#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uew s SER 2 N 0.00 7.13 0.02 1.61 0.01 -1.26 -5.06 113.70 116.16 1uew s SER 2 Ca 0.00 2.25 0.00 0.00 1.31 0.00 0.00 55.95 59.52 1uew s SER 2 Cb 0.00 -2.61 -0.00 0.00 0.21 0.00 0.00 66.02 63.61 1uew s SER 2 CO 0.00 -0.31 0.02 -0.24 0.41 0.00 0.00 173.24 173.12 1uew n SER 3 N 2.06 0.25 0.00 2.44 2.88 -1.26 -5.03 113.62 114.95 1uew n SER 3 Ca 0.03 -1.15 0.00 0.00 -1.33 0.00 0.00 58.87 56.42 1uew n SER 3 Cb 0.45 0.10 0.00 0.00 -0.75 0.00 0.00 64.21 64.01 1uew n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uew n GLY 4 N 0.59 1.54 2.52 0.46 0.00 -1.26 -4.94 105.19 104.09 1uew n GLY 4 Ca 0.00 0.15 -0.04 0.00 0.00 0.00 0.00 46.02 46.14 1uew n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1uew n SER 5 N 6.86 -3.82 -4.03 1.61 7.64 -1.26 -5.05 113.62 115.57 1uew n SER 5 Ca 0.00 1.55 -0.31 0.00 1.01 0.00 0.00 58.87 61.12 1uew n SER 5 Cb 0.00 -5.22 -0.16 0.00 -1.01 0.00 0.00 64.21 57.83 1uew n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1uew s SER 6 N -0.63 3.69 -0.21 6.43 0.15 -1.26 -5.04 113.70 116.83 1uew s SER 6 Ca -0.18 -1.02 -0.27 0.00 0.70 0.00 0.00 55.95 55.18 1uew s SER 6 Cb 0.01 -1.35 0.09 0.00 -1.71 0.00 0.00 66.02 63.07 1uew s SER 6 CO 0.49 -0.15 0.85 -0.83 1.20 0.00 0.00 173.24 174.80 1uew s GLY 7 N 1.30 -0.39 0.00 9.45 0.00 -1.26 -5.02 107.32 111.40 1uew s GLY 7 Ca -0.03 2.07 0.00 0.00 0.00 0.00 0.00 44.72 46.76 1uew s GLY 7 CO -0.08 1.49 0.00 1.44 0.00 0.00 0.00 173.10 175.95 1uew n SER 8 N 1.86 0.00 -3.83 1.64 7.64 -1.26 -4.74 113.62 114.93 1uew n SER 8 Ca -0.14 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.32 1uew n SER 8 Cb 0.56 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 1uew n SER 8 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1uew n LEU 9 N 0.00 6.70 0.00 -3.43 7.94 -1.26 -4.88 117.00 122.07 1uew n LEU 9 Ca 0.00 -4.48 -0.06 0.00 -1.11 0.00 0.00 56.01 50.37 1uew n LEU 9 Cb 0.00 -1.54 0.01 0.00 0.53 0.00 0.00 43.42 42.42 1uew n LEU 9 CO 0.00 1.28 0.06 1.67 -1.11 0.00 0.00 177.39 179.29 1uew n GLN 10 N 4.63 1.05 -4.26 1.96 7.27 -1.26 -5.05 117.38 121.72 1uew n GLN 10 Ca 0.44 -0.82 -0.14 0.00 0.07 0.00 0.00 57.00 56.55 1uew n GLN 10 Cb 0.37 -0.00 -0.10 0.00 2.41 0.00 0.00 30.24 32.92 1uew n GLN 10 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 1uew s THR 11 N -0.21 0.39 0.13 1.69 -4.23 -1.26 -4.71 115.64 107.43 1uew s THR 11 Ca 0.12 -1.99 0.10 0.00 -1.18 0.00 0.00 61.69 58.74 1uew s THR 11 Cb -0.01 -2.44 -0.04 0.00 1.34 0.00 0.00 72.50 71.35 1uew s THR 11 CO 0.08 -0.14 -0.23 -0.44 -0.54 0.00 0.00 174.62 173.35 1uew s SER 12 N -3.22 2.94 0.18 3.99 0.01 -0.14 -4.88 113.70 112.57 1uew s SER 12 Ca 0.34 -0.74 -0.12 0.00 1.31 0.00 0.00 55.95 56.74 1uew s SER 12 Cb 0.07 -0.18 -0.07 0.00 0.21 0.00 0.00 66.02 66.05 1uew s SER 12 CO 0.10 0.11 0.54 -1.81 0.41 0.00 0.00 173.24 172.59 1uew s ASP 13 N -2.09 6.73 -0.30 2.44 1.01 -1.26 -1.48 116.67 121.74 1uew s ASP 13 Ca 0.11 1.00 -0.01 0.00 0.71 0.00 0.00 52.55 54.37 1uew s ASP 13 Cb -0.10 -2.26 0.09 0.00 1.01 0.00 0.00 42.92 41.67 1uew s ASP 13 CO 0.06 0.03 0.09 -0.69 0.21 0.00 0.00 175.17 174.86 1uew s VAL 14 N -1.61 0.86 0.32 -1.27 1.01 0.09 -4.96 120.40 114.84 1uew s VAL 14 Ca 0.42 -1.31 -0.28 0.00 0.00 0.00 0.00 61.98 60.81 1uew s VAL 14 Cb -0.13 -1.61 -0.09 0.00 0.00 0.00 0.00 36.38 34.54 1uew s VAL 14 CO 0.20 -0.61 1.15 0.54 0.00 0.00 0.00 175.10 176.38 1uew s VAL 15 N 1.63 3.30 -0.03 2.92 0.11 -1.26 -1.36 120.40 125.71 1uew s VAL 15 Ca 0.08 1.25 0.01 0.00 -2.93 0.00 0.00 61.98 60.40 1uew s VAL 15 Cb -0.17 -3.78 0.01 0.00 -1.53 0.00 0.00 36.38 30.92 1uew s VAL 15 CO -0.23 0.26 -0.05 -0.63 -3.33 0.00 0.00 175.10 171.12 1uew s ILE 16 N -1.23 0.51 0.16 7.04 1.01 -0.47 -4.99 121.20 123.22 1uew s ILE 16 Ca 0.48 -0.17 0.05 0.00 0.00 0.00 0.00 60.65 61.01 1uew s ILE 16 Cb -0.33 -0.50 -0.04 0.00 0.01 0.00 0.00 42.46 41.60 1uew s ILE 16 CO 0.42 0.19 0.13 -1.00 0.00 0.00 0.00 174.94 174.68 1uew s HIS 17 N 0.55 3.14 0.07 3.97 3.76 -1.26 -1.42 115.29 124.11 1uew s HIS 17 Ca -0.07 -0.01 0.01 0.00 -0.15 0.00 0.00 55.06 54.84 1uew s HIS 17 Cb -0.11 -1.52 -0.00 0.00 1.11 0.00 0.00 32.58 32.06 1uew s HIS 17 CO 0.00 0.52 0.05 2.89 -0.85 0.00 0.00 174.74 177.35 1uew n ARG 18 N -0.26 0.38 -4.29 1.40 1.85 -0.50 -4.77 116.66 110.48 1uew n ARG 18 Ca -0.08 -0.67 -0.26 0.00 -1.00 0.00 0.00 57.85 55.83 1uew n ARG 18 Cb 0.54 0.48 -0.08 0.00 -1.05 0.00 0.00 32.46 32.35 1uew n ARG 18 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1uew s LYS 19 N -2.29 2.15 0.32 2.89 3.01 -1.26 -4.86 119.74 119.70 1uew s LYS 19 Ca 0.06 -1.94 0.17 0.00 -1.01 0.00 0.00 55.97 53.26 1uew s LYS 19 Cb 0.00 -1.87 0.14 0.00 -1.01 0.00 0.00 37.83 35.09 1uew s LYS 19 CO 0.05 -0.11 1.47 1.05 0.51 0.00 0.00 175.35 178.32 1uew h GLU 20 N 1.51 0.00 0.00 1.68 4.11 -2.00 -3.11 114.58 116.78 1uew h GLU 20 Ca -0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.00 1uew h GLU 20 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1uew h GLU 20 CO 0.73 0.35 0.00 0.09 0.07 0.00 0.00 179.01 180.25 1uew n ASN 21 N -3.18 0.01 -4.25 3.06 4.13 -1.26 -4.88 115.26 108.89 1uew n ASN 21 Ca 0.02 0.50 -0.14 0.00 1.68 0.00 0.00 54.58 56.64 1uew n ASN 21 Cb 0.68 -0.50 -0.10 0.00 -1.54 0.00 0.00 39.78 38.31 1uew n ASN 21 CO 0.00 0.00 0.00 -1.83 0.28 0.00 0.00 177.26 175.71 1uew s GLU 22 N -3.00 1.27 0.70 3.52 -1.05 -1.18 -5.17 118.70 113.79 1uew s GLU 22 Ca 0.07 -1.67 -0.04 0.00 -0.15 0.00 0.00 54.97 53.18 1uew s GLU 22 Cb 0.09 -0.01 0.15 0.00 -0.44 0.00 0.00 34.13 33.92 1uew s GLU 22 CO 0.27 -0.32 0.96 0.41 0.95 0.00 0.00 175.26 177.52 1uew n GLY 23 N -0.34 0.09 3.90 -3.83 0.00 -1.26 -4.72 105.19 99.03 1uew n GLY 23 Ca 0.00 -1.94 -0.29 0.00 0.00 0.00 0.00 46.02 43.79 1uew n GLY 23 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1uew s PHE 24 N -2.92 2.88 -0.41 1.61 0.08 -1.26 -4.74 117.98 113.22 1uew s PHE 24 Ca 0.60 0.72 0.10 0.00 0.12 0.00 0.00 56.93 58.48 1uew s PHE 24 Cb -0.03 -3.53 0.42 0.00 -0.57 0.00 0.00 43.02 39.31 1uew s PHE 24 CO 0.41 -1.82 0.99 0.41 -0.10 0.00 0.00 175.22 175.11 1uew n GLY 25 N -3.34 4.07 2.97 4.36 0.00 -1.26 -4.99 105.19 106.99 1uew n GLY 25 Ca 0.08 -2.12 -0.15 0.00 0.00 0.00 0.00 46.02 43.84 1uew n GLY 25 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1uew s PHE 26 N -3.26 0.43 -0.03 1.61 -0.71 -1.26 -1.73 117.98 113.04 1uew s PHE 26 Ca 0.40 -0.16 0.04 0.00 -1.04 0.00 0.00 56.93 56.16 1uew s PHE 26 Cb 0.40 -0.27 -0.00 0.00 -1.21 0.00 0.00 43.02 41.93 1uew s PHE 26 CO -0.09 -0.03 -0.15 0.08 -1.34 0.00 0.00 175.22 173.70 1uew s VAL 27 N -0.37 1.22 -0.24 -2.49 1.01 0.35 -5.00 120.40 114.87 1uew s VAL 27 Ca -0.01 -0.61 -0.06 0.00 0.00 0.00 0.00 61.98 61.30 1uew s VAL 27 Cb -0.03 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.28 1uew s VAL 27 CO -0.00 0.35 0.03 -0.63 0.00 0.00 0.00 175.10 174.85 1uew s ILE 28 N -0.00 3.97 0.00 2.22 1.01 -1.26 -0.62 121.20 126.51 1uew s ILE 28 Ca -0.02 -0.29 0.00 0.00 0.00 0.00 0.00 60.65 60.35 1uew s ILE 28 Cb -0.10 -2.84 0.00 0.00 0.01 0.00 0.00 42.46 39.53 1uew s ILE 28 CO 0.01 0.37 0.00 2.30 0.00 0.00 0.00 174.94 177.62 1uew n ILE 29 N 4.87 0.00 -1.67 2.92 -5.35 0.76 -4.86 119.36 116.02 1uew n ILE 29 Ca -0.17 0.00 0.10 0.00 -0.27 0.00 0.00 62.75 62.41 1uew n ILE 29 Cb 0.51 -0.46 -0.02 0.00 -1.74 0.00 0.00 39.64 37.93 1uew n ILE 29 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 1uew n SER 30 N -1.84 -4.96 -3.66 7.28 2.88 -1.26 -2.05 113.62 110.01 