#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uhc n SER 2 N 0.00 -7.63 -1.28 1.61 2.88 -1.26 -4.95 113.62 102.99 1uhc n SER 2 Ca 0.00 1.05 0.15 0.00 -1.33 0.00 0.00 58.87 58.74 1uhc n SER 2 Cb 0.00 -3.85 -0.06 0.00 -0.75 0.00 0.00 64.21 59.56 1uhc n SER 2 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1uhc n SER 3 N 0.71 -7.10 0.00 -3.46 3.41 -1.26 -4.70 113.62 101.23 1uhc n SER 3 Ca 0.00 0.84 0.00 0.00 -0.26 0.00 0.00 58.87 59.45 1uhc n SER 3 Cb 0.00 -4.11 0.00 0.00 -0.26 0.00 0.00 64.21 59.84 1uhc n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uhc n GLY 4 N -3.88 1.60 3.07 5.00 0.00 -1.26 -4.87 105.19 104.84 1uhc n GLY 4 Ca -0.03 0.26 -0.00 0.00 0.00 0.00 0.00 46.02 46.25 1uhc n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1uhc n SER 5 N 4.25 -6.83 0.00 1.61 2.88 -1.26 -5.01 113.62 109.25 1uhc n SER 5 Ca 0.00 0.69 0.00 0.00 -1.33 0.00 0.00 58.87 58.23 1uhc n SER 5 Cb 0.00 -2.48 0.00 0.00 -0.75 0.00 0.00 64.21 60.98 1uhc n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1uhc n SER 6 N 1.26 0.00 0.00 -3.46 7.64 -1.26 -5.12 113.62 112.67 1uhc n SER 6 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.87 1uhc n SER 6 Cb 0.36 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.56 1uhc n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uhc n GLY 7 N 0.00 2.27 3.89 0.23 0.00 -1.26 -4.75 105.19 105.56 1uhc n GLY 7 Ca 0.00 -0.34 -0.30 0.00 0.00 0.00 0.00 46.02 45.38 1uhc n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uhc s SER 8 N -4.00 5.49 -0.40 1.61 0.01 -1.26 -5.01 113.70 110.14 1uhc s SER 8 Ca 0.00 1.09 0.06 0.00 1.31 0.00 0.00 55.95 58.42 1uhc s SER 8 Cb 0.00 -1.92 0.43 0.00 0.21 0.00 0.00 66.02 64.74 1uhc s SER 8 CO 0.00 -1.29 1.12 -1.84 0.41 0.00 0.00 173.24 171.64 1uhc n GLU 9 N -2.95 3.32 -1.74 12.44 0.28 -1.26 -4.93 120.64 125.80 1uhc n GLU 9 Ca 0.07 -4.35 -0.01 0.00 -0.16 0.00 0.00 57.16 52.70 1uhc n GLU 9 Cb 0.57 -2.19 0.00 0.00 1.43 0.00 0.00 31.44 31.25 1uhc n GLU 9 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1uhc n ALA 10 N -0.51 -2.74 -2.60 -1.84 0.00 -1.26 -4.97 120.51 106.59 1uhc n ALA 10 Ca 0.38 0.16 -0.43 0.00 0.00 0.00 0.00 53.44 53.56 1uhc n ALA 10 Cb 0.74 -0.57 -0.03 0.00 0.00 0.00 0.00 19.45 19.58 1uhc n ALA 10 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1uhc s GLU 11 N -1.62 3.83 2.68 0.00 2.12 -1.26 -4.71 118.70 119.73 1uhc s GLU 11 Ca 0.03 0.62 0.00 0.00 0.36 0.00 0.00 54.97 55.98 1uhc s GLU 