#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uhp s SER 2 N 0.00 6.68 -0.30 1.61 0.15 -1.26 -4.98 113.70 115.61 1uhp s SER 2 Ca 0.00 0.69 0.05 0.00 0.70 0.00 0.00 55.95 57.40 1uhp s SER 2 Cb 0.00 -2.42 0.19 0.00 -1.71 0.00 0.00 66.02 62.08 1uhp s SER 2 CO 0.00 -0.63 0.56 -0.44 1.20 0.00 0.00 173.24 173.93 1uhp s SER 3 N 1.62 -1.25 -0.46 5.45 0.01 -1.26 -5.05 113.70 112.76 1uhp s SER 3 Ca 0.33 -0.00 0.09 0.00 1.31 0.00 0.00 55.95 57.68 1uhp s SER 3 Cb -0.14 1.86 0.36 0.00 0.21 0.00 0.00 66.02 68.31 1uhp s SER 3 CO 0.13 -0.30 0.88 0.61 0.41 0.00 0.00 173.24 174.97 1uhp n GLY 4 N 5.32 4.46 3.31 3.44 0.00 -1.26 -5.10 105.19 115.36 1uhp n GLY 4 Ca 0.05 -2.21 -0.36 0.00 0.00 0.00 0.00 46.02 43.49 1uhp n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uhp n SER 5 N -0.05 -2.90 -4.52 1.61 3.41 -1.26 -4.62 113.62 105.29 1uhp n SER 5 Ca 0.27 0.49 -0.40 0.00 -0.26 0.00 0.00 58.87 58.96 1uhp n SER 5 Cb 0.57 -1.04 -0.07 0.00 -0.26 0.00 0.00 64.21 63.41 1uhp n SER 5 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1uhp n SER 6 N 1.04 1.83 -1.84 4.04 7.64 -1.26 -4.89 113.62 120.19 1uhp n SER 6 Ca 0.07 -0.12 0.00 0.00 1.01 0.00 0.00 58.87 59.82 1uhp n SER 6 Cb 0.51 -1.36 0.00 0.00 -1.01 0.00 0.00 64.21 62.35 1uhp n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uhp n GLY 7 N 6.22 3.14 3.19 0.23 0.00 -1.26 -5.00 105.19 111.70 1uhp n GLY 7 Ca 0.45 -2.16 -0.17 0.00 0.00 0.00 0.00 46.02 44.14 1uhp n GLY 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1uhp s LYS 8 N -1.67 0.89 -0.25 1.61 2.47 -1.02 -5.01 119.74 116.75 1uhp s LYS 8 Ca 0.00 -1.08 -0.05 0.00 -1.56 0.00 0.00 55.97 53.27 1uhp s LYS 8 Cb 0.00 -0.79 -0.00 0.00 -1.46 0.00 0.00 37.83 35.58 1uhp s LYS 8 CO 0.00 0.16 0.02 -1.54 0.16 0.00 0.00 175.35 174.15 1uhp s SER 9 N -2.10 4.76 0.05 1.43 1.04 -1.26 -0.82 113.70 116.79 1uhp s SER 9 Ca 0.03 -0.50 0.02 0.00 0.48 0.00 0.00 55.95 55.98 1uhp s SER 9 Cb -0.07 -1.82 -0.04 0.00 0.10 0.00 0.00 66.02 64.19 1uhp s SER 9 CO 0.02 -0.09 0.05 -0.76 0.98 0.00 0.00 173.24 173.44 1uhp s LEU 10 N 1.50 3.72 -0.10 2.42 1.02 0.49 -4.92 118.68 122.81 1uhp s LEU 10 Ca 0.04 0.00 -0.06 0.00 0.02 0.00 0.00 54.13 54.13 1uhp s LEU 10 Cb -0.16 -2.31 -0.04 0.00 0.02 0.00 0.00 46.19 43.71 1uhp s LEU 10 CO 0.00 0.22 0.15 -0.89 0.02 0.00 0.00 176.35 175.84 1uhp s THR 11 N -1.28 5.50 -0.06 5.49 2.01 -1.26 -0.67 115.64 125.37 1uhp s THR 11 Ca 0.25 0.16 -0.06 0.00 0.31 0.00 0.00 61.69 62.36 1uhp s THR 11 Cb -0.12 -3.42 0.02 0.00 0.01 0.00 0.00 72.50 68.99 1uhp s THR 11 CO 0.17 0.58 0.17 -1.48 -0.69 0.00 0.00 174.62 173.37 1uhp s LEU 12 N -1.15 1.33 -0.33 4.42 0.05 0.61 -4.97 118.68 118.63 1uhp s LEU 12 Ca 0.17 0.34 -0.13 0.00 0.05 0.00 0.00 54.13 54.56 1uhp s LEU 12 Cb -0.12 0.57 -0.02 0.00 -2.05 0.00 0.00 46.19 44.57 1uhp s LEU 12 CO 0.06 -0.06 0.26 -0.69 -0.55 0.00 0.00 176.35 175.36 1uhp s VAL 13 N 0.13 5.27 0.18 1.48 1.01 -1.19 0.19 120.40 127.47 1uhp s VAL 13 Ca -0.00 -0.08 0.06 0.00 0.00 0.00 0.00 61.98 61.96 1uhp s VAL 13 Cb -0.02 -3.70 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 1uhp s VAL 13 CO -0.00 0.03 0.11 -0.76 0.00 0.00 0.00 175.10 174.48 1uhp s LEU 14 N 1.79 3.68 0.20 3.92 1.43 0.21 -3.82 118.68 126.09 1uhp s LEU 14 Ca 0.07 -0.22 0.01 0.00 -1.03 0.00 0.00 54.13 52.97 1uhp s LEU 14 Cb -0.17 -2.29 -0.05 0.00 0.03 0.00 0.00 46.19 43.72 1uhp s LEU 14 CO 0.11 0.06 0.06 -1.00 0.23 0.00 0.00 176.35 175.80 1uhp s HIS 15 N -1.80 1.30 -0.19 0.29 3.76 -1.26 -1.33 115.29 116.05 1uhp s HIS 15 Ca 0.30 -1.14 -0.02 0.00 -0.15 0.00 