1uew n SER 30 Ca 0.00 0.76 -0.08 0.00 -1.33 0.00 0.00 58.87 58.22 1uew n SER 30 Cb 0.00 -2.14 -0.02 0.00 -0.75 0.00 0.00 64.21 61.30 1uew n SER 30 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1uew s SER 31 N -4.94 -0.36 0.50 -3.46 0.01 -1.07 -4.81 113.70 99.57 1uew s SER 31 Ca 0.00 -0.32 -0.23 0.00 1.31 0.00 0.00 55.95 56.72 1uew s SER 31 Cb 0.00 0.62 -0.07 0.00 0.21 0.00 0.00 66.02 66.78 1uew s SER 31 CO 0.00 -1.09 1.22 0.00 0.41 0.00 0.00 173.24 173.79 1uew n LEU 32 N -0.41 4.40 -3.49 2.44 -0.00 -1.26 -4.32 117.00 114.37 1uew n LEU 32 Ca -0.09 1.00 -0.11 0.00 -0.00 0.00 0.00 56.01 56.80 1uew n LEU 32 Cb 0.62 -1.50 -0.03 0.00 -0.00 0.00 0.00 43.42 42.51 1uew n LEU 32 CO 0.13 -0.92 0.56 0.54 -0.00 0.00 0.00 177.39 177.71 1uew s ASN 33 N -0.82 -0.48 0.14 1.45 4.22 -1.26 -5.08 114.94 113.11 1uew s ASN 33 Ca 0.68 0.16 -0.35 0.00 -2.14 0.00 0.00 52.86 51.21 1uew s ASN 33 Cb -0.46 0.47 -0.15 0.00 1.28 0.00 0.00 41.25 42.39 1uew s ASN 33 CO 0.53 -0.71 1.43 -2.11 -2.04 0.00 0.00 177.10 174.20 1uew n ARG 34 N 0.01 1.63 0.11 3.55 1.85 -1.26 -4.91 116.66 117.64 1uew n ARG 34 Ca -0.13 0.59 -0.00 0.00 -1.00 0.00 0.00 57.85 57.30 1uew n ARG 34 Cb 0.62 -2.27 -0.02 0.00 -1.05 0.00 0.00 32.46 29.74 1uew n ARG 34 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 1uew h PRO 35 N 4.98 0.00 0.00 2.89 0.13 -2.01 -3.47 132.00 134.52 1uew h PRO 35 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1uew h PRO 35 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1uew h PRO 35 CO 0.81 0.61 0.00 -1.91 -0.23 0.00 0.00 178.00 177.28 1uew n GLU 36 N -3.23 0.00 -1.86 0.86 2.13 -1.26 -4.84 120.64 112.44 1uew n GLU 36 Ca 0.00 0.00 -0.29 0.00 0.66 0.00 0.00 57.16 57.53 1uew n GLU 36 Cb 0.80 0.00 0.15 0.00 0.27 0.00 0.00 31.44 32.66 1uew n GLU 36 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1uew s SER 37 N 0.00 3.50 0.03 4.31 0.15 -1.26 -5.02 113.70 115.41 1uew s SER 37 Ca 0.00 0.50 -0.26 0.00 0.70 0.00 0.00 55.95 56.88 1uew s SER 37 Cb 0.00 -0.73 -0.17 0.00 -1.71 0.00 0.00 66.02 63.41 1uew s SER 37 CO 0.00 -2.51 1.35 1.23 1.20 0.00 0.00 173.24 174.51 1uew h GLY 38 N -1.48 -0.48 -4.41 9.45 0.00 -2.05 -3.44 103.07 100.66 1uew h GLY 38 Ca -0.45 0.18 -0.56 0.00 0.00 0.00 0.00 47.33 46.50 1uew h GLY 38 CO 0.49 -0.18 -0.83 -1.35 0.00 0.00 0.00 176.54 174.67 1uew s SER 39 N -4.97 2.40 0.13 0.19 1.04 -1.26 -5.06 113.70 106.18 1uew s SER 39 Ca -0.15 -0.57 0.09 0.00 0.48 0.00 0.00 55.95 55.80 1uew s SER 39 Cb 0.03 -0.17 -0.04 0.00 0.10 0.00 0.00 66.02 65.94 1uew s SER 39 CO 0.57 0.11 -0.21 0.42 0.98 0.00 0.00 173.24 175.11 1uew s THR 40 N -0.93 1.86 -2.06 2.02 -4.23 -1.26 -5.02 115.64 106.02 1uew s THR 40 Ca 0.06 -1.71 0.17 0.00 -1.18 0.00 0.00 61.69 59.03 1uew s THR 40 Cb -0.09 -1.74 0.44 0.00 1.34 0.00 0.00 72.50 72.46 1uew s THR 40 CO 0.03 -0.12 1.58 2.30 -0.54 0.00 0.00 174.62 177.87 1uew n ILE 41 N 0.78 0.06 -1.86 2.99 -5.35 -1.26 -4.88 119.36 109.83 1uew n ILE 41 Ca -0.17 -0.09 -0.38 0.00 -0.27 0.00 0.00 62.75 61.85 1uew n ILE 41 Cb 0.55 -0.10 0.04 0.00 -1.74 0.00 0.00 39.64 38.38 1uew n ILE 41 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 1uew s THR 42 N -1.94 2.25 -0.04 7.28 2.01 -1.26 -5.07 115.64 118.88 1uew s THR 42 Ca 0.25 0.18 0.05 0.00 0.31 0.00 0.00 61.69 62.49 1uew s THR 42 Cb 0.12 -3.09 -0.01 0.00 0.01 0.00 0.00 72.50 69.53 1uew s THR 42 CO 0.20 -0.01 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.24 1uew s VAL 43 N -1.37 1.52 -1.06 3.82 1.01 -1.26 -5.05 120.40 118.02 1uew s VAL 43 Ca 0.72 -0.78 0.22 0.00 0.00 0.00 0.00 61.98 62.14 1uew s VAL 43 Cb -0.38 -1.29 0.21 0.00 0.00 0.00 0.00 36.38 34.92 1uew s VAL 43 CO 0.44 0.43 1.71 -0.81 0.00 0.00 0.00 175.10 176.88 1uew n PRO 44 N 2.99 0.04 -3.70 2.72 -0.04 -1.26 -4.54 135.00 131.21 1uew n PRO 44 Ca -0.17 0.11 -0.19 0.00 -0.04 0.00 0.00 63.50 63.21 1uew n PRO 44 Cb 0.53 -1.50 -0.18 0.00 -0.04 0.00 0.00 33.50 32.31 1uew n PRO 44 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1uew s HIS 45 N -2.94 0.09 0.03 0.54 3.76 -1.26 -2.58 115.29 112.93 1uew s HIS 45 Ca 0.12 0.21 -0.16 0.00 -0.15 0.00 0.00 55.06 55.08 1uew s HIS 45 Cb 0.15 -0.44 0.03 0.00 1.11 0.00 0.00 32.58 33.42 1uew s HIS 45 CO 0.39 -0.17 0.36 -1.59 -0.85 0.00 0.00 174.74 172.88 1uew s LYS 46 N 1.91 0.84 0.48 1.40 -2.85 -0.87 -1.78 119.74 118.88 1uew s LYS 46 Ca 0.02 -0.38 -0.24 0.00 -1.00 0.00 0.00 55.97 54.37 1uew s LYS 46 Cb -0.12 0.37 -0.07 0.00 -2.06 0.00 0.00 37.83 35.95 1uew s LYS 46 CO -0.03 -0.27 1.35 0.42 0.10 0.00 0.00 175.35 176.92 1uew s ILE 47 N -2.31 2.28 0.01 3.79 -1.09 -0.53 -0.17 121.20 123.18 1uew s ILE 47 Ca -0.06 0.23 0.00 0.00 -2.23 0.00 0.00 60.65 58.59 1uew s ILE 47 Cb -0.01 -3.13 0.00 0.00 -1.58 0.00 0.00 42.46 37.74 1uew s ILE 47 CO -0.01 0.02 0.00 0.61 -1.23 0.00 0.00 174.94 174.32 1uew n GLY 48 N 0.63 -0.01 3.31 6.18 0.00 0.21 -1.44 105.19 114.07 1uew n GLY 48 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1uew n GLY 48 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1uew s ARG 49 N -2.00 2.12 0.13 1.61 3.52 -1.20 -4.89 118.95 118.24 1uew s ARG 49 Ca 0.00 -0.93 0.11 0.00 -0.13 0.00 0.00 55.73 54.78 1uew s ARG 49 Cb 0.00 -2.04 -0.04 0.00 -1.56 0.00 0.00 34.95 31.31 1uew s ARG 49 CO 0.00 0.56 -0.27 0.42 -0.81 0.00 0.00 175.30 175.20 1uew s ILE 50 N -0.60 2.25 -0.08 4.11 1.01 -1.26 -0.50 121.20 126.13 1uew s ILE 50 Ca 0.10 -1.74 -0.22 0.00 0.00 0.00 0.00 60.65 58.78 1uew s ILE 50 Cb -0.10 -1.99 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 1uew s ILE 50 CO -0.01 0.10 0.66 -0.63 0.00 0.00 0.00 174.94 175.06 1uew s ILE 51 N -1.05 5.07 0.10 2.92 1.09 -0.70 -5.00 121.20 123.63 1uew s ILE 51 Ca 0.14 1.34 -0.31 0.00 -1.10 0.00 0.00 60.65 60.72 1uew s ILE 51 Cb -0.10 -4.00 -0.10 0.00 -1.06 0.00 0.00 42.46 37.21 1uew s ILE 51 CO 0.06 0.25 1.80 -0.62 -0.10 0.00 0.00 174.94 176.33 1uew s ASP 52 N 0.79 6.47 0.00 3.58 2.15 -1.26 -2.76 116.67 125.65 1uew s ASP 52 Ca 0.35 2.68 0.00 0.00 0.43 0.00 0.00 52.55 56.01 1uew s ASP 52 Cb -0.17 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 39.89 1uew s ASP 52 CO 0.16 -0.98 0.00 0.61 -0.17 0.00 0.00 175.17 174.79 1uew n GLY 53 N 4.21 0.84 3.83 2.66 0.00 -1.26 -5.10 105.19 110.38 1uew n GLY 53 Ca 0.18 -0.23 -0.21 0.00 0.00 0.00 0.00 46.02 45.75 1uew n GLY 53 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uew s SER 54 N -2.21 5.29 0.53 1.61 1.04 -1.11 -5.03 113.70 113.82 1uew s SER 54 Ca 0.00 -0.46 0.27 0.00 0.48 0.00 0.00 55.95 56.24 1uew s SER 54 Cb 0.00 -1.05 1.51 0.00 0.10 0.00 0.00 66.02 66.57 1uew s SER 54 CO 0.00 -0.27 2.11 1.55 0.98 0.00 0.00 173.24 177.61 1uew h PRO 55 N 1.34 0.00 0.55 4.02 0.13 -1.87 -2.72 132.00 133.44 1uew h PRO 55 Ca -0.46 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.65 1uew h PRO 55 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1uew h PRO 55 CO 0.59 0.10 -0.29 0.00 -0.23 0.00 0.00 178.00 178.17 1uew h ALA 56 N 1.90 -0.78 -0.60 -0.56 0.00 -1.90 -2.51 119.26 114.81 1uew h ALA 56 Ca -0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1uew h ALA 56 Cb 0.27 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1uew h ALA 56 CO 0.01 -0.94 0.19 0.22 0.00 0.00 0.00 179.25 178.73 1uew h ASP 57 N -0.78 0.84 0.49 0.00 3.58 -1.76 -0.47 116.42 118.31 1uew h ASP 57 Ca -0.07 -0.13 -0.02 0.00 0.42 0.00 0.00 57.03 57.23 1uew h ASP 57 Cb 0.61 -0.22 -0.00 0.00 1.72 0.00 0.00 39.33 41.44 1uew h ASP 57 CO 0.10 0.78 -0.09 0.03 -2.88 0.00 0.00 179.24 177.19 1uew h ARG 58 N 0.88 0.00 -2.02 