#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x2k h SER 2 N 0.00 -1.24 -3.17 1.61 0.02 -2.11 -3.39 113.55 105.26 1x2k h SER 2 Ca 0.00 0.18 -0.56 0.00 -0.84 0.00 0.00 61.79 60.57 1x2k h SER 2 Cb 0.00 0.53 -0.03 0.00 0.14 0.00 0.00 62.40 63.03 1x2k h SER 2 CO 0.00 -0.38 0.64 -0.44 -1.14 0.00 0.00 176.83 175.51 1x2k s SER 3 N -4.96 7.16 0.00 3.07 0.01 -1.26 -4.84 113.70 112.89 1x2k s SER 3 Ca -0.15 1.62 0.00 0.00 1.31 0.00 0.00 55.95 58.73 1x2k s SER 3 Cb 0.11 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.78 1x2k s SER 3 CO 0.65 -0.52 0.00 0.61 0.41 0.00 0.00 173.24 174.39 1x2k n GLY 4 N 3.22 2.27 3.13 3.44 0.00 -1.26 -5.12 105.19 110.88 1x2k n GLY 4 Ca 0.10 -1.68 -0.12 0.00 0.00 0.00 0.00 46.02 44.32 1x2k n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x2k s SER 5 N 0.00 1.09 -0.27 1.61 0.15 -1.26 -5.01 113.70 110.00 1x2k s SER 5 Ca 0.00 -0.79 0.08 0.00 0.70 0.00 0.00 55.95 55.93 1x2k s SER 5 Cb 0.00 0.06 0.45 0.00 -1.71 0.00 0.00 66.02 64.82 1x2k s SER 5 CO 0.00 -0.33 1.20 -1.20 1.20 0.00 0.00 173.24 174.11 1x2k n SER 6 N 0.65 4.27 -4.68 5.45 7.64 -1.26 -5.06 113.62 120.64 1x2k n SER 6 Ca -0.17 -3.77 -0.46 0.00 1.01 0.00 0.00 58.87 55.48 1x2k n SER 6 Cb 0.58 -0.38 -0.04 0.00 -1.01 0.00 0.00 64.21 63.36 1x2k n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x2k n GLY 7 N -0.79 1.50 3.93 0.23 0.00 -1.26 -4.91 105.19 103.89 1x2k n GLY 7 Ca 0.39 0.81 -0.25 0.00 0.00 0.00 0.00 46.02 46.97 1x2k n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x2k s LYS 8 N 3.59 3.51 -0.36 1.61 1.02 -0.99 -4.91 119.74 123.21 1x2k s LYS 8 Ca 0.89 -0.19 -0.05 0.00 0.02 0.00 0.00 55.97 56.64 1x2k s LYS 8 Cb -0.63 -2.61 0.07 0.00 -0.52 0.00 0.00 37.83 34.14 1x2k s LYS 8 CO 0.47 0.09 0.14 0.08 -0.92 0.00 0.00 175.35 175.21 1x2k s VAL 9 N -2.36 3.57 -0.05 3.17 1.01 -1.26 -1.48 120.40 123.01 1x2k s VAL 9 Ca 0.42 -1.48 -0.02 0.00 0.00 0.00 0.00 61.98 60.90 1x2k s VAL 9 Cb -0.10 -3.17 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 1x2k s VAL 9 CO 0.37 -0.36 0.05 -0.36 0.00 0.00 0.00 175.10 174.80 1x2k s PHE 10 N 1.31 3.25 -0.07 5.22 0.40 0.58 -3.23 117.98 125.45 1x2k s PHE 10 Ca 0.01 0.23 -0.00 0.00 -0.60 0.00 0.00 56.93 56.57 1x2k s PHE 10 Cb -0.21 -1.77 -0.03 0.00 0.51 0.00 0.00 43.02 41.51 1x2k s PHE 10 CO 0.00 0.53 -0.04 0.50 0.70 0.00 0.00 175.22 176.92 1x2k s ARG 11 N -1.30 2.83 -0.44 0.44 3.52 -1.22 0.05 118.95 122.82 1x2k s ARG 11 Ca 0.18 -0.51 -0.29 0.00 -0.13 0.00 0.00 55.73 54.98 1x2k s