0.00 55.06 54.05 1uhp s HIS 15 Cb -0.10 -0.74 0.06 0.00 1.11 0.00 0.00 32.58 32.92 1uhp s HIS 15 CO 0.22 -0.34 0.02 -0.98 -0.85 0.00 0.00 174.74 172.82 1uhp s ARG 16 N -4.00 0.80 -1.21 1.40 1.70 -1.26 -4.09 118.95 112.29 1uhp s ARG 16 Ca 0.31 -0.46 -0.14 0.00 -0.47 0.00 0.00 55.73 54.96 1uhp s ARG 16 Cb 0.07 -2.10 0.16 0.00 -0.57 0.00 0.00 34.95 32.51 1uhp s ARG 16 CO 0.08 -0.61 1.45 0.34 -1.08 0.00 0.00 175.30 175.49 1uhp s ASP 17 N 1.80 7.03 0.00 -2.89 2.15 -0.83 -4.19 116.67 119.74 1uhp s ASP 17 Ca -0.01 -2.91 0.00 0.00 0.43 0.00 0.00 52.55 50.06 1uhp s ASP 17 Cb -0.17 -2.42 0.00 0.00 -0.30 0.00 0.00 42.92 40.03 1uhp s ASP 17 CO -0.08 -0.80 0.00 -0.24 -0.17 0.00 0.00 175.17 173.88 1uhp n SER 18 N 5.95 -1.50 -2.89 -0.34 2.88 -1.26 -4.14 113.62 112.32 1uhp n SER 18 Ca 0.37 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.72 1uhp n SER 18 Cb 0.43 -0.43 0.01 0.00 -0.75 0.00 0.00 64.21 63.47 1uhp n SER 18 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uhp n GLY 19 N -1.07 -0.50 2.64 0.46 0.00 -1.26 -4.93 105.19 100.54 1uhp n GLY 19 Ca 0.00 0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 1uhp n GLY 19 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1uhp s SER 20 N -2.45 3.51 0.32 1.61 0.15 -1.26 -4.96 113.70 110.61 1uhp s SER 20 Ca 0.21 -2.36 0.01 0.00 0.70 0.00 0.00 55.95 54.51 1uhp s SER 20 Cb -0.10 -0.83 0.55 0.00 -1.71 0.00 0.00 66.02 63.93 1uhp s SER 20 CO 0.26 -0.30 1.96 -0.07 1.20 0.00 0.00 173.24 176.29 1uhp h LEU 21 N 7.01 0.86 0.00 3.45 -0.00 -1.90 -2.21 115.31 122.51 1uhp h LEU 21 Ca -0.01 -0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.86 1uhp h LEU 21 Cb 0.95 -0.20 0.00 0.00 -0.00 0.00 0.00 40.66 41.41 1uhp h LEU 21 CO 0.42 0.59 0.00 0.61 -0.00 0.00 0.00 178.44 180.06 1uhp n GLY 22 N -1.42 1.97 3.39 0.83 0.00 -1.26 -2.69 105.19 106.02 1uhp n GLY 22 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.11 1uhp n GLY 22 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1uhp n PHE 23 N -0.87 -0.98 -4.15 1.61 -1.74 -1.26 0.19 117.46 110.27 1uhp n PHE 23 Ca 0.00 -0.96 -0.09 0.00 -0.56 0.00 0.00 57.45 55.84 1uhp n PHE 23 Cb 0.00 0.46 -0.03 0.00 1.52 0.00 0.00 39.48 41.43 1uhp n PHE 23 CO 0.00 0.00 0.00 0.09 -0.56 0.00 0.00 176.76 176.29 1uhp n ASN 24 N -1.13 0.05 -3.78 5.98 4.13 -0.93 -4.89 115.26 114.69 1uhp n ASN 24 Ca -0.00 -1.95 -0.09 0.00 1.68 0.00 0.00 54.58 54.21 1uhp n ASN 24 Cb 0.51 0.65 -0.06 0.00 -1.54 0.00 0.00 39.78 39.34 1uhp n ASN 24 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 1uhp s ILE 25 N -2.49 0.10 0.26 2.41 -4.36 -1.26 -4.19 121.20 111.67 1uhp s ILE 25 Ca 0.15 -0.96 0.04 0.00 -0.26 0.00 0.00 60.65 59.63 1uhp s ILE 25 Cb 0.01 -1.33 -0.06 0.00 1.25 0.00 0.00 42.46 42.34 1uhp s ILE 25 CO 0.11 -0.48 -0.01 0.27 0.24 0.00 0.00 174.94 175.08 1uhp s ILE 26 N -3.85 1.20 0.00 8.37 -4.36 0.11 -4.83 121.20 117.85 1uhp s ILE 26 Ca 0.05 -2.05 0.00 0.00 -0.26 0.00 0.00 60.65 58.39 1uhp s ILE 26 Cb 0.03 -2.45 0.00 0.00 1.25 0.00 0.00 42.46 41.29 1uhp s ILE 26 CO -0.10 -0.26 0.00 0.61 0.24 0.00 0.00 174.94 175.43 1uhp n GLY 27 N -0.50 -0.40 3.27 6.27 0.00 -1.26 -2.70 105.19 109.87 1uhp n GLY 27 Ca -0.05 -2.11 -0.11 0.00 0.00 0.00 0.00 46.02 43.75 1uhp n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uhp n GLY 28 N 0.00 -1.19 3.74 -0.02 0.00 -1.25 -4.41 105.19 102.06 1uhp n GLY 28 Ca 0.00 0.52 -0.41 0.00 0.00 0.00 0.00 46.02 46.13 1uhp n GLY 28 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1uhp s ARG 29 N -4.00 4.67 -0.80 1.61 3.00 -1.26 -4.63 118.95 117.54 