0.28 3.08 -1.50 -3.01 114.38 112.09 1uew h ARG 58 Ca 0.20 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.68 1uew h ARG 58 Cb 0.24 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 30.10 1uew h ARG 58 CO -0.01 0.09 0.61 0.00 -1.07 0.00 0.00 179.97 179.59 1uew n ALA 60 N 0.56 1.44 0.24 0.00 0.00 -1.14 -1.13 120.51 120.47 1uew n ALA 60 Ca 0.50 0.00 0.14 0.00 0.00 0.00 0.00 53.44 54.08 1uew n ALA 60 Cb 0.46 -0.96 0.70 0.00 0.00 0.00 0.00 19.45 19.66 1uew n ALA 60 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1uew h LYS 61 N 0.00 0.00 -6.14 0.00 1.57 -1.91 -3.41 116.57 106.68 1uew h LYS 61 Ca 0.00 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 58.09 1uew h LYS 61 Cb 0.00 0.00 -0.26 0.00 0.08 0.00 0.00 32.23 32.05 1uew h LYS 61 CO 0.00 0.00 -0.80 -1.17 -0.57 0.00 0.00 179.45 176.91 1uew s LEU 62 N -4.90 2.57 0.18 2.94 0.20 -0.28 -5.01 118.68 114.39 1uew s LEU 62 Ca -0.02 -0.29 0.01 0.00 0.69 0.00 0.00 54.13 54.52 1uew s LEU 62 Cb 0.08 -1.52 -0.05 0.00 -0.43 0.00 0.00 46.19 44.28 1uew s LEU 62 CO 0.28 0.30 0.05 -0.54 -0.29 0.00 0.00 176.35 176.15 1uew s LYS 63 N -0.46 1.14 -0.22 1.98 1.02 -1.26 -4.91 119.74 117.03 1uew s LYS 63 Ca 0.05 -1.57 -0.32 0.00 0.02 0.00 0.00 55.97 54.16 1uew s LYS 63 Cb -0.12 -0.10 -0.09 0.00 -0.52 0.00 0.00 37.83 37.00 1uew s LYS 63 CO 0.02 -0.22 2.13 0.28 -0.92 0.00 0.00 175.35 176.64 1uew n VAL 64 N -0.26 0.36 0.00 3.17 0.31 -1.26 -1.65 118.33 119.00 1uew n VAL 64 Ca -0.04 -0.31 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 1uew n VAL 64 Cb 0.64 -2.11 0.00 0.00 -0.91 0.00 0.00 33.84 31.47 1uew n VAL 64 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1uew n GLY 65 N 5.69 1.53 3.58 2.92 0.00 -0.52 -4.95 105.19 113.44 1uew n GLY 65 Ca 0.32 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.92 1uew n GLY 65 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1uew s ASP 66 N -0.94 5.79 0.27 1.61 1.01 -0.66 -4.57 116.67 119.18 1uew s ASP 66 Ca 0.00 0.78 -0.21 0.00 0.71 0.00 0.00 52.55 53.83 1uew s ASP 66 Cb 0.00 -2.53 -0.14 0.00 1.01 0.00 0.00 42.92 41.26 1uew s ASP 66 CO 0.00 -1.88 0.26 0.54 0.21 0.00 0.00 175.17 174.29 1uew n ARG 67 N 8.65 0.00 -4.31 8.23 1.74 -1.26 -1.45 116.66 128.26 1uew n ARG 67 Ca 0.20 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 57.06 1uew n ARG 67 Cb 0.49 -0.87 -0.16 0.00 -1.02 0.00 0.00 32.46 30.90 1uew n ARG 67 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1uew s ILE 68 N -1.17 0.74 -0.18 0.55 1.01 -0.73 -3.96 121.20 117.46 1uew s ILE 68 Ca 0.53 -0.25 -0.03 0.00 0.00 0.00 0.00 60.65 60.90 1uew s ILE 68 Cb -0.68 -0.73 -0.22 0.00 0.01 0.00 0.00 42.46 40.84 1uew s ILE 68 CO 0.52 0.27 0.12 0.18 0.00 0.00 0.00 174.94 176.02 1uew n LEU 69 N 3.95 2.77 -3.86 2.97 4.77 -0.13 -4.69 117.00 122.77 1uew n LEU 69 Ca -0.24 0.07 -0.08 0.00 -0.03 0.00 0.00 56.01 55.73 1uew n LEU 69 Cb 0.51 -1.03 -0.03 0.00 -2.33 0.00 0.00 43.42 40.54 1uew n LEU 69 CO 0.24 0.88 0.37 0.00 -1.33 0.00 0.00 177.39 177.55 1uew s ALA 70 N -2.54 -0.96 -0.08 -1.18 0.00 -1.19 -3.96 121.76 111.85 1uew s ALA 70 Ca -0.28 -0.41 0.01 0.00 0.00 0.00 0.00 51.96 51.29 1uew s ALA 70 Cb 0.08 0.91 0.02 0.00 0.00 0.00 0.00 23.12 24.12 1uew s ALA 70 CO 0.70 -0.95 -0.11 0.08 0.00 0.00 0.00 175.76 175.48 1uew s VAL 71 N -3.93 1.08 -1.05 0.00 1.01 -0.80 -2.91 120.40 113.79 1uew s VAL 71 Ca 0.13 -0.41 -0.10 0.00 0.00 0.00 0.00 61.98 61.60 1uew s VAL 71 Cb -0.04 -1.02 0.10 0.00 0.00 0.00 0.00 36.38 35.42 1uew s VAL 71 CO 0.06 0.35 0.35 0.59 0.00 0.00 0.00 175.10 176.45 1uew n ASN 72 N 4.15 -2.30 0.00 3.32 3.02 -0.59 -0.79 115.26 122.07 1uew n ASN 72 Ca -0.20 -0.35 0.00 0.00 -0.03 0.00 0.00 54.58 54.00 1uew n ASN 72 Cb 0.51 -1.98 0.00 0.00 -0.61 0.00 0.00 39.78 37.70 1uew