ARG 11 Cb -0.12 -2.67 0.02 0.00 -1.56 0.00 0.00 34.95 30.63 1x2k s ARG 11 CO 0.08 0.67 1.26 0.00 -0.81 0.00 0.00 175.30 176.50 1x2k s ALA 12 N -0.87 3.12 0.54 6.12 0.00 -1.16 -2.86 121.76 126.66 1x2k s ALA 12 Ca 0.13 -0.31 0.22 0.00 0.00 0.00 0.00 51.96 52.00 1x2k s ALA 12 Cb -0.11 -3.91 1.42 0.00 0.00 0.00 0.00 23.12 20.52 1x2k s ALA 12 CO 0.03 -2.29 2.12 -0.07 0.00 0.00 0.00 175.76 175.55 1x2k h LEU 13 N 11.62 0.00 -7.00 0.00 3.38 -0.87 -0.72 115.31 121.72 1x2k h LEU 13 Ca -0.25 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.69 1x2k h LEU 13 Cb 1.08 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.67 1x2k h LEU 13 CO 1.11 0.00 0.21 -0.31 0.09 0.00 0.00 178.44 179.54 1x2k s TYR 14 N -4.94 -0.59 -0.02 1.13 1.51 -1.26 -4.75 117.35 108.43 1x2k s TYR 14 Ca -0.05 0.74 -0.33 0.00 -1.01 0.00 0.00 57.07 56.41 1x2k s TYR 14 Cb 0.17 0.48 -0.12 0.00 -0.11 0.00 0.00 41.96 42.39 1x2k s TYR 14 CO 0.65 -0.71 1.85 2.41 -1.11 0.00 0.00 175.55 178.64 1x2k n THR 15 N 0.30 0.51 -4.32 -0.71 -1.04 -1.26 -4.40 114.28 103.35 1x2k n THR 15 Ca -0.18 -0.09 -0.31 0.00 -2.04 0.00 0.00 64.05 61.43 1x2k n THR 15 Cb 0.61 -1.90 -0.10 0.00 -1.82 0.00 0.00 70.33 67.12 1x2k n THR 15 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1x2k s PHE 16 N 3.58 2.83 -0.21 -1.42 5.36 -1.16 -4.91 117.98 122.06 1x2k s PHE 16 Ca 0.90 -0.09 0.00 0.00 -0.96 0.00 0.00 56.93 56.77 1x2k s PHE 16 Cb -0.64 -1.52 0.02 0.00 -0.34 0.00 0.00 43.02 40.54 1x2k s PHE 16 CO 0.47 0.41 -0.15 -1.21 -1.46 0.00 0.00 175.22 173.28 1x2k s GLU 17 N -1.88 2.90 -0.10 10.12 8.01 -1.26 -3.68 118.70 132.80 1x2k s GLU 17 Ca 0.20 -0.91 -0.29 0.00 0.01 0.00 0.00 54.97 53.98 1x2k s GLU 17 Cb -0.11 -2.73 -0.04 0.00 -4.31 0.00 0.00 34.13 26.94 1x2k s GLU 17 CO 0.12 -0.29 1.53 -1.25 0.01 0.00 0.00 175.26 175.38 1x2k s PRO 18 N 1.29 4.16 0.17 0.39 0.04 -1.26 -4.90 135.00 134.88 1x2k s PRO 18 Ca 0.02 1.98 0.07 0.00 0.04 0.00 0.00 61.00 63.11 1x2k s PRO 18 Cb -0.15 -3.92 -0.02 0.00 0.04 0.00 0.00 34.50 30.45 1x2k s PRO 18 CO -0.09 -0.85 1.39 0.00 0.04 0.00 0.00 177.00 177.48 1x2k h ARG 19 N 9.25 0.03 -6.08 4.56 -0.00 -1.96 -3.45 114.38 116.72 1x2k h ARG 19 Ca -0.35 -0.03 -0.64 0.00 -0.50 0.00 0.00 59.98 58.46 1x2k h ARG 19 Cb 1.15 0.01 -0.08 0.00 0.00 0.00 0.00 29.97 31.06 1x2k h ARG 19 CO 0.96 0.89 -0.57 0.95 0.00 0.00 0.00 179.97 182.20 1x2k s THR 20 N -3.03 4.79 -1.97 2.04 -4.23 -1.26 -4.99 115.64 107.00 1x2k s THR 20 Ca -0.00 -0.61 0.16 0.00 -1.18 0.00 0.00 61.69 60.05 