1uhp s ARG 29 Ca 0.21 1.62 -0.06 0.00 0.00 0.00 0.00 55.73 57.49 1uhp s ARG 29 Cb -0.04 -3.29 -0.11 0.00 0.00 0.00 0.00 34.95 31.50 1uhp s ARG 29 CO 0.77 0.21 2.61 -0.35 0.00 0.00 0.00 175.30 178.54 1uhp n PRO 30 N 2.17 2.35 -3.53 3.54 -0.04 -1.26 -4.66 135.00 133.56 1uhp n PRO 30 Ca 0.01 -1.43 -0.33 0.00 -0.04 0.00 0.00 63.50 61.72 1uhp n PRO 30 Cb 0.47 -2.35 0.02 0.00 -0.04 0.00 0.00 33.50 31.60 1uhp n PRO 30 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1uhp n SER 31 N 3.48 -4.95 -0.32 3.54 7.64 -1.26 -4.73 113.62 117.02 1uhp n SER 31 Ca 0.50 -0.47 0.20 0.00 1.01 0.00 0.00 58.87 60.11 1uhp n SER 31 Cb 0.35 -1.51 0.41 0.00 -1.01 0.00 0.00 64.21 62.44 1uhp n SER 31 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 1uhp h VAL 32 N 1.13 0.29 0.00 0.44 3.04 -2.01 -3.40 116.25 115.74 1uhp h VAL 32 Ca -0.58 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.02 1uhp h VAL 32 Cb 1.35 -0.00 0.00 0.00 -2.01 0.00 0.00 31.29 30.62 1uhp h VAL 32 CO 0.27 0.05 0.00 -0.67 -1.01 0.00 0.00 177.57 176.21 1uhp n ASP 33 N -5.13 0.00 0.00 3.17 2.03 -1.26 -5.17 116.55 110.19 1uhp n ASP 33 Ca 0.28 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.59 1uhp n ASP 33 Cb 0.88 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.28 1uhp n ASP 33 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1uhp n ASN 34 N 0.00 0.00 -0.03 1.67 3.02 -1.26 -5.09 115.26 113.57 1uhp n ASN 34 Ca 0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 54.58 54.54 1uhp n ASN 34 Cb 0.00 0.00 -0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1uhp n ASN 34 CO 0.00 0.00 0.00 -0.74 -2.62 0.00 0.00 177.26 173.90 1uhp h HIS 35 N 0.00 0.00 -2.95 3.10 -0.00 -2.02 -3.48 115.15 109.81 1uhp h HIS 35 Ca 0.00 0.00 0.32 0.00 -0.00 0.00 0.00 60.37 60.69 1uhp h HIS 35 Cb 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 27.41 27.30 1uhp h HIS 35 CO 0.00 0.00 -0.69 -0.25 -0.00 0.00 0.00 177.93 176.99 1uhp n ASP 36 N -3.55 -7.32 0.28 3.26 8.00 -1.26 -4.05 116.55 111.90 1uhp n ASP 36 Ca -0.02 0.78 -0.16 0.00 0.71 0.00 0.00 54.79 56.09 1uhp n ASP 36 Cb 0.08 -4.11 -0.08 0.00 -0.02 0.00 0.00 41.12 36.99 1uhp n ASP 36 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1uhp h GLY 37 N -1.29 -0.81 -5.91 0.44 0.00 -2.07 -3.41 103.07 90.01 1uhp h GLY 37 Ca -0.05 0.35 -0.11 0.00 0.00 0.00 0.00 47.33 47.52 1uhp h GLY 37 CO 0.03 -0.30 -0.49 -1.35 0.00 0.00 0.00 176.54 174.44 1uhp s SER 38 N -4.55 -1.18 0.74 0.19 1.04 -1.26 -5.15 113.70 103.53 1uhp s SER 38 Ca -0.17 -1.03 -0.17 0.00 0.48 0.00 0.00 55.95 55.06 1uhp s SER 38 Cb 0.05 1.77 -0.15 0.00 0.10 0.00 0.00 66.02 67.79 1uhp s SER 38 CO 0.63 -0.16 -0.45 -1.20 0.98 0.00 0.00 173.24 173.03 1uhp n SER 39 N 4.18 -4.78 -3.57 7.02 7.64 -1.26 -5.00 113.62 117.86 1uhp n SER 39 Ca 0.12 0.42 -0.17 0.00 1.01 0.00 0.00 58.87 60.26 1uhp n SER 39 Cb 0.55 -0.80 -0.06 0.00 -1.01 0.00 0.00 64.21 62.89 1uhp n SER 39 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1uhp s SER 40 N -0.99 -0.65 0.16 6.43 0.15 -1.26 -5.17 113.70 112.37 1uhp s SER 40 Ca 0.48 0.87 0.02 0.00 0.70 0.00 0.00 55.95 58.03 1uhp s SER 40 Cb -0.34 0.77 -0.01 0.00 -1.71 0.00 0.00 66.02 64.73 1uhp s SER 40 CO 0.74 -0.50 0.08 -0.62 1.20 0.00 0.00 173.24 174.14 1uhp n GLU 41 N 1.43 0.58 -4.31 5.44 4.71 -1.26 -5.03 120.64 122.19 1uhp n GLU 41 Ca -0.18 -1.42 -0.17 0.00 -0.01 0.00 0.00 57.16 55.38 1uhp n GLU 41 Cb 0.56 0.90 -0.10 0.00 -1.01 0.00 0.00 31.44 31.79 1uhp n GLU 41 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1uhp s GLY 42 N -2.02 1.33 -0.16 0.62 