#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uh0 s LYS 2 N 0.00 4.08 0.47 1.61 2.20 0.44 -4.74 119.74 123.80 1uh0 s LYS 2 Ca 0.00 0.23 -0.21 0.00 -0.36 0.00 0.00 55.97 55.63 1uh0 s LYS 2 Cb 0.00 -3.62 -0.09 0.00 -1.51 0.00 0.00 37.83 32.61 1uh0 s LYS 2 CO 0.00 -0.26 1.04 0.00 -0.36 0.00 0.00 175.35 175.77 1uh0 s ALA 3 N 2.00 2.91 0.04 3.13 0.00 -1.26 -1.35 121.76 127.23 1uh0 s ALA 3 Ca 0.19 0.62 -0.03 0.00 0.00 0.00 0.00 51.96 52.75 1uh0 s ALA 3 Cb -0.15 -3.26 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 1uh0 s ALA 3 CO 0.09 -0.29 0.02 -0.59 0.00 0.00 0.00 175.76 174.99 1uh0 s PHE 4 N -1.93 0.33 -0.29 0.00 -0.71 0.48 -4.95 117.98 110.92 1uh0 s PHE 4 Ca 0.66 -0.73 0.03 0.00 -1.04 0.00 0.00 56.93 55.84 1uh0 s PHE 4 Cb -0.17 -0.24 0.17 0.00 -1.21 0.00 0.00 43.02 41.57 1uh0 s PHE 4 CO 0.21 -0.34 0.47 0.34 -1.34 0.00 0.00 175.22 174.56 1uh0 s ASP 5 N -2.31 -0.33 0.39 1.98 2.15 -1.26 -0.72 116.67 116.57 1uh0 s ASP 5 Ca -0.02 -0.12 0.19 0.00 0.43 0.00 0.00 52.55 53.02 1uh0 s ASP 5 Cb 0.01 1.44 0.79 0.00 -0.30 0.00 0.00 42.92 44.86 1uh0 s ASP 5 CO -0.06 -0.33 1.79 0.44 -0.17 0.00 0.00 175.17 176.84 1uh0 h ASP 6 N 8.11 0.00 -3.81 -0.34 3.32 -1.57 -3.49 116.42 118.64 1uh0 h ASP 6 Ca -0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1uh0 h ASP 6 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 1uh0 h ASP 6 CO 0.23 0.35 0.00 0.61 -1.72 0.00 0.00 179.24 178.70 1uh0 n GLY 7 N -0.01 -1.86 3.77 2.75 0.00 -1.25 -4.96 105.19 103.63 1uh0 n GLY 7 Ca -0.01 -1.74 -0.31 0.00 0.00 0.00 0.00 46.02 43.97 1uh0 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uh0 s ALA 8 N -1.51 3.55 0.00 4.61 0.00 -1.26 -4.04 121.76 123.11 1uh0 s ALA 8 Ca 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 50.95 1uh0 s ALA 8 Cb 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 23.12 21.69 1uh0 s ALA 8 CO 0.00 0.75 0.00 1.19 0.00 0.00 0.00 175.76 177.70 1uh0 n PHE 9 N 0.50 0.00 0.10 0.00 3.01 0.42 -5.00 117.46 116.49 1uh0 n PHE 9 Ca -0.09 0.00 -0.00 0.00 1.01 0.00 0.00 57.45 58.37 1uh0 n PHE 9 Cb 0.52 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.96 1uh0 n PHE 9 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1uh0 h THR 10 N 0.81 0.97 0.00 4.37 2.02 -1.34 -3.45 112.91 116.28 1uh0 h THR 10 Ca 0.00 -2.44 0.00 0.00 0.77 0.00 0.00 66.41 64.74 1uh0 h THR 10 Cb 0.00 2.44 0.00 0.00 -1.74 0.00 0.00 68.15 68.85 1uh0 h THR 10 CO 0.00 0.55 0.00 0.61 0.37 0.00 0.00 175.52 177.05 1uh0 n GLY 11 N 1.29 -1.30 3.19 2.16 0.00 -1.13 -4.94 105.19 104.46 1uh0 n GLY 11 Ca -0.01 -0.92 -0.29 0.00 0.00 0.00 0.00 46.02 44.80 1uh0 n GLY 11 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uh0 s ILE 12 N -2.93 1.75 -0.15 -0.61 1.01 -1.26 -1.10 121.20 117.91 1uh0 s ILE 12 Ca 0.00 -0.88 -0.01 0.00 0.00 0.00 0.00 60.65 59.77 1uh0 s ILE 12 Cb 0.00 -1.50 -0.09 0.00 0.01 0.00 0.00 42.46 40.87 1uh0 s ILE 12 CO 0.00 0.49 -0.15 0.54 0.00 0.00 0.00 174.94 175.83 1uh0 n ARG 13 N 3.23 0.37 -3.70 2.79 1.74 -0.23 -4.81 116.66 116.05 1uh0 n ARG 13 Ca -0.19 0.10 -0.14 0.00 -0.77 0.00 0.00 57.85 56.86 1uh0 n ARG 13 Cb 0.52 -1.25 -0.09 0.00 -1.02 0.00 0.00 32.46 30.62 1uh0 n ARG 13 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1uh0 s GLU 14 N -2.30 0.63 -0.10 5.56 2.12 -0.86 -1.31 118.70 122.44 1uh0 s GLU 14 Ca -0.21 0.51 0.03 0.00 0.36 0.00 0.00 54.97 55.67 1uh0 s GLU 14 Cb 0.06 0.30 0.01 0.00 0.26 0.00 0.00 34.13 34.76 1uh0 s GLU 14 CO 0.33 -0.11 -0.20 0.42 -0.54 0.00 0.00 175.26 175.16 1uh0 s ILE 15 N -0.11 1.78 -0.24 -3.70 1.01 -0.28 0.03 121.20 119.69 1uh0 s ILE 15 Ca -0.03 -0.85 0.01 0.00 0.00 0.00 0.00 60.65 59.79 1uh0 s ILE 15 Cb -0.03 -1.57 0.04 0.00 0.01 0.00 0.00 42.46 40.91 1uh0 s ILE 15 CO 0.02 0.50 -0.11 0.20 0.00 0.00 0.00 174.94 175.54 1uh0 s ASN 16 N 0.55 4.13 0.17 3.58 0.01 0.80 -0.05 114.94 124.13 1uh0 s ASN 16 Ca -0.15 -1.10 0.03 0.00 -0.71 0.00 0.00 52.86 50.93 1uh0 s ASN 16 Cb -0.17 -1.57 -0.05 0.00 0.41 0.00 0.00 41.25 39.88 1uh0 s ASN 16 CO 0.05 -0.14 -0.03 -1.48 -1.51 0.00 0.00 177.10 174.00 1uh0 s LEU 17 N 1.20 2.26 0.09 0.60 0.05 -0.68 -0.63 118.68 121.58 1uh0 s LEU 17 Ca -0.03 -1.13 0.05 0.00 0.05 0.00 0.00 54.13 53.06 1uh0 s LEU 17 Cb -0.18 -0.15 -0.03 0.00 -2.05 0.00 0.00 46.19 43.78 1uh0 s LEU 17 CO -0.07 -0.50 -0.12 -0.94 -0.55 0.00 0.00 176.35 174.17 1uh0 s SER 18 N -3.18 1.60 0.29 1.48 1.04 -0.82 0.22 113.70 114.33 1uh0 s SER 18 Ca 