1x2k s THR 20 Cb 0.11 -3.30 0.44 0.00 1.34 0.00 0.00 72.50 71.08 1x2k s THR 20 CO 0.81 0.16 1.35 -0.81 -0.54 0.00 0.00 174.62 175.59 1x2k n PRO 21 N 0.52 0.47 -0.00 3.99 -0.04 -1.26 -1.84 135.00 136.84 1x2k n PRO 21 Ca -0.08 0.01 0.09 0.00 -0.04 0.00 0.00 63.50 63.47 1x2k n PRO 21 Cb 0.52 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.36 1x2k n PRO 21 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1x2k n ASP 22 N -1.01 0.82 -4.80 3.54 9.92 -1.26 -4.98 116.55 118.77 1x2k n ASP 22 Ca 0.11 -0.71 -0.27 0.00 -0.53 0.00 0.00 54.79 53.40 1x2k n ASP 22 Cb 0.06 1.21 0.09 0.00 -0.64 0.00 0.00 41.12 41.84 1x2k n ASP 22 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1x2k s GLU 23 N -2.87 1.89 -0.07 -1.24 2.02 -0.77 -2.19 118.70 115.48 1x2k s GLU 23 Ca 0.04 -0.22 0.03 0.00 0.02 0.00 0.00 54.97 54.83 1x2k s GLU 23 Cb 0.13 -2.07 -0.02 0.00 0.10 0.00 0.00 34.13 32.27 1x2k s GLU 23 CO 0.76 -1.51 -0.15 -1.17 0.02 0.00 0.00 175.26 173.21 1x2k s LEU 24 N -5.42 2.66 -0.12 1.80 2.96 0.12 -4.52 118.68 116.16 1x2k s LEU 24 Ca 0.63 -0.25 -0.09 0.00 -0.22 0.00 0.00 54.13 54.20 1x2k s LEU 24 Cb -0.10 -1.55 -0.04 0.00 0.50 0.00 0.00 46.19 45.01 1x2k s LEU 24 CO 0.47 0.30 0.18 -0.47 -1.32 0.00 0.00 176.35 175.51 1x2k s TYR 25 N -0.47 3.59 0.27 5.38 6.14 -1.26 -4.52 117.35 126.48 1x2k s TYR 25 Ca 0.06 0.57 -0.04 0.00 0.64 0.00 0.00 57.07 58.30 1x2k s TYR 25 Cb -0.12 -2.03 -0.02 0.00 0.42 0.00 0.00 41.96 40.21 1x2k s TYR 25 CO 0.02 0.65 0.34 -0.59 0.64 0.00 0.00 175.55 176.60 1x2k s PHE 26 N -0.79 0.99 0.24 4.97 -0.71 -1.24 -4.83 117.98 116.61 1x2k s PHE 26 Ca 0.15 -1.21 0.10 0.00 -1.04 0.00 0.00 56.93 54.93 1x2k s PHE 26 Cb -0.13 -0.25 -0.05 0.00 -1.21 0.00 0.00 43.02 41.39 1x2k s PHE 26 CO 0.04 -0.90 -0.19 -1.21 -1.34 0.00 0.00 175.22 171.63 1x2k s GLU 27 N -3.74 1.53 0.09 1.99 2.02 -1.26 -3.00 118.70 116.33 1x2k s GLU 27 Ca 0.32 -1.67 -0.36 0.00 0.02 0.00 0.00 54.97 53.29 1x2k s GLU 27 Cb 0.02 -1.55 -0.15 0.00 0.10 0.00 0.00 34.13 32.55 1x2k s GLU 27 CO 0.15 0.29 1.49 -1.91 0.02 0.00 0.00 175.26 175.30 1x2k n GLU 28 N -0.42 1.62 -2.06 1.61 2.13 -1.26 -2.96 120.64 119.31 1x2k n GLU 28 Ca -0.07 0.59 -0.04 0.00 0.66 0.00 0.00 57.16 58.30 1x2k n GLU 28 Cb 0.60 -2.30 0.02 0.00 0.27 0.00 0.00 31.44 30.03 1x2k n GLU 28 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1x2k n GLY 29 N 3.09 0.34 3.03 8.31 0.00 -0.28 -4.92 105.19 114.77 1x2k n GLY 29 Ca 0.18 -0.12 -0.23 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.16 