#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x2k n SER 2 N 0.00 -2.92 -3.87 1.61 2.88 -1.26 -4.94 113.62 105.12 1x2k n SER 2 Ca 0.00 -0.96 -0.29 0.00 -1.33 0.00 0.00 58.87 56.29 1x2k n SER 2 Cb 0.00 -3.06 -0.16 0.00 -0.75 0.00 0.00 64.21 60.24 1x2k n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1x2k s SER 3 N -3.55 3.37 -0.42 -3.46 0.01 -1.26 -5.02 113.70 103.37 1x2k s SER 3 Ca 0.56 -0.97 0.01 0.00 1.31 0.00 0.00 55.95 56.86 1x2k s SER 3 Cb -0.30 -0.95 0.24 0.00 0.21 0.00 0.00 66.02 65.22 1x2k s SER 3 CO 0.90 -0.25 1.01 0.61 0.41 0.00 0.00 173.24 175.92 1x2k n GLY 4 N 4.83 -0.94 3.77 3.44 0.00 -1.26 -5.15 105.19 109.87 1x2k n GLY 4 Ca -0.11 0.68 -0.40 0.00 0.00 0.00 0.00 46.02 46.18 1x2k n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x2k s SER 5 N -0.31 6.94 -0.84 1.61 0.01 -1.26 -4.97 113.70 114.87 1x2k s SER 5 Ca 0.28 2.45 -0.17 0.00 1.31 0.00 0.00 55.95 59.82 1x2k s SER 5 Cb 0.16 -2.63 0.16 0.00 0.21 0.00 0.00 66.02 63.92 1x2k s SER 5 CO -0.14 -0.39 0.94 -0.55 0.41 0.00 0.00 173.24 173.51 1x2k s SER 6 N -0.77 6.61 -0.19 2.44 0.15 -1.26 -5.02 113.70 115.65 1x2k s SER 6 Ca 0.48 -2.17 -0.09 0.00 0.70 0.00 0.00 55.95 54.88 1x2k s SER 6 Cb -0.35 -2.32 -0.05 0.00 -1.71 0.00 0.00 66.02 61.60 1x2k s SER 6 CO 0.45 -0.91 0.11 -0.83 1.20 0.00 0.00 173.24 173.27 1x2k s GLY 7 N 3.11 2.00 0.35 9.45 0.00 -1.26 -4.85 107.32 116.13 1x2k s GLY 7 Ca 0.24 -0.71 -0.15 0.00 0.00 0.00 0.00 44.72 44.10 1x2k s GLY 7 CO -0.07 0.11 0.78 0.54 0.00 0.00 0.00 173.10 174.46 1x2k s LYS 8 N 0.36 4.01 -0.30 2.90 3.01 -1.04 -4.91 119.74 123.77 1x2k s LYS 8 Ca 0.06 0.73 -0.01 0.00 -1.01 0.00 0.00 55.97 55.74 1x2k s LYS 8 Cb -0.11 -2.38 0.05 0.00 -1.01 0.00 0.00 37.83 34.38 1x2k s LYS 8 CO -0.01 0.10 0.00 0.08 0.51 0.00 0.00 175.35 176.03 1x2k s VAL 9 N -2.07 2.94 0.01 3.17 1.01 -1.26 -1.30 120.40 122.90 1x2k s VAL 9 Ca 0.55 -1.46 0.02 0.00 0.00 0.00 0.00 61.98 61.10 1x2k s VAL 9 Cb -0.10 -2.72 -0.04 0.00 0.00 0.00 0.00 36.38 33.52 1x2k s VAL 9 CO 0.18 -0.14 -0.01 -0.36 0.00 0.00 0.00 175.10 174.77 1x2k s PHE 10 N 1.23 3.05 -0.09 5.22 0.40 -0.28 -3.23 117.98 124.27 1x2k s PHE 10 Ca -0.04 0.05 -0.02 0.00 -0.60 0.00 0.00 56.93 56.32 1x2k s PHE 