11 Cb -0.01 -3.82 0.00 0.00 0.26 0.00 0.00 34.13 30.56 1uhc s GLU 11 CO 0.13 -1.04 0.00 0.41 -0.54 0.00 0.00 175.26 174.22 1uhc n GLY 12 N 4.43 1.28 1.11 -1.50 0.00 -1.26 -4.80 105.19 104.45 1uhc n GLY 12 Ca 0.09 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1uhc n GLY 12 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1uhc n ASN 13 N 4.07 -0.45 -4.43 1.61 2.85 -1.26 -5.14 115.26 112.51 1uhc n ASN 13 Ca 0.00 0.14 -0.38 0.00 -0.11 0.00 0.00 54.58 54.23 1uhc n ASN 13 Cb 0.00 0.68 0.03 0.00 1.24 0.00 0.00 39.78 41.73 1uhc n ASN 13 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1uhc n GLN 14 N -2.27 0.41 -3.58 1.20 6.02 -1.26 -4.97 117.38 112.93 1uhc n GLN 14 Ca 0.00 0.16 -0.29 0.00 -0.01 0.00 0.00 57.00 56.86 1uhc n GLN 14 Cb 0.00 -1.58 -0.14 0.00 1.02 0.00 0.00 30.24 29.54 1uhc n GLN 14 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1uhc s VAL 15 N -1.78 0.43 0.14 5.09 1.01 -1.26 -4.91 120.40 119.13 1uhc s VAL 15 Ca 0.67 -1.53 0.05 0.00 0.00 0.00 0.00 61.98 61.17 1uhc s VAL 15 Cb -0.45 -1.33 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 1uhc s VAL 15 CO 0.57 -0.84 0.10 -0.31 0.00 0.00 0.00 175.10 174.61 1uhc s TYR 16 N 1.34 3.11 0.04 5.22 1.51 -1.25 -2.30 117.35 125.03 1uhc s TYR 16 Ca 0.14 -0.01 0.01 0.00 -1.01 0.00 0.00 57.07 56.19 1uhc s TYR 16 Cb -0.20 -1.52 -0.03 0.00 -0.11 0.00 0.00 41.96 40.10 1uhc s TYR 16 CO -0.15 0.52 -0.05 -0.59 -1.11 0.00 0.00 175.55 174.17 1uhc s PHE 17 N -1.65 0.52 0.20 2.71 -0.12 -0.29 -0.59 117.98 118.76 1uhc s PHE 17 Ca 0.30 -0.67 -0.32 0.00 -0.05 0.00 0.00 56.93 56.19 1uhc s PHE 17 Cb -0.10 -0.34 -0.11 0.00 -0.63 0.00 0.00 43.02 41.84 1uhc s PHE 17 CO 0.22 -0.19 1.64 0.00 -0.05 0.00 0.00 175.22 176.84 1uhc s ALA 18 N -2.18 3.84 0.02 1.99 0.00 0.82 -0.21 121.76 126.05 1uhc s ALA 18 Ca -0.06 1.48 -0.22 0.00 0.00 0.00 0.00 51.96 53.17 1uhc s ALA 18 Cb -0.05 -3.66 -0.16 0.00 0.00 0.00 0.00 23.12 19.25 1uhc s ALA 18 CO -0.03 -0.86 1.30 0.28 0.00 0.00 0.00 175.76 176.46 1uhc h VAL 19 N 3.85 1.37 -2.72 0.00 2.07 -1.66 1.10 116.25 120.26 1uhc h VAL 19 Ca -0.43 -1.32 -0.56 0.00 0.82 0.00 0.00 66.70 65.21 1uhc h VAL 19 Cb 1.20 2.00 -0.15 0.00 -1.52 0.00 0.00 31.29 32.82 1uhc h VAL 19 CO 0.92 0.38 -0.77 -0.31 0.02 0.00 0.00 177.57 177.81 1uhc s TYR 20 N -4.21 2.06 -0.42 1.57 2.02 -1.26 -3.98 117.35 113.14 1uhc s TYR 20 Ca -0.15 -0.42 -0.28 0.00 -0.37 0.00 0.00 57.07 55.86 1uhc s TYR 20 Cb 0.04 -0.95 -0.02 0.00 -0.40 0.00 0.00 