0.22 -0.71 -0.06 0.00 0.48 0.00 0.00 55.95 55.87 1uh0 s SER 18 Cb 0.05 -0.03 -0.01 0.00 0.10 0.00 0.00 66.02 66.14 1uh0 s SER 18 CO 0.03 -0.16 0.43 -0.72 0.98 0.00 0.00 173.24 173.80 1uh0 s TYR 19 N -1.83 0.80 -0.08 5.02 1.13 -0.77 0.32 117.35 121.95 1uh0 s TYR 19 Ca 0.02 -1.09 -0.01 0.00 -1.41 0.00 0.00 57.07 54.58 1uh0 s TYR 19 Cb -0.07 -0.04 0.03 0.00 -1.10 0.00 0.00 41.96 40.79 1uh0 s TYR 19 CO 0.02 -1.02 0.01 1.21 -2.51 0.00 0.00 175.55 173.25 1uh0 s ASN 20 N -3.14 1.69 0.00 -0.18 3.04 -0.94 0.34 114.94 115.75 1uh0 s ASN 20 Ca 0.28 -0.14 0.03 0.00 0.04 0.00 0.00 52.86 53.07 1uh0 s ASN 20 Cb 0.00 -0.45 0.18 0.00 -1.54 0.00 0.00 41.25 39.44 1uh0 s ASN 20 CO 0.15 -0.20 0.70 2.29 -3.04 0.00 0.00 177.10 176.99 1uh0 n LYS 21 N 5.14 0.09 -0.01 0.43 2.85 -1.26 -1.81 118.16 123.59 1uh0 n LYS 21 Ca -0.07 0.03 0.02 0.00 -1.05 0.00 0.00 58.31 57.24 1uh0 n LYS 21 Cb 0.50 -1.50 -0.06 0.00 -0.65 0.00 0.00 35.03 33.31 1uh0 n LYS 21 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1uh0 n GLU 22 N -1.04 0.87 0.00 -1.58 1.02 -1.26 -4.62 120.64 114.04 1uh0 n GLU 22 Ca 0.02 -0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.10 1uh0 n GLU 22 Cb 0.01 -1.20 0.00 0.00 -0.02 0.00 0.00 31.44 30.23 1uh0 n GLU 22 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1uh0 n THR 23 N -1.91 0.00 -2.63 2.62 -2.24 -0.75 -5.01 114.28 104.35 1uh0 n THR 23 Ca -0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 1uh0 n THR 23 Cb 0.35 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 1uh0 n THR 23 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uh0 n ALA 24 N -3.00 0.00 -1.78 6.98 0.00 -1.22 -4.62 120.51 116.87 1uh0 n ALA 24 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 1uh0 n ALA 24 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1uh0 n ALA 24 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1uh0 s ILE 25 N -2.80 3.48 0.00 0.00 -1.09 -0.95 -2.22 121.20 117.62 1uh0 s ILE 25 Ca 0.00 1.48 0.00 0.00 -2.23 0.00 0.00 60.65 59.90 1uh0 s ILE 25 Cb 0.00 -3.94 0.00 0.00 -1.58 0.00 0.00 42.46 36.94 1uh0 s ILE 25 CO 0.00 0.35 0.00 0.61 -1.23 0.00 0.00 174.94 174.67 1uh0 n GLY 26 N 1.25 -0.06 3.89 6.18 0.00 0.15 -1.67 105.19 114.94 1uh0 n GLY 26 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 1uh0 n GLY 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1uh0 s ASP 27 N -0.41 6.46 -0.07 1.61 1.01 -1.23 -4.28 116.67 119.76 1uh0 s ASP 27 Ca 0.00 0.89 -0.03 0.00 0.71 0.00 0.00 52.55 54.11 1uh0 s ASP 27 Cb 0.00 -2.22 0.04 0.00 1.01 0.00 0.00 42.92 41.75 1uh0 s ASP 27 CO 0.00 -0.30 0.17 0.12 0.21 0.00 0.00 175.17 175.36 1uh0 s PHE 28 N -2.24 -0.20 -0.18 4.23 5.36 -0.25 -1.95 117.98 122.75 1uh0 s PHE 28 Ca 0.47 0.55 -0.16 0.00 -0.96 0.00 0.00 56.93 56.83 1uh0 s PHE 28 Cb -0.10 -0.07 0.05 0.00 -0.34 0.00 0.00 43.02 42.56 1uh0 s PHE 28 CO 0.31 -0.19 0.47 -1.14 -1.46 0.00 0.00 175.22 173.22 1uh0 s GLN 29 N 1.24 0.54 0.03 10.12 -0.44 0.20 -1.33 119.66 130.02 1uh0 s GLN 29 Ca -0.09 0.69 0.06 0.00 -2.50 0.00 0.00 55.36 53.52 1uh0 s GLN 29 Cb -0.11 0.23 -0.02 0.00 -1.64 0.00 0.00 33.01 31.47 1uh0 s GLN 29 CO -0.06 -0.08 -0.17 0.08 0.50 0.00 0.00 175.29 175.56 1uh0 s VAL 30 N 0.42 1.32 -0.41 1.34 1.01 -1.26 -0.14 120.40 122.68 1uh0 s VAL 30 Ca -0.01 -1.00 -0.07 0.00 0.00 0.00 0.00 61.98 60.89 1uh0 s VAL 30 Cb -0.04 -1.16 0.08 0.00 0.00 0.00 0.00 36.38 35.27 1uh0 s VAL 30 CO -0.01 0.14 0.23 -0.69 0.00 0.00 0.00 175.10 174.77 1uh0 s VAL 31 N -0.73 3.95 0.75 2.92 1.01 0.10 -0.76 120.40 127.65 1uh0 s VAL 31 Ca 0.04 -1.54 -0.05 0.00 0.00 0.00 0.00 61.98 60.43 1uh0 s VAL 31 Cb -0.08 -3.47 0.12 0.00 0.00 0.00 0.00 36.38 32.96 1uh0 s VAL 31 CO 0.01 -0.52 1.05 -0.31 0.00 0.00 0.00 175.10 175.33 1uh0 s TYR 32 N 1.36 2.01 -0.16 5.22 1.51 0.40 -1.07 117.35 126.62 1uh0 s TYR 32 Ca 0.03 0.04 -0.03 0.00 -1.01 0.00 0.00 57.07 56.10 1uh0 s TYR 32 Cb -0.23 -3.25 -0.02 0.00 -0.11 0.00 0.00 41.96 38.35 1uh0 s TYR 32 CO 0.00 -1.76 -0.07 0.34 -1.11 0.00 0.00 175.55 172.96 1uh0 s ASP 33 N -4.69 4.46 -0.41 2.29 2.15 -0.26 0.23 116.67 120.44 1uh0 s ASP 33 Ca 0.66 -0.24 0.02 0.00 0.43 0.00 0.00 52.55 53.42 1uh0 s ASP 33 Cb -0.07 -1.72 0.11 0.00 -0.30 0.00 0.00 42.92 40.95 1uh0 s ASP 33 CO 0.46 0.13 0.15 -0.22 -0.17 0.00 0.00 175.17 175.52 1uh0 s LEU 34 N 0.55 4.77 -1.36 -1.34 2.96 0.27 -1.00 118.68 123.54 1uh0 s LEU 34 Ca -0.05 -2.39 -0.01 0.00 -0.22 0.00 0.00 54.13 51.47 1uh0 s