10 Cb -0.20 -1.65 -0.03 0.00 0.51 0.00 0.00 43.02 41.65 1x2k s PHE 10 CO -0.02 0.45 0.01 0.50 0.70 0.00 0.00 175.22 176.87 1x2k s ARG 11 N -1.64 3.05 -0.50 0.44 6.06 -1.20 -0.56 118.95 124.60 1x2k s ARG 11 Ca 0.20 -0.39 -0.29 0.00 -2.50 0.00 0.00 55.73 52.75 1x2k s ARG 11 Cb -0.11 -2.83 0.03 0.00 0.06 0.00 0.00 34.95 32.10 1x2k s ARG 11 CO 0.11 0.69 1.16 0.00 -2.50 0.00 0.00 175.30 174.76 1x2k s ALA 12 N -0.83 3.11 0.39 6.12 0.00 -1.01 -2.94 121.76 126.60 1x2k s ALA 12 Ca 0.13 -0.54 0.23 0.00 0.00 0.00 0.00 51.96 51.77 1x2k s ALA 12 Cb -0.11 -3.93 1.22 0.00 0.00 0.00 0.00 23.12 20.29 1x2k s ALA 12 CO 0.02 -2.36 2.00 -0.07 0.00 0.00 0.00 175.76 175.35 1x2k h LEU 13 N 11.43 0.00 -7.04 0.00 3.38 -1.50 0.30 115.31 121.87 1x2k h LEU 13 Ca -0.24 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.73 1x2k h LEU 13 Cb 1.06 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.69 1x2k h LEU 13 CO 1.14 0.18 0.24 -0.31 0.09 0.00 0.00 178.44 179.78 1x2k s TYR 14 N -4.22 -0.51 0.12 1.13 1.51 -1.26 -4.72 117.35 109.41 1x2k s TYR 14 Ca -0.03 0.29 -0.31 0.00 -1.01 0.00 0.00 57.07 56.01 1x2k s TYR 14 Cb 0.13 0.56 -0.09 0.00 -0.11 0.00 0.00 41.96 42.46 1x2k s TYR 14 CO 0.63 -0.84 1.58 0.99 -1.11 0.00 0.00 175.55 176.79 1x2k s THR 15 N -3.70 2.88 -0.14 -0.71 2.01 -1.26 -4.10 115.64 110.61 1x2k s THR 15 Ca 0.02 0.53 -0.04 0.00 0.31 0.00 0.00 61.69 62.51 1x2k s THR 15 Cb -0.01 -3.34 -0.03 0.00 0.01 0.00 0.00 72.50 69.12 1x2k s THR 15 CO -0.12 0.02 0.01 0.12 -0.69 0.00 0.00 174.62 173.96 1x2k s PHE 16 N 1.73 3.14 -0.60 4.92 5.36 -0.84 -4.91 117.98 126.79 1x2k s PHE 16 Ca 0.71 -0.03 -0.13 0.00 -0.96 0.00 0.00 56.93 56.52 1x2k s PHE 16 Cb -0.41 -1.95 0.15 0.00 -0.34 0.00 0.00 43.02 40.47 1x2k s PHE 16 CO 0.31 0.18 0.53 -1.21 -1.46 0.00 0.00 175.22 173.57 1x2k s GLU 17 N -0.01 2.99 -0.24 10.12 2.02 -1.26 -3.86 118.70 128.45 1x2k s GLU 17 Ca 0.03 -1.97 -0.29 0.00 0.02 0.00 0.00 54.97 52.76 1x2k s GLU 17 Cb -0.13 -4.20 -0.02 0.00 0.10 0.00 0.00 34.13 29.88 1x2k s GLU 17 CO 0.02 -1.28 1.63 -1.25 0.02 0.00 0.00 175.26 174.40 1x2k s PRO 18 N 1.06 3.72 0.30 0.39 0.04 -1.26 -4.88 135.00 134.38 1x2k s PRO 18 Ca 0.08 1.59 0.17 0.00 0.04 0.00 0.00 61.00 62.89 