#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 4.04 -1.62 1.61 0.15 -1.26 -4.79 113.70 111.83 2d7n s SER 2 Ca 0.00 -1.46 -0.15 0.00 0.70 0.00 0.00 55.95 55.04 2d7n s SER 2 Cb 0.00 -1.18 0.12 0.00 -1.71 0.00 0.00 66.02 63.25 2d7n s SER 2 CO 0.00 -0.31 0.82 -1.20 1.20 0.00 0.00 173.24 173.75 2d7n n SER 3 N 4.64 -3.50 -1.99 5.45 7.64 -1.26 -4.95 113.62 119.65 2d7n n SER 3 Ca -0.07 -0.93 0.00 0.00 1.01 0.00 0.00 58.87 58.88 2d7n n SER 3 Cb 0.43 -3.17 0.00 0.00 -1.01 0.00 0.00 64.21 60.46 2d7n n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d7n n GLY 4 N -1.55 2.88 3.76 0.23 0.00 -1.26 -5.09 105.19 104.16 2d7n n GLY 4 Ca 0.03 -2.16 -0.39 0.00 0.00 0.00 0.00 46.02 43.50 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 5.75 -0.60 1.61 0.01 -1.26 -4.99 113.70 113.23 2d7n s SER 5 Ca 0.00 2.68 0.00 0.00 1.31 0.00 0.00 55.95 59.95 2d7n s SER 5 Cb 0.00 -2.63 0.15 0.00 0.21 0.00 0.00 66.02 63.75 2d7n s SER 5 CO 0.00 -1.24 0.38 -0.55 0.41 0.00 0.00 173.24 172.24 2d7n s SER 6 N -0.91 4.84 -0.51 2.44 0.15 -1.26 -5.06 113.70 113.39 2d7n s SER 6 Ca 0.65 -3.01 -0.28 0.00 0.70 0.00 0.00 55.95 54.01 2d7n s SER 6 Cb -0.38 -1.76 0.01 0.00 -1.71 0.00 0.00 66.02 62.19 2d7n s SER 6 CO 0.47 -0.29 1.41 -0.83 1.20 0.00 0.00 173.24 175.20 2d7n s GLY 7 N 0.13 0.97 -0.05 9.45 0.00 -1.26 -4.87 107.32 111.69 2d7n s GLY 7 Ca 0.18 -0.49 0.04 0.00 0.00 0.00 0.00 44.72 44.45 2d7n s GLY 7 CO -0.03 2.78 -0.15 1.08 0.00 0.00 0.00 173.10 176.78 2d7n s LEU 8 N 5.81 1.85 0.46 0.66 1.43 -1.26 0.05 118.68 127.67 2d7n s LEU 8 Ca 0.55 -0.33 -0.25 0.00 -1.03 0.00 0.00 54.13 53.07 2d7n s LEU 8 Cb -0.12 -0.91 -0.08 0.00 0.03 0.00 0.00 46.19 45.11 2d7n s LEU 8 CO 0.28 0.11 1.42 -0.13 0.23 0.00 0.00 176.35 178.26 2d7n s ARG 9 N 0.22 3.65 1.10 1.70 0.52 -1.23 -4.81 118.95 120.10 2d7n s ARG 9 Ca -0.07 2.39 -0.15 0.00 -0.52 0.00 0.00 55.73 57.38 2d7n s ARG 9 Cb -0.13 -2.63 0.24 0.00 0.52 0.00 0.00 34.95 32.96 2d7n s ARG 9 CO 0.03 -0.84 1.10 -1.25 0.02 0.00 0.00 175.30 174.36 2d7n s PRO 10 N -2.48 -0.37 -0.23 3.54 0.04 -1.26 -4.68 135.00 129.55 2d7n s PRO 10 Ca 0.62 0.24 -0.00 0.00 0.04 0.00 0.00 61.00 61.89 2d7n s PRO 10 Cb -0.43 -1.67 0.03 0.00 0.04 0.00 0.00 34.50 32.47 2d7n s PRO 10 CO 0.55 -3.21 -0.11 0.12 0.04 0.00 0.00 177.00 174.40 2d7n s PHE 11 N -2.99 3.01 -0.12 0.56 5.36 -0.13 -4.99 117.98 118.69 2d7n s PHE 11 Ca 0.68 -1.67 -0.01 0.00 -0.96 0.00 0.00 56.93 54.97 2d7n s PHE 11 Cb -0.15 -2.00 0.03 0.00 -0.34 0.00 0.00 43.02 40.56 2d7n s PHE 11 CO 0.57 -0.76 -0.02 0.54 -1.46 0.00 0.00 175.22 174.08 2d7n s ASN 12 N 1.29 2.14 -0.01 6.13 4.22 -1.26 -2.12 114.94 125.34 2d7n s ASN 12 Ca 0.00 -0.34 -0.11 0.00 -2.14 0.00 0.00 52.86 50.27 2d7n s ASN 12 Cb -0.16 -0.65 0.01 0.00 1.28 0.00 0.00 41.25 41.73 2d7n s ASN 12 CO -0.07 -0.19 0.23 -0.22 -2.04 0.00 0.00 177.10 174.81 2d7n s LEU 13 N 1.83 1.18 -0.21 3.54 2.96 -1.11 -4.98 118.68 121.89 2d7n s LEU 13 Ca 0.03 -0.01 0.00 0.00 -0.22 0.00 0.00 54.13 53.94 2d7n s LEU 13 Cb -0.13 0.97 