0.00 -1.26 -4.38 107.32 101.46 1uhp s GLY 42 Ca 0.11 -1.62 -0.02 0.00 0.00 0.00 0.00 44.72 43.19 1uhp s GLY 42 CO 0.08 -1.69 -0.08 -0.42 0.00 0.00 0.00 173.10 170.99 1uhp s ILE 43 N -3.14 3.42 0.06 0.90 -1.09 -1.26 -3.96 121.20 116.13 1uhp s ILE 43 Ca 0.21 -0.52 0.00 0.00 -2.23 0.00 0.00 60.65 58.12 1uhp s ILE 43 Cb 0.01 -2.48 -0.04 0.00 -1.58 0.00 0.00 42.46 38.37 1uhp s ILE 43 CO 0.05 0.49 -0.05 -0.36 -1.23 0.00 0.00 174.94 173.85 1uhp s PHE 44 N 0.55 0.63 -0.22 3.97 0.40 -1.10 -3.04 117.98 119.18 1uhp s PHE 44 Ca -0.05 -0.93 -0.14 0.00 -0.60 0.00 0.00 56.93 55.20 1uhp s PHE 44 Cb -0.15 -0.42 -0.04 0.00 0.51 0.00 0.00 43.02 42.92 1uhp s PHE 44 CO 0.03 -0.26 0.32 0.08 0.70 0.00 0.00 175.22 176.09 1uhp s VAL 45 N -3.43 5.25 0.00 -0.44 1.01 0.49 0.10 120.40 123.38 1uhp s VAL 45 Ca 0.05 0.53 0.00 0.00 0.00 0.00 0.00 61.98 62.56 1uhp s VAL 45 Cb 0.04 -3.65 0.00 0.00 0.00 0.00 0.00 36.38 32.77 1uhp s VAL 45 CO -0.07 0.28 0.75 -0.24 0.00 0.00 0.00 175.10 175.82 1uhp n SER 46 N 4.47 1.41 -3.54 3.32 2.88 -1.26 0.45 113.62 121.35 1uhp n SER 46 Ca -0.10 -1.54 -0.16 0.00 -1.33 0.00 0.00 58.87 55.73 1uhp n SER 46 Cb 0.51 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.91 1uhp n SER 46 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1uhp s LYS 47 N -0.54 0.95 -0.22 -1.46 2.20 -1.26 -4.96 119.74 114.45 1uhp s LYS 47 Ca 0.00 0.26 -0.07 0.00 -0.36 0.00 0.00 55.97 55.81 1uhp s LYS 47 Cb 0.00 0.45 0.10 0.00 -1.51 0.00 0.00 37.83 36.88 1uhp s LYS 47 CO 0.00 -0.29 0.46 0.42 -0.36 0.00 0.00 175.35 175.57 1uhp s ILE 48 N -1.11 -0.71 0.14 5.43 1.01 -1.26 -2.19 121.20 122.50 1uhp s ILE 48 Ca -0.09 0.11 -0.31 0.00 0.00 0.00 0.00 60.65 60.37 1uhp s ILE 48 Cb -0.00 -0.74 -0.08 0.00 0.01 0.00 0.00 42.46 41.64 1uhp s ILE 48 CO 0.08 0.04 1.36 -0.69 0.00 0.00 0.00 174.94 175.73 1uhp s VAL 49 N 2.66 3.29 0.00 2.92 1.01 0.51 -4.91 120.40 125.88 1uhp s VAL 49 Ca -0.00 0.96 0.00 0.00 0.00 0.00 0.00 61.98 62.94 1uhp s VAL 49 Cb -0.12 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.64 1uhp s VAL 49 CO -0.14 0.09 0.60 0.47 0.00 0.00 0.00 175.10 176.12 1uhp n ASP 50 N 3.58 0.00 0.27 3.32 9.92 -1.26 -2.80 116.55 129.57 1uhp n ASP 50 Ca 0.10 0.64 0.15 0.00 -0.53 0.00 0.00 54.79 55.15 1uhp n ASP 50 Cb 0.42 -0.24 0.70 0.00 -0.64 0.00 0.00 41.12 41.37 1uhp n ASP 50 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 1uhp h SER 51 N 0.00 0.00 -3.21 -2.24 0.02 -1.96 -3.34 113.55 102.82 1uhp h SER 51 Ca 0.00 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.38 1uhp h SER 51 Cb 0.00 0.00 0.17 0.00 0.14 0.00 0.00 62.40 62.71 1uhp h SER 51 CO 0.00 0.00 -0.25 0.61 -1.14 0.00 0.00 176.83 176.05 1uhp n GLY 52 N -1.32 -1.19 0.00 -3.77 0.00 -1.12 -4.76 105.19 93.03 1uhp n GLY 52 Ca 0.01 -0.23 0.12 0.00 0.00 0.00 0.00 46.02 45.92 1uhp n GLY 52 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1uhp n PRO 53 N -0.55 0.58 -0.01 1.61 -0.04 -1.25 -1.44 135.00 133.90 1uhp n PRO 53 Ca 0.12 0.03 -0.13 0.00 -0.04 0.00 0.00 63.50 63.48 1uhp n PRO 53 Cb 0.48 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.30 1uhp n PRO 53 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1uhp h ALA 54 N 3.34 0.65 0.00 0.55 0.00 -1.73 0.06 119.26 122.12 1uhp h ALA 54 Ca 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 54.91 53.48 1uhp h ALA 54 Cb 0.08 0.55 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1uhp h ALA 54 CO 0.00 1.48 -1.14 0.00 0.00 0.00 0.00 179.25 179.59 1uhp n ALA 55 N -2.70 2.60 -1.00 0.00 0.00 -1.04 -1.90 120.51 116.47 1uhp n ALA 55 Ca -0.21 