n ASN 72 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uew n GLY 73 N -0.91 1.13 3.73 7.41 0.00 -1.26 -4.98 105.19 110.30 1uew n GLY 73 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1uew n GLY 73 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1uew s GLN 74 N -0.22 4.54 0.23 1.61 2.00 0.03 -4.94 119.66 122.90 1uew s GLN 74 Ca 0.00 1.77 -0.30 0.00 -2.00 0.00 0.00 55.36 54.83 1uew s GLN 74 Cb 0.00 -3.28 -0.09 0.00 0.80 0.00 0.00 33.01 30.44 1uew s GLN 74 CO 0.00 -0.02 1.18 -1.12 -0.50 0.00 0.00 175.29 174.83 1uew s SER 75 N 0.14 7.10 0.00 6.67 0.01 -1.26 -1.90 113.70 124.46 1uew s SER 75 Ca 0.52 2.29 0.05 0.00 1.31 0.00 0.00 55.95 60.11 1uew s SER 75 Cb -0.30 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.28 1uew s SER 75 CO 0.35 -0.33 0.27 2.30 0.41 0.00 0.00 173.24 176.24 1uew n ILE 76 N 1.98 0.00 0.02 1.44 -5.35 -1.25 -4.34 119.36 111.85 1uew n ILE 76 Ca 0.02 -0.41 -0.10 0.00 -0.27 0.00 0.00 62.75 61.99 1uew n ILE 76 Cb 0.44 1.02 -0.03 0.00 -1.74 0.00 0.00 39.64 39.33 1uew n ILE 76 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1uew h ILE 77 N 0.17 0.51 0.00 7.28 1.08 -1.92 -3.20 117.51 121.43 1uew h ILE 77 Ca 0.00 0.00 -0.18 0.00 -0.39 0.00 0.00 64.86 64.29 1uew h ILE 77 Cb 0.12 0.51 -0.03 0.00 -3.07 0.00 0.00 36.82 34.36 1uew h ILE 77 CO 0.00 0.00 -1.39 0.78 -0.69 0.00 0.00 178.15 176.85 1uew h ASN 78 N -0.27 0.00 -3.68 1.72 4.21 -1.99 -3.48 115.58 112.10 1uew h ASN 78 Ca 0.09 0.00 -0.52 0.00 1.21 0.00 0.00 56.30 57.07 1uew h ASN 78 Cb 0.39 0.00 0.06 0.00 -1.12 0.00 0.00 38.32 37.65 1uew h ASN 78 CO -0.25 0.64 0.68 -0.32 -1.29 0.00 0.00 177.43 176.90 1uew s MET 79 N -2.87 4.32 0.44 0.81 1.75 -1.21 -5.00 119.30 117.54 1uew s MET 79 Ca -0.03 2.24 -0.22 0.00 -1.25 0.00 0.00 55.69 56.43 1uew s MET 79 Cb 0.09 -3.09 -0.09 0.00 2.84 0.00 0.00 34.83 34.58 1uew s MET 79 CO 0.81 -0.28 1.05 -1.25 -0.65 0.00 0.00 175.02 174.70 1uew s PRO 80 N -1.19 3.98 0.40 4.11 0.04 -1.26 -4.88 135.00 136.20 1uew s PRO 80 Ca 0.53 1.44 0.13 0.00 0.04 0.00 0.00 61.00 63.14 1uew s PRO 80 Cb -0.40 -2.31 0.97 0.00 0.04 0.00 0.00 34.50 32.80 1uew s PRO 80 CO 0.49 -0.29 1.90 0.45 0.04 0.00 0.00 177.00 179.59 1uew h HIS 81 N 2.02 0.60 -0.73 0.56 3.86 -1.94 -0.90 115.15 118.62 1uew h HIS 81 Ca -0.49 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 58.77 1uew h HIS 81 Cb 1.22 -0.19 -0.04 0.00 1.06 0.00 0.00 27.41 29.45 1uew h HIS 81 CO 0.57 0.23 0.46 0.00 0.86 0.00 0.00 177.93 180.05 1uew h ALA 82 N 1.63 0.95 -0.40 2.45 0.00 -1.99 0.58 119.26 122.48 1uew h ALA 82 Ca 0.40 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 55.13 1uew h ALA 82 Cb 0.80 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1uew h ALA 82 CO -0.15 0.24 -0.35 0.22 0.00 0.00 0.00 179.25 179.22 1uew h ASP 83 N 0.89 0.99 -0.64 0.00 3.58 -1.56 -0.44 116.42 119.25 1uew h ASP 83 Ca 0.29 -0.43 -0.09 0.00 0.42 0.00 0.00 57.03 57.21 1uew h ASP 83 Cb 0.02 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.77 1uew h ASP 83 CO -0.11 1.23 0.03 0.40 -2.88 0.00 0.00 179.24 177.91 1uew h ILE 84 N 0.77 1.27 -0.55 2.25 2.04 -1.14 0.61 117.51 122.75 1uew h ILE 84 Ca 0.07 -1.13 -0.08 0.00 1.00 0.00 0.00 64.86 64.72 1uew h ILE 84 Cb 0.94 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 1uew h ILE 84 CO 0.09 0.41 0.02 0.58 0.00 0.00 0.00 178.15 179.25 1uew h VAL 85 N 1.01 1.26 -0.19 1.67 2.07 -0.74 -2.37 116.25 118.97 1uew h VAL 85 Ca 0.18 -1.09 0.05 0.00 0.82 0.00 0.00 66.70 66.67 1uew h VAL 85 Cb 0.53 0.88 -0.06 0.00 -1.52 0.00 0.00 31.29 31.12 1uew h VAL 85 CO 0.03 0.39 -0.22 0.50 0.02 0.00 0.00 177.57 178.29 1uew h LYS 86 N 0.84 -0.24 -0.86 1.57 1.63 -0.69 -2.05 116.57 116.77 1uew h LYS 86 Ca 0.16 0.02 0.16 0.00 -0.85 0.00 0.00 60.65 60.14 