LEU 34 Cb -0.15 -1.68 -0.00 0.00 0.50 0.00 0.00 46.19 44.86 1uh0 s LEU 34 CO 0.03 -0.37 0.52 0.59 -1.32 0.00 0.00 176.35 175.80 1uh0 n ASN 35 N 3.99 -0.81 0.00 3.68 5.03 -1.26 -1.57 115.26 124.32 1uh0 n ASN 35 Ca 0.03 -0.95 0.00 0.00 0.87 0.00 0.00 54.58 54.54 1uh0 n ASN 35 Cb 0.39 -3.39 0.00 0.00 -1.02 0.00 0.00 39.78 35.77 1uh0 n ASN 35 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1uh0 n GLY 36 N -1.84 1.19 3.37 7.41 0.00 -1.26 -5.04 105.19 109.02 1uh0 n GLY 36 Ca -0.30 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 1uh0 n GLY 36 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uh0 s SER 37 N -3.04 3.38 0.24 1.61 0.01 -0.61 -5.10 113.70 110.19 1uh0 s SER 37 Ca 0.00 -0.44 -0.30 0.00 1.31 0.00 0.00 55.95 56.53 1uh0 s SER 37 Cb 0.00 -0.47 -0.09 0.00 0.21 0.00 0.00 66.02 65.67 1uh0 s SER 37 CO 0.00 0.30 1.31 -2.84 0.41 0.00 0.00 173.24 172.42 1uh0 s PRO 38 N -0.90 4.38 -0.21 12.44 0.02 -1.26 0.95 135.00 150.42 1uh0 s PRO 38 Ca 0.11 2.11 0.01 0.00 0.02 0.00 0.00 61.00 63.25 1uh0 s PRO 38 Cb -0.10 -3.15 0.05 0.00 0.02 0.00 0.00 34.50 31.31 1uh0 s PRO 38 CO 0.01 -0.22 -0.08 -0.47 -0.33 0.00 0.00 177.00 175.91 1uh0 s TYR 39 N -0.30 2.36 -0.48 6.54 6.14 0.13 -4.80 117.35 126.94 1uh0 s TYR 39 Ca 0.54 -1.62 -0.29 0.00 0.64 0.00 0.00 57.07 56.34 1uh0 s TYR 39 Cb -0.38 -1.59 0.02 0.00 0.42 0.00 0.00 41.96 40.43 1uh0 s TYR 39 CO 0.43 -0.75 1.29 0.08 0.64 0.00 0.00 175.55 177.24 1uh0 s VAL 40 N 1.41 4.00 0.75 3.14 1.01 -1.26 -0.45 120.40 128.99 1uh0 s VAL 40 Ca -0.03 0.98 -0.11 0.00 0.00 0.00 0.00 61.98 62.82 1uh0 s VAL 40 Cb -0.17 -4.45 0.04 0.00 0.00 0.00 0.00 36.38 31.80 1uh0 s VAL 40 CO -0.07 -0.99 1.08 -0.83 0.00 0.00 0.00 175.10 174.29 1uh0 s GLY 41 N 3.39 1.65 0.34 4.51 0.00 0.06 -4.98 107.32 112.30 1uh0 s GLY 41 Ca 0.53 0.01 -0.29 0.00 0.00 0.00 0.00 44.72 44.98 1uh0 s GLY 41 CO 0.30 0.37 1.38 1.62 0.00 0.00 0.00 173.10 176.78 1uh0 s GLN 42 N -5.06 4.26 -0.46 2.90 0.74 -1.26 -4.62 119.66 116.16 1uh0 s GLN 42 Ca 0.59 2.35 -0.26 0.00 0.05 0.00 0.00 55.36 58.10 1uh0 s GLN 42 Cb -0.15 -3.04 0.03 0.00 1.10 0.00 0.00 33.01 30.95 1uh0 s GLN 42 CO 0.55 -0.33 0.95 1.21 -0.55 0.00 0.00 175.29 177.12 1uh0 s ASN 43 N -0.28 6.53 -0.36 6.67 2.47 -1.26 -4.55 114.94 124.15 1uh0 s ASN 43 Ca 0.51 0.19 -0.22 0.00 0.42 0.00 0.00 52.86 53.76 1uh0 s ASN 43 Cb -0.42 -2.46 0.01 0.00 -1.45 0.00 0.00 41.25 36.92 1uh0 s ASN 43 CO 0.56 -1.07 0.72 -1.00 -3.72 0.00 0.00 177.10 172.60 1uh0 s HIS 44 N 3.83 3.12 0.16 0.43 3.76 -0.44 -4.99 115.29 121.16 1uh0 s HIS 44 Ca 0.39 0.45 0.07 0.00 -0.15 0.00 0.00 55.06 55.82 1uh0 s HIS 44 Cb -0.10 -3.31 -0.04 0.00 1.11 0.00 0.00 32.58 30.25 1uh0 s HIS 44 CO 0.27 -0.70 0.01 0.15 -0.85 0.00 0.00 174.74 173.61 1uh0 s LYS 45 N 2.95 2.46 0.54 1.40 1.02 -1.26 -1.09 119.74 125.76 1uh0 s LYS 45 Ca 0.28 -1.05 -0.19 0.00 0.02 0.00 0.00 55.97 55.03 1uh0 s LYS 45 Cb -0.14 -2.40 -0.06 0.00 -0.52 0.00 0.00 37.83 34.71 1uh0 s LYS 45 CO 0.16 0.47 1.11 0.45 -0.92 0.00 0.00 175.35 176.62 1uh0 s SER 46 N -2.87 5.80 0.56 2.83 0.15 -1.26 -4.85 113.70 114.07 1uh0 s SER 46 Ca 0.27 2.11 0.33 0.00 0.70 0.00 0.00 55.95 59.36 1uh0 s SER 46 Cb -0.10 -2.57 1.66 0.00 -1.71 0.00 0.00 66.02 63.30 1uh0 s SER 46 CO 0.19 -1.16 2.12 -0.26 1.20 0.00 0.00 173.24 175.32 1uh0 h PHE 47 N 1.16 0.00 -0.67 3.44 0.04 -0.75 -3.44 116.94 116.72 1uh0 h PHE 47 Ca -0.50 0.00 -0.64 0.00 2.80 0.00 0.00 57.97 59.63 1uh0 h PHE 47 Cb 1.25 0.00 -0.11 0.00 2.20 0.00 0.00 35.95 39.29 1uh0 h PHE 47 CO 0.53 0.06 -0.48 0.96 -0.60 0.00 0.00 178.31 178.78 1uh0 s ILE 48 N -4.02 1.48 0.06 -0.55 -4.36 -1.26 -5.04 121.20 107.51 1uh0 s ILE 48 Ca -0.02 -1.85 0.00 0.00 -0.26 0.00 0.00 60.65 58.51 1uh0 s ILE 48 Cb 0.12 -2.34 -0.00 0.00 1.25 0.00 0.00 42.46 41.49 1uh0 s ILE 48 CO 0.53 0.00 0.00 0.35 0.24 0.00 0.00 174.94 176.06 1uh0 n THR 49 N -1.34 0.00 -0.30 8.37 -2.24 -1.26 -4.91 114.28 112.59 1uh0 n THR 49 Ca -0.12 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1uh0 n THR 49 Cb 0.66 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.95 1uh0 n THR 49 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uh0 n GLY 50 N 4.14 0.98 3.98 3.38 0.00 -1.26 -5.10 105.19 111.32 1uh0 n GLY 50 Ca -0.02 -0.27 -0.20 0.00 0.00 0.00 0.00 46.02 45.53 1uh0 n GLY 50 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1uh0 s PHE 51 N -2.00 3.14 -0.30 1.61 0.08 -1.26 -4.86 117.98 114.38 1uh0 s