0.02 0.00 0.50 0.00 0.00 46.19 47.55 2d7n s LEU 13 CO -0.07 -0.38 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.74 2d7n s VAL 14 N -1.23 2.39 -0.20 1.68 1.01 -1.26 -0.23 120.40 122.56 2d7n s VAL 14 Ca -0.13 -0.96 -0.09 0.00 0.00 0.00 0.00 61.98 60.80 2d7n s VAL 14 Cb -0.06 -2.10 -0.05 0.00 0.00 0.00 0.00 36.38 34.18 2d7n s VAL 14 CO 0.03 0.41 0.11 -0.63 0.00 0.00 0.00 175.10 175.01 2d7n s ILE 15 N 1.30 5.10 -1.16 2.22 1.01 0.17 -4.91 121.20 124.93 2d7n s ILE 15 Ca 0.03 0.08 -0.23 0.00 0.00 0.00 0.00 60.65 60.53 2d7n s ILE 15 Cb -0.15 -3.33 -0.08 0.00 0.01 0.00 0.00 42.46 38.91 2d7n s ILE 15 CO -0.09 0.42 1.94 -2.16 0.00 0.00 0.00 174.94 175.04 2d7n s PRO 16 N 0.59 2.49 -0.18 2.79 0.04 -1.26 -1.48 135.00 137.99 2d7n s PRO 16 Ca 0.06 -1.08 -0.04 0.00 0.04 0.00 0.00 61.00 59.98 2d7n s PRO 16 Cb -0.12 -5.22 0.09 0.00 0.04 0.00 0.00 34.50 29.28 2d7n s PRO 16 CO 0.01 -3.93 0.24 0.12 0.04 0.00 0.00 177.00 173.47 2d7n s PHE 17 N 10.97 -0.34 0.49 0.56 5.36 -1.04 -4.96 117.98 129.02 2d7n s PHE 17 Ca 0.69 0.44 -0.24 0.00 -0.96 0.00 0.00 56.93 56.86 2d7n s PHE 17 Cb -0.01 -0.26 -0.07 0.00 -0.34 0.00 0.00 43.02 42.33 2d7n s PHE 17 CO 0.12 -0.54 1.38 0.00 -1.46 0.00 0.00 175.22 174.72 2d7n n ALA 18 N 5.33 1.73 -3.37 11.12 0.00 -0.94 -3.89 120.51 130.49 2d7n n ALA 18 Ca -0.05 0.20 -0.11 0.00 0.00 0.00 0.00 53.44 53.47 2d7n n ALA 18 Cb 0.50 -2.36 -0.09 0.00 0.00 0.00 0.00 19.45 17.50 2d7n n ALA 18 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2d7n s VAL 19 N -1.24 -0.55 0.00 0.00 1.01 -1.26 -4.96 120.40 113.40 2d7n s VAL 19 Ca 0.66 -0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.52 2d7n s VAL 19 Cb -0.44 -0.82 0.00 0.00 0.00 0.00 0.00 36.38 35.12 2d7n s VAL 19 CO 0.54 -0.17 0.00 0.00 0.00 0.00 0.00 175.10 175.47 2d7n n GLN 20 N 5.35 0.00 -2.73 2.72 6.02 -1.26 -4.19 117.38 123.29 2d7n n GLN 20 Ca -0.03 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.61 2d7n n GLN 20 Cb 0.50 0.00 -0.01 0.00 1.02 0.00 0.00 30.24 31.75 2d7n n GLN 20 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2d7n n LYS 21 N -2.27 4.31 -3.77 -1.09 5.02 -1.26 -4.99 118.16 114.11 2d7n n LYS 21 Ca 0.00 -4.70 -0.13 0.00 -2.02 0.00 0.00 58.31 51.46 2d7n n LYS 21 Cb 0.00 -2.35 -0.09 0.00 -0.02 0.00 0.00 35.03 32.56 2d7n n LYS 21 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2d7n s GLY 22 N -2.33 -0.17 -0.29 0.72 0.00 -1.26 -5.06 107.32 98.93 2d7n s GLY 22 Ca 0.44 0.49 -0.26 0.00 0.00 0.00 0.00 44.72 45.39 2d7n s GLY 22 CO -0.15 0.31 0.90 1.85 0.00 0.00 0.00 173.10 176.01 2d7n s GLU 23 N -0.86 4.07 -0.42 2.90 2.12 -1.26 -4.85 118.70 120.40 2d7n s GLU 23 Ca -0.09 0.88 -0.07 0.00 0.36 0.00 0.00 54.97 56.04 2d7n s GLU 23 Cb -0.04 -3.70 0.09 0.00 0.26 0.00 0.00 34.13 30.73 2d7n s GLU 23 CO 0.03 -0.70 0.24 -1.17 -0.54 0.00 0.00 175.26 173.13 2d7n s LEU 24 N 3.14 5.18 0.31 2.70 2.96 -1.26 -0.26 118.68 131.45 2d7n s LEU 24 Ca 0.38 -1.67 0.11 0.00 -0.22 0.00 0.00 54.13 52.72 2d7n s LEU 24 Cb -0.14 -1.94 -0.06 0.00 0.50 