1.65 -0.13 1.61 1.11 -1.15 -4.92 116.67 111.67 1x2k s ASP 30 Ca 0.09 -0.27 -0.29 0.00 0.18 0.00 0.00 52.55 52.26 1x2k s ASP 30 Cb -0.01 -0.62 -0.03 0.00 1.07 0.00 0.00 42.92 43.33 1x2k s ASP 30 CO 0.19 0.06 1.34 -0.63 1.18 0.00 0.00 175.17 177.32 1x2k s ILE 31 N 0.42 4.11 0.02 0.77 -1.09 -1.26 -2.97 121.20 121.21 1x2k s ILE 31 Ca -0.09 1.36 0.08 0.00 -2.23 0.00 0.00 60.65 59.77 1x2k s ILE 31 Cb -0.13 -3.88 -0.03 0.00 -1.58 0.00 0.00 42.46 36.85 1x2k s ILE 31 CO 0.02 -0.11 -0.24 -0.63 -1.23 0.00 0.00 174.94 172.75 1x2k s ILE 32 N 3.48 2.27 -0.45 2.92 1.01 0.11 -4.58 121.20 125.97 1x2k s ILE 32 Ca 0.59 -1.24 -0.11 0.00 0.00 0.00 0.00 60.65 59.89 1x2k s ILE 32 Cb -0.25 -1.87 0.09 0.00 0.01 0.00 0.00 42.46 40.44 1x2k s ILE 32 CO 0.19 0.43 0.32 -0.31 0.00 0.00 0.00 174.94 175.57 1x2k s TYR 33 N -0.77 3.32 -0.47 3.97 1.51 -0.74 -0.30 117.35 123.87 1x2k s TYR 33 Ca 0.12 -1.43 -0.16 0.00 -1.01 0.00 0.00 57.07 54.59 1x2k s TYR 33 Cb -0.10 -3.13 0.06 0.00 -0.11 0.00 0.00 41.96 38.68 1x2k s TYR 33 CO 0.02 -0.87 0.44 0.42 -1.11 0.00 0.00 175.55 174.45 1x2k s ILE 34 N 1.48 5.14 -0.14 2.71 -1.09 -0.55 -2.15 121.20 126.60 1x2k s ILE 34 Ca 0.04 -0.84 0.07 0.00 -2.23 0.00 0.00 60.65 57.69 1x2k s ILE 34 Cb -0.24 -4.14 -0.14 0.00 -1.58 0.00 0.00 42.46 36.36 1x2k s ILE 34 CO 0.03 -0.59 -0.04 0.35 -1.23 0.00 0.00 174.94 173.46 1x2k n THR 35 N 5.31 0.90 -3.46 2.92 -2.24 -1.24 -2.34 114.28 114.15 1x2k n THR 35 Ca -0.11 -0.47 -0.43 0.00 -2.27 0.00 0.00 64.05 60.78 1x2k n THR 35 Cb 0.45 -0.84 -0.10 0.00 -2.10 0.00 0.00 70.33 67.74 1x2k n THR 35 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1x2k s ASP 36 N -5.00 6.09 -0.37 3.42 1.01 -1.15 -4.94 116.67 115.73 1x2k s ASP 36 Ca -0.13 -1.01 0.05 0.00 0.71 0.00 0.00 52.55 52.17 1x2k s ASP 36 Cb 0.05 -2.15 0.46 0.00 1.01 0.00 0.00 42.92 42.28 1x2k s ASP 36 CO 0.46 -0.49 1.34 0.23 0.21 0.00 0.00 175.17 176.92 1x2k n MET 37 N 5.16 3.44 0.02 8.23 2.81 -1.26 -2.39 117.12 133.13 1x2k n MET 37 Ca -0.11 -4.03 -0.04 0.00 -1.81 0.00 0.00 57.70 51.71 1x2k n MET 37 Cb 0.46 -2.28 0.18 0.00 -0.71 0.00 0.00 33.22 30.87 1x2k n MET 37 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 1x2k h SER 38 N 2.17 0.47 -3.85 7.83 0.02 -1.92 -3.38 113.55 114.89 1x2k h SER 38 Ca 0.41 -0.18 -0.65 0.00 -0.84 0.00 0.00 61.79 60.54 1x2k h SER 38 Cb 1.38 -0.13 -0.40 0.00 0.14 0.00 0.00 62.40 63.38 1x2k h SER 38 CO 0.91 0.77 -0.70 -1.81 -1.14 0.00 0.00 176.83 174.86 1x2k s ASP 39 N -6.83 4.54 0.56 3.07 