PHE 51 Ca 0.00 -0.14 -0.09 0.00 0.12 0.00 0.00 56.93 56.82 1uh0 s PHE 51 Cb 0.00 -2.05 -0.01 0.00 -0.57 0.00 0.00 43.02 40.39 1uh0 s PHE 51 CO 0.00 -0.07 0.13 0.99 -0.10 0.00 0.00 175.22 176.17 1uh0 s THR 52 N -2.24 4.50 0.56 0.64 2.01 0.15 -4.83 115.64 116.43 1uh0 s THR 52 Ca 0.46 -0.41 -0.19 0.00 0.31 0.00 0.00 61.69 61.86 1uh0 s THR 52 Cb -0.10 -3.27 -0.05 0.00 0.01 0.00 0.00 72.50 69.09 1uh0 s THR 52 CO 0.32 0.10 1.12 -2.16 -0.69 0.00 0.00 174.62 173.31 1uh0 s PRO 53 N 1.60 3.29 -0.07 4.92 0.04 -1.26 -1.84 135.00 141.68 1uh0 s PRO 53 Ca 0.05 1.54 -0.04 0.00 0.04 0.00 0.00 61.00 62.59 1uh0 s PRO 53 Cb -0.17 -2.00 0.03 0.00 0.04 0.00 0.00 34.50 32.40 1uh0 s PRO 53 CO 0.06 -0.89 0.16 0.08 0.04 0.00 0.00 177.00 176.45 1uh0 s VAL 54 N -1.91 -0.04 -0.17 -0.36 1.01 0.13 -4.94 120.40 114.13 1uh0 s VAL 54 Ca 0.71 0.13 -0.01 0.00 0.00 0.00 0.00 61.98 62.81 1uh0 s VAL 54 Cb -0.22 -0.26 -0.01 0.00 0.00 0.00 0.00 36.38 35.89 1uh0 s VAL 54 CO 0.29 0.06 -0.10 -0.75 0.00 0.00 0.00 175.10 174.59 1uh0 s LYS 55 N 0.95 3.35 -0.50 2.72 2.20 -1.26 -1.69 119.74 125.51 1uh0 s LYS 55 Ca -0.07 -0.67 -0.04 0.00 -0.36 0.00 0.00 55.97 54.83 1uh0 s LYS 55 Cb -0.09 -2.77 0.13 0.00 -1.51 0.00 0.00 37.83 33.60 1uh0 s LYS 55 CO -0.05 0.03 0.31 0.42 -0.36 0.00 0.00 175.35 175.70 1uh0 s ILE 56 N 0.83 3.57 -0.31 5.43 1.01 0.92 -4.99 121.20 127.67 1uh0 s ILE 56 Ca -0.03 -2.36 -0.18 0.00 0.00 0.00 0.00 60.65 58.08 1uh0 s ILE 56 Cb -0.15 -3.39 -0.02 0.00 0.01 0.00 0.00 42.46 38.92 1uh0 s ILE 56 CO 0.01 -0.77 0.51 -0.44 0.00 0.00 0.00 174.94 174.24 1uh0 s SER 57 N 1.51 6.36 0.14 3.58 0.01 -1.26 -1.12 113.70 122.91 1uh0 s SER 57 Ca 0.11 0.22 -0.09 0.00 1.31 0.00 0.00 55.95 57.50 1uh0 s SER 57 Cb -0.22 -2.27 -0.06 0.00 0.21 0.00 0.00 66.02 63.68 1uh0 s SER 57 CO -0.04 -0.38 0.44 -0.76 0.41 0.00 0.00 173.24 172.91 1uh0 s LEU 58 N 2.35 4.28 -1.43 2.44 1.43 -0.43 -4.98 118.68 122.34 1uh0 s LEU 58 Ca 0.20 0.78 -0.11 0.00 -1.03 0.00 0.00 54.13 53.97 1uh0 s LEU 58 Cb -0.15 -3.27 0.06 0.00 0.03 0.00 0.00 46.19 42.86 1uh0 s LEU 58 CO 0.11 0.07 2.30 -0.67 0.23 0.00 0.00 176.35 178.40 1uh0 n ASP 59 N 0.40 5.64 -4.77 2.29 4.64 -1.26 -4.85 116.55 118.65 1uh0 n ASP 59 Ca -0.04 -2.90 -0.40 0.00 -1.38 0.00 0.00 54.79 50.08 1uh0 n ASP 59 Cb 0.52 -1.56 -0.01 0.00 -1.04 0.00 0.00 41.12 39.04 1uh0 n ASP 59 CO 0.00 0.00 0.00 0.12 -0.82 0.00 0.00 177.20 176.50 1uh0 s PHE 60 N 1.74 2.87 -1.67 -0.67 5.36 -1.26 -0.77 117.98 123.57 1uh0 s PHE 60 Ca 0.50 1.40 0.25 0.00 -0.96 0.00 0.00 56.93 58.12 1uh0 s PHE 60 Cb 0.14 -3.69 0.49 0.00 -0.34 0.00 0.00 43.02 39.62 1uh0 s PHE 60 CO -0.06 -2.08 1.40 -0.35 -1.46 0.00 0.00 175.22 172.67 1uh0 n PRO 61 N 0.32 0.76 0.22 10.12 -0.05 -1.26 -4.86 135.00 140.25 1uh0 n PRO 61 Ca 0.03 -0.51 0.09 0.00 -0.05 0.00 0.00 63.50 63.06 1uh0 n PRO 61 Cb 0.43 -1.49 0.48 0.00 -0.05 0.00 0.00 33.50 32.86 1uh0 n PRO 61 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 175.50 176.11 1uh0 h SER 62 N 1.24 0.00 -3.29 3.54 4.64 -1.85 -3.42 113.55 114.40 1uh0 h SER 62 Ca 0.00 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.69 1uh0 h SER 62 Cb 0.56 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 62.46 1uh0 h SER 62 CO 0.00 0.26 -0.62 -0.70 -0.87 0.00 0.00 176.83 174.89 1uh0 s GLU 63 N -3.79 3.77 0.04 4.77 2.12 0.05 -4.96 118.70 120.69 1uh0 s GLU 63 Ca -0.01 -0.44 -0.07 0.00 0.36 0.00 0.00 54.97 54.82 1uh0 s GLU 63 Cb 0.11 -3.03 -0.01 0.00 0.26 0.00 0.00 34.13 31.47 1uh0 s GLU 63 CO 0.64 0.28 0.13 1.52 -0.54 0.00 0.00 175.26 177.30 1uh0 s TYR 64 N 0.29 0.15 0.13 5.30 1.13 -1.26 -4.28 117.35 118.81 1uh0 s TYR 64 Ca -0.00 -0.43 -0.31 0.00 -1.41 0.00 0.00 57.07 54.92 1uh0 s TYR 64 Cb -0.13 -0.10 -0.07 0.00 -1.10 0.00 0.00 41.96 40.55 1uh0 s TYR 64 CO 0.02 -0.39 1.28 0.42 -2.51 0.00 0.00 175.55 174.36 1uh0 s ILE 65 N -2.66 3.57 -0.07 -3.49 1.01 -1.26 -2.27 121.20 116.02 1uh0 s ILE 65 Ca -0.04 1.19 0.11 0.00 0.00 0.00 0.00 60.65 61.90 1uh0 s ILE 65 Cb -0.01 -3.76 -0.15 0.00 0.01 0.00 0.00 42.46 38.55 1uh0 s ILE 65 CO -0.05 0.13 0.12 0.23 0.00 0.00 0.00 174.94 175.37 1uh0 n MET 66 N 3.41 1.52 -3.74 2.79 2.81 0.10 -4.77 117.12 119.25 1uh0 n MET 66 Ca 0.08 -0.04 -0.13 0.00 -1.81 0.00 0.00 57.70 55.80 1uh0 n MET 66 Cb 0.44 -1.28 -0.09 0.00 -0.71 0.00 0.00 33.22 31.57 1uh0 n MET 66 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1uh0 s GLU 67 N -2.47 0.57 -0.08 0.03 2.12 -0.75 -0.64 118.70 117.48 1uh0 s GLU 67 Ca -0.05 0.22 0.03 0.00 0.36 0.00 0.00 54.97 55.53 1uh0 s GLU 67 Cb 0.05 0.27 0.01 0.00 0.26 0.00 0.00 34.13 34.71 1uh0 s GLU 67 CO 0.47 -0.12 -0.15 0.08 -0.54 0.00 0.00 175.26 175.00 1uh0 s VAL 68 N -0.49 1.36 0.16 3.70 1.01 -0.80 -1.24 120.40 124.09 1uh0 s VAL 68 Ca -0.06 -0.60 -0.01 0.00 0.00 0.00 0.00 61.98 61.30 1uh0 s VAL 68 Cb -0.04 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1uh0 s VAL 68 CO 0.03 0.41 0.09 -0.94 0.00 0.00 0.00 175.10 174.68 1uh0 s SER 69 N 0.65 0.24 0.00 3.32 1.04 -0.47 0.64 113.70 119.12 1uh0 s SER 69 Ca -0.14 -1.26 0.00 0.00 0.48 0.00 0.00 55.95 55.02 1uh0 s SER 69 Cb -0.16 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.29 1uh0 s SER 69 CO 0.04 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 174.10 1uh0 n GLY 70 N -0.16 -1.26 3.07 7.32 0.00 -0.69 0.52 105.19 114.00 1uh0 n GLY 70 Ca -0.03 -0.93 -0.17 0.00 0.00 0.00 0.00 46.02 44.90 1uh0 n GLY 70 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1uh0 s TYR 71 N -3.00 0.88 -0.03 1.61 2.02 -0.83 -1.51 117.35 116.48 1uh0 s TYR 71 Ca 0.00 -0.33 0.06 0.00 -0.37 0.00 0.00 57.07 56.43 1uh0 s TYR 71 Cb 0.00 -0.53 -0.02 0.00 -0.40 0.00 0.00 41.96 41.01 1uh0 s TYR 71 CO 0.00 -0.01 -0.21 0.95 -1.57 0.00 0.00 175.55 174.71 1uh0 s THR 72 N -0.81 2.52 0.00 -0.71 -4.23 -0.29 -0.82 115.64 111.30 1uh0 s THR 72 Ca -0.02 -0.93 0.00 0.00 -1.18 0.00 0.00 61.69 59.56 1uh0 s THR 72 Cb -0.07 -1.93 0.00 0.00 1.34 0.00 0.00 72.50 71.84 1uh0 s THR 72 CO 0.01 0.58 0.00 0.61 -0.54 0.00 0.00 174.62 175.28 1uh0 n GLY 73 N 2.39 2.94 3.57 3.99 0.00 0.17 -1.13 105.19 117.11 1uh0 n GLY 73 Ca -0.17 -1.08 -0.35 0.00 0.00 0.00 0.00 46.02 44.43 1uh0 n GLY 73 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1uh0 s ASN 74 N 0.09 5.38 -0.13 1.61 3.04 -1.26 -0.57 114.94 123.09 1uh0 s ASN 74 Ca 0.00 -0.02 -0.03 0.00 0.04 0.00 0.00 52.86 52.85 1uh0 s ASN 74 Cb 0.00 -1.92 0.05 0.00 -1.54 0.00 0.00 41.25 37.83 1uh0 s ASN 74 CO 0.00 0.13 0.05 -0.69 -3.04 0.00 0.00 177.10 173.55 1uh0 s VAL 75 N 0.65 0.17 -1.46 -5.21 1.01 0.22 -4.80 120.40 110.99 1uh0 s VAL 75 Ca 0.02 -0.10 -0.03 0.00 0.00 0.00 0.00 61.98 61.87 1uh0 s VAL 75 Cb -0.13 -0.61 0.01 0.00 0.00 0.00 0.00 36.38 35.65 1uh0 s VAL 75 CO 0.02 -0.06 0.29 -1.20 0.00 0.00 0.00 175.10 174.15 1uh0 n SER 76 N 5.19 -5.16 0.00 3.32 7.64 -1.26 -1.21 113.62 122.14 1uh0 n SER 76 Ca -0.07 -0.13 0.00 0.00 1.01 0.00 0.00 58.87 59.69 1uh0 n SER 76 Cb 0.49 -4.26 0.00 0.00 -1.01 0.00 0.00 64.21 59.43 1uh0 n SER 76 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uh0 n GLY 77 N -1.17 1.28 3.70 0.23 0.00 -1.26 -5.04 105.19 102.93 1uh0 n GLY 77 Ca -0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 1uh0 n GLY 77 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1uh0 s TYR 78 N -2.99 3.19 -0.19 1.61 2.02 -0.35 -5.07 117.35 115.57 1uh0 s TYR 78 Ca 0.00 0.22 -0.23 0.00 -0.37 0.00 0.00 57.07 56.69 1uh0 s TYR 78 Cb 0.00 -1.80 -0.02 0.00 -0.40 0.00 0.00 41.96 39.75 1uh0 s TYR 78 CO 0.00 0.49 0.73 0.08 -1.57 0.00 0.00 175.55 175.29 1uh0 s VAL 79 N -0.91 4.94 0.30 0.71 1.01 -1.26 -0.61 120.40 124.59 1uh0 s VAL 79 Ca 0.14 1.41 0.04 0.00 0.00 0.00 0.00 61.98 63.56 1uh0 s VAL 79 Cb -0.11 -4.04 -0.03 0.00 0.00 0.00 0.00 36.38 32.20 1uh0 s VAL 79 CO 0.03 0.05 0.27 0.68 0.00 0.00 0.00 175.10 176.13 1uh0 s VAL 80 N 2.13 0.00 -0.57 2.92 -7.23 0.27 -4.78 120.40 113.13 1uh0 s VAL 80 Ca 0.33 -1.94 -0.22 0.00 -1.81 0.00 0.00 61.98 58.34 1uh0 s VAL 80 Cb -0.16 -2.51 0.06 0.00 0.56 0.00 0.00 36.38 34.33 1uh0 s VAL 80 CO 0.11 0.00 0.83 -0.69 -0.31 0.00 0.00 175.10 175.04 1uh0 s VAL 81 N -3.58 4.56 0.04 1.32 1.01 0.20 -0.66 120.40 123.29 1uh0 s VAL 81 Ca 0.39 -0.28 0.10 0.00 0.00 0.00 0.00 61.98 62.19 1uh0 s VAL 81 Cb 0.03 -4.51 -0.14 0.00 0.00 0.00 0.00 36.38 31.76 1uh0 s VAL 81 CO 0.23 -1.13 1.27 0.03 0.00 0.00 0.00 175.10 175.50 1uh0 h ARG 82 N 9.28 0.00 -3.70 2.72 3.08 -1.26 -2.53 114.38 121.96 1uh0 h ARG 82 Ca -0.28 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.64 1uh0 h ARG 82 Cb 1.08 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 30.95 1uh0 h ARG 82 CO 1.08 0.83 -0.50 0.45 -1.07 0.00 0.00 179.97 180.76 1uh0 s SER 83 N -6.59 0.12 -0.07 7.04 0.15 -1.02 -1.11 113.70 112.23 1uh0 s SER 83 Ca 0.01 -0.43 -0.06 0.00 0.70 0.00 0.00 55.95 56.17 1uh0 s SER 83 Cb 0.09 0.23 0.02 0.00 -1.71 0.00 0.00 66.02 64.65 1uh0 