0.00 0.00 46.19 44.56 2d7n s LEU 24 CO 0.11 -0.55 -0.15 0.42 -1.32 0.00 0.00 176.35 174.87 2d7n s THR 25 N 1.34 2.42 0.36 3.68 -4.23 -0.63 -4.94 115.64 113.64 2d7n s THR 25 Ca 0.04 -2.30 -0.08 0.00 -1.18 0.00 0.00 61.69 58.16 2d7n s THR 25 Cb -0.23 -2.46 0.03 0.00 1.34 0.00 0.00 72.50 71.18 2d7n s THR 25 CO 0.00 -0.32 0.62 0.61 -0.54 0.00 0.00 174.62 174.99 2d7n n GLY 26 N -0.70 1.57 3.50 3.99 0.00 -1.26 0.48 105.19 112.77 2d7n n GLY 26 Ca -0.05 -1.43 -0.16 0.00 0.00 0.00 0.00 46.02 44.38 2d7n n GLY 26 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2d7n s GLU 27 N -2.43 1.09 0.01 1.61 2.12 -0.93 -4.46 118.70 115.71 2d7n s GLU 27 Ca 0.22 0.08 0.06 0.00 0.36 0.00 0.00 54.97 55.70 2d7n s GLU 27 Cb -0.03 0.51 -0.02 0.00 0.26 0.00 0.00 34.13 34.85 2d7n s GLU 27 CO 0.16 -0.38 -0.20 0.08 -0.54 0.00 0.00 175.26 174.39 2d7n s VAL 28 N -1.79 1.57 -0.19 3.70 1.01 0.87 -1.61 120.40 123.97 2d7n s VAL 28 Ca -0.08 -0.97 -0.01 0.00 0.00 0.00 0.00 61.98 60.92 2d7n s VAL 28 Cb -0.00 -1.33 0.01 0.00 0.00 0.00 0.00 36.38 35.05 2d7n s VAL 28 CO 0.04 0.33 -0.14 -0.60 0.00 0.00 0.00 175.10 174.74 2d7n s ARG 29 N -0.75 3.18 0.14 2.72 6.06 -0.57 -0.92 118.95 128.81 2d7n s ARG 29 Ca 0.07 -0.74 -0.02 0.00 -2.50 0.00 0.00 55.73 52.54 2d7n s ARG 29 Cb -0.08 -2.73 -0.05 0.00 0.06 0.00 0.00 34.95 32.15 2d7n s ARG 29 CO 0.00 -0.15 0.33 0.00 -2.50 0.00 0.00 175.30 172.99 2d7n s MET 30 N 1.24 3.53 0.35 5.12 0.23 -0.97 -2.89 119.30 125.90 2d7n s MET 30 Ca 0.03 -0.28 0.27 0.00 -1.03 0.00 0.00 55.69 54.67 2d7n s MET 30 Cb -0.14 -2.90 1.11 0.00 -1.53 0.00 0.00 34.83 31.37 2d7n s MET 30 CO -0.07 0.49 1.80 -1.00 -2.03 0.00 0.00 175.02 174.21 2d7n h PRO 31 N 2.61 0.00 -0.98 3.16 0.13 -1.87 -3.08 132.00 131.97 2d7n h PRO 31 Ca -0.46 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.70 2d7n h PRO 31 Cb 1.17 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.25 2d7n h PRO 31 CO 0.72 0.00 0.64 1.03 -0.23 0.00 0.00 178.00 180.16 2d7n h SER 32 N 0.00 1.08 0.00 1.44 0.87 -1.94 -3.46 113.55 111.54 2d7n h SER 32 Ca 0.00 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 2d7n h SER 32 Cb 0.40 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 2d7n h SER 32 CO 0.00 0.74 0.00 0.61 -0.53 0.00 0.00 176.83 177.65 2d7n n GLY 33 N -1.38 1.10 1.95 5.77 0.00 -1.16 -5.15 105.19 106.31 2d7n n GLY 33 Ca 0.13 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.04 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 0.30 -3.98 1.61 5.02 -1.25 -5.07 118.16 114.80 2d7n n LYS 34 Ca 0.00 -1.88 -0.12 0.00 -2.02 0.00 0.00 58.31 54.29 2d7n n LYS 34 Cb 0.00 1.63 -0.13 0.00 -0.02 0.00 0.00 35.03 36.51 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 -2.76 0.17 0.21 -0.18 -4.23 -1.26 -2.30 115.64 105.29 2d7n s THR 35 Ca 0.22 -0.48 0.05 0.00 -1.18 0.00 0.00 61.69 60.30 2d7n s THR 35 Cb 0.01 -0.22 -0.05 0.00 1.34 0.00 0.00 72.50 73.57 2d7n s THR 35 CO 0.15 -0.20 -0.07 0.00 -0.54 0.00 0.00 174.62 173.96 2d7n s ALA 36 N -0.69 1.88 -0.27 3.99 