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1uhp n ALA 55 Cb 1.05 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1uhp n ALA 55 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1uhp n LYS 56 N -2.58 0.00 -0.01 0.00 4.76 -0.52 -4.69 118.16 115.12 1uhp n LYS 56 Ca -0.00 0.00 0.10 0.00 -2.87 0.00 0.00 58.31 55.53 1uhp n LYS 56 Cb 0.55 -0.49 -0.15 0.00 -1.84 0.00 0.00 35.03 33.10 1uhp n LYS 56 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1uhp n GLU 57 N -0.36 0.60 -0.15 1.97 -0.58 -1.21 -4.61 120.64 116.30 1uhp n GLU 57 Ca 0.00 -0.17 -0.04 0.00 -0.42 0.00 0.00 57.16 56.53 1uhp n GLU 57 Cb 0.00 -1.46 -0.04 0.00 -0.57 0.00 0.00 31.44 29.37 1uhp n GLU 57 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1uhp n GLY 58 N 1.39 -2.28 0.00 0.62 0.00 0.01 -4.74 105.19 100.18 1uhp n GLY 58 Ca -0.03 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.66 1uhp n GLY 58 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uhp n GLY 59 N -1.09 0.75 3.69 -0.02 0.00 -0.80 -3.19 105.19 104.54 1uhp n GLY 59 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 1uhp n GLY 59 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1uhp s LEU 60 N 0.00 1.54 -0.27 0.99 2.96 -1.19 -5.00 118.68 117.72 1uhp s LEU 60 Ca 0.00 1.00 -0.11 0.00 -0.22 0.00 0.00 54.13 54.80 1uhp s LEU 60 Cb 0.00 -3.13 0.11 0.00 0.50 0.00 0.00 46.19 43.67 1uhp s LEU 60 CO 0.00 -3.18 0.61 -1.58 -1.32 0.00 0.00 176.35 170.89 1uhp s GLN 61 N -5.14 0.56 0.55 1.98 0.74 -1.26 -4.90 119.66 112.20 1uhp s GLN 61 Ca 0.66 1.31 -0.16 0.00 0.05 0.00 0.00 55.36 57.21 1uhp s GLN 61 Cb -0.16 0.57 -0.14 0.00 1.10 0.00 0.00 33.01 34.38 1uhp s GLN 61 CO 0.56 -0.19 -0.24 -0.89 -0.55 0.00 0.00 175.29 173.98 1uhp n ILE 62 N 5.10 0.00 -3.20 -2.34 5.41 -1.26 -2.66 119.36 120.41 1uhp n ILE 62 Ca -0.14 -0.46 -0.15 0.00 1.00 0.00 0.00 62.75 63.00 1uhp n ILE 62 Cb 0.52 0.00 0.06 0.00 -0.71 0.00 0.00 39.64 39.51 1uhp n ILE 62 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1uhp n HIS 63 N -1.56 -1.92 -4.76 1.39 8.25 0.17 -4.98 115.22 111.82 1uhp n HIS 63 Ca 0.06 0.73 -0.32 0.00 -0.26 0.00 0.00 57.72 57.93 1uhp n HIS 63 Cb 0.45 -4.16 -0.13 0.00 1.12 0.00 0.00 29.99 27.27 1uhp n HIS 63 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1uhp s ASP 64 N -3.61 3.91 -0.71 0.41 2.15 -1.09 -4.87 116.67 112.87 1uhp s ASP 64 Ca 0.23 -0.32 -0.09 0.00 0.43 0.00 0.00 52.55 52.80 1uhp s ASP 64 Cb -0.10 -0.72 0.18 0.00 -0.30 0.00 0.00 42.92 41.98 1uhp s ASP 64 CO 0.55 0.29 0.59 -0.60 -0.17 0.00 0.00 175.17 175.83 1uhp s ARG 65 N -1.15 3.07 0.31 4.34 3.52 -1.26 -0.38 118.95 127.40 1uhp s ARG 65 Ca 0.14 -2.40 -0.27 0.00 -0.13 0.00 0.00 55.73 53.06 1uhp s ARG 65 Cb -0.11 -4.11 -0.14 0.00 -1.56 0.00 0.00 34.95 29.04 1uhp s ARG 65 CO 0.04 -1.24 1.01 -0.89 -0.81 0.00 0.00 175.30 173.41 1uhp n ILE 66 N 3.91 2.04 -0.04 4.11 5.41 -1.17 -3.18 119.36 130.44 1uhp n ILE 66 Ca 0.08 -0.50 -0.07 0.00 1.00 0.00 0.00 62.75 63.27 1uhp n ILE 66 Cb 0.43 -1.03 -0.03 0.00 -0.71 0.00 0.00 39.64 38.29 1uhp n ILE 66 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 1uhp n ILE 67 N 0.11 0.44 -3.80 1.39 2.08 0.19 -4.15 119.36 115.62 1uhp n ILE 67 Ca 0.09 -0.15 -0.12 0.00 0.56 0.00 0.00 62.75 63.14 1uhp n ILE 67 Cb 0.33 -1.11 -0.08 0.00 -0.75 0.00 0.00 39.64 38.02 1uhp n ILE 67 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 1uhp s GLU 68 N -2.15 0.68 -0.07 0.38 2.12 -1.23 -2.86 118.70 115.57 1uhp s GLU 68 Ca -0.11 -0.43 -0.03 0.00 0.36 0.00 0.00 54.97 54.76 1uhp s GLU 68 Cb 0.03 0.29 0.04 0.00 0.26 