1uew h LYS 86 Cb 0.52 0.05 -0.06 0.00 -0.60 0.00 0.00 32.23 32.14 1uew h LYS 86 CO 0.03 -0.16 0.56 -0.07 -3.45 0.00 0.00 179.45 176.36 1uew h LEU 87 N -0.25 0.51 0.04 5.20 -0.00 -0.60 0.30 115.31 120.52 1uew h LEU 87 Ca 0.12 0.04 -0.27 0.00 -0.00 0.00 0.00 57.88 57.76 1uew h LEU 87 Cb 0.43 -0.06 0.01 0.00 -0.00 0.00 0.00 40.66 41.04 1uew h LEU 87 CO -0.33 0.25 -1.17 0.40 -0.00 0.00 0.00 178.44 177.58 1uew h ILE 88 N 0.53 1.39 -0.41 1.22 2.04 -1.02 0.64 117.51 121.91 1uew h ILE 88 Ca 0.43 -2.67 -0.07 0.00 1.00 0.00 0.00 64.86 63.54 1uew h ILE 88 Cb 0.88 2.72 -0.02 0.00 -0.74 0.00 0.00 36.82 39.66 1uew h ILE 88 CO -0.18 0.80 -0.06 0.50 0.00 0.00 0.00 178.15 179.21 1uew h LYS 89 N 0.19 0.69 -0.41 2.37 3.64 -0.53 -2.95 116.57 119.57 1uew h LYS 89 Ca -0.14 -0.19 -0.11 0.00 -1.27 0.00 0.00 60.65 58.93 1uew h LYS 89 Cb 1.85 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.58 1uew h LYS 89 CO 0.21 0.74 -0.20 0.22 -2.27 0.00 0.00 179.45 178.15 1uew h ASP 90 N 0.64 0.80 -0.87 4.20 1.82 -0.34 -3.15 116.42 119.52 1uew h ASP 90 Ca 0.12 -0.28 0.06 0.00 -0.39 0.00 0.00 57.03 56.54 1uew h ASP 90 Cb 0.48 -0.22 -0.06 0.00 0.68 0.00 0.00 39.33 40.21 1uew h ASP 90 CO 0.03 0.98 0.54 0.00 -1.61 0.00 0.00 179.24 179.18 1uew h ALA 91 N 1.08 1.19 0.00 -0.78 0.00 -0.68 -3.48 119.26 116.58 1uew h ALA 91 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1uew h ALA 91 Cb 0.71 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1uew h ALA 91 CO 0.05 0.30 0.00 0.41 0.00 0.00 0.00 179.25 180.01 1uew n GLY 92 N -1.33 0.51 0.24 0.00 0.00 -1.19 -4.34 105.19 99.08 1uew n GLY 92 Ca 0.12 -1.76 -0.14 0.00 0.00 0.00 0.00 46.02 44.25 1uew n GLY 92 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1uew h LEU 93 N 0.00 0.91 -9.37 0.99 3.38 -1.90 -3.43 115.31 105.89 1uew h LEU 93 Ca 0.00 -0.50 -0.59 0.00 0.09 0.00 0.00 57.88 56.88 1uew h LEU 93 Cb 0.00 -0.26 -0.09 0.00 0.09 0.00 0.00 40.66 40.40 1uew h LEU 93 CO 0.00 1.23 -0.27 -0.94 0.09 0.00 0.00 178.44 178.54 1uew s SER 94 N -6.78 6.54 -0.01 -0.43 1.04 -1.26 -1.41 113.70 111.39 1uew s SER 94 Ca -0.11 0.63 0.03 0.00 0.48 0.00 0.00 55.95 56.98 1uew s SER 94 Cb 0.10 -2.21 -0.01 0.00 0.10 0.00 0.00 66.02 64.00 1uew s SER 94 CO 0.87 0.12 -0.09 0.54 0.98 0.00 0.00 173.24 175.66 1uew s VAL 95 N 0.24 0.71 -0.35 5.02 0.11 -0.51 -4.69 120.40 120.94 1uew s VAL 95 Ca 0.19 -0.38 -0.06 0.00 -2.93 0.00 0.00 61.98 58.80 1uew s VAL 95 Cb -0.14 -0.60 0.05 0.00 -1.53 0.00 0.00 36.38 34.16 1uew s VAL 95 CO 0.06 0.20 0.12 -0.89 -3.33 0.00 0.00 175.10 171.26 1uew s THR 96 N -0.20 3.76 0.15 5.04 2.01 -1.26 -1.37 115.64 123.78 1uew s THR 96 Ca 0.03 -1.20 -0.13 0.00 0.31 0.00 0.00 61.69 60.69 1uew s THR 96 Cb -0.04 -3.16 -0.07 0.00 0.01 0.00 0.00 72.50 69.24 1uew s THR 96 CO -0.00 -0.22 0.54 -0.76 -0.69 0.00 0.00 174.62 173.49 1uew s LEU 97 N 1.39 4.31 -0.26 4.42 1.43 -0.46 -1.55 118.68 127.96 1uew s LEU 97 Ca -0.01 1.04 -0.02 0.00 -1.03 0.00 0.00 54.13 54.11 1uew s LEU 97 Cb -0.20 -3.31 0.03 0.00 0.03 0.00 0.00 46.19 42.74 1uew s LEU 97 CO 0.02 0.08 -0.04 -0.60 0.23 0.00 0.00 176.35 176.05 1uew s ARG 98 N -2.07 2.78 0.28 1.70 3.52 -1.15 -0.73 118.95 123.29 1uew s ARG 98 Ca 0.39 -1.02 0.10 0.00 -0.13 0.00 0.00 55.73 55.07 1uew s ARG 98 Cb -0.14 -3.06 -0.05 0.00 -1.56 0.00 0.00 34.95 30.14 1uew s ARG 98 CO 0.19 -0.45 -0.04 0.96 -0.81 0.00 0.00 175.30 175.16 1uew s ILE 99 N 1.33 3.09 -0.31 4.11 -5.25 -0.55 -0.96 121.20 122.66 1uew s ILE 99 Ca -0.01 -2.02 -0.17 0.00 -0.99 0.00 0.00 60.65 57.46 1uew s ILE 99 Cb -0.17 -2.72 -0.02 0.00 2.95 0.00 0.00 42.46 42.50 1uew s ILE 99 CO -0.03 -0.35 0.45 -0.63 -1.79 0.00 0.00 174.94 172.59 1uew s ILE 100 N -2.40 5.10 0.02 8.37 1.01 -1.25 -0.97 121.20 131.07 1uew s ILE 100 Ca 0.32 