0.00 -0.09 -4.99 121.76 121.59 2d7n s ALA 36 Ca -0.06 -1.70 -0.09 0.00 0.00 0.00 0.00 51.96 50.10 2d7n s ALA 36 Cb -0.05 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 2d7n s ALA 36 CO -0.00 -0.10 0.13 0.50 0.00 0.00 0.00 175.76 176.29 2d7n s ARG 37 N -3.75 3.76 0.00 0.00 3.52 -1.26 -0.09 118.95 121.13 2d7n s ARG 37 Ca 0.24 -0.42 0.00 0.00 -0.13 0.00 0.00 55.73 55.42 2d7n s ARG 37 Cb 0.03 -3.50 0.00 0.00 -1.56 0.00 0.00 34.95 29.92 2d7n s ARG 37 CO 0.07 -0.20 0.00 -0.35 -0.81 0.00 0.00 175.30 174.00 2d7n n PRO 38 N 4.99 0.23 -3.99 5.12 -0.04 -1.26 -4.95 135.00 135.10 2d7n n PRO 38 Ca -0.15 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.19 2d7n n PRO 38 Cb 0.51 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.84 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 0.31 -0.06 3.54 0.01 -0.02 -4.97 114.94 112.25 2d7n s ASN 39 Ca 0.00 -0.19 0.00 0.00 -0.71 0.00 0.00 52.86 51.96 2d7n s ASN 39 Cb 0.00 0.01 0.02 0.00 0.41 0.00 0.00 41.25 41.69 2d7n s ASN 39 CO 0.00 -0.07 -0.03 -0.63 -1.51 0.00 0.00 177.10 174.86 2d7n s ILE 40 N -0.50 0.52 -0.64 0.60 1.01 -1.26 -0.21 121.20 120.72 2d7n s ILE 40 Ca -0.04 -0.06 -0.15 0.00 0.00 0.00 0.00 60.65 60.39 2d7n s ILE 40 Cb -0.04 -0.59 0.16 0.00 0.01 0.00 0.00 42.46 42.01 2d7n s ILE 40 CO -0.00 0.24 0.60 -0.89 0.00 0.00 0.00 174.94 174.89 2d7n s THR 41 N 1.27 5.34 -0.03 2.92 2.01 -0.58 -4.99 115.64 121.59 2d7n s THR 41 Ca -0.05 -1.83 -0.30 0.00 0.31 0.00 0.00 61.69 59.81 2d7n s THR 41 Cb -0.14 -4.39 -0.09 0.00 0.01 0.00 0.00 72.50 67.90 2d7n s THR 41 CO -0.02 -0.93 2.01 -0.67 -0.69 0.00 0.00 174.62 174.32 2d7n n ASP 42 N 4.82 3.89 0.00 3.53 -0.08 -1.26 -3.59 116.55 123.86 2d7n n ASP 42 Ca -0.04 0.79 -0.02 0.00 -1.51 0.00 0.00 54.79 54.01 2d7n n ASP 42 Cb 0.42 -1.50 -0.11 0.00 2.34 0.00 0.00 41.12 42.27 2d7n n ASP 42 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2d7n n ASN 43 N 8.14 0.65 -2.39 1.67 3.02 -1.25 -4.97 115.26 120.13 2d7n n ASN 43 Ca 0.22 0.29 -0.19 0.00 -0.03 0.00 0.00 54.58 54.87 2d7n n ASN 43 Cb 0.39 0.43 -0.01 0.00 -0.61 0.00 0.00 39.78 39.99 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 -2.83 -1.78 0.00 3.52 4.76 -1.26 -4.82 118.16 115.75 2d7n n LYS 44 Ca -0.14 0.94 0.00 0.00 -2.87 0.00 0.00 58.31 56.24 2d7n n LYS 44 Cb 0.89 -5.59 0.00 0.00 -1.84 0.00 0.00 35.03 28.50 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 -1.96 1.01 0.00 4.39 8.00 -1.26 -4.97 116.55 121.76 2d7n n ASP 45 Ca -0.23 -1.03 0.00 0.00 0.71 0.00 0.00 54.79 54.24 2d7n n ASP 45 Cb 0.67 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.77 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 -0.02 1.13 3.32 0.44 0.00 -1.26 -5.03 105.19 103.77 2d7n n GLY 46 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 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 0.61 0.01 2.61 -4.23 -1.25 -2.21 115.64 109.18 2d7n s THR 47 Ca 0.00 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.52 2d7n s THR 47 Cb 0.00 -2.59 -0.01 0.00 1.34 0.00 0.00 