39 0.00 0.00 -1.00 0.00 0.00 55.97 55.45 2d7n s LYS 57 Cb -0.02 -2.56 0.00 0.00 -2.06 0.00 0.00 37.83 33.20 2d7n s LYS 57 CO 0.01 0.23 0.00 0.41 0.10 0.00 0.00 175.35 176.09 2d7n n GLY 58 N -0.38 1.57 3.67 0.59 0.00 -1.13 -4.90 105.19 104.61 2d7n n GLY 58 Ca 0.01 -2.04 -0.42 0.00 0.00 0.00 0.00 46.02 43.57 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 4.26 0.25 0.99 2.96 -1.26 -2.53 118.68 123.35 2d7n s LEU 59 Ca 0.00 1.94 0.09 0.00 -0.22 0.00 0.00 54.13 55.94 2d7n s LEU 59 Cb 0.00 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.10 2d7n s LEU 59 CO 0.00 -0.77 0.05 -1.00 -1.32 0.00 0.00 176.35 173.31 2d7n s HIS 60 N 3.18 2.82 -0.18 5.38 3.76 -1.05 -4.44 115.29 124.76 2d7n s HIS 60 Ca 0.61 -0.18 -0.00 0.00 -0.15 0.00 0.00 55.06 55.34 2d7n s HIS 60 Cb -0.27 -1.27 0.01 0.00 1.11 0.00 0.00 32.58 32.16 2d7n s HIS 60 CO 0.22 0.58 -0.16 -1.14 -0.85 0.00 0.00 174.74 173.40 2d7n s GLN 61 N -3.62 3.12 -0.21 1.40 0.74 -1.12 -3.54 119.66 116.43 2d7n s GLN 61 Ca 0.31 -0.77 0.00 0.00 0.05 0.00 0.00 55.36 54.95 2d7n s GLN 61 Cb -0.07 -2.67 0.02 0.00 1.10 0.00 0.00 33.01 31.39 2d7n s GLN 61 CO 0.21 -0.15 -0.14 1.41 -0.55 0.00 0.00 175.29 176.07 2d7n s MET 62 N 1.20 2.91 -0.25 1.67 -2.45 -1.04 -1.55 119.30 119.79 2d7n s MET 62 Ca 0.02 -0.90 0.01 0.00 -1.25 0.00 0.00 55.69 53.57 2d7n s MET 62 Cb -0.14 -2.75 0.04 0.00 1.25 0.00 0.00 34.83 33.23 2d7n s MET 62 CO -0.07 -0.30 -0.10 0.20 1.05 0.00 0.00 175.02 175.81 2d7n s GLY 63 N 1.30 1.62 -0.06 2.11 0.00 -1.01 -0.81 107.32 110.47 2d7n s GLY 63 Ca 0.02 -1.61 -0.03 0.00 0.00 0.00 0.00 44.72 43.10 2d7n s GLY 63 CO -0.09 0.55 0.11 -0.42 0.00 0.00 0.00 173.10 173.25 2d7n s ILE 64 N 1.21 5.07 0.17 0.90 -1.09 -1.26 -2.46 121.20 123.74 2d7n s ILE 64 Ca -0.04 -0.11 0.08 0.00 -2.23 0.00 0.00 60.65 58.35 2d7n s ILE 64 Cb -0.18 -3.26 -0.04 0.00 -1.58 0.00 0.00 42.46 37.40 2d7n s ILE 64 CO -0.06 0.49 -0.16 -0.54 -1.23 0.00 0.00 174.94 173.44 2d7n s LYS 65 N -1.37 1.25 -0.24 2.79 -0.14 0.59 -3.19 119.74 119.43 2d7n s LYS 65 Ca 0.19 -1.44 -0.04 0.00 -1.36 0.00 0.00 55.97 53.33 2d7n s LYS 65 Cb -0.12 -1.19 0.08 0.00 -1.68 0.00 0.00 37.83 34.92 2d7n s LYS 65 CO 0.09 0.23 0.09 -0.47 -0.76 0.00 0.00 175.35 174.53 2d7n s TYR 66 N -2.36 0.65 -1.18 3.18 5.04 -0.15 -1.80 117.35 120.74 2d7n s TYR 66 Ca 0.17 -0.84 -0.00 0.00 -2.44 0.00 0.00 57.07 53.95 2d7n s TYR 66 Cb -0.04 -0.99 0.00 0.00 0.35 0.00 0.00 41.96 41.28 2d7n s TYR 66 CO 0.06 -0.70 0.01 -3.47 -1.34 0.00 0.00 175.55 170.11 2d7n n ASP 67 N 5.15 -4.24 -0.51 4.32 2.03 -0.25 -1.93 116.55 121.12 2d7n n ASP 67 Ca -0.06 0.15 0.00 0.00 0.52 0.00 0.00 54.79 55.40 2d7n n ASP 67 Cb 0.45 -3.59 0.00 0.00 -0.72 0.00 0.00 41.12 37.27 2d7n n ASP 67 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2d7n n GLY 68 N -0.85 0.69 3.57 0.27 0.00 -1.26 -4.99 105.19 102.62 2d7n n GLY 68 Ca -0.16 -0.37 -0.03 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.46 -0.94 -0.69 1.61 2.47 -0.81 -5.09 114.94 109.03 2d7n s ASN 69 Ca 0.00 1.44 -0.25 0.00 0.42 0.00 0.00 52.86 54.47 2d7n s ASN 69 Cb 0.00 2.02 -0.13 0.00 -1.45 0.00 0.00 41.25 41.69 2d7n s ASN 69 CO 0.00 -0.22 2.43 1.41 -3.72 0.00 0.00 177.10 176.99 2d7n n HIS 70 N 5.33 1.14 -1.20 0.43 8.25 -1.26 -0.98 115.22 126.93 2d7n n HIS 70 Ca -0.12 0.08 -0.38 0.00 -0.26 0.00 0.00 57.72 57.04 2d7n n HIS 70 Cb 0.50 -2.45 0.02 0.00 1.12 0.00 0.00 29.99 29.18 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 8.07 0.09 -2.04 1.59 -5.35 -1.19 -4.72 119.36 115.81 2d7n n ILE 71 Ca 0.46 -0.50 -0.31 0.00 -0.27 0.00 0.00 62.75 62.13 2d7n n ILE 71 Cb 0.43 -0.03 -0.04 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 -1.29 2.58 0.00 6.28 0.04 -1.26 -2.44 135.00 138.91 2d7n s PRO 72 Ca 0.54 0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.61 2d7n s PRO 72 Cb -0.42 -4.82 0.00 0.00 0.04 0.00 0.00 34.50 29.30 2d7n s PRO 72 CO 0.69 -3.15 0.00 0.41 0.04 0.00 0.00 177.00 175.00 2d7n n GLY 73 N 6.44 -0.66 3.19 0.56 0.00 -1.26 -4.89 105.19 108.57 2d7n n GLY 73 Ca 0.33 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.19 2d7n n GLY 73 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d7n s SER 74 N -0.09 1.63 1.11 1.61 0.15 -1.02 -4.27 113.70 112.82 2d7n s SER 74 Ca 0.00 -0.78 -0.16 0.00 0.70 0.00 0.00 55.95 55.71 2d7n s SER 74 Cb 0.00 -0.02 0.24 0.00 -1.71 0.00 0.00 66.02 64.53 2d7n s SER 74 CO 0.00 -0.20 1.10 -2.16 1.20 0.00 0.00 173.24 173.18 2d7n s PRO 75 N -2.59 -0.45 0.11 5.44 0.04 -1.26 -4.73 135.00 131.57 2d7n s PRO 75 Ca 0.05 0.21 0.03 0.00 0.04 0.00 0.00 61.00 61.33 2d7n s PRO 75 Cb -0.05 -1.66 -0.04 0.00 0.04 0.00 0.00 34.50 32.79 2d7n s PRO 75 