s SER 83 CO 0.80 -0.48 0.18 -0.22 1.20 0.00 0.00 173.24 174.72 1uh0 s LEU 84 N -1.94 1.30 -0.02 3.45 2.96 -0.64 -1.97 118.68 121.82 1uh0 s LEU 84 Ca -0.07 0.37 0.00 0.00 -0.22 0.00 0.00 54.13 54.20 1uh0 s LEU 84 Cb -0.03 0.62 0.02 0.00 0.50 0.00 0.00 46.19 47.30 1uh0 s LEU 84 CO -0.03 -0.06 0.00 -0.89 -1.32 0.00 0.00 176.35 174.05 1uh0 s THR 85 N 0.11 0.09 -0.23 3.68 2.01 0.19 -1.22 115.64 120.27 1uh0 s THR 85 Ca -0.00 0.08 0.01 0.00 0.31 0.00 0.00 61.69 62.08 1uh0 s THR 85 Cb -0.01 -0.16 0.03 0.00 0.01 0.00 0.00 72.50 72.37 1uh0 s THR 85 CO 0.00 0.09 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.55 1uh0 s PHE 86 N 0.71 3.04 -0.25 4.92 0.08 -0.12 -1.37 117.98 124.99 1uh0 s PHE 86 Ca -0.07 -1.81 -0.07 0.00 0.12 0.00 0.00 56.93 55.11 1uh0 s PHE 86 Cb -0.09 -1.98 -0.02 0.00 -0.57 0.00 0.00 43.02 40.35 1uh0 s PHE 86 CO -0.02 -0.80 0.05 0.21 -0.10 0.00 0.00 175.22 174.57 1uh0 s LYS 87 N 1.25 3.59 0.35 0.44 2.20 -0.38 -0.15 119.74 127.04 1uh0 s LYS 87 Ca -0.01 -0.51 0.05 0.00 -0.36 0.00 0.00 55.97 55.14 1uh0 s LYS 87 Cb -0.16 -3.28 0.05 0.00 -1.51 0.00 0.00 37.83 32.93 1uh0 s LYS 87 CO -0.07 -0.20 0.41 0.25 -0.36 0.00 0.00 175.35 175.38 1uh0 n THR 88 N 4.90 0.00 1.87 3.43 -2.24 0.33 0.03 114.28 122.59 1uh0 n THR 88 Ca -0.16 -1.23 0.15 0.00 -2.27 0.00 0.00 64.05 60.53 1uh0 n THR 88 Cb 0.51 -0.53 0.87 0.00 -2.10 0.00 0.00 70.33 69.08 1uh0 n THR 88 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1uh0 n ASN 89 N -2.35 0.00 0.00 3.42 6.94 -0.96 -3.71 115.26 118.59 1uh0 n ASN 89 Ca 0.06 -0.95 0.00 0.00 -0.02 0.00 0.00 54.58 53.67 1uh0 n ASN 89 Cb 0.37 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.79 1uh0 n ASN 89 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1uh0 n LYS 90 N -0.99 2.11 -3.59 -3.83 5.02 -1.26 -5.05 118.16 110.56 1uh0 n LYS 90 Ca 0.22 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.43 1uh0 n LYS 90 Cb 0.10 -0.89 -0.02 0.00 -0.02 0.00 0.00 35.03 34.20 1uh0 n LYS 90 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1uh0 s LYS 91 N -1.67 1.11 -0.15 1.97 2.20 -1.24 -5.15 119.74 116.81 1uh0 s LYS 91 Ca 0.00 -0.51 -0.01 0.00 -0.36 0.00 0.00 55.97 55.10 1uh0 s LYS 91 Cb 0.00 0.45 -0.01 0.00 -1.51 0.00 0.00 37.83 36.76 1uh0 s LYS 91 CO 0.00 -0.50 -0.13 0.99 -0.36 0.00 0.00 175.35 175.35 1uh0 s THR 92 N -3.37 2.94 -0.30 3.43 2.01 -1.26 -0.51 115.64 118.57 1uh0 s THR 92 Ca 0.07 -0.68 -0.04 0.00 0.31 0.00 0.00 61.69 61.34 1uh0 s THR 92 Cb -0.02 -2.25 0.03 0.00 0.01 0.00 0.00 72.50 70.28 1uh0 s THR 92 CO -0.05 0.51 0.04 -0.31 -0.69 0.00 0.00 174.62 174.12 1uh0 s TYR 93 N 0.69 3.20 -0.13 4.92 1.51 0.78 -5.00 117.35 123.33 1uh0 s TYR 93 Ca -0.06 -1.47 0.00 0.00 -1.01 0.00 0.00 57.07 54.53 1uh0 s TYR 93 Cb -0.15 -2.18 0.00 0.00 -0.11 0.00 0.00 41.96 39.51 1uh0 s TYR 93 CO 0.02 -0.72 0.00 0.41 -1.11 0.00 0.00 175.55 174.15 1uh0 n GLY 94 N 4.75 0.27 3.76 0.71 0.00 -1.26 -0.95 105.19 112.47 1uh0 n GLY 94 Ca -0.14 -2.30 -0.34 0.00 0.00 0.00 0.00 46.02 43.24 1uh0 n GLY 94 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uh0 s PRO 95 N -0.05 2.90 -0.08 1.61 0.04 -1.26 -4.99 135.00 133.17 1uh0 s PRO 95 Ca 0.00 1.56 0.04 0.00 0.04 0.00 0.00 61.00 62.65 1uh0 s PRO 95 Cb 0.00 -1.95 -0.00 0.00 0.04 0.00 0.00 34.50 32.59 1uh0 s PRO 95 CO 0.00 -1.21 -0.22 0.71 0.04 0.00 0.00 177.00 176.32 1uh0 s TYR 96 N -2.02 2.29 0.00 0.56 2.02 -0.36 -4.97 117.35 114.88 1uh0 s TYR 96 Ca 0.71 -0.84 0.00 0.00 -0.37 0.00 0.00 57.07 56.57 1uh0 s TYR 96 Cb -0.24 -1.54 0.00 0.00 -0.40 0.00 0.00 41.96 39.78 1uh0 s TYR 96 CO 0.37 -0.32 0.00 0.41 -1.57 0.00 0.00 175.55 174.43 1uh0 n GLY 97 N 3.37 -0.89 3.54 0.71 0.00 -1.26 -1.61 105.19 109.04 1uh0 n GLY 97 Ca -0.19 -1.93 -0.38 0.00 0.00 0.00 0.00 46.02 43.52 1uh0 n GLY 97 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uh0 s VAL 98 N 0.00 5.04 -1.34 1.61 1.01 -0.27 -4.78 120.40 121.67 1uh0 s VAL 98 Ca 0.00 0.02 -0.11 0.00 0.00 0.00 0.00 61.98 61.89 1uh0 s VAL 98 Cb 0.00 -3.42 0.12 0.00 0.00 0.00 0.00 36.38 33.08 1uh0 s VAL 98 CO 0.00 0.23 2.01 0.35 0.00 0.00 0.00 175.10 177.70 1uh0 n THR 99 N 5.03 4.06 -3.81 3.92 -2.24 -1.26 -3.71 114.28 116.28 1uh0 n THR 99 Ca -0.14 -3.92 -0.12 0.00 -2.27 0.00 0.00 64.05 57.60 1uh0 n THR 99 Cb 0.51 -2.44 -0.12 0.00 -2.10 0.00 0.00 70.33 66.19 1uh0 n THR 99 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1uh0 s SER 100 N 1.63 -0.20 0.00 3.42 0.15 -1.26 -5.09 113.70 112.36 1uh0 s SER 100 Ca 0.42 0.36 0.00 0.00 0.70 0.00 0.00 55.95 57.44 1uh0 s SER 100 Cb 0.11 0.40 0.00 0.00 -1.71 0.00 0.00 66.02 64.82 1uh0 s SER 100 CO -0.03 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 174.92 1uh0 n GLY 101 N 2.84 0.18 3.68 9.45 0.00 -1.26 -4.50 105.19 115.58 1uh0 n GLY 101 Ca -0.13 -1.86 -0.35 0.00 0.00 0.00 0.00 46.02 43.68 1uh0 n GLY 101 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uh0 s THR 102 N -0.59 4.95 0.53 2.61 -4.23 -0.29 -4.90 115.64 113.71 1uh0 s THR 102 Ca 0.00 0.02 -0.12 0.00 -1.18 0.00 0.00 61.69 60.41 1uh0 s THR 102 Cb 0.00 -3.22 -0.06 0.00 1.34 0.00 0.00 72.50 70.56 1uh0 s THR 102 CO 0.00 0.48 0.94 -2.16 -0.54 0.00 0.00 174.62 173.34 1uh0 s PRO 103 N 0.15 3.75 0.00 3.99 0.04 -1.26 -1.14 135.00 140.54 1uh0 s PRO 103 Ca 0.06 0.71 -0.15 0.00 0.04 0.00 0.00 61.00 61.65 1uh0 s PRO 103 Cb -0.12 -2.19 0.02 0.00 0.04 0.00 0.00 34.50 32.25 1uh0 s PRO 103 CO 0.00 -0.32 0.33 -0.59 0.04 0.00 0.00 177.00 176.46 1uh0 s PHE 104 N -2.78 -0.18 -0.10 0.56 -0.12 -0.57 -4.93 117.98 109.86 1uh0 s PHE 104 Ca 0.55 0.21 -0.22 0.00 -0.05 0.00 0.00 56.93 57.42 1uh0 s PHE 104 Cb -0.10 0.11 0.05 0.00 -0.63 0.00 0.00 43.02 42.45 1uh0 s PHE 104 CO 0.41 -0.44 0.53 0.54 -0.05 0.00 0.00 175.22 176.21 1uh0 s ASN 105 N -1.57 -0.50 -0.34 1.98 6.03 -1.26 -1.70 114.94 117.58 1uh0 s ASN 105 Ca -0.11 0.70 0.01 0.00 -1.03 0.00 0.00 52.86 52.43 1uh0 s ASN 105 Cb -0.03 0.70 0.11 0.00 -3.03 0.00 0.00 41.25 38.99 1uh0 s ASN 105 CO 0.02 -0.41 0.11 -0.22 -2.03 0.00 0.00 177.10 174.57 1uh0 s LEU 106 N -0.67 2.79 0.18 3.54 2.96 0.21 -4.98 118.68 122.72 1uh0 s LEU 106 Ca -0.08 -1.89 -0.18 0.00 -0.22 0.00 0.00 54.13 51.77 1uh0 s LEU 106 Cb -0.03 -1.04 -0.08 0.00 0.50 0.00 0.00 46.19 45.55 1uh0 s LEU 106 CO 0.05 -0.39 0.65 -2.84 -1.32 0.00 0.00 176.35 172.50 1uh0 s PRO 107 N 1.29 4.15 -0.21 0.98 0.02 -1.26 -1.90 135.00 138.06 1uh0 s PRO 107 Ca 0.11 0.72 0.01 0.00 0.02 0.00 0.00 61.00 61.86 1uh0 s PRO 107 Cb -0.19 -2.93 0.04 0.00 0.02 0.00 0.00 34.50 31.45 1uh0 s PRO 107 CO -0.18 0.44 -0.11 0.42 -0.33 0.00 0.00 177.00 177.24 1uh0 s ILE 108 N -1.47 1.81 0.05 2.83 1.01 0.19 -4.99 121.20 120.63 1uh0 s ILE 108 Ca 0.40 -1.16 -0.14 0.00 0.00 0.00 0.00 60.65 59.75 1uh0 s ILE 108 Cb -0.16 -1.87 -0.31 0.00 0.01 0.00 0.00 42.46 40.13 1uh0 s ILE 108 CO 0.20 0.15 1.08 -0.33 0.00 0.00 0.00 174.94 176.05 1uh0 h GLU 109 N 7.92 0.58 -2.94 2.79 5.08 -1.98 -3.45 114.58 122.59 1uh0 h GLU 109 Ca -0.27 -0.84 -0.23 0.00 -1.00 0.00 0.00 59.36 57.02 1uh0 h GLU 109 Cb 1.09 0.29 -0.33 0.00 0.50 0.00 0.00 28.75 30.30 1uh0 h GLU 109 CO 0.49 1.39 -0.55 1.21 -1.00 0.00 0.00 179.01 180.55 1uh0 s ASN 110 N -7.46 0.35 0.00 1.42 3.84 -1.26 -5.13 114.94 106.70 1uh0 s ASN 110 Ca -0.09 0.53 0.00 0.00 0.21 0.00 0.00 52.86 53.51 1uh0 s ASN 110 Cb 0.05 0.56 0.00 0.00 -0.55 0.00 0.00 41.25 41.32 1uh0 s ASN 110 CO 0.93 -0.23 0.00 0.61 -2.79 0.00 0.00 177.10 175.63 1uh0 n GLY 111 N 5.18 1.99 3.04 1.21 0.00 -1.26 -4.98 105.19 110.37 1uh0 n GLY 111 Ca -0.09 -1.98 -0.11 0.00 0.00 0.00 0.00 46.02 43.85 1uh0 n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uh0 s LEU 112 N 0.00 2.30 -0.20 0.99 1.43 0.24 -4.93 118.68 118.51 1uh0 s LEU 112 Ca 0.00 -0.62 -0.23 0.00 -1.03 0.00 0.00 54.13 52.25 1uh0 s LEU 112 Cb 0.00 -0.02 -0.02 0.00 0.03 0.00 0.00 46.19 46.18 1uh0 s LEU 112 CO 0.00 -0.30 0.72 -0.63 0.23 0.00 0.00 176.35 176.37 1uh0 s ILE 113 N -1.87 4.95 0.00 -0.59 1.01 -1.26 -0.91 121.20 122.53 1uh0 s ILE 113 Ca -0.09 1.38 0.00 0.00 0.00 0.00 0.00 60.65 61.95 1uh0 s ILE 113 Cb -0.07 -4.03 0.00 0.00 0.01 0.00 0.00 42.46 38.37 1uh0 s ILE 113 CO -0.02 0.05 0.94 1.33 0.00 0.00 0.00 174.94 177.25 1uh0 n VAL 114 N 4.82 0.89 -3.64 2.92 0.24 0.55 -4.47 118.33 119.64 1uh0 n VAL 114 Ca 0.02 -0.90 -0.02 0.00 -2.04 0.00 0.00 64.34 61.39 1uh0 n VAL 114 Cb 0.49 0.56 -0.03 0.00 -1.47 0.00 0.00 33.84 33.39 1uh0 n VAL 114 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1uh0 s GLY 115 N -0.89 -0.12 0.09 7.63 0.00 -1.23 -0.44 107.32 112.36 1uh0 s GLY 115 Ca 0.00 2.15 0.05 0.00 0.00 0.00 0.00 44.72 46.93 1uh0 s GLY 115 CO 0.00 0.77 -0.14 -1.36 0.00 0.00 0.00 173.10 172.36 1uh0 s PHE 116 N -1.77 1.29 -0.01 1.90 0.08 -1.26 -0.90 117.98 117.31 1uh0 s PHE 116 Ca 0.11 -0.49 -0.20 0.00 0.12 0.00 0.00 56.93 56.47 1uh0 s PHE 116 Cb -0.01 -0.71 0.04 0.00 -0.57 0.00 0.00 43.02 41.77 1uh0 s