72.50 71.24 2d7n s THR 47 CO 0.00 -0.05 -0.03 0.27 -0.54 0.00 0.00 174.62 174.27 2d7n s ILE 48 N -3.72 0.21 -0.08 2.99 -4.36 -0.55 -3.92 121.20 111.78 2d7n s ILE 48 Ca 0.36 -0.45 0.01 0.00 -0.26 0.00 0.00 60.65 60.31 2d7n s ILE 48 Cb 0.08 -0.25 -0.03 0.00 1.25 0.00 0.00 42.46 43.51 2d7n s ILE 48 CO 0.13 -0.16 -0.08 -0.89 0.24 0.00 0.00 174.94 174.18 2d7n s THR 49 N -0.61 3.61 -0.09 8.37 2.01 -1.24 -0.66 115.64 127.04 2d7n s THR 49 Ca -0.05 -0.50 0.01 0.00 0.31 0.00 0.00 61.69 61.45 2d7n s THR 49 Cb -0.05 -2.48 -0.02 0.00 0.01 0.00 0.00 72.50 69.96 2d7n s THR 49 CO -0.00 0.58 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.72 2d7n s VAL 50 N -0.59 3.38 -0.07 3.82 1.01 0.68 -1.53 120.40 127.10 2d7n s VAL 50 Ca 0.09 -0.58 -0.01 0.00 0.00 0.00 0.00 61.98 61.47 2d7n s VAL 50 Cb -0.12 -2.38 0.03 0.00 0.00 0.00 0.00 36.38 33.91 2d7n s VAL 50 CO 0.02 0.57 -0.00 -0.13 0.00 0.00 0.00 175.10 175.55 2d7n s ARG 51 N -0.40 0.63 0.00 2.72 0.52 0.70 -2.74 118.95 120.38 2d7n s ARG 51 Ca 0.05 0.09 0.00 0.00 -0.52 0.00 0.00 55.73 55.35 2d7n s ARG 51 Cb -0.12 -0.95 -0.00 0.00 0.52 0.00 0.00 34.95 34.39 2d7n s ARG 51 CO 0.02 -0.28 -0.01 -0.47 0.02 0.00 0.00 175.30 174.58 2d7n s TYR 52 N 1.85 0.10 -0.38 -0.53 5.04 -0.90 -0.84 117.35 121.70 2d7n s TYR 52 Ca 0.03 -0.11 0.02 0.00 -2.44 0.00 0.00 57.07 54.57 2d7n s TYR 52 Cb -0.12 -0.07 0.11 0.00 0.35 0.00 0.00 41.96 42.22 2d7n s TYR 52 CO -0.05 -0.04 0.11 0.00 -1.34 0.00 0.00 175.55 174.24 2d7n s ALA 53 N -0.29 3.01 0.62 3.97 0.00 -1.26 -0.95 121.76 126.86 2d7n s ALA 53 Ca -0.03 -2.60 -0.16 0.00 0.00 0.00 0.00 51.96 49.17 2d7n s ALA 53 Cb -0.02 -2.13 -0.02 0.00 0.00 0.00 0.00 23.12 20.95 2d7n s ALA 53 CO -0.00 -1.75 1.12 -1.25 0.00 0.00 0.00 175.76 173.88 2d7n s PRO 54 N 0.89 2.98 -0.03 0.00 0.04 -1.26 -4.98 135.00 132.64 2d7n s PRO 54 Ca 0.11 1.46 0.09 0.00 0.04 0.00 0.00 61.00 62.70 2d7n s PRO 54 Cb -0.20 -1.97 -0.14 0.00 0.04 0.00 0.00 34.50 32.23 2d7n s PRO 54 CO -0.06 -1.12 0.17 2.41 0.04 0.00 0.00 177.00 178.44 2d7n n THR 55 N -2.05 0.11 -4.03 1.26 -1.04 -1.26 -4.74 114.28 102.53 2d7n n THR 55 Ca 0.11 -0.25 -0.12 0.00 -2.04 0.00 0.00 64.05 61.75 2d7n n THR 55 Cb 0.52 0.08 -0.11 0.00 -1.82 0.00 0.00 70.33 68.99 2d7n n THR 55 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2d7n s GLU 56 N -2.57 0.43 0.43 -2.82 8.01 -1.26 -4.74 118.70 116.18 2d7n s GLU 56 Ca -0.04 -0.66 -0.23 0.00 0.01 0.00 0.00 54.97 54.05 2d7n s GLU 56 Cb 0.05 -0.15 -0.09 0.00 -4.31 0.00 0.00 34.13 29.64 2d7n s GLU 56 CO 0.39 0.02 1.04 -1.59 0.01 0.00 0.00 175.26 175.13 2d7n s LYS 57 N -1.44 4.04 0.00 1.61 -2.85 -1.26 -4.85 119.74 114.99 2d7n s LYS 57 Ca -0.11 1.45 0.00 0.00 -1.00 0.00 0.00 55.97 56.31 2d7n s LYS 57 Cb -0.09 -2.38 0.00 0.00 -2.06 0.00 0.00 37.83 33.30 2d7n s LYS 57 CO -0.00 -0.24 0.00 0.41 0.10 0.00 0.00 175.35 175.62 2d7n n GLY 58 N 0.12 2.16 3.74 0.59 0.00 -0.72 -4.93 105.19 106.14 2d7n n GLY 58 Ca 0.07 -1.84 -0.41 0.00 0.00 0.00 0.00 46.02 43.84 