1x2k s PRO 18 Cb -0.23 -4.06 0.11 0.00 0.04 0.00 0.00 34.50 30.36 1x2k s PRO 18 CO -0.01 -1.38 1.45 0.00 0.04 0.00 0.00 177.00 177.10 1x2k h ARG 19 N 11.01 0.00 -5.89 4.56 -0.00 -1.96 -3.45 114.38 118.65 1x2k h ARG 19 Ca -0.33 0.00 -0.63 0.00 -0.50 0.00 0.00 59.98 58.51 1x2k h ARG 19 Cb 1.15 0.00 -0.05 0.00 0.00 0.00 0.00 29.97 31.07 1x2k h ARG 19 CO 1.01 0.39 -0.51 0.95 0.00 0.00 0.00 179.97 181.81 1x2k s THR 20 N -3.01 5.29 -1.22 2.04 -4.23 -1.26 -4.99 115.64 108.26 1x2k s THR 20 Ca 0.04 -0.31 0.14 0.00 -1.18 0.00 0.00 61.69 60.38 1x2k s THR 20 Cb 0.07 -3.52 0.19 0.00 1.34 0.00 0.00 72.50 70.58 1x2k s THR 20 CO 0.73 0.24 1.43 -0.81 -0.54 0.00 0.00 174.62 175.67 1x2k n PRO 21 N 0.68 0.11 0.06 3.99 -0.04 -1.26 -2.16 135.00 136.37 1x2k n PRO 21 Ca -0.09 0.20 0.05 0.00 -0.04 0.00 0.00 63.50 63.63 1x2k n PRO 21 Cb 0.52 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.43 1x2k n PRO 21 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1x2k n ASP 22 N -1.39 0.80 -4.86 3.54 2.03 -1.26 -4.92 116.55 110.49 1x2k n ASP 22 Ca 0.05 0.33 -0.31 0.00 0.52 0.00 0.00 54.79 55.39 1x2k n ASP 22 Cb 0.14 0.39 0.03 0.00 -0.72 0.00 0.00 41.12 40.95 1x2k n ASP 22 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1x2k s GLU 23 N -3.14 3.31 -0.17 -0.67 2.02 -0.92 -0.16 118.70 118.97 1x2k s GLU 23 Ca -0.02 0.76 -0.04 0.00 0.02 0.00 0.00 54.97 55.69 1x2k s GLU 23 Cb 0.09 -2.05 -0.03 0.00 0.10 0.00 0.00 34.13 32.25 1x2k s GLU 23 CO 0.81 -0.78 -0.03 -1.17 0.02 0.00 0.00 175.26 174.11 1x2k s LEU 24 N -5.30 3.24 -0.12 1.80 2.96 0.11 -4.55 118.68 116.81 1x2k s LEU 24 Ca 0.56 -0.16 -0.26 0.00 -0.22 0.00 0.00 54.13 54.05 1x2k s LEU 24 Cb -0.12 -1.79 -0.02 0.00 0.50 0.00 0.00 46.19 44.76 1x2k s LEU 24 CO 0.54 0.13 0.85 -0.47 -1.32 0.00 0.00 176.35 176.08 1x2k s TYR 25 N 0.60 3.49 0.06 5.38 6.14 -1.26 -4.74 117.35 127.01 1x2k s TYR 25 Ca -0.02 1.35 -0.00 0.00 0.64 0.00 0.00 57.07 59.04 1x2k s TYR 25 Cb -0.14 -3.01 -0.04 0.00 0.42 0.00 0.00 41.96 39.18 1x2k s TYR 25 CO 0.02 -0.15 -0.04 -0.59 0.64 0.00 0.00 175.55 175.43 1x2k s PHE 26 N 1.76 0.60 0.14 4.97 -0.71 -1.25 -4.87 117.98 118.62 1x2k s PHE 26 Ca 0.41 -1.02 0.09 0.00 -1.04 0.00 0.00 56.93 55.37 1x2k s