0.00 0.00 34.13 34.75 1uhp s GLU 68 CO 0.16 -0.19 0.07 0.54 -0.54 0.00 0.00 175.26 175.29 1uhp s VAL 69 N -2.00 -0.10 -1.68 3.70 0.11 0.50 -0.83 120.40 120.10 1uhp s VAL 69 Ca -0.09 0.29 0.00 0.00 -2.93 0.00 0.00 61.98 59.25 1uhp s VAL 69 Cb -0.03 -0.25 0.00 0.00 -1.53 0.00 0.00 36.38 34.56 1uhp s VAL 69 CO -0.00 0.08 0.00 -3.20 -3.33 0.00 0.00 175.10 168.64 1uhp n ASN 70 N 5.29 -4.25 0.00 3.54 2.85 0.59 0.18 115.26 123.47 1uhp n ASN 70 Ca -0.04 0.39 0.00 0.00 -0.11 0.00 0.00 54.58 54.82 1uhp n ASN 70 Cb 0.50 -3.84 0.00 0.00 1.24 0.00 0.00 39.78 37.68 1uhp n ASN 70 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1uhp n GLY 71 N -0.28 0.34 3.69 8.20 0.00 -1.25 -4.90 105.19 110.99 1uhp n GLY 71 Ca -0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 1uhp n GLY 71 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1uhp s ARG 72 N -0.99 4.22 -0.02 1.61 3.52 0.49 -5.05 118.95 122.73 1uhp s ARG 72 Ca 0.00 0.26 -0.29 0.00 -0.13 0.00 0.00 55.73 55.57 1uhp s ARG 72 Cb 0.00 -3.50 -0.03 0.00 -1.56 0.00 0.00 34.95 29.86 1uhp s ARG 72 CO 0.00 0.03 0.95 0.34 -0.81 0.00 0.00 175.30 175.82 1uhp s ASP 73 N 0.88 7.31 0.00 -2.12 2.15 -1.26 0.19 116.67 123.82 1uhp s ASP 73 Ca 0.21 1.59 0.00 0.00 0.43 0.00 0.00 52.55 54.78 1uhp s ASP 73 Cb -0.15 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 39.92 1uhp s ASP 73 CO 0.08 -0.27 0.51 0.18 -0.17 0.00 0.00 175.17 175.50 1uhp n LEU 74 N 4.01 0.95 -0.25 -1.34 4.77 -1.13 -4.64 117.00 119.36 1uhp n LEU 74 Ca 0.06 -0.95 0.11 0.00 -0.03 0.00 0.00 56.01 55.20 1uhp n LEU 74 Cb 0.51 0.00 0.38 0.00 -2.33 0.00 0.00 43.42 41.98 1uhp n LEU 74 CO 0.51 0.24 1.22 -1.28 -1.33 0.00 0.00 177.39 176.75 1uhp h SER 75 N 0.00 0.63 -0.22 -1.43 0.87 -1.72 0.38 113.55 112.07 1uhp h SER 75 Ca 0.00 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.58 1uhp h SER 75 Cb 0.26 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.12 1uhp h SER 75 CO 0.00 0.33 -0.01 -2.11 -0.53 0.00 0.00 176.83 174.52 1uhp n ARG 76 N -4.54 2.55 -3.01 2.24 1.85 -1.26 -4.31 116.66 110.17 1uhp n ARG 76 Ca 0.16 -2.83 -0.17 0.00 -1.00 0.00 0.00 57.85 54.01 1uhp n ARG 76 Cb 0.44 -1.79 0.02 0.00 -1.05 0.00 0.00 32.46 30.08 1uhp n ARG 76 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1uhp s ALA 77 N -2.88 4.55 0.42 2.89 0.00 0.12 -4.67 121.76 122.20 1uhp s ALA 77 Ca 0.41 -1.74 0.05 0.00 0.00 0.00 0.00 51.96 50.68 1uhp s ALA 77 Cb 0.34 -1.61 0.05 0.00 0.00 0.00 0.00 23.12 21.89 1uhp s ALA 77 CO 0.07 -0.38 0.38 0.25 0.00 0.00 0.00 175.76 176.09 1uhp n THR 78 N -1.92 0.00 -0.22 0.00 -2.24 -1.26 -4.34 114.28 104.31 1uhp n THR 78 Ca 0.09 -1.58 -0.07 0.00 -2.27 0.00 0.00 64.05 60.22 1uhp n THR 78 Cb 0.59 -0.28 0.03 0.00 -2.10 0.00 0.00 70.33 68.58 1uhp n THR 78 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 1uhp h HIS 79 N 0.48 0.89 0.21 4.78 2.76 -1.82 0.61 115.15 123.06 1uhp h HIS 79 Ca -0.24 -0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 57.87 1uhp h HIS 79 Cb 0.95 -0.27 0.00 0.00 1.55 0.00 0.00 27.41 29.63 1uhp h HIS 79 CO 0.00 0.69 -0.10 -0.44 -1.30 0.00 0.00 177.93 176.77 1uhp h ASP 80 N 0.84 -0.24 -0.15 3.26 5.19 -1.93 0.18 116.42 123.57 1uhp h ASP 80 Ca 0.21 0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.62 1uhp h ASP 80 Cb 0.14 0.06 -0.01 0.00 0.18 0.00 0.00 39.33 39.71 1uhp h ASP 80 CO -0.02 -0.17 0.08 1.56 -3.12 0.00 0.00 179.24 177.57 1uhp h GLN 81 N -0.28 0.21 0.05 3.56 4.20 -1.89 0.14 115.11 121.10 1uhp h GLN 81 Ca -0.03 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.68 1uhp h GLN 81 Cb 