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 4.46 0.01 0.99 2.96 -1.26 -1.87 118.68 123.96 2d7n s LEU 59 Ca 0.00 2.25 0.05 0.00 -0.22 0.00 0.00 54.13 56.21 2d7n s LEU 59 Cb 0.00 -3.61 -0.02 0.00 0.50 0.00 0.00 46.19 43.06 2d7n s LEU 59 CO 0.00 -0.35 -0.17 -1.00 -1.32 0.00 0.00 176.35 173.52 2d7n s HIS 60 N -0.23 1.50 -0.27 5.38 3.76 -1.12 -4.27 115.29 120.05 2d7n s HIS 60 Ca 0.52 -0.31 -0.07 0.00 -0.15 0.00 0.00 55.06 55.04 2d7n s HIS 60 Cb -0.33 -0.94 -0.02 0.00 1.11 0.00 0.00 32.58 32.40 2d7n s HIS 60 CO 0.38 0.00 0.08 -1.14 -0.85 0.00 0.00 174.74 173.21 2d7n s GLN 61 N -0.64 3.46 -0.19 1.40 0.74 -1.14 -3.36 119.66 119.93 2d7n s GLN 61 Ca 0.06 -0.61 -0.03 0.00 0.05 0.00 0.00 55.36 54.82 2d7n s GLN 61 Cb -0.07 -3.36 -0.02 0.00 1.10 0.00 0.00 33.01 30.66 2d7n s GLN 61 CO 0.00 -0.29 -0.05 1.41 -0.55 0.00 0.00 175.29 175.81 2d7n s MET 62 N 1.58 3.48 -0.22 1.67 -2.45 -0.99 -1.51 119.30 120.86 2d7n s MET 62 Ca 0.05 -0.60 0.01 0.00 -1.25 0.00 0.00 55.69 53.91 2d7n s MET 62 Cb -0.16 -2.93 0.05 0.00 1.25 0.00 0.00 34.83 33.04 2d7n s MET 62 CO 0.03 0.01 -0.11 0.20 1.05 0.00 0.00 175.02 176.20 2d7n s GLY 63 N 0.95 1.40 0.21 2.11 0.00 -0.63 -0.55 107.32 110.81 2d7n s GLY 63 Ca -0.00 -1.39 0.02 0.00 0.00 0.00 0.00 44.72 43.35 2d7n s GLY 63 CO 0.01 0.65 0.36 -0.42 0.00 0.00 0.00 173.10 173.70 2d7n s ILE 64 N 1.30 5.26 0.02 0.90 -1.09 -1.26 -2.19 121.20 124.14 2d7n s ILE 64 Ca -0.03 -0.68 -0.05 0.00 -2.23 0.00 0.00 60.65 57.65 2d7n s ILE 64 Cb -0.17 -3.79 -0.01 0.00 -1.58 0.00 0.00 42.46 36.91 2d7n s ILE 64 CO -0.08 -0.23 0.09 -0.54 -1.23 0.00 0.00 174.94 172.96 2d7n s LYS 65 N -3.58 0.52 -0.31 2.79 -0.14 0.18 -3.86 119.74 115.35 2d7n s LYS 65 Ca 0.36 -0.63 -0.01 0.00 -1.36 0.00 0.00 55.97 54.32 2d7n s LYS 65 Cb -0.10 0.21 0.10 0.00 -1.68 0.00 0.00 37.83 36.36 2d7n s LYS 65 CO 0.29 -0.13 0.11 -0.47 -0.76 0.00 0.00 175.35 174.40 2d7n s TYR 66 N -2.11 1.39 -1.44 3.18 5.04 -0.62 -1.61 117.35 121.19 2d7n s TYR 66 Ca -0.09 -1.56 -0.02 0.00 -2.44 0.00 0.00 57.07 52.96 2d7n s TYR 66 Cb -0.04 -1.53 0.01 0.00 0.35 0.00 0.00 41.96 40.75 2d7n s TYR 66 CO -0.02 -0.86 0.19 -3.47 -1.34 0.00 0.00 175.55 170.04 2d7n n ASP 67 N 4.90 -5.05 -0.54 4.32 -0.08 0.63 -2.33 116.55 118.41 2d7n n ASP 67 Ca -0.02 -0.05 0.00 0.00 -1.51 0.00 0.00 54.79 53.21 2d7n n ASP 67 Cb 0.42 -4.19 0.00 0.00 2.34 0.00 0.00 41.12 39.69 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 -1.07 0.72 3.22 0.27 0.00 -1.26 -5.00 105.19 102.06 2d7n n GLY 68 Ca -0.16 -0.42 -0.03 0.00 0.00 0.00 0.00 46.02 45.41 2d7n n GLY 68 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2d7n s ASN 69 N -2.58 -0.66 -0.64 1.61 0.01 -0.98 -5.10 114.94 106.60 2d7n s ASN 69 Ca 0.00 0.88 -0.29 0.00 -0.71 0.00 0.00 52.86 52.74 2d7n s ASN 69 Cb 0.00 1.74 -0.12 0.00 0.41 0.00 0.00 41.25 43.28 2d7n s ASN 69 CO 0.00 -0.26 2.49 1.41 -1.51 0.00 0.00 177.10 179.23 2d7n n HIS 70 N 5.41 1.17 -1.27 2.20 8.25 -1.26 -1.58 115.22 128.13 2d7n n HIS 70 Ca -0.06 0.22 -0.37 0.00 -0.26 0.00 0.00 57.72 