PHE 26 Cb -0.17 -0.42 -0.04 0.00 -1.21 0.00 0.00 43.02 41.18 1x2k s PHE 26 CO 0.16 -0.32 -0.13 -1.21 -1.34 0.00 0.00 175.22 172.38 1x2k s GLU 27 N -3.83 1.96 0.47 1.99 2.02 -1.26 -1.98 118.70 118.07 1x2k s GLU 27 Ca 0.08 -1.18 -0.20 0.00 0.02 0.00 0.00 54.97 53.69 1x2k s GLU 27 Cb 0.07 -2.17 -0.14 0.00 0.10 0.00 0.00 34.13 31.99 1x2k s GLU 27 CO -0.08 0.47 0.16 -1.91 0.02 0.00 0.00 175.26 173.91 1x2k n GLU 28 N 0.50 0.17 -3.38 1.61 0.00 -1.26 -2.92 120.64 115.36 1x2k n GLU 28 Ca -0.13 0.06 -0.17 0.00 0.00 0.00 0.00 57.16 56.93 1x2k n GLU 28 Cb 0.54 -1.19 0.08 0.00 0.00 0.00 0.00 31.44 30.87 1x2k n GLU 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1x2k n GLY 29 N 2.22 -0.60 2.98 8.31 0.00 0.10 -4.92 105.19 113.28 1x2k n GLY 29 Ca 0.10 0.25 -0.22 0.00 0.00 0.00 0.00 46.02 46.14 1x2k n GLY 29 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x2k s ASP 30 N -4.07 1.42 0.05 1.61 1.11 -1.15 -4.92 116.67 110.72 1x2k s ASP 30 Ca 0.14 -0.23 -0.31 0.00 0.18 0.00 0.00 52.55 52.34 1x2k s ASP 30 Cb -0.02 -0.62 -0.06 0.00 1.07 0.00 0.00 42.92 43.29 1x2k s ASP 30 CO 0.74 0.01 1.28 -0.63 1.18 0.00 0.00 175.17 177.75 1x2k s ILE 31 N 0.65 3.84 0.03 0.77 -1.09 -1.26 -2.39 121.20 121.74 1x2k s ILE 31 Ca -0.12 1.29 0.07 0.00 -2.23 0.00 0.00 60.65 59.66 1x2k s ILE 31 Cb -0.14 -3.83 -0.02 0.00 -1.58 0.00 0.00 42.46 36.89 1x2k s ILE 31 CO 0.02 0.07 -0.20 -0.63 -1.23 0.00 0.00 174.94 172.97 1x2k s ILE 32 N 1.45 1.62 -0.30 2.92 1.01 0.27 -4.61 121.20 123.57 1x2k s ILE 32 Ca 0.61 -1.09 -0.08 0.00 0.00 0.00 0.00 60.65 60.08 1x2k s ILE 32 Cb -0.31 -1.40 -0.00 0.00 0.01 0.00 0.00 42.46 40.76 1x2k s ILE 32 CO 0.28 0.27 0.12 -0.31 0.00 0.00 0.00 174.94 175.29 1x2k s TYR 33 N -0.71 3.16 -0.48 3.97 1.51 -0.90 -1.13 117.35 122.78 1x2k s TYR 33 Ca 0.07 -0.73 -0.06 0.00 -1.01 0.00 0.00 57.07 55.35 1x2k s TYR 33 Cb -0.08 -2.30 0.13 0.00 -0.11 0.00 0.00 41.96 39.59 1x2k s TYR 33 CO 0.01 -0.50 0.31 0.42 -1.11 0.00 0.00 175.55 174.68 1x2k s ILE 34 N 1.57 3.77 -0.17 2.71 -1.09 -0.42 -1.35 121.20 126.22 1x2k s ILE 34 Ca 0.04 -2.11 0.07 0.00 -2.23 0.00 0.00 60.65 56.43 1x2k s ILE 34 Cb -0.17 -3.52 -0.23 0.00 -1.58 0.00 0.00 42.46 36.97 1x2k s ILE 34 CO 0.04 -0.76 