#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x2k s SER 2 N 0.00 6.47 -1.20 1.61 0.15 -1.26 -4.99 113.70 114.48 1x2k s SER 2 Ca 0.00 0.37 -0.13 0.00 0.70 0.00 0.00 55.95 56.89 1x2k s SER 2 Cb 0.00 -2.33 0.18 0.00 -1.71 0.00 0.00 66.02 62.17 1x2k s SER 2 CO 0.00 -0.49 1.41 -1.20 1.20 0.00 0.00 173.24 174.16 1x2k n SER 3 N 5.89 5.25 0.00 5.45 7.64 -1.26 -4.79 113.62 131.80 1x2k n SER 3 Ca -0.01 -2.98 0.00 0.00 1.01 0.00 0.00 58.87 56.88 1x2k n SER 3 Cb 0.49 -1.55 0.00 0.00 -1.01 0.00 0.00 64.21 62.13 1x2k n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x2k n GLY 4 N 3.95 3.83 3.39 0.23 0.00 -1.26 -5.03 105.19 110.30 1x2k n GLY 4 Ca 0.36 -1.01 -0.45 0.00 0.00 0.00 0.00 46.02 44.91 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 0.00 6.83 -1.05 1.61 0.01 -1.26 -4.97 113.70 114.87 1x2k s SER 5 Ca 0.00 -2.64 -0.23 0.00 1.31 0.00 0.00 55.95 54.39 1x2k s SER 5 Cb 0.00 -2.29 -0.04 0.00 0.21 0.00 0.00 66.02 63.90 1x2k s SER 5 CO 0.00 -0.71 1.86 -0.55 0.41 0.00 0.00 173.24 174.25 1x2k s SER 6 N 2.60 5.42 -0.00 2.44 0.15 -1.26 -4.90 113.70 118.14 1x2k s SER 6 Ca 0.27 -1.26 -0.01 0.00 0.70 0.00 0.00 55.95 55.65 1x2k s SER 6 Cb -0.08 -2.57 -0.00 0.00 -1.71 0.00 0.00 66.02 61.66 1x2k s SER 6 CO -0.08 -2.57 0.03 -0.83 1.20 0.00 0.00 173.24 170.99 1x2k s GLY 7 N 6.81 0.05 0.44 9.45 0.00 -1.26 -4.85 107.32 117.96 1x2k s GLY 7 Ca 0.65 -0.10 -0.15 0.00 0.00 0.00 0.00 44.72 45.12 1x2k s GLY 7 CO 0.04 -0.14 0.87 0.54 0.00 0.00 0.00 173.10 174.40 1x2k s LYS 8 N -0.50 3.92 -0.33 2.90 1.02 -1.08 -4.88 119.74 120.79 1x2k s LYS 8 Ca -0.06 0.76 -0.06 0.00 0.02 0.00 0.00 55.97 56.64 1x2k s LYS 8 Cb -0.04 -2.27 0.04 0.00 -0.52 0.00 0.00 37.83 35.04 1x2k s LYS 8 CO -0.00 -0.10 0.08 0.08 -0.92 0.00 0.00 175.35 174.49 1x2k s VAL 9 N -2.40 3.65 -0.04 3.17 1.01 -1.26 -1.37 120.40 123.15 1x2k s VAL 9 Ca 0.56 -1.14 0.00 0.00 0.00 0.00 0.00 61.98 61.40 1x2k s VAL 9 Cb -0.10 -3.05 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 1x2k s VAL 9 CO 0.28 -0.14 -0.01 -0.36 0.00 0.00 0.00 175.10 174.86 1x2k s PHE 10 N 1.38 3.08 -0.05 5.22 0.40 -0.13 -2.62 117.98 125.25 1x2k s PHE 10 Ca -0.02 0.11 -0.00 0.00 -0.60 0.00 0.00 56.93 56.42 1x2k s PHE 10 Cb -0.19 -1.72 -0.03 0.00 0.51 0.00 0.00 43.02 41.58 1x2k s PHE 10 CO 0.02 0.44 0.00 0.50 0.70 0.00 0.00 175.22 176.88 1x2k s ARG 11 N -1.16 2.90 -0.56 0.44 3.52 -1.18 -0.81 118.95 122.09 1x2k s ARG 11 Ca 0.16 -0.49 -0.28 0.00 -0.13 0.00 0.00 55.73 54.98 1x2k s ARG 11 Cb -0.11 -2.74 0.03 0.00 -1.56 0.00 0.00 34.95 30.56 1x2k s ARG 11 CO 0.06 0.67 1.24 0.00 -0.81 0.00 0.00 175.30 176.45 1x2k s ALA 12 N -0.97 2.97 0.53 6.12 0.00 -1.14 -2.99 121.76 126.28 1x2k s ALA 12 Ca 0.16 -0.75 0.21 0.00 0.00 0.00 0.00 51.96 51.58 1x2k s ALA 12 Cb -0.11 -4.04 1.35 0.00 0.00 0.00 0.00 23.12 20.31 1x2k s ALA 12 CO 0.06 -2.68 2.08 -0.07 0.00 0.00 0.00 175.76 175.15 1x2k h LEU 13 N 12.11 0.00 -7.33 0.00 3.38 -1.70 -0.60 115.31 121.17 1x2k h LEU 13 Ca -0.25 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 1x2k h LEU 13 Cb 1.06 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.71 1x2k h LEU 13 CO 1.18 0.00 0.13 -0.31 0.09 0.00 0.00 178.44 179.52 1x2k s TYR 14 N -5.03 -0.35 0.01 1.13 1.51 -1.26 -4.75 117.35 108.61 1x2k s TYR 14 Ca -0.05 0.06 -0.30 0.00 -1.01 0.00 0.00 57.07 55.77 1x2k s TYR 14 Cb 0.18 0.49 -0.07 0.00 -0.11 0.00 0.00 41.96 42.45 1x2k s TYR 14 CO 0.69 -0.89 1.78 0.99 -1.11 0.00 0.00 175.55 177.02 1x2k s THR 15 N -3.81 3.23 0.08 -0.71 2.01 -1.26 -4.28 115.64 110.89 1x2k s THR 15 Ca 0.04 0.38 0.06 0.00 0.31 0.00 0.00 61.69 62.49 1x2k s THR 15 Cb -0.01 -3.25 -0.04 0.00 0.01 0.00 0.00 72.50 69.21 1x2k s THR 15 CO -0.08 -0.03 -0.10 0.12 -0.69 0.00 0.00 174.62 173.84 1x2k s PHE 16 N 3.89 2.75 -0.19 4.92 5.36 -1.14 -4.93 117.98 128.64 1x2k s PHE 16 Ca 0.79 -0.14 0.01 0.00 -0.96 0.00 0.00 56.93 56.63 1x2k s PHE 16 Cb -0.39 -1.47 0.02 0.00 -0.34 0.00 0.00 43.02 40.85 1x2k s PHE 16 CO 0.35 0.40 -0.19 -1.21 -1.46 0.00 0.00 175.22 173.11 1x2k s GLU 17 N -1.98 2.94 -0.06 10.12 2.02 -1.26 -3.73 118.70 126.75 1x2k s GLU 17 Ca 0.20 -0.87 -0.30 0.00 0.02 0.00 0.00 54.97 54.03 1x2k s GLU 17 Cb -0.11 -2.62 -0.05 0.00 0.10 0.00 0.00 34.13 31.46 1x2k s GLU 17 CO 0.12 -0.24 1.49 -1.25 0.02 0.00 0.00 175.26 175.40 1x2k s PRO 18 N 1.28 4.22 0.19 0.39 0.04 -1.26 -4.91 