57.24 2d7n n HIS 70 Cb 0.50 -2.55 0.04 0.00 1.12 0.00 0.00 29.99 29.10 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 7.76 1.10 -2.05 1.59 -5.35 -1.25 -4.75 119.36 116.41 2d7n n ILE 71 Ca 0.47 -0.46 -0.27 0.00 -0.27 0.00 0.00 62.75 62.21 2d7n n ILE 71 Cb 0.35 -0.40 -0.05 0.00 -1.74 0.00 0.00 39.64 37.79 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 -1.95 2.54 0.00 6.28 0.04 -1.26 -2.25 135.00 138.39 2d7n s PRO 72 Ca 0.61 -0.52 0.00 0.00 0.04 0.00 0.00 61.00 61.13 2d7n s PRO 72 Cb -0.40 -5.11 0.00 0.00 0.04 0.00 0.00 34.50 29.03 2d7n s PRO 72 CO 0.63 -3.54 0.00 0.41 0.04 0.00 0.00 177.00 174.54 2d7n n GLY 73 N 6.58 -0.33 3.40 0.56 0.00 -1.26 -4.92 105.19 109.22 2d7n n GLY 73 Ca 0.41 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.18 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 0.00 3.25 1.18 1.61 0.15 -0.95 -4.24 113.70 114.69 2d7n s SER 74 Ca 0.00 -0.86 -0.18 0.00 0.70 0.00 0.00 55.95 55.61 2d7n s SER 74 Cb 0.00 -0.23 0.27 0.00 -1.71 0.00 0.00 66.02 64.35 2d7n s SER 74 CO 0.00 0.09 1.11 -2.16 1.20 0.00 0.00 173.24 173.48 2d7n s PRO 75 N -2.66 -1.03 0.08 5.44 0.04 -1.26 -4.71 135.00 130.90 2d7n s PRO 75 Ca 0.19 0.01 0.01 0.00 0.04 0.00 0.00 61.00 61.25 2d7n s PRO 75 Cb -0.08 -1.61 -0.04 0.00 0.04 0.00 0.00 34.50 32.81 2d7n s PRO 75 CO 0.09 -3.60 -0.06 -0.48 0.04 0.00 0.00 177.00 172.99 2d7n s LEU 76 N -6.89 2.46 -0.01 -3.56 0.05 0.29 -4.99 118.68 106.04 2d7n s LEU 76 Ca 0.70 -0.92 0.03 0.00 0.05 0.00 0.00 54.13 53.99 2d7n s LEU 76 Cb -0.11 -0.03 -0.03 0.00 -2.05 0.00 0.00 46.19 43.97 2d7n s LEU 76 CO 0.56 -0.45 -0.09 -1.10 -0.55 0.00 0.00 176.35 174.73 2d7n s GLN 77 N -3.45 2.51 -0.30 1.48 -1.52 -1.26 -2.35 119.66 114.76 2d7n s GLN 77 Ca 0.07 -0.73 -0.10 0.00 -1.95 0.00 0.00 55.36 52.65 2d7n s GLN 77 Cb 0.03 -2.46 0.13 0.00 -0.22 0.00 0.00 33.01 30.49 2d7n s GLN 77 CO -0.05 0.61 0.64 -0.59 -0.25 0.00 0.00 175.29 175.65 2d7n s PHE 78 N -0.93 -1.33 0.11 0.91 -0.71 -1.21 -5.05 117.98 109.77 2d7n s PHE 78 Ca 0.15 2.32 -0.22 0.00 -1.04 0.00 0.00 56.93 58.14 2d7n s PHE 78 Cb -0.11 0.79 -0.07 0.00 -1.21 0.00 0.00 43.02 42.42 2d7n s PHE 78 CO 0.05 -0.66 0.68 -0.47 -1.34 0.00 0.00 175.22 173.48 2d7n s TYR 79 N 2.88 3.85 -0.21 3.49 5.04 -1.26 -2.77 117.35 128.36 2d7n s TYR 79 Ca -0.06 1.45 -0.07 0.00 -2.44 0.00 0.00 57.07 55.95 2d7n s TYR 79 Cb -0.12 -2.65 -0.03 0.00 0.35 0.00 0.00 41.96 39.51 2d7n s TYR 79 CO -0.19 0.53 0.05 0.08 -1.34 0.00 0.00 175.55 174.67 2d7n s VAL 80 N -1.02 4.41 0.33 3.14 1.01 -0.78 -4.94 120.40 122.54 2d7n s VAL 80 Ca 0.33 -0.16 0.10 0.00 0.00 0.00 0.00 61.98 62.25 2d7n s VAL 80 Cb -0.21 -3.01 -0.06 0.00 0.00 0.00 0.00 36.38 33.10 2d7n s VAL 80 CO 0.23 0.41 -0.10 1.51 0.00 0.00 0.00 175.10 177.15 2d7n s ASP 81 N 0.94 3.78 0.70 3.32 1.47 -1.26 -1.76 116.67 123.85 2d7n s ASP 81 Ca 0.03 -1.15 -0.15 0.00 1.18 0.00 0.00 52.55 52.46 2d7n s ASP 81 Cb -0.14 -0.37 0.02 0.00 -0.34 0.00 0.00 42.92 42.09 2d7n s ASP 81 CO 0.02 -0.17 1.18 0.00 0.68 0.00 0.00 175.17 