0.16 0.35 -1.23 0.00 0.00 174.94 173.50 1x2k n THR 35 N 4.52 1.54 -3.73 2.92 -2.24 -1.23 -2.49 114.28 113.57 1x2k n THR 35 Ca -0.02 -0.72 -0.38 0.00 -2.27 0.00 0.00 64.05 60.66 1x2k n THR 35 Cb 0.41 -1.11 -0.12 0.00 -2.10 0.00 0.00 70.33 67.41 1x2k n THR 35 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1x2k s ASP 36 N -6.21 5.25 -0.16 3.42 2.15 -1.22 -4.94 116.67 114.95 1x2k s ASP 36 Ca -0.19 -0.64 0.16 0.00 0.43 0.00 0.00 52.55 52.31 1x2k s ASP 36 Cb 0.07 -1.92 0.36 0.00 -0.30 0.00 0.00 42.92 41.13 1x2k s ASP 36 CO 0.75 -0.19 1.21 0.23 -0.17 0.00 0.00 175.17 177.00 1x2k n MET 37 N 4.90 1.55 -0.34 4.34 2.81 -1.26 -2.68 117.12 126.44 1x2k n MET 37 Ca -0.14 -2.82 0.03 0.00 -1.81 0.00 0.00 57.70 52.96 1x2k n MET 37 Cb 0.48 -1.58 0.10 0.00 -0.71 0.00 0.00 33.22 31.51 1x2k n MET 37 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1x2k n SER 38 N -1.25 -0.43 -4.73 7.83 7.64 -1.26 -4.48 113.62 116.94 1x2k n SER 38 Ca 0.18 1.61 -0.23 0.00 1.01 0.00 0.00 58.87 61.45 1x2k n SER 38 Cb 0.70 -0.45 0.11 0.00 -1.01 0.00 0.00 64.21 63.56 1x2k n SER 38 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1x2k s ASP 39 N -5.27 4.39 -0.01 6.43 1.11 -1.26 -5.06 116.67 117.00 1x2k s ASP 39 Ca -0.14 -0.60 0.01 0.00 0.18 0.00 0.00 52.55 52.01 1x2k s ASP 39 Cb 0.23 0.27 -0.01 0.00 1.07 0.00 0.00 42.92 44.48 1x2k s ASP 39 CO 0.71 -1.85 0.00 0.41 1.18 0.00 0.00 175.17 175.62 1x2k n THR 40 N -2.75 0.06 0.05 -1.27 -1.04 -1.26 -4.76 114.28 103.31 1x2k n THR 40 Ca 0.17 -0.04 -0.22 0.00 -2.04 0.00 0.00 64.05 61.92 1x2k n THR 40 Cb 0.61 -0.97 -0.15 0.00 -1.82 0.00 0.00 70.33 68.01 1x2k n THR 40 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 1x2k h ASN 41 N 0.00 0.53 -3.31 8.00 2.35 -1.96 -3.42 115.58 117.76 1x2k h ASN 41 Ca -0.02 -0.90 -0.67 0.00 -0.55 0.00 0.00 56.30 54.15 1x2k h ASN 41 Cb 1.05 -0.17 -0.35 0.00 0.05 0.00 0.00 38.32 38.89 1x2k h ASN 41 CO 0.00 1.66 -0.84 0.26 -1.65 0.00 0.00 177.43 176.86 1x2k s TRP 42 N -2.52 2.93 0.19 1.19 0.52 -1.26 -3.63 118.94 116.35 1x2k s TRP 42 Ca -0.16 -1.84 0.05 0.00 0.02 0.00 0.00 56.10 54.17 1x2k s TRP 42 Cb 0.04 -1.93 -0.04 0.00 -1.15 0.00 0.00 33.47 30.40 1x2k s TRP 42 CO 0.83 -0.82 0.20 -1.58 0.02 