PHE 116 CO -0.04 0.08 0.43 -1.59 -0.10 0.00 0.00 175.22 174.01 1uh0 s LYS 117 N -2.02 0.84 0.00 0.44 -2.85 -1.02 -1.22 119.74 113.92 1uh0 s LYS 117 Ca 0.01 -0.12 0.00 0.00 -1.00 0.00 0.00 55.97 54.86 1uh0 s LYS 117 Cb -0.08 0.38 0.00 0.00 -2.06 0.00 0.00 37.83 36.07 1uh0 s LYS 117 CO 0.02 -0.26 0.00 0.41 0.10 0.00 0.00 175.35 175.63 1uh0 n GLY 118 N 0.97 -0.77 3.29 0.59 0.00 0.10 -0.14 105.19 109.22 1uh0 n GLY 118 Ca -0.20 -0.32 -0.13 0.00 0.00 0.00 0.00 46.02 45.36 1uh0 n GLY 118 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1uh0 s SER 119 N -4.00 -0.35 -0.04 1.61 0.15 -0.66 -0.39 113.70 110.02 1uh0 s SER 119 Ca 0.00 0.54 -0.01 0.00 0.70 0.00 0.00 55.95 57.19 1uh0 s SER 119 Cb 0.00 0.62 0.03 0.00 -1.71 0.00 0.00 66.02 64.96 1uh0 s SER 119 CO 0.00 -0.28 0.03 -0.63 1.20 0.00 0.00 173.24 173.56 1uh0 s ILE 120 N -0.43 0.06 0.00 6.45 1.01 -0.46 -0.59 121.20 127.25 1uh0 s ILE 120 Ca -0.06 0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.84 1uh0 s ILE 120 Cb -0.03 -0.24 0.00 0.00 0.01 0.00 0.00 42.46 42.20 1uh0 s ILE 120 CO 0.02 0.17 0.00 0.61 0.00 0.00 0.00 174.94 175.74 1uh0 n GLY 121 N 4.73 0.90 0.09 6.18 0.00 -1.26 -0.42 105.19 115.41 1uh0 n GLY 121 Ca -0.15 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.83 1uh0 n GLY 121 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1uh0 h TYR 122 N 0.00 0.00 -4.59 1.61 -1.99 -1.95 0.24 116.97 110.29 1uh0 h TYR 122 Ca 0.00 0.00 -0.34 0.00 2.00 0.00 0.00 58.73 60.39 1uh0 h TYR 122 Cb 0.00 0.00 -0.14 0.00 2.00 0.00 0.00 36.73 38.59 1uh0 h TYR 122 CO 0.00 0.83 -0.57 -1.58 -0.00 0.00 0.00 178.16 176.84 1uh0 s TRP 123 N -2.79 1.43 -0.47 4.88 0.51 -1.26 -4.53 118.94 116.71 1uh0 s TRP 123 Ca 0.01 -1.47 -0.28 0.00 -2.12 0.00 0.00 56.10 52.24 1uh0 s TRP 123 Cb 0.09 -0.66 -0.01 0.00 -0.81 0.00 0.00 33.47 32.08 1uh0 s TRP 123 CO 0.80 -0.70 1.71 -1.17 -0.51 0.00 0.00 176.95 177.08 1uh0 s LEU 124 N -3.26 3.43 0.04 2.99 2.96 -0.67 -4.34 118.68 119.83 1uh0 s LEU 124 Ca 0.39 0.75 -0.23 0.00 -0.22 0.00 0.00 54.13 54.83 1uh0 s LEU 124 Cb 0.05 -3.11 -0.15 0.00 0.50 0.00 0.00 46.19 43.48 1uh0 s LEU 124 CO 0.18 -1.90 1.48 0.44 -1.32 0.00 0.00 176.35 175.23 1uh0 h ASP 125 N 13.03 0.13 -5.21 3.68 3.32 -1.15 0.61 116.42 130.82 1uh0 h ASP 125 Ca -0.29 -0.29 0.16 0.00 0.02 0.00 0.00 57.03 56.63 1uh0 h ASP 125 Cb 1.15 -0.04 -0.09 0.00 0.22 0.00 0.00 39.33 40.57 1uh0 h ASP 125 CO 1.13 0.39 0.47 -0.72 -1.72 0.00 0.00 179.24 178.78 1uh0 s TYR 126 N -5.05 -0.17 0.11 4.55 -0.85 -1.24 -4.04 117.35 110.67 1uh0 s TYR 126 Ca -0.14 -0.12 -0.23 0.00 -0.52 0.00 0.00 57.07 56.06 1uh0 s TYR 126 Cb 0.05 0.63 0.06 0.00 0.38 0.00 0.00 41.96 43.08 1uh0 s TYR 126 CO 0.69 -0.81 0.57 -0.59 -1.52 0.00 0.00 175.55 173.88 1uh0 s PHE 127 N -3.31 -0.48 0.17 -3.49 -0.71 -1.26 -1.66 117.98 107.24 1uh0 s PHE 127 Ca 0.11 0.37 0.01 0.00 -1.04 0.00 0.00 56.93 56.38 1uh0 s PHE 127 Cb -0.02 0.47 -0.04 0.00 -1.21 0.00 0.00 43.02 42.21 1uh0 s PHE 127 CO 0.01 -0.77 0.03 -1.12 -1.34 0.00 0.00 175.22 172.03 1uh0 s SER 128 N -2.47 0.90 0.02 1.98 0.01 0.80 -4.96 113.70 109.97 1uh0 s SER 128 Ca -0.01 -1.22 0.03 0.00 1.31 0.00 0.00 55.95 56.07 1uh0 s SER 128 Cb -0.00 0.19 -0.01 0.00 0.21 0.00 0.00 66.02 66.40 1uh0 s SER 128 CO -0.09 -0.65 -0.10 -0.04 0.41 0.00 0.00 173.24 172.77 1uh0 s MET 129 N -3.98 0.74 -0.12 12.44 -1.94 -1.26 -2.43 119.30 122.75 1uh0 s MET 129 Ca 0.26 -0.55 -0.21 0.00 -1.71 0.00 0.00 55.69 53.49 1uh0 s MET 129 Cb 0.07 -0.69 -0.04 0.00 2.01 0.00 0.00 34.83 36.18 1uh0 s MET 129 CO 0.05 0.17 0.61 0.71 -0.01 0.00 0.00 175.02 176.55 1uh0 s TYR 130 N -0.64 3.50 0.07 -0.03 1.51 -0.08 -4.97 117.35 116.71 1uh0 s TYR 130 Ca 0.00 1.05 0.06 0.00 -1.01 0.00 0.00 57.07 57.17 1uh0 s TYR 130 Cb -0.06 -2.72 -0.04 0.00 -0.11 0.00 0.00 41.96 39.03 1uh0 s TYR 130 CO 0.00 0.04 -0.11 -0.51 -1.11 0.00 0.00 175.55 173.87 1uh0 s LEU 131 N 1.04 2.98 0.30 -1.29 1.02 -1.26 -0.33 118.68 121.15 1uh0 s LEU 131 Ca 0.31 -0.35 -0.19 0.00 0.02 0.00 0.00 54.13 53.92 1uh0 s LEU 131 Cb -0.16 -1.77 0.04 0.00 0.02 0.00 0.00 46.19 44.32 1uh0 s LEU 131 CO 0.13 0.21 0.80 -0.55 0.02 0.00 0.00 176.35 176.97 1uh0 s SER 132 N -1.91 -0.13 0.00 2.29 0.15 -0.08 -4.91 113.70 109.11 1uh0 s SER 132 Ca 0.19 -0.80 0.24 0.00 0.70 0.00 0.00 55.95 56.28 1uh0 s SER 132 Cb -0.11 0.74 0.29 0.00 -1.71 0.00 0.00 66.02 65.23 1uh0 s SER 132 CO 0.11 -1.41 1.32 0.18 1.20 0.00 0.00 173.24 174.63