41.96 40.63 1uhc s TYR 20 CO 0.74 0.53 1.87 0.99 -1.57 0.00 0.00 175.55 178.10 1uhc s THR 21 N -2.41 3.40 0.17 -0.71 2.01 -1.26 -4.12 115.64 112.71 1uhc s THR 21 Ca 0.24 0.36 0.06 0.00 0.31 0.00 0.00 61.69 62.66 1uhc s THR 21 Cb -0.05 -3.67 -0.04 0.00 0.01 0.00 0.00 72.50 68.76 1uhc s THR 21 CO 0.11 -0.51 0.07 0.12 -0.69 0.00 0.00 174.62 173.72 1uhc s PHE 22 N 7.94 3.00 0.09 4.92 5.36 0.49 -4.84 117.98 134.94 1uhc s PHE 22 Ca 0.78 -0.07 0.03 0.00 -0.96 0.00 0.00 56.93 56.71 1uhc s PHE 22 Cb -0.19 -1.45 -0.04 0.00 -0.34 0.00 0.00 43.02 41.00 1uhc s PHE 22 CO 0.29 0.52 -0.10 0.15 -1.46 0.00 0.00 175.22 174.63 1uhc s LYS 23 N -3.03 0.82 0.95 10.12 1.02 -1.26 -0.76 119.74 127.59 1uhc s LYS 23 Ca 0.29 -1.14 -0.13 0.00 0.02 0.00 0.00 55.97 55.01 1uhc s LYS 23 Cb -0.10 -0.49 0.16 0.00 -0.52 0.00 0.00 37.83 36.89 1uhc s LYS 23 CO 0.21 0.07 1.16 0.00 -0.92 0.00 0.00 175.35 175.87 1uhc s ALA 24 N -2.45 1.74 0.00 5.17 0.00 -1.26 -4.81 121.76 120.15 1uhc s ALA 24 Ca 0.05 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.34 1uhc s ALA 24 Cb -0.03 -2.98 0.00 0.00 0.00 0.00 0.00 23.12 20.11 1uhc s ALA 24 CO -0.00 -2.42 0.00 0.54 0.00 0.00 0.00 175.76 173.87 1uhc n ARG 25 N -3.86 0.00 -3.61 0.00 3.00 -1.26 -4.99 116.66 105.95 1uhc n ARG 25 Ca 0.08 0.00 -0.22 0.00 -0.01 0.00 0.00 57.85 57.70 1uhc n ARG 25 Cb 0.59 0.00 -0.01 0.00 0.00 0.00 0.00 32.46 33.04 1uhc n ARG 25 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 1uhc s ASN 26 N -0.88 6.26 0.00 0.55 -0.87 -1.26 -4.96 114.94 113.78 1uhc s ASN 26 Ca 0.00 0.24 -0.01 0.00 -1.57 0.00 0.00 52.86 51.52 1uhc s ASN 26 Cb 0.00 -1.88 -0.05 0.00 -0.02 0.00 0.00 41.25 39.29 1uhc s ASN 26 CO 0.00 -0.23 1.84 -0.81 -2.57 0.00 0.00 177.10 175.33 1uhc n PRO 27 N -1.64 0.94 -1.04 -0.60 -0.04 -1.26 -2.30 135.00 129.06 1uhc n PRO 27 Ca -0.06 -0.19 -0.01 0.00 -0.04 0.00 0.00 63.50 63.20 1uhc n PRO 27 Cb 0.57 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 1uhc n PRO 27 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1uhc n ASN 28 N 1.88 -0.25 -4.10 3.54 3.02 -1.26 -5.14 115.26 112.95 1uhc n ASN 28 Ca 0.08 -0.74 -0.20 0.00 -0.03 0.00 0.00 54.58 53.68 1uhc n ASN 28 Cb 0.46 0.10 -0.14 0.00 -0.61 0.00 0.00 39.78 39.58 1uhc n ASN 28 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1uhc s GLU 29 N 0.01 0.96 -0.05 3.52 2.02 -0.97 -2.38 118.70 121.82 1uhc s GLU 29 Ca 0.01 -0.56 0.01 0.00 0.02 0.00 0.00 54.97 54.44 1uhc s GLU 29 Cb 0.04 -0.94 -0.03 