176.88 2d7n s ALA 82 N -2.58 2.25 -0.29 2.11 0.00 -1.26 -3.49 121.76 118.50 2d7n s ALA 82 Ca 0.32 0.81 -0.28 0.00 0.00 0.00 0.00 51.96 52.81 2d7n s ALA 82 Cb 0.01 -3.43 0.01 0.00 0.00 0.00 0.00 23.12 19.71 2d7n s ALA 82 CO 0.17 -1.65 1.04 0.42 0.00 0.00 0.00 175.76 175.73 2d7n s ILE 83 N -2.03 4.59 -0.31 0.00 1.01 0.11 -4.74 121.20 119.83 2d7n s ILE 83 Ca 0.73 1.79 -0.15 0.00 0.00 0.00 0.00 60.65 63.02 2d7n s ILE 83 Cb -0.27 -4.35 -0.02 0.00 0.01 0.00 0.00 42.46 37.82 2d7n s ILE 83 CO 0.43 -0.36 0.34 0.20 0.00 0.00 0.00 174.94 175.56 2d7n s ASN 84 N 1.50 6.18 -0.10 3.58 0.02 -1.26 -5.00 114.94 119.85 2d7n s ASN 84 Ca 0.44 -0.05 -0.20 0.00 -1.02 0.00 0.00 52.86 52.03 2d7n s ASN 84 Cb -0.13 -2.19 0.05 0.00 0.02 0.00 0.00 41.25 38.99 2d7n s ASN 84 CO 0.12 -0.26 0.49 -0.44 0.02 0.00 0.00 177.10 177.03 2d7n s SER 85 N 1.71 -0.46 0.47 -1.22 0.01 -1.26 -5.15 113.70 107.80 2d7n s SER 85 Ca 0.12 0.67 -0.23 0.00 1.31 0.00 0.00 55.95 57.83 2d7n s SER 85 Cb -0.16 0.70 -0.07 0.00 0.21 0.00 0.00 66.02 66.70 2d7n s SER 85 CO 0.11 -0.36 1.19 0.00 0.41 0.00 0.00 173.24 174.59 2d7n s ARG 86 N -0.56 3.66 -0.70 12.44 1.70 -1.26 -4.88 118.95 129.35 2d7n s ARG 86 Ca -0.07 1.84 -0.26 0.00 -0.47 0.00 0.00 55.73 56.78 2d7n s ARG 86 Cb -0.03 -2.38 -0.08 0.00 -0.57 0.00 0.00 34.95 31.89 2d7n s ARG 86 CO 0.04 -0.65 2.20 -1.01 -1.08 0.00 0.00 175.30 174.80 2d7n s HIS 87 N -1.51 1.37 0.13 5.89 3.76 -1.26 -4.82 115.29 118.85 2d7n s HIS 87 Ca 0.65 1.34 -0.26 0.00 -0.15 0.00 0.00 55.06 56.64 2d7n s HIS 87 Cb -0.30 -3.74 -0.03 0.00 1.11 0.00 0.00 32.58 29.62 2d7n s HIS 87 CO 0.37 -2.01 1.61 1.03 -0.85 0.00 0.00 174.74 174.88 2d7n h SER 88 N 14.70 -1.03 0.00 1.40 0.87 -2.04 -3.49 113.55 123.97 2d7n h SER 88 Ca -0.09 0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 2d7n h SER 88 Cb 1.11 0.43 0.00 0.00 -0.44 0.00 0.00 62.40 63.50 2d7n h SER 88 CO 1.13 -0.37 0.00 0.61 -0.53 0.00 0.00 176.83 177.67 2d7n n GLY 89 N -1.41 -0.08 0.00 5.77 0.00 -1.26 -4.89 105.19 103.31 2d7n n GLY 89 Ca -0.03 -1.30 0.06 0.00 0.00 0.00 0.00 46.02 44.74 2d7n n GLY 89 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d7n n PRO 90 N 0.00 0.49 -0.03 1.61 -0.04 -1.26 -3.25 135.00 132.52 2d7n n PRO 90 Ca 0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.33 2d7n n PRO 90 Cb 0.00 -1.37 -0.09 0.00 -0.04 0.00 0.00 33.50 32.00 2d7n n PRO 90 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2d7n h SER 91 N 0.00 0.13 -1.07 3.54 0.87 -2.01 -3.43 113.55 111.58 2d7n h SER 91 Ca 0.00 -0.46 -0.80 0.00 -1.23 0.00 0.00 61.79 59.29 2d7n h SER 91 Cb 0.00 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 61.93 2d7n h SER 91 CO 0.00 0.57 0.90 -0.24 -0.53 0.00 0.00 176.83 177.52 2d7n n SER 92 N -4.76 1.63 0.00 6.23 2.88 -1.20 -5.21 113.62 113.18 2d7n n SER 92 Ca -0.08 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.50 2d7n n SER 92 Cb 0.28 -1.00 0.00 0.00 -0.75 0.00 0.00 64.21 62.74 2d7n n SER 92 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42