0.45 -0.00 0.00 0.00 0.00 0.00 60.65 61.42 1uew s ILE 100 Cb -0.05 -3.84 0.00 0.00 0.01 0.00 0.00 42.46 38.58 1uew s ILE 100 CO 0.19 -0.04 0.03 -0.81 0.00 0.00 0.00 174.94 174.31 1uew n PRO 101 N 5.53 0.37 -4.00 2.79 -0.04 -1.26 -4.80 135.00 133.59 1uew n PRO 101 Ca -0.06 -0.06 -0.09 0.00 -0.04 0.00 0.00 63.50 63.24 1uew n PRO 101 Cb 0.50 -0.02 -0.08 0.00 -0.04 0.00 0.00 33.50 33.85 1uew n PRO 101 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 1uew s GLN 102 N -2.68 1.05 0.00 0.54 0.00 -1.26 -5.04 119.66 112.28 1uew s GLN 102 Ca 0.02 -1.22 0.00 0.00 -0.00 0.00 0.00 55.36 54.16 1uew s GLN 102 Cb -0.00 0.34 0.00 0.00 0.00 0.00 0.00 33.01 33.34 1uew s GLN 102 CO 0.01 -0.36 0.02 -0.85 0.00 0.00 0.00 175.29 174.11 1uew n GLU 103 N -0.16 0.01 0.00 9.60 0.00 -1.26 -4.94 120.64 123.89 1uew n GLU 103 Ca -0.08 -0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.06 1uew n GLU 103 Cb 0.63 -0.45 0.00 0.00 0.00 0.00 0.00 31.44 31.62 1uew n GLU 103 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 1uew n GLU 104 N -0.01 4.20 -1.90 3.44 0.00 -1.26 -4.98 120.64 120.13 1uew n GLU 104 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 57.16 56.83 1uew n GLU 104 Cb 0.20 -0.64 0.03 0.00 0.00 0.00 0.00 31.44 31.03 1uew n GLU 104 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1uew s LEU 105 N -2.17 3.48 -0.25 -1.84 1.43 -1.26 -5.08 118.68 112.99 1uew s LEU 105 Ca 0.00 2.00 -0.26 0.00 -1.03 0.00 0.00 54.13 54.85 1uew s LEU 105 Cb 0.00 -4.55 0.08 0.00 0.03 0.00 0.00 46.19 41.74 1uew s LEU 105 CO 0.00 -1.48 0.77 0.21 0.23 0.00 0.00 176.35 176.08 1uew s ASN 106 N -2.46 -0.69 0.08 2.29 3.84 -1.26 -5.14 114.94 111.59 1uew s ASN 106 Ca 0.67 1.29 0.03 0.00 0.21 0.00 0.00 52.86 55.07 1uew s ASN 106 Cb -0.20 1.29 -0.03 0.00 -0.55 0.00 0.00 41.25 41.75 1uew s ASN 106 CO 0.38 -0.27 -0.10 -0.44 -2.79 0.00 0.00 177.10 173.88 1uew s SER 107 N 0.20 1.33 0.72 -4.21 0.01 -1.26 -5.16 113.70 105.33 1uew s SER 107 Ca -0.01 -0.77 -0.11 0.00 1.31 0.00 0.00 55.95 56.38 1uew s SER 107 Cb -0.05 0.02 0.02 0.00 0.21 0.00 0.00 66.02 66.22 1uew s SER 107 CO 0.01 -0.25 1.07 -2.16 0.41 0.00 0.00 173.24 172.31 1uew s PRO 108 N -2.58 2.78 0.17 12.44 0.04 -1.26 -4.96 135.00 141.63 1uew s PRO 108 Ca 0.03 0.77 0.22 0.00 0.04 0.00 0.00 61.00 62.06 1uew s PRO 108 Cb -0.04 -1.99 0.88 0.00 0.04 0.00 0.00 34.50 33.40 1uew s PRO 108 CO -0.00 -1.16 1.68 -1.13 0.04 0.00 0.00 177.00 176.42 1uew n SER 109 N -3.15 0.47 0.00 6.66 3.41 -1.26 -4.92 113.62 114.84 1uew n SER 109 Ca 0.07 0.60 0.00 0.00 -0.26 0.00 0.00 58.87 59.28 1uew n SER 109 Cb 0.55 -0.70 0.00 0.00 -0.26 0.00 0.00 64.21 63.79 1uew n SER 109 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uew n GLY 110 N 0.31 -1.18 3.76 5.00 0.00 -1.26 -5.14 105.19 106.68 1uew n GLY 110 Ca 0.03 -1.01 -0.41 0.00 0.00 0.00 0.00 46.02 44.64 1uew n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uew s PRO 111 N -1.81 4.21 0.21 1.61 0.04 -1.26 -5.01 135.00 132.98 1uew s PRO 111 Ca 0.00 2.42 -0.30 0.00 0.04 0.00 0.00 61.00 63.16 1uew s PRO 111 Cb 0.00 -3.05 -0.08 0.00 0.04 0.00 0.00 34.50 31.40 1uew s PRO 111 CO 0.00 -0.47 1.19 -1.12 0.04 0.00 0.00 177.00 176.65 1uew s SER 112 N 0.17 7.09 0.00 6.66 0.01 -1.26 -5.03 113.70 121.34 1uew s SER 112 Ca 0.58 2.27 0.00 0.00 1.31 0.00 0.00 55.95 60.10 1uew s SER 112 Cb -0.44 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.18 1uew s SER 112 CO 0.50 -0.35 0.00 -0.24 0.41 0.00 0.00 173.24 173.56 1uew n SER 113 N 2.22 0.00 -0.22 2.44 2.88 -1.26 -5.28 113.62 114.40 1uew n SER 113 Ca 0.03 -0.68 0.15 0.00 -1.33 0.00 0.00 58.87 57.04 1uew n SER 113 Cb 0.44 0.00 0.75 0.00 -0.75 0.00 0.00 64.21 64.66 1uew n SER 113 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42