135.00 134.95 1x2k s PRO 18 Ca 0.04 2.01 0.06 0.00 0.04 0.00 0.00 61.00 63.14 1x2k s PRO 18 Cb -0.14 -3.81 0.06 0.00 0.04 0.00 0.00 34.50 30.66 1x2k s PRO 18 CO -0.12 -0.74 1.43 0.00 0.04 0.00 0.00 177.00 177.61 1x2k h ARG 19 N 8.72 0.11 -6.24 4.56 2.47 -1.97 -3.45 114.38 118.57 1x2k h ARG 19 Ca -0.36 -0.11 -0.64 0.00 -1.26 0.00 0.00 59.98 57.61 1x2k h ARG 19 Cb 1.16 0.03 -0.10 0.00 -1.65 0.00 0.00 29.97 29.41 1x2k h ARG 19 CO 0.94 0.86 -0.62 0.95 0.56 0.00 0.00 179.97 182.67 1x2k s THR 20 N -3.24 4.34 -2.00 2.04 -4.23 -1.26 -4.99 115.64 106.29 1x2k s THR 20 Ca -0.02 -0.87 0.12 0.00 -1.18 0.00 0.00 61.69 59.74 1x2k s THR 20 Cb 0.11 -3.09 0.34 0.00 1.34 0.00 0.00 72.50 71.19 1x2k s THR 20 CO 0.81 0.10 1.14 -0.81 -0.54 0.00 0.00 174.62 175.32 1x2k n PRO 21 N 0.43 0.48 -0.01 3.99 -0.04 -1.26 -1.95 135.00 136.65 1x2k n PRO 21 Ca -0.09 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.47 1x2k n PRO 21 Cb 0.52 -1.38 -0.15 0.00 -0.04 0.00 0.00 33.50 32.44 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 -0.88 0.45 -4.78 3.54 8.00 -1.26 -4.98 116.55 116.63 1x2k n ASP 22 Ca 0.09 -0.14 -0.29 0.00 0.71 0.00 0.00 54.79 55.16 1x2k n ASP 22 Cb 0.04 1.79 0.11 0.00 -0.02 0.00 0.00 41.12 43.04 1x2k n ASP 22 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1x2k s GLU 23 N -3.33 1.65 -0.11 -1.24 2.02 -0.82 -2.62 118.70 114.25 1x2k s GLU 23 Ca -0.05 0.07 0.00 0.00 0.02 0.00 0.00 54.97 55.01 1x2k s GLU 23 Cb 0.13 -1.92 -0.02 0.00 0.10 0.00 0.00 34.13 32.43 1x2k s GLU 23 CO 0.84 -1.81 -0.12 -1.17 0.02 0.00 0.00 175.26 173.02 1x2k s LEU 24 N -5.70 2.82 -0.09 1.80 2.96 0.39 -4.57 118.68 116.29 1x2k s LEU 24 Ca 0.64 -0.26 -0.17 0.00 -0.22 0.00 0.00 54.13 54.12 1x2k s LEU 24 Cb -0.11 -1.63 -0.05 0.00 0.50 0.00 0.00 46.19 44.91 1x2k s LEU 24 CO 0.50 0.21 0.44 -0.47 -1.32 0.00 0.00 176.35 175.71 1x2k s TYR 25 N 0.07 3.56 0.21 5.38 6.14 -1.26 -4.61 117.35 126.84 1x2k s TYR 25 Ca -0.05 0.88 -0.00 0.00 0.64 0.00 0.00 57.07 58.54 1x2k s TYR 25 Cb -0.14 -2.46 -0.04 0.00 0.42 0.00 0.00 41.96 39.73 1x2k s TYR 25 CO 0.04 0.29 0.12 -0.59 0.64 0.00 0.00 175.55 176.05 1x2k s PHE 26 N 0.20 1.23 0.27 4.97 -0.71 -1.24 -4.87 117.98 117.83 1x2k s PHE 26 Ca 0.24 -1.32 0.09 0.00 -1.04 0.00 0.00 56.93 54.90 1x2k s PHE 26 Cb -0.15 -0.63 -0.05 0.00 -1.21 0.00 0.00 43.02 40.97 1x2k s PHE 26 CO 0.10 -0.56 -0.14 -1.21 -1.34 0.00 0.00 175.22 172.07 1x2k s GLU 27 N -4.12 1.59 0.03 1.99 2.02 -1.26 -2.89 118.70 116.06 1x2k s GLU 27 Ca 0.38 -1.76 -0.36 0.00 0.02 0.00 0.00 54.97 53.25 1x2k s GLU 27 Cb 0.07 -1.48 -0.15 0.00 0.10 0.00 0.00 34.13 32.67 1x2k s GLU 27 CO 0.12 0.20 1.51 -1.91 0.02 0.00 0.00 175.26 175.20 1x2k n GLU 28 N -0.58 1.49 -2.33 1.61 2.13 -1.26 -2.56 120.64 119.13 1x2k n GLU 28 Ca -0.06 0.54 -0.05 0.00 0.66 0.00 0.00 57.16 58.25 1x2k n GLU 28 Cb 0.61 -2.24 0.03 0.00 0.27 0.00 0.00 31.44 30.11 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 3.17 0.20 3.03 8.31 0.00 -0.23 -4.95 105.19 114.71 1x2k n GLY 29 Ca 0.20 -0.19 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.34 2.31 0.28 1.61 1.11 -1.06 -4.92 116.67 112.66 1x2k s ASP 30 Ca 0.05 -0.39 -0.29 0.00 0.18 0.00 0.00 52.55 52.10 1x2k s ASP 30 Cb -0.01 -1.02 -0.10 0.00 1.07 0.00 0.00 42.92 42.87 1x2k s ASP 30 CO 0.24 -0.01 1.37 -0.63 1.18 0.00 0.00 175.17 177.32 1x2k s ILE 31 N 1.07 2.76 0.01 0.77 -1.09 -1.26 -2.89 121.20 120.57 1x2k s ILE 31 Ca -0.05 0.68 0.02 0.00 -2.23 0.00 0.00 60.65 59.07 1x2k s ILE 31 Cb -0.15 -3.44 -0.01 0.00 -1.58 0.00 0.00 42.46 37.29 1x2k s ILE 31 CO -0.02 0.13 -0.06 -0.63 -1.23 0.00 0.00 174.94 173.13 1x2k s ILE 32 N -0.48 0.42 -0.40 2.92 1.01 0.01 -4.62 121.20 120.06 1x2k s ILE 32 Ca 0.54 -0.49 -0.11 0.00 0.00 0.00 0.00 60.65 60.60 1x2k s ILE 32 Cb -0.40 -0.40 0.05 0.00 0.01 0.00 0.00 42.46 41.72 1x2k s ILE 32 CO 0.47 -0.06 0.24 -0.31 0.00 0.00 0.00 174.94 175.28 1x2k s TYR 33 N -0.53 3.28 -0.47 3.97 1.51 -0.32 -0.96 117.35 123.83 1x2k s TYR 33 Ca -0.02 -1.17 -0.10 0.00 -1.01 0.00 0.00 57.07 54.76 1x2k s TYR 33 Cb -0.05 -2.68 0.11 0.00 -0.11 0.00 0.00 41.96 39.23 1x2k s TYR 33 CO -0.00 -0.74 0.35 0.42 -1.11 0.00 0.00 175.55 174.47 1x2k s ILE 34 N 1.51 4.41 -0.25 2.71 -1.09 -0.47 -1.18 121.20 126.84 1x2k s ILE 34 Ca 0.02 -1.61 -0.02 0.00 -2.23 0.00 0.00 60.65 56.81 1x2k s ILE 34 Cb -0.21 -3.82 -0.17 0.00 -1.58 0.00 0.00 42.46 36.68 1x2k s ILE 34 CO 0.05 -0.71 -0.19 0.35 -1.23 0.00 0.00 174.94 173.21 1x2k n THR 35 N 4.97 1.52 -3.55 2.92 -2.24 -1.23 -2.63 114.28 114.05 1x2k n THR 35 Ca -0.09 -0.53 -0.37 0.00 -2.27 0.00 0.00 64.05 60.78 1x2k n THR 35 Cb 0.41 -1.54 -0.09 0.00 -2.10 0.00 0.00 70.33 67.01 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 -6.75 6.26 -0.24 3.42 -1.08 -1.19 -4.96 116.67 112.12 1x2k s ASP 36 Ca -0.35 0.29 0.13 0.00 -0.52 0.00 0.00 52.55 52.11 1x2k s ASP 36 Cb 0.10 -2.16 0.46 0.00 -1.46 0.00 0.00 42.92 39.86 1x2k s ASP 36 CO 0.59 0.01 1.17 0.23 0.52 0.00 0.00 175.17 177.70 1x2k n MET 37 N 4.34 2.43 -0.04 4.34 2.81 -1.26 -2.50 117.12 127.24 1x2k n MET 37 Ca -0.12 -3.64 0.05 0.00 -1.81 0.00 0.00 57.70 52.18 1x2k n MET 37 Cb 0.52 -1.77 0.42 0.00 -0.71 0.00 0.00 33.22 31.67 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 1.94 0.49 -3.55 7.83 0.02 -1.93 -3.38 113.55 114.98 1x2k h SER 38 Ca 0.12 -0.01 -0.64 0.00 -0.84 0.00 0.00 61.79 60.42 1x2k h SER 38 Cb 1.41 -0.12 -0.37 0.00 0.14 0.00 0.00 62.40 63.46 1x2k h SER 38 CO 0.41 0.34 -0.81 -1.81 -1.14 0.00 0.00 176.83 173.82 1x2k s ASP 39 N -6.55 3.78 0.52 3.07 1.11 -1.26 -4.99 116.67 112.36 1x2k s ASP 39 Ca -0.08 -1.06 0.18 0.00 0.18 0.00 0.00 52.55 51.76 1x2k s ASP 39 Cb 0.18 -1.38 1.31 0.00 1.07 0.00 0.00 42.92 44.10 1x2k s ASP 39 CO 0.74 -0.15 2.14 0.71 1.18 0.00 0.00 175.17 179.80 1x2k h THR 40 N 6.48 0.95 -0.08 -1.27 1.35 -1.99 -2.20 112.91 116.15 1x2k h THR 40 Ca -0.27 -0.09 -0.22 0.00 -0.55 0.00 0.00 66.41 65.28 1x2k h THR 40 Cb 1.08 1.05 0.01 0.00 -1.73 0.00 0.00 68.15 68.57 1x2k h THR 40 CO 0.49 0.03 -0.81 0.78 -0.25 0.00 0.00 175.52 175.76 1x2k h ASN 41 N 0.00 0.85 -3.40 5.36 4.21 -1.94 -3.37 115.58 117.29 1x2k h ASN 41 Ca -0.00 -0.68 -0.57 0.00 1.21 0.00 0.00 56.30 56.26 1x2k h ASN 41 Cb 0.05 -0.26 -0.39 0.00 -1.12 0.00 0.00 38.32 36.60 1x2k h ASN 41 CO 0.00 1.40 -0.77 0.26 -1.29 0.00 0.00 177.43 177.04 1x2k s TRP 42 N -3.54 1.71 0.09 1.19 0.52 -0.83 -3.87 118.94 114.21 1x2k s TRP 42 Ca -0.11 -1.39 -0.09 0.00 0.02 0.00 0.00 56.10 54.53 1x2k s TRP 42 Cb 0.07 -1.39 -0.06 0.00 -1.15 0.00 0.00 33.47 30.95 