0.00 0.10 0.00 0.00 34.13 33.29 1uhc s GLU 29 CO -0.01 0.25 -0.05 -1.17 0.02 0.00 0.00 175.26 174.30 1uhc s LEU 30 N -0.63 3.27 0.12 1.80 2.96 -1.25 -4.65 118.68 120.30 1uhc s LEU 30 Ca 0.03 -0.02 -0.24 0.00 -0.22 0.00 0.00 54.13 53.68 1uhc s LEU 30 Cb -0.06 -1.78 -0.07 0.00 0.50 0.00 0.00 46.19 44.78 1uhc s LEU 30 CO 0.00 0.34 0.74 -0.55 -1.32 0.00 0.00 176.35 175.56 1uhc s SER 31 N -1.05 7.30 -0.10 3.68 0.15 -1.26 -4.26 113.70 118.17 1uhc s SER 31 Ca 0.14 1.54 -0.06 0.00 0.70 0.00 0.00 55.95 58.27 1uhc s SER 31 Cb -0.11 -2.47 0.04 0.00 -1.71 0.00 0.00 66.02 61.77 1uhc s SER 31 CO 0.04 0.18 0.24 0.68 1.20 0.00 0.00 173.24 175.57 1uhc s VAL 32 N -0.89 -0.03 0.81 4.45 -7.23 0.06 -4.93 120.40 112.64 1uhc s VAL 32 Ca 0.35 0.09 -0.14 0.00 -1.81 0.00 0.00 61.98 60.48 1uhc s VAL 32 Cb -0.22 -0.36 0.19 0.00 0.56 0.00 0.00 36.38 36.55 1uhc s VAL 32 CO 0.24 0.04 1.10 -1.54 -0.31 0.00 0.00 175.10 174.63 1uhc n SER 33 N 3.74 0.05 -4.74 4.85 3.41 -1.26 0.19 113.62 119.86 1uhc n SER 33 Ca -0.21 -1.39 -0.41 0.00 -0.26 0.00 0.00 58.87 56.61 1uhc n SER 33 Cb 0.55 -0.84 -0.05 0.00 -0.26 0.00 0.00 64.21 63.61 1uhc n SER 33 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1uhc s ALA 34 N -3.96 3.30 -0.54 7.33 0.00 -1.26 -2.91 121.76 123.72 1uhc s ALA 34 Ca 0.62 0.61 0.00 0.00 0.00 0.00 0.00 51.96 53.19 1uhc s ALA 34 Cb -0.02 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.86 1uhc s ALA 34 CO 0.44 0.09 0.00 0.09 0.00 0.00 0.00 175.76 176.37 1uhc n ASN 35 N 2.09 -5.30 -4.67 0.00 3.02 0.38 -4.88 115.26 105.90 1uhc n ASN 35 Ca 0.00 0.13 -0.43 0.00 -0.03 0.00 0.00 54.58 54.25 1uhc n ASN 35 Cb 0.48 -3.25 -0.02 0.00 -0.61 0.00 0.00 39.78 36.38 1uhc n ASN 35 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1uhc s GLN 36 N -2.16 4.33 0.66 3.52 2.00 -1.14 -4.70 119.66 122.17 1uhc s GLN 36 Ca 0.00 1.47 -0.17 0.00 -2.00 0.00 0.00 55.36 54.65 1uhc s GLN 36 Cb 0.00 -3.61 -0.00 0.00 0.80 0.00 0.00 33.01 30.20 1uhc s GLN 36 CO 0.00 -0.50 1.24 1.17 -0.50 0.00 0.00 175.29 176.71 1uhc n LYS 37 N 5.70 0.97 -3.62 1.67 4.81 -1.26 -0.12 118.16 126.30 1uhc n LYS 37 Ca 0.11 0.39 -0.04 0.00 -0.87 0.00 0.00 58.31 57.90 1uhc n LYS 37 Cb 0.47 -2.48 -0.06 0.00 0.02 0.00 0.00 35.03 32.98 1uhc n LYS 37 CO 0.00 0.00 0.00 -0.48 1.17 0.00 0.00 177.40 178.09 1uhc s LEU 38 N -4.22 -0.89 -0.41 3.14 0.05 0.24 -4.79 118.68 111.79 1uhc s LEU 38 Ca 0.81 1.34 -0.29 0.00 0.05 0.00 0.00 54.13 56.05 1uhc s LEU 38 Cb -0.37 2.18 