0.00 0.00 176.95 175.59 1x2k s TRP 43 N 1.24 3.24 -0.31 -1.98 0.51 -0.41 -4.36 118.94 116.87 1x2k s TRP 43 Ca 0.01 -0.01 -0.03 0.00 -2.12 0.00 0.00 56.10 53.95 1x2k s TRP 43 Cb -0.15 -1.53 0.05 0.00 -0.81 0.00 0.00 33.47 31.03 1x2k s TRP 43 CO -0.10 0.51 0.04 0.21 -0.51 0.00 0.00 176.95 177.10 1x2k s LYS 44 N -3.36 2.51 0.19 4.98 2.20 -1.09 0.85 119.74 126.03 1x2k s LYS 44 Ca 0.32 -1.22 -0.06 0.00 -0.36 0.00 0.00 55.97 54.65 1x2k s LYS 44 Cb -0.10 -3.28 -0.02 0.00 -1.51 0.00 0.00 37.83 32.92 1x2k s LYS 44 CO 0.25 -0.63 0.25 0.20 -0.36 0.00 0.00 175.35 175.06 1x2k s GLY 45 N 1.31 0.89 -0.13 5.54 0.00 -1.04 -3.41 107.32 110.48 1x2k s GLY 45 Ca -0.04 -1.24 0.03 0.00 0.00 0.00 0.00 44.72 43.47 1x2k s GLY 45 CO 0.00 -1.05 -0.22 -1.59 0.00 0.00 0.00 173.10 170.24 1x2k s THR 46 N -4.06 2.06 0.00 0.90 2.01 -0.46 -2.71 115.64 113.38 1x2k s THR 46 Ca 0.27 -0.98 0.00 0.00 0.31 0.00 0.00 61.69 61.28 1x2k s THR 46 Cb 0.04 -1.81 0.00 0.00 0.01 0.00 0.00 72.50 70.74 1x2k s THR 46 CO 0.07 0.55 0.00 -0.24 -0.69 0.00 0.00 174.62 174.31 1x2k n SER 47 N 3.98 0.00 -4.32 3.53 2.88 -1.22 -2.11 113.62 116.36 1x2k n SER 47 Ca -0.20 0.00 -0.46 0.00 -1.33 0.00 0.00 58.87 56.88 1x2k n SER 47 Cb 0.52 -0.07 -0.05 0.00 -0.75 0.00 0.00 64.21 63.86 1x2k n SER 47 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1x2k s LYS 48 N -0.32 3.08 -0.74 -1.46 2.36 -1.26 -4.68 119.74 116.72 1x2k s LYS 48 Ca 0.00 -1.77 -0.08 0.00 -2.55 0.00 0.00 55.97 51.57 1x2k s LYS 48 Cb 0.00 -4.32 0.08 0.00 -1.05 0.00 0.00 37.83 32.54 1x2k s LYS 48 CO 0.00 -1.35 0.20 0.41 1.55 0.00 0.00 175.35 176.16 1x2k n GLY 49 N 5.09 -0.14 3.38 5.54 0.00 -1.26 -4.79 105.19 113.00 1x2k n GLY 49 Ca -0.09 0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 1x2k n GLY 49 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x2k s ARG 50 N -3.72 1.27 -0.23 1.61 0.52 -1.26 -5.15 118.95 111.99 1x2k s ARG 50 Ca 0.29 -1.29 -0.03 0.00 -0.52 0.00 0.00 55.73 54.18 1x2k s ARG 50 Cb -0.17 0.38 0.10 0.00 0.52 0.00 0.00 34.95 35.78 1x2k s ARG 50 CO 0.41 -0.47 0.22 0.99 0.02 0.00 0.00 175.30 176.46 1x2k s THR 51 N -4.02 -0.29 0.08 0.02 2.01 -1.26 -3.39 115.64 108.78 1x2k s THR 51 Ca 0.23 -0.27 -0.01 0.00 0.31 