1x2k s TRP 42 CO 0.89 -0.72 0.41 -1.58 0.02 0.00 0.00 176.95 175.97 1x2k s TRP 43 N 1.62 3.57 -0.39 -1.98 0.51 0.11 -4.05 118.94 118.33 1x2k s TRP 43 Ca -0.01 0.78 -0.13 0.00 -2.12 0.00 0.00 56.10 54.62 1x2k s TRP 43 Cb -0.18 -2.15 0.02 0.00 -0.81 0.00 0.00 33.47 30.35 1x2k s TRP 43 CO -0.10 0.50 0.25 0.21 -0.51 0.00 0.00 176.95 177.30 1x2k s LYS 44 N -2.02 2.97 0.25 4.98 2.20 -1.04 0.15 119.74 127.23 1x2k s LYS 44 Ca 0.34 -1.00 -0.08 0.00 -0.36 0.00 0.00 55.97 54.87 1x2k s LYS 44 Cb -0.14 -3.86 -0.01 0.00 -1.51 0.00 0.00 37.83 32.32 1x2k s LYS 44 CO 0.19 -0.69 0.40 0.20 -0.36 0.00 0.00 175.35 175.09 1x2k s GLY 45 N 1.63 0.90 -0.13 5.54 0.00 -0.87 -3.16 107.32 111.24 1x2k s GLY 45 Ca 0.04 -1.17 0.01 0.00 0.00 0.00 0.00 44.72 43.60 1x2k s GLY 45 CO 0.09 -0.86 -0.18 -1.59 0.00 0.00 0.00 173.10 170.56 1x2k s THR 46 N -3.87 2.58 0.00 0.90 2.01 -0.33 -2.17 115.64 114.76 1x2k s THR 46 Ca 0.27 -0.82 0.00 0.00 0.31 0.00 0.00 61.69 61.45 1x2k s THR 46 Cb 0.01 -2.05 0.00 0.00 0.01 0.00 0.00 72.50 70.47 1x2k s THR 46 CO 0.12 0.54 0.00 -0.24 -0.69 0.00 0.00 174.62 174.34 1x2k n SER 47 N 3.67 0.00 -4.32 3.53 2.88 -1.22 -1.17 113.62 116.99 1x2k n SER 47 Ca -0.19 0.00 -0.46 0.00 -1.33 0.00 0.00 58.87 56.89 1x2k n SER 47 Cb 0.53 -0.05 -0.04 0.00 -0.75 0.00 0.00 64.21 63.89 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 -0.31 3.10 -0.82 -1.46 2.47 -1.26 -4.68 119.74 116.78 1x2k s LYS 48 Ca 0.00 -1.79 -0.10 0.00 -1.56 0.00 0.00 55.97 52.51 1x2k s LYS 48 Cb 0.00 -4.32 0.10 0.00 -1.46 0.00 0.00 37.83 32.15 1x2k s LYS 48 CO 0.00 -1.35 0.26 0.41 0.16 0.00 0.00 175.35 174.83 1x2k n GLY 49 N 5.05 -0.18 3.45 5.54 0.00 -1.26 -4.78 105.19 113.02 1x2k n GLY 49 Ca -0.09 0.03 -0.12 0.00 0.00 0.00 0.00 46.02 45.84 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 -3.73 1.63 -0.22 1.61 1.81 -1.26 -5.15 118.95 113.64 1x2k s ARG 50 Ca 0.37 -1.57 -0.04 0.00 -1.72 0.00 0.00 55.73 52.77 1x2k s ARG 50 Cb -0.21 0.41 0.10 0.00 -0.45 0.00 0.00 34.95 34.79 1x2k s ARG 50 CO 0.45 -0.65 0.22 0.99 -0.68 0.00 0.00 175.30 175.63 1x2k s THR 51 N -3.63 -0.31 0.25 0.02 2.01 -1.26 -3.40 115.64 109.32 1x2k s THR 51 Ca 0.30 -0.19 -0.04 0.00 0.31 0.00 0.00 61.69 62.07 1x2k s THR 51 Cb 0.01 -0.72 0.02 0.00 0.01 0.00 0.00 72.50 71.81 1x2k s THR 51 CO 0.15 -0.27 0.40 0.61 -0.69 0.00 0.00 174.62 174.83 1x2k n GLY 52 N 5.31 2.06 3.80 4.40 0.00 -0.92 -4.98 105.19 114.86 1x2k n GLY 52 Ca -0.05 -1.42 -0.33 0.00 0.00 0.00 0.00 46.02 44.22 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 3.48 -0.08 0.99 1.43 -1.08 -2.05 118.68 121.37 1x2k s LEU 53 Ca 0.17 1.85 -0.06 0.00 -1.03 0.00 0.00 54.13 55.06 1x2k s LEU 53 Cb -0.02 -4.54 0.03 0.00 0.03 0.00 0.00 46.19 41.70 1x2k s LEU 53 CO 0.12 -1.24 0.21 -0.63 0.23 0.00 0.00 176.35 175.04 1x2k s ILE 54 N -2.43 -0.02 -0.08 -0.59 1.01 0.40 -0.46 121.20 119.03 1x2k s ILE 54 Ca 0.64 0.06 -0.30 0.00 0.00 0.00 0.00 60.65 61.06 1x2k s ILE 54 Cb -0.17 -0.31 -0.04 0.00 0.01 0.00 0.00 42.46 41.95 1x2k s ILE 54 CO 0.38 0.03 1.51 -2.16 0.00 0.00 0.00 174.94 174.69 1x2k s PRO 55 N 0.56 4.21 0.00 2.79 0.04 -1.26 -0.71 135.00 140.63 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 -0.05 -3.86 1.08 0.00 0.04 0.00 0.00 34.50 31.71 1x2k s PRO 55 CO -0.03 -0.77 1.60 -1.13 0.04 0.00 0.00 177.00 176.71 1x2k n SER 56 N 6.72 0.00 0.03 6.66 3.41 -1.25 -2.65 113.62 126.54 1x2k n SER 56 Ca 0.16 -0.29 -0.16 0.00 -0.26 0.00 0.00 58.87 58.31 1x2k n SER 56 Cb 0.43 -0.15 -0.14 0.00 -0.26 0.00 0.00 64.21 64.09 1x2k n SER 56 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1x2k h ASN 57 N 0.00 0.30 0.22 4.04 2.35 -1.88 -3.38 115.58 117.23 1x2k h ASN 57 Ca 0.00 -0.53 -0.29 0.00 -0.55 0.00 0.00 56.30 54.94 1x2k h ASN 57 Cb 0.10 -0.10 0.03 0.00 0.05 0.00 0.00 38.32 38.40 1x2k h ASN 57 CO 0.00 1.46 -1.26 1.88 -1.65 0.00 0.00 177.43 177.86 1x2k h TYR 58 N 0.05 0.83 -2.75 1.19 -1.99 -1.91 -3.46 116.97 108.93 1x2k h TYR 58 Ca -0.30 -0.61 -0.51 0.00 2.00 0.00 0.00 58.73 59.31 1x2k h TYR 58 Cb 2.02 -0.03 -0.01 0.00 2.00 0.00 0.00 36.73 40.71 1x2k h TYR 58 CO 0.05 1.48 -0.30 0.14 -0.00 0.00 0.00 178.16 179.53 1x2k s VAL 59 N -2.54 5.18 0.01 -2.88 -7.23 -1.12 -1.77 120.40 110.05 1x2k s VAL 59 Ca -0.11 -0.47 -0.13 0.00 -1.81 0.00 0.00 61.98 59.46 1x2k s VAL 59 Cb 0.03 -3.78 0.02 0.00 0.56 0.00 0.00 36.38 33.20 