CO 0.01 -3.25 -0.08 -0.48 0.04 0.00 0.00 177.00 173.24 2d7n s LEU 76 N -6.72 2.50 -0.12 -3.56 0.05 0.01 -4.98 118.68 105.86 2d7n s LEU 76 Ca 0.68 -0.98 0.02 0.00 0.05 0.00 0.00 54.13 53.91 2d7n s LEU 76 Cb -0.14 -0.18 -0.00 0.00 -2.05 0.00 0.00 46.19 43.81 2d7n s LEU 76 CO 0.57 -0.40 -0.20 -1.10 -0.55 0.00 0.00 176.35 174.67 2d7n s GLN 77 N -3.65 3.15 -0.06 1.48 -0.21 -1.26 -2.50 119.66 116.61 2d7n s GLN 77 Ca 0.12 -0.81 -0.02 0.00 0.02 0.00 0.00 55.36 54.67 2d7n s GLN 77 Cb 0.03 -2.45 0.04 0.00 1.00 0.00 0.00 33.01 31.63 2d7n s GLN 77 CO -0.03 0.13 0.12 -0.59 -2.12 0.00 0.00 175.29 172.81 2d7n s PHE 78 N 0.50 -0.12 0.16 0.91 -0.71 -1.23 -5.02 117.98 112.46 2d7n s PHE 78 Ca -0.13 0.42 -0.17 0.00 -1.04 0.00 0.00 56.93 56.01 2d7n s PHE 78 Cb -0.17 -0.14 -0.07 0.00 -1.21 0.00 0.00 43.02 41.43 2d7n s PHE 78 CO 0.05 -0.16 0.61 -0.47 -1.34 0.00 0.00 175.22 173.91 2d7n s TYR 79 N 1.27 3.67 -0.07 3.49 5.04 -1.26 -2.53 117.35 126.96 2d7n s TYR 79 Ca -0.08 1.22 0.01 0.00 -2.44 0.00 0.00 57.07 55.79 2d7n s TYR 79 Cb -0.12 -2.49 -0.03 0.00 0.35 0.00 0.00 41.96 39.68 2d7n s TYR 79 CO -0.05 0.44 -0.08 0.08 -1.34 0.00 0.00 175.55 174.59 2d7n s VAL 80 N -1.40 3.59 0.26 3.14 1.01 -1.05 -4.94 120.40 121.01 2d7n s VAL 80 Ca 0.37 -0.52 0.02 0.00 0.00 0.00 0.00 61.98 61.86 2d7n s VAL 80 Cb -0.17 -2.46 -0.05 0.00 0.00 0.00 0.00 36.38 33.70 2d7n s VAL 80 CO 0.20 0.59 0.06 1.51 0.00 0.00 0.00 175.10 177.46 2d7n s ASP 81 N -0.74 1.59 0.49 3.32 -4.77 -1.26 -2.83 116.67 112.47 2d7n s ASP 81 Ca 0.11 -1.33 -0.22 0.00 -3.30 0.00 0.00 52.55 47.81 2d7n s ASP 81 Cb -0.11 0.07 -0.06 0.00 -1.09 0.00 0.00 42.92 41.73 2d7n s ASP 81 CO 0.01 -0.64 1.23 0.00 0.70 0.00 0.00 175.17 176.48 2d7n s ALA 82 N -3.57 2.92 -0.74 2.11 0.00 -1.26 -3.49 121.76 117.73 2d7n s ALA 82 Ca 0.34 1.07 -0.26 0.00 0.00 0.00 0.00 51.96 53.12 2d7n s ALA 82 Cb 0.07 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.73 2d7n s ALA 82 CO 0.12 -0.91 1.75 0.42 0.00 0.00 0.00 175.76 177.14 2d7n s ILE 83 N -1.46 3.49 -0.35 0.00 1.01 -0.69 -4.77 121.20 118.44 2d7n s ILE 83 Ca 0.66 0.01 -0.02 0.00 0.00 0.00 0.00 60.65 61.31 2d7n s ILE 83 Cb -0.33 -4.22 0.16 0.00 0.01 0.00 0.00 42.46 38.09 2d7n s ILE 83 CO 0.39 -1.17 2.26 -3.20 0.00 0.00 0.00 174.94 173.22 2d7n n ASN 84 N 12.15 6.45 -3.78 3.58 2.85 -1.26 -4.80 115.26 130.45 2d7n n ASN 84 Ca 0.23 -3.09 -0.25 0.00 -0.11 0.00 0.00 54.58 51.36 2d7n n ASN 84 Cb 0.50 -1.11 -0.17 0.00 1.24 0.00 0.00 39.78 40.24 2d7n n ASN 84 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 2d7n s SER 85 N 0.26 2.04 0.43 1.20 0.01 -1.26 -5.14 113.70 111.23 2d7n s SER 85 Ca 0.39 -0.32 -0.21 0.00 1.31 0.00 0.00 55.95 57.13 2d7n s SER 85 Cb 0.28 -0.54 -0.11 0.00 0.21 0.00 0.00 66.02 65.87 2d7n s SER 85 CO -0.06 -0.22 0.95 -0.60 0.41 0.00 0.00 173.24 173.72 2d7n s ARG 86 N 1.91 4.22 -0.17 12.44 6.06 -1.26 -5.00 118.95 137.14 2d7n s ARG 86 Ca 0.03 1.10 -0.16 0.00 -2.50 0.00 0.00 55.73 54.21 2d7n s ARG 86 Cb -0.14 -2.19 -0.22 0.00 0.06 0.00 0.00 34.95 32.47 2d7n s ARG 86 CO -0.06 -0.03 0.30 0.45 -2.50 0.00 0.00 175.30 173.45 2d7n h HIS 87 N 1.89 0.20 -3.98 5.12 3.86 -2.00 -3.49 115.15 116.75 2d7n h HIS 87 Ca -0.49 -0.15 -0.23 0.00 -1.16 0.00 0.00 60.37 58.34 2d7n h HIS 87 Cb 1.18 -0.01 0.09 0.00 1.06 0.00 0.00 27.41 29.73 2d7n h HIS 87 CO 0.62 1.59 -0.42 0.45 0.86 0.00 0.00 177.93 181.03 2d7n n SER 88 N -4.07 -4.11 0.00 2.45 2.88 -1.26 -4.79 113.62 104.72 2d7n n SER 88 Ca -0.31 -0.34 0.00 0.00 -1.33 0.00 0.00 58.87 56.89 2d7n n SER 88 Cb 0.82 -3.25 0.00 0.00 -0.75 0.00 0.00 64.21 61.03 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 -1.35 -1.67 3.77 0.46 0.00 -1.26 -4.98 105.19 100.17 2d7n n GLY 89 Ca -0.03 -1.86 -0.34 0.00 0.00 0.00 0.00 46.02 43.79 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 0.00 2.98 0.32 1.61 0.04 -1.26 -5.07 135.00 133.62 2d7n s PRO 90 Ca 0.00 1.46 0.04 0.00 0.04 0.00 0.00 61.00 62.54 2d7n s PRO 90 Cb 0.00 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 32.54 2d7n s PRO 90 CO 0.00 -1.12 0.19 -1.12 0.04 0.00 0.00 177.00 174.99 2d7n s SER 91 N -2.33 1.67 -0.01 6.66 0.01 -1.26 -5.15 113.70 113.28 2d7n s SER 91 Ca 0.69 -1.63 0.03 0.00 1.31 0.00 0.00 55.95 56.34 2d7n s SER 91 Cb -0.21 0.47 -0.00 0.00 0.21 0.00 0.00 66.02 66.48 2d7n s SER 91 CO 0.37 -0.95 -0.09 -0.55 0.41 0.00 0.00 173.24 172.43 2d7n s SER 92 N -3.39 1.12 0.00 2.44 0.15 -1.26 -5.27 113.70 107.49 2d7n s SER 92 Ca 0.36 -0.17 0.00 0.00 0.70 0.00 0.00 55.95 56.83 2d7n s SER 92 Cb 0.04 -0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.16 2d7n s SER 92 CO 0.20 0.10 0.13 0.61 1.20 0.00 0.00 173.24 175.48