0.22 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 27.91 1uhp h GLN 81 CO 0.05 0.21 -0.41 0.00 -0.67 0.00 0.00 178.83 178.00 1uhp h ALA 82 N 0.99 -0.69 -0.14 3.87 0.00 0.43 0.52 119.26 124.23 1uhp h ALA 82 Ca 0.05 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1uhp h ALA 82 Cb 0.06 0.71 -0.06 0.00 0.00 0.00 0.00 17.79 18.50 1uhp h ALA 82 CO -0.01 -0.96 -0.29 0.28 0.00 0.00 0.00 179.25 178.27 1uhp h VAL 83 N -0.60 0.33 -0.67 0.00 2.07 -0.50 0.28 116.25 117.15 1uhp h VAL 83 Ca 0.04 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.69 1uhp h VAL 83 Cb 0.66 0.33 -0.10 0.00 -1.52 0.00 0.00 31.29 30.66 1uhp h VAL 83 CO -0.28 0.00 0.15 -0.08 0.02 0.00 0.00 177.57 177.38 1uhp h GLU 84 N -0.36 0.25 0.31 1.57 4.81 -0.28 1.32 114.58 122.21 1uhp h GLU 84 Ca 0.10 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1uhp h GLU 84 Cb 0.51 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.81 1uhp h GLU 84 CO -0.34 0.17 -0.39 0.00 -0.73 0.00 0.00 179.01 177.71 1uhp h ALA 85 N 1.55 -0.80 0.00 2.92 0.00 0.15 1.17 119.26 124.25 1uhp h ALA 85 Ca 0.36 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1uhp h ALA 85 Cb 0.58 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1uhp h ALA 85 CO -0.46 -1.00 -0.12 0.74 0.00 0.00 0.00 179.25 178.41 1uhp h PHE 86 N -0.75 0.00 -0.01 0.00 0.04 0.13 1.43 116.94 117.79 1uhp h PHE 86 Ca -0.01 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.73 1uhp h PHE 86 Cb 0.70 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.85 1uhp h PHE 86 CO -0.25 0.12 -0.07 -0.22 -0.60 0.00 0.00 178.31 177.28 1uhp h LYS 87 N 0.00 0.07 -0.00 1.51 3.64 0.31 -3.19 116.57 118.91 1uhp h LYS 87 Ca -0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1uhp h LYS 87 Cb 0.30 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 1uhp h LYS 87 CO 0.02 0.76 -0.15 0.25 -2.27 0.00 0.00 179.45 178.05 1uhp n THR 88 N -4.68 0.00 -2.03 1.00 -2.24 0.39 -4.87 114.28 101.85 1uhp n THR 88 Ca -0.09 -0.03 -0.36 0.00 -2.27 0.00 0.00 64.05 61.31 1uhp n THR 88 Cb 0.39 -0.17 0.03 0.00 -2.10 0.00 0.00 70.33 68.47 1uhp n THR 88 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uhp s ALA 89 N -2.75 2.56 0.16 6.98 0.00 0.49 -5.04 121.76 124.16 1uhp s ALA 89 Ca 0.21 0.97 0.10 0.00 0.00 0.00 0.00 51.96 53.24 1uhp s ALA 89 Cb 0.19 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.83 1uhp s ALA 89 CO 0.54 -1.12 -0.19 0.15 0.00 0.00 0.00 175.76 175.13 1uhp s LYS 90 N -3.35 1.70 0.10 0.00 -0.14 -1.26 -4.96 119.74 111.83 1uhp s LYS 90 Ca 0.76 -1.33 -0.15 0.00 -1.36 0.00 0.00 55.97 53.89 1uhp s LYS 90 Cb -0.29 -2.01 -0.07 0.00 -1.68 0.00 0.00 37.83 33.79 1uhp s LYS 90 CO 0.33 0.44 0.51 -1.21 -0.76 0.00 0.00 175.35 174.66 1uhp s GLU 91 N -2.45 3.98 0.31 1.68 8.01 -1.26 -2.60 118.70 126.37 1uhp s GLU 91 Ca 0.20 0.48 -0.28 0.00 0.01 0.00 0.00 54.97 55.38 1uhp s GLU 91 Cb -0.09 -3.03 -0.09 0.00 -4.31 0.00 0.00 34.13 26.60 1uhp s GLU 91 CO 0.10 0.55 1.07 -1.25 0.01 0.00 0.00 175.26 175.75 1uhp s PRO 92 N -1.68 4.53 -0.40 0.39 0.04 -1.26 -5.12 135.00 131.50 1uhp s PRO 92 Ca 0.34 1.70 -0.19 0.00 0.04 0.00 0.00 61.00 62.89 1uhp s PRO 92 Cb -0.16 -3.02 0.01 0.00 0.04 0.00 0.00 34.50 31.37 1uhp s PRO 92 CO 0.18 0.14 0.57 0.42 0.04 0.00 0.00 177.00 178.35 1uhp s ILE 93 N -1.30 4.93 -0.46 0.56 1.01 -0.45 -4.95 121.20 120.56 1uhp s ILE 93 Ca 0.48 0.13 -0.27 0.00 0.00 0.00 0.00 60.65 60.99 1uhp s ILE 93 Cb -0.29 -4.09 0.03 0.00 0.01 0.00 0.00 42.46 38.11 1uhp s ILE 93 CO 0.37 -0.43 1.01 -0.69 0.00 0.00 0.00 174.94 175.20 1uhp s VAL 94 N 2.56 