1x2k s VAL 59 CO 0.91 -0.30 0.28 0.00 -0.31 0.00 0.00 175.10 175.68 1x2k s ALA 60 N -2.01 -0.68 -0.48 1.32 0.00 -1.16 -4.72 121.76 114.04 1x2k s ALA 60 Ca 0.38 0.14 -0.34 0.00 0.00 0.00 0.00 51.96 52.14 1x2k s ALA 60 Cb -0.10 0.17 -0.13 0.00 0.00 0.00 0.00 23.12 23.05 1x2k s ALA 60 CO 0.31 -0.31 2.29 -1.91 0.00 0.00 0.00 175.76 176.14 1x2k n GLU 61 N 1.04 0.82 -0.85 0.00 2.13 -1.26 -3.13 120.64 119.39 1x2k n GLU 61 Ca -0.21 0.18 -0.35 0.00 0.66 0.00 0.00 57.16 57.45 1x2k n GLU 61 Cb 0.57 -2.38 0.10 0.00 0.27 0.00 0.00 31.44 30.00 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 8.30 -0.56 -4.04 5.31 1.13 -1.08 -4.96 117.38 121.48 1x2k n GLN 62 Ca 0.45 -0.15 -0.23 0.00 -1.94 0.00 0.00 57.00 55.14 1x2k n GLN 62 Cb 0.22 -1.44 -0.06 0.00 0.11 0.00 0.00 30.24 29.07 1x2k n GLN 62 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1x2k s SER 63 N -1.53 4.62 0.07 1.08 1.04 -1.26 -5.06 113.70 112.66 1x2k s SER 63 Ca 0.48 -0.89 0.01 0.00 0.48 0.00 0.00 55.95 56.04 1x2k s SER 63 Cb -0.11 -0.61 -0.03 0.00 0.10 0.00 0.00 66.02 65.37 1x2k s SER 63 CO 0.70 -0.43 -0.06 -0.83 0.98 0.00 0.00 173.24 173.60 1x2k s GLY 64 N -3.90 0.59 0.22 7.32 0.00 -1.26 -5.03 107.32 105.26 1x2k s GLY 64 Ca 0.40 -1.10 0.22 0.00 0.00 0.00 0.00 44.72 44.24 1x2k s GLY 64 CO 0.23 -1.19 1.67 -1.55 0.00 0.00 0.00 173.10 172.26 1x2k n PRO 65 N 0.53 0.16 -4.46 2.90 -0.04 -1.26 -4.79 135.00 128.05 1x2k n PRO 65 Ca -0.16 0.40 -0.22 0.00 -0.04 0.00 0.00 63.50 63.47 1x2k n PRO 65 Cb 0.59 -1.81 -0.09 0.00 -0.04 0.00 0.00 33.50 32.14 1x2k n PRO 65 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1x2k s SER 66 N -4.05 2.36 -0.16 3.54 1.04 -1.26 -5.10 113.70 110.07 1x2k s SER 66 Ca 0.05 -1.52 -0.14 0.00 0.48 0.00 0.00 55.95 54.82 1x2k s SER 66 Cb 0.09 0.23 -0.05 0.00 0.10 0.00 0.00 66.02 66.39 1x2k s SER 66 CO 0.37 -0.78 -0.28 -0.24 0.98 0.00 0.00 173.24 173.30 1x2k n SER 67 N -0.93 1.83 0.00 7.02 2.88 -1.26 -5.16 113.62 118.00 1x2k n SER 67 Ca -0.03 0.44 0.00 0.00 -1.33 0.00 0.00 58.87 57.95 1x2k n SER 67 Cb 0.66 -0.78 0.00 0.00 -0.75 0.00 0.00 64.21 63.33 1x2k n SER 67 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42