1.11 -1.26 -4.96 116.67 112.90 1x2k s ASP 39 Ca -0.07 -2.40 0.37 0.00 0.18 0.00 0.00 52.55 50.63 1x2k s ASP 39 Cb 0.13 -1.56 1.50 0.00 1.07 0.00 0.00 42.92 44.06 1x2k s ASP 39 CO 0.80 -0.33 1.70 0.00 1.18 0.00 0.00 175.17 178.51 1x2k h THR 40 N 6.21 0.25 0.02 -1.27 1.03 -1.97 0.31 112.91 117.50 1x2k h THR 40 Ca -0.06 0.00 -0.08 0.00 -0.01 0.00 0.00 66.41 66.26 1x2k h THR 40 Cb 0.98 0.29 0.01 0.00 -1.07 0.00 0.00 68.15 68.35 1x2k h THR 40 CO 0.57 0.00 -0.34 0.78 -0.01 0.00 0.00 175.52 176.51 1x2k h ASN 41 N 0.00 0.27 -3.72 0.00 2.35 -1.95 -3.40 115.58 109.14 1x2k h ASN 41 Ca 0.59 -0.83 -0.64 0.00 -0.55 0.00 0.00 56.30 54.87 1x2k h ASN 41 Cb 2.55 -0.08 -0.38 0.00 0.05 0.00 0.00 38.32 40.45 1x2k h ASN 41 CO -0.01 1.06 -0.77 0.26 -1.65 0.00 0.00 177.43 176.32 1x2k s TRP 42 N -2.93 3.03 0.52 1.19 0.52 0.11 -3.43 118.94 117.95 1x2k s TRP 42 Ca -0.16 -2.28 -0.02 0.00 0.02 0.00 0.00 56.10 53.67 1x2k s TRP 42 Cb 0.01 -2.04 0.01 0.00 -1.15 0.00 0.00 33.47 30.29 1x2k s TRP 42 CO 0.76 -0.86 0.77 -1.58 0.02 0.00 0.00 176.95 176.05 1x2k s TRP 43 N 1.17 3.16 -0.21 -1.98 0.51 -0.37 -4.00 118.94 117.22 1x2k s TRP 43 Ca -0.02 0.31 -0.01 0.00 -2.12 0.00 0.00 56.10 54.26 1x2k s TRP 43 Cb -0.19 -2.54 0.06 0.00 -0.81 0.00 0.00 33.47 29.98 1x2k s TRP 43 CO -0.07 -0.62 -0.01 0.21 -0.51 0.00 0.00 176.95 175.95 1x2k s LYS 44 N -4.74 1.19 0.01 4.98 2.36 -1.00 0.08 119.74 122.61 1x2k s LYS 44 Ca 0.52 -0.73 -0.00 0.00 -2.55 0.00 0.00 55.97 53.21 1x2k s LYS 44 Cb -0.10 -2.36 0.00 0.00 -1.05 0.00 0.00 37.83 34.32 1x2k s LYS 44 CO 0.40 -0.61 0.01 0.41 1.55 0.00 0.00 175.35 177.11 1x2k n GLY 45 N 4.84 3.16 2.93 5.54 0.00 -1.07 -2.94 105.19 117.65 1x2k n GLY 45 Ca -0.11 -1.39 -0.20 0.00 0.00 0.00 0.00 46.02 44.32 1x2k n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x2k s THR 46 N -2.43 0.62 0.00 2.61 2.01 -0.91 -2.30 115.64 115.24 1x2k s THR 46 Ca 0.01 -0.20 0.00 0.00 0.31 0.00 0.00 61.69 61.81 1x2k s THR 46 Cb -0.00 -0.61 0.00 0.00 0.01 0.00 0.00 72.50 71.90 1x2k s THR 46 CO 0.00 0.23 0.00 -0.24 -0.69 0.00 0.00 174.62 173.93 1x2k n SER 47 N 3.82 0.00 -4.32 3.53 2.88 -1.20 -1.80 113.62 116.54 1x2k n SER 47 Ca -0.23 0.00 -0.46 0.00 -1.33 0.00 0.00 58.87 56.85 1x2k n SER 47 Cb 0.52 -0.02 -0.05 0.00 -0.75 0.00 0.00 64.21 63.91 1x2k n SER 47 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1x2k s LYS 48 N -0.31 3.08 -0.81 -1.46 -0.14 -1.26 -4.68 119.74 114.16 1x2k s LYS 48 Ca 0.00 -1.77 -0.10 0.00 -1.36 0.00 0.00 55.97 52.74 1x2k