0.00 0.00 61.69 61.95 1x2k s THR 51 Cb 0.03 -0.77 0.00 0.00 0.01 0.00 0.00 72.50 71.78 1x2k s THR 51 CO 0.05 -0.32 0.11 0.61 -0.69 0.00 0.00 174.62 174.38 1x2k n GLY 52 N 5.31 2.70 3.79 4.40 0.00 -1.10 -4.98 105.19 115.31 1x2k n GLY 52 Ca -0.05 -1.36 -0.34 0.00 0.00 0.00 0.00 46.02 44.27 1x2k n GLY 52 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x2k s LEU 53 N 0.00 3.79 -0.04 0.99 1.43 0.77 -2.49 118.68 123.13 1x2k s LEU 53 Ca 0.06 1.99 -0.02 0.00 -1.03 0.00 0.00 54.13 55.13 1x2k s LEU 53 Cb -0.00 -4.56 0.03 0.00 0.03 0.00 0.00 46.19 41.68 1x2k s LEU 53 CO 0.04 -0.93 0.08 -0.63 0.23 0.00 0.00 176.35 175.14 1x2k s ILE 54 N -1.96 -0.04 -0.04 -0.59 1.01 0.25 0.05 121.20 119.89 1x2k s ILE 54 Ca 0.69 0.14 -0.30 0.00 0.00 0.00 0.00 60.65 61.17 1x2k s ILE 54 Cb -0.18 -0.14 -0.05 0.00 0.01 0.00 0.00 42.46 42.09 1x2k s ILE 54 CO 0.23 0.06 1.48 -2.16 0.00 0.00 0.00 174.94 174.55 1x2k s PRO 55 N 0.78 4.23 0.00 2.79 0.04 -1.26 -1.29 135.00 140.30 1x2k s PRO 55 Ca -0.06 2.02 0.13 0.00 0.04 0.00 0.00 61.00 63.13 1x2k s PRO 55 Cb -0.09 -3.74 0.77 0.00 0.04 0.00 0.00 34.50 31.49 1x2k s PRO 55 CO -0.03 -0.70 1.30 -1.13 0.04 0.00 0.00 177.00 176.48 1x2k n SER 56 N 6.14 0.00 -0.03 6.66 3.41 -1.24 -2.52 113.62 126.05 1x2k n SER 56 Ca 0.15 -1.04 -0.02 0.00 -0.26 0.00 0.00 58.87 57.70 1x2k n SER 56 Cb 0.43 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.25 1x2k n SER 56 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1x2k n ASN 57 N -0.78 0.39 0.02 4.04 2.85 -1.26 -4.34 115.26 116.18 1x2k n ASN 57 Ca 0.10 0.17 -0.15 0.00 -0.11 0.00 0.00 54.58 54.59 1x2k n ASN 57 Cb 0.04 0.80 -0.14 0.00 1.24 0.00 0.00 39.78 41.73 1x2k n ASN 57 CO 0.00 0.00 0.00 1.88 -2.11 0.00 0.00 177.26 177.03 1x2k h TYR 58 N 0.00 0.29 -2.22 1.20 -1.99 -1.88 -3.47 116.97 108.90 1x2k h TYR 58 Ca -0.27 -0.21 -0.48 0.00 2.00 0.00 0.00 58.73 59.76 1x2k h TYR 58 Cb 1.73 -0.01 -0.03 0.00 2.00 0.00 0.00 36.73 40.42 1x2k h TYR 58 CO 0.00 1.36 -0.47 0.14 -0.00 0.00 0.00 178.16 179.19 1x2k s VAL 59 N -2.60 4.92 -0.05 -2.88 -7.23 -1.19 -1.16 120.40 110.22 1x2k s VAL 59 Ca -0.11 -1.14 -0.11 0.00 -1.81 0.00 0.00 61.98 58.80 1x2k s VAL 59 Cb 0.07 -3.66 0.02 0.00 0.56 0.00 0.00 