4.38 0.12 2.92 1.01 -1.26 0.64 120.40 130.76 1uhp s VAL 94 Ca 0.20 0.97 0.09 0.00 0.00 0.00 0.00 61.98 63.24 1uhp s VAL 94 Cb -0.15 -4.50 -0.04 0.00 0.00 0.00 0.00 36.38 31.69 1uhp s VAL 94 CO 0.16 -0.88 -0.16 -0.69 0.00 0.00 0.00 175.10 173.53 1uhp s VAL 95 N 4.01 2.94 -0.03 2.92 1.01 0.51 0.22 120.40 131.97 1uhp s VAL 95 Ca 0.41 -1.50 0.04 0.00 0.00 0.00 0.00 61.98 60.93 1uhp s VAL 95 Cb -0.09 -2.36 -0.00 0.00 0.00 0.00 0.00 36.38 33.92 1uhp s VAL 95 CO 0.28 0.08 -0.14 -1.58 0.00 0.00 0.00 175.10 173.74 1uhp s GLN 96 N -2.23 1.39 0.30 2.72 0.74 -0.01 0.22 119.66 122.80 1uhp s GLN 96 Ca 0.19 -0.48 0.07 0.00 0.05 0.00 0.00 55.36 55.19 1uhp s GLN 96 Cb -0.10 -1.25 -0.06 0.00 1.10 0.00 0.00 33.01 32.70 1uhp s GLN 96 CO 0.11 0.20 -0.06 0.14 -0.55 0.00 0.00 175.29 175.14 1uhp s VAL 97 N 0.04 1.74 -0.36 1.34 -7.23 0.16 0.53 120.40 116.62 1uhp s VAL 97 Ca -0.02 -2.13 -0.07 0.00 -1.81 0.00 0.00 61.98 57.95 1uhp s VAL 97 Cb -0.10 -2.51 0.05 0.00 0.56 0.00 0.00 36.38 34.38 1uhp s VAL 97 CO 0.01 -0.26 0.14 -0.76 -0.31 0.00 0.00 175.10 173.92 1uhp s LEU 98 N -3.48 4.53 -0.06 1.32 1.02 -1.19 -0.38 118.68 120.45 1uhp s LEU 98 Ca 0.30 -1.27 0.05 0.00 0.02 0.00 0.00 54.13 53.23 1uhp s LEU 98 Cb 0.04 -1.89 -0.02 0.00 0.02 0.00 0.00 46.19 44.35 1uhp s LEU 98 CO 0.13 -0.38 -0.21 -0.60 0.02 0.00 0.00 176.35 175.31 1uhp s ARG 99 N 1.39 2.56 0.57 1.70 3.52 0.00 -4.51 118.95 124.18 1uhp s ARG 99 Ca -0.00 -0.83 0.44 0.00 -0.13 0.00 0.00 55.73 55.20 1uhp s ARG 99 Cb -0.20 -2.25 1.53 0.00 -1.56 0.00 0.00 34.95 32.47 1uhp s ARG 99 CO 0.02 0.45 1.52 0.07 -0.81 0.00 0.00 175.30 176.55 1uhp h ARG 100 N 5.87 0.00 0.00 5.12 -0.00 -1.95 -2.71 114.38 120.71 1uhp h ARG 100 Ca -0.36 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.62 1uhp h ARG 100 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.14 1uhp h ARG 100 CO 0.49 0.00 0.00 -2.37 -0.00 0.00 0.00 179.97 178.09 1uhp n THR 101 N -3.77 0.00 -3.74 0.08 5.66 -1.26 -4.46 114.28 106.78 1uhp n THR 101 Ca 0.38 0.00 -0.00 0.00 -3.05 0.00 0.00 64.05 61.38 1uhp n THR 101 Cb 1.85 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 70.64 1uhp n THR 101 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1uhp n SER 102 N -1.90 -0.71 -3.11 1.09 3.41 -1.26 -4.98 113.62 106.15 1uhp n SER 102 Ca 0.00 -1.31 0.06 0.00 -0.26 0.00 0.00 58.87 57.35 1uhp n SER 102 Cb 0.00 1.14 0.00 0.00 -0.26 0.00 0.00 64.21 65.09 1uhp n SER 102 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1uhp s GLY 103 N -2.82 -0.91 0.74 5.00 0.00 -1.26 -5.00 107.32 103.07 1uhp s GLY 103 Ca 0.12 2.30 -0.11 0.00 0.00 0.00 0.00 44.72 47.03 1uhp s GLY 103 CO 0.02 4.23 1.08 2.56 0.00 0.00 0.00 173.10 180.98 1uhp s PRO 104 N 2.91 2.58 0.10 2.90 0.04 -1.26 -5.02 135.00 137.25 1uhp s PRO 104 Ca 0.31 0.82 0.00 0.00 0.04 0.00 0.00 61.00 62.17 1uhp s PRO 104 Cb 0.01 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.59 1uhp s PRO 104 CO -0.22 -1.32 0.00 0.45 0.04 0.00 0.00 177.00 175.95 1uhp n SER 105 N -3.26 0.99 -4.26 6.66 2.88 -1.26 -5.07 113.62 110.31 1uhp n SER 105 Ca 0.07 0.14 -0.38 0.00 -1.33 0.00 0.00 58.87 57.38 1uhp n SER 105 Cb 0.55 -0.29 0.03 0.00 -0.75 0.00 0.00 64.21 63.75 1uhp n SER 105 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1uhp n SER 106 N -3.46 -3.48 0.00 -3.46 3.41 -1.26 -5.30 113.62 100.06 1uhp n SER 106 Ca 0.00 0.53 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 1uhp n SER 106 Cb 0.04 -0.94 0.00 0.00 -0.26 0.00 0.00 64.21 63.05 1uhp n SER 106 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49