s LYS 48 Cb 0.00 -4.32 0.10 0.00 -1.68 0.00 0.00 37.83 31.93 1x2k s LYS 48 CO 0.00 -1.35 0.25 0.41 -0.76 0.00 0.00 175.35 173.90 1x2k n GLY 49 N 5.09 -0.17 3.27 -3.33 0.00 -1.26 -4.80 105.19 103.99 1x2k n GLY 49 Ca -0.10 0.03 -0.09 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.76 1.00 -0.22 1.61 0.52 -1.26 -5.15 118.95 111.69 1x2k s ARG 50 Ca 0.35 -1.10 -0.04 0.00 -0.52 0.00 0.00 55.73 54.42 1x2k s ARG 50 Cb -0.20 0.35 0.09 0.00 0.52 0.00 0.00 34.95 35.71 1x2k s ARG 50 CO 0.44 -0.34 0.16 0.99 0.02 0.00 0.00 175.30 176.57 1x2k s THR 51 N -3.93 -0.18 0.08 0.02 2.01 -1.26 -3.21 115.64 109.16 1x2k s THR 51 Ca 0.12 -0.31 -0.02 0.00 0.31 0.00 0.00 61.69 61.80 1x2k s THR 51 Cb 0.04 -0.73 0.01 0.00 0.01 0.00 0.00 72.50 71.83 1x2k s THR 51 CO -0.05 -0.37 0.13 0.61 -0.69 0.00 0.00 174.62 174.25 1x2k n GLY 52 N 5.29 2.35 3.78 4.40 0.00 -0.97 -4.97 105.19 115.06 1x2k n GLY 52 Ca -0.06 -1.24 -0.37 0.00 0.00 0.00 0.00 46.02 44.35 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 4.16 -0.02 0.99 1.43 -0.93 -2.58 118.68 121.73 1x2k s LEU 53 Ca 0.05 2.16 0.01 0.00 -1.03 0.00 0.00 54.13 55.31 1x2k s LEU 53 Cb -0.01 -4.13 0.01 0.00 0.03 0.00 0.00 46.19 42.10 1x2k s LEU 53 CO 0.03 -0.57 -0.04 -0.63 0.23 0.00 0.00 176.35 175.37 1x2k s ILE 54 N -1.56 0.35 -0.06 -0.59 1.01 0.11 0.14 121.20 120.61 1x2k s ILE 54 Ca 0.58 -0.12 -0.30 0.00 0.00 0.00 0.00 60.65 60.81 1x2k s ILE 54 Cb -0.25 -0.35 -0.05 0.00 0.01 0.00 0.00 42.46 41.82 1x2k s ILE 54 CO 0.32 0.14 1.49 -2.16 0.00 0.00 0.00 174.94 174.73 1x2k s PRO 55 N 0.36 4.22 0.00 2.79 0.04 -1.26 -1.24 135.00 139.91 1x2k s PRO 55 Ca -0.04 2.01 0.20 0.00 0.04 0.00 0.00 61.00 63.21 1x2k s PRO 55 Cb -0.07 -3.80 1.17 0.00 0.04 0.00 0.00 34.50 31.85 1x2k s PRO 55 CO -0.00 -0.73 1.64 -1.13 0.04 0.00 0.00 177.00 176.81 1x2k n SER 56 N 6.42 0.00 0.01 6.66 3.41 -1.22 -2.63 113.62 126.27 1x2k n SER 56 Ca 0.15 -1.00 0.05 0.00 -0.26 0.00 0.00 58.87 57.81 1x2k n SER 56 Cb 0.43 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.28 1x2k n SER 56 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1x2k n ASN 57 N -0.88 0.42 -0.02 4.04 3.02 -1.26 -4.27 115.26 116.30 1x2k n ASN 57 Ca 0.15 0.17 -0.11 0.00 -0.03 0.00 0.00 54.58 54.77 1x2k n ASN 57 Cb 0.07 1.01 -0.14 0.00 -0.61 0.00 0.00 39.78 40.10 1x2k n ASN 57 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1x2k n TYR 58 N -2.60 1.00 -3.47 3.10 4.02 -1.08 -4.94 117.16 113.19 1x2k n TYR 58 Ca -0.09 0.33 -0.19 0.00 -0.01 0.00 0.00 