36.38 33.38 1x2k s VAL 59 CO 0.82 -0.32 0.27 0.00 -0.31 0.00 0.00 175.10 175.56 1x2k s ALA 60 N -2.02 -0.68 -0.34 1.32 0.00 -1.15 -4.79 121.76 114.10 1x2k s ALA 60 Ca 0.33 0.47 -0.34 0.00 0.00 0.00 0.00 51.96 52.43 1x2k s ALA 60 Cb -0.09 -0.17 -0.10 0.00 0.00 0.00 0.00 23.12 22.76 1x2k s ALA 60 CO 0.27 -0.20 2.21 -1.91 0.00 0.00 0.00 175.76 176.13 1x2k n GLU 61 N 2.04 1.20 -0.72 0.00 2.13 -1.26 -3.21 120.64 120.82 1x2k n GLU 61 Ca -0.18 0.32 -0.32 0.00 0.66 0.00 0.00 57.16 57.64 1x2k n GLU 61 Cb 0.57 -2.59 0.15 0.00 0.27 0.00 0.00 31.44 29.84 1x2k n GLU 61 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 1x2k n GLN 62 N 8.32 -0.79 -0.06 5.31 6.02 -1.20 -4.99 117.38 129.99 1x2k n GLN 62 Ca 0.40 -0.19 -0.13 0.00 -0.01 0.00 0.00 57.00 57.07 1x2k n GLN 62 Cb 0.27 -1.97 -0.04 0.00 1.02 0.00 0.00 30.24 29.52 1x2k n GLN 62 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1x2k n SER 63 N -2.35 0.93 0.00 1.08 7.64 -1.26 -5.06 113.62 114.59 1x2k n SER 63 Ca 0.06 0.16 0.00 0.00 1.01 0.00 0.00 58.87 60.10 1x2k n SER 63 Cb 0.55 -0.38 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 1x2k n SER 63 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x2k n GLY 64 N 2.21 -0.11 3.57 0.23 0.00 -1.26 -4.88 105.19 104.95 1x2k n GLY 64 Ca -0.24 -1.49 -0.41 0.00 0.00 0.00 0.00 46.02 43.88 1x2k n GLY 64 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x2k s PRO 65 N -4.52 3.01 0.17 1.61 0.04 -1.26 -4.88 135.00 129.17 1x2k s PRO 65 Ca 0.00 0.96 -0.16 0.00 0.04 0.00 0.00 61.00 61.84 1x2k s PRO 65 Cb 0.00 -4.27 0.12 0.00 0.04 0.00 0.00 34.50 30.38 1x2k s PRO 65 CO 0.00 -2.26 1.67 0.77 0.04 0.00 0.00 177.00 177.23 1x2k h SER 66 N 13.64 -0.31 -1.76 6.66 0.02 -2.07 -3.42 113.55 126.31 1x2k h SER 66 Ca -0.29 0.12 -0.52 0.00 -0.84 0.00 0.00 61.79 60.25 1x2k h SER 66 Cb 1.16 0.23 -0.06 0.00 0.14 0.00 0.00 62.40 63.87 1x2k h SER 66 CO 1.13 -0.11 -0.47 -0.44 -1.14 0.00 0.00 176.83 175.80 1x2k s SER 67 N -5.23 4.91 0.00 3.07 0.01 -1.26 -5.33 113.70 109.87 1x2k s SER 67 Ca -0.14 -0.72 0.00 0.00 1.31 0.00 0.00 55.95 56.40 1x2k s SER 67 Cb 0.15 -0.74 0.00 0.00 0.21 0.00 0.00 66.02 65.64 1x2k s SER 67 CO 0.71 -0.42 0.47 0.61 0.41 0.00 0.00 173.24 175.03