57.90 57.94 1x2k n TYR 58 Cb 0.73 -1.18 -0.01 0.00 -0.02 0.00 0.00 39.34 38.86 1x2k n TYR 58 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1x2k s VAL 59 N -2.59 3.50 -0.16 -0.72 -7.23 -1.19 -0.12 120.40 111.89 1x2k s VAL 59 Ca -0.08 -1.14 -0.20 0.00 -1.81 0.00 0.00 61.98 58.75 1x2k s VAL 59 Cb 0.08 -3.20 0.05 0.00 0.56 0.00 0.00 36.38 33.86 1x2k s VAL 59 CO 0.82 -0.11 0.54 0.00 -0.31 0.00 0.00 175.10 176.04 1x2k s ALA 60 N -2.29 -1.34 -0.55 1.32 0.00 -1.13 -4.84 121.76 112.92 1x2k s ALA 60 Ca 0.47 1.36 -0.34 0.00 0.00 0.00 0.00 51.96 53.44 1x2k s ALA 60 Cb -0.08 -0.64 -0.14 0.00 0.00 0.00 0.00 23.12 22.26 1x2k s ALA 60 CO 0.30 -0.28 2.35 -1.91 0.00 0.00 0.00 175.76 176.22 1x2k n GLU 61 N 2.31 0.65 -1.59 0.00 2.13 -1.26 -3.46 120.64 119.42 1x2k n GLU 61 Ca -0.15 0.13 -0.59 0.00 0.66 0.00 0.00 57.16 57.20 1x2k n GLU 61 Cb 0.56 -2.26 -0.09 0.00 0.27 0.00 0.00 31.44 29.93 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 0.70 -1.68 5.31 1.13 -1.20 -4.82 117.38 125.14 1x2k n GLN 62 Ca 0.49 0.24 -0.44 0.00 -1.94 0.00 0.00 57.00 55.35 1x2k n GLN 62 Cb 0.20 -1.94 -0.02 0.00 0.11 0.00 0.00 30.24 28.59 1x2k n GLN 62 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 1x2k n SER 63 N 6.25 2.76 0.00 1.08 7.64 -1.26 -4.85 113.62 125.23 1x2k n SER 63 Ca 0.35 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.39 1x2k n SER 63 Cb 0.08 -1.45 0.00 0.00 -1.01 0.00 0.00 64.21 61.83 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 1.74 -0.95 0.27 0.23 0.00 -1.26 -5.03 105.19 100.19 1x2k n GLY 64 Ca 0.09 0.42 0.16 0.00 0.00 0.00 0.00 46.02 46.70 1x2k n GLY 64 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x2k h PRO 65 N 0.00 0.00 -6.13 1.61 0.13 -2.01 -3.46 132.00 122.14 1x2k h PRO 65 Ca 0.00 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.58 1x2k h PRO 65 Cb 0.00 0.00 0.23 0.00 0.13 0.00 0.00 31.00 31.36 1x2k h PRO 65 CO 0.00 0.05 -1.58 0.43 -0.23 0.00 0.00 178.00 176.66 1x2k n SER 66 N -3.17 -5.15 -3.77 1.44 7.64 -1.26 -4.97 113.62 104.38 1x2k n SER 66 Ca 0.00 0.25 -0.30 0.00 1.01 0.00 0.00 58.87 59.84 1x2k n SER 66 Cb 0.31 -0.85 -0.15 0.00 -1.01 0.00 0.00 64.21 62.52 1x2k n SER 66 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x2k s SER 67 N -1.16 3.86 0.00 6.43 0.01 -1.26 -5.26 113.70 116.31 1x2k s SER 67 Ca 0.44 -1.48 0.20 0.00 1.31 0.00 0.00 55.95 56.42 1x2k s SER 67 Cb -0.21 -0.89 0.15 0.00 0.21 0.00 0.00 66.02 65.29 1x2k s SER 67 CO 0.79 -0.38 1.12 0.61 0.41 0.00 0.00 173.24 175.79