0.02 0.00 -2.05 0.00 0.00 46.19 45.98 1uhc s LEU 38 CO 0.42 -0.20 1.09 -0.75 -0.55 0.00 0.00 176.35 176.36 1uhc s LYS 39 N 2.02 3.85 -0.60 1.48 2.36 -1.24 -3.94 119.74 123.66 1uhc s LYS 39 Ca -0.08 0.73 -0.27 0.00 -2.55 0.00 0.00 55.97 53.80 1uhc s LYS 39 Cb -0.07 -3.84 0.01 0.00 -1.05 0.00 0.00 37.83 32.88 1uhc s LYS 39 CO -0.19 -1.18 1.50 0.42 1.55 0.00 0.00 175.35 177.45 1uhc s ILE 40 N 4.09 3.67 -0.01 5.43 -1.09 -1.26 -2.15 121.20 129.87 1uhc s ILE 40 Ca 0.46 0.51 -0.11 0.00 -2.23 0.00 0.00 60.65 59.29 1uhc s ILE 40 Cb -0.09 -4.39 -0.06 0.00 -1.58 0.00 0.00 42.46 36.33 1uhc s ILE 40 CO 0.25 -1.22 0.65 -0.07 -1.23 0.00 0.00 174.94 173.32 1uhc h LEU 41 N 13.82 -0.33 -8.52 2.97 3.38 0.11 -3.47 115.31 123.27 1uhc h LEU 41 Ca -0.27 0.01 -0.41 0.00 0.09 0.00 0.00 57.88 57.30 1uhc h LEU 41 Cb 1.10 0.08 -0.20 0.00 0.09 0.00 0.00 40.66 41.74 1uhc h LEU 41 CO 1.20 -0.09 -0.77 -1.61 0.09 0.00 0.00 178.44 177.26 1uhc s GLU 42 N -2.98 0.93 -0.07 1.13 2.02 -1.16 -4.96 118.70 113.61 1uhc s GLU 42 Ca -0.06 -1.12 0.16 0.00 0.02 0.00 0.00 54.97 53.98 1uhc s GLU 42 Cb 0.01 -0.86 0.59 0.00 0.10 0.00 0.00 34.13 33.97 1uhc s GLU 42 CO 0.17 0.17 1.48 1.19 0.02 0.00 0.00 175.26 178.30 1uhc n PHE 43 N 0.85 1.16 -3.69 1.61 3.01 -1.26 -0.37 117.46 118.77 1uhc n PHE 43 Ca -0.18 -0.48 -0.14 0.00 1.01 0.00 0.00 57.45 57.66 1uhc n PHE 43 Cb 0.56 -0.16 -0.08 0.00 -0.01 0.00 0.00 39.48 39.78 1uhc n PHE 43 CO 0.00 0.00 0.00 -1.59 1.01 0.00 0.00 176.76 176.18 1uhc s LYS 44 N -1.65 0.69 0.76 -1.08 0.00 -1.21 -4.24 119.74 113.00 1uhc s LYS 44 Ca 0.43 0.31 -0.09 0.00 0.00 0.00 0.00 55.97 56.62 1uhc s LYS 44 Cb 0.26 0.32 0.08 0.00 0.00 0.00 0.00 37.83 38.50 1uhc s LYS 44 CO 0.23 -0.15 1.09 0.16 0.00 0.00 0.00 175.35 176.67 1uhc s ASP 45 N -0.54 4.54 0.31 0.03 1.47 -0.75 -4.69 116.67 117.05 1uhc s ASP 45 Ca -0.07 0.48 0.07 0.00 1.18 0.00 0.00 52.55 54.22 1uhc s ASP 45 Cb -0.03 -1.01 0.82 0.00 -0.34 0.00 0.00 42.92 42.36 1uhc s ASP 45 CO 0.04 -1.80 1.72 -0.37 0.68 0.00 0.00 175.17 175.43 1uhc h VAL 46 N -0.82 0.53 -0.21 2.11 -1.51 -1.94 1.44 116.25 115.85 1uhc h VAL 46 Ca -0.44 -0.19 0.06 0.00 -1.23 0.00 0.00 66.70 64.90 1uhc h VAL 46 Cb 1.31 -0.05 -0.01 0.00 -2.13 0.00 0.00 31.29 30.41 1uhc h VAL 46 CO 0.59 0.10 0.23 0.71 -1.23 0.00 0.00 177.57 177.96 1uhc h THR 47 N 0.54 0.48 0.00 7.19 1.35 -2.01 -3.45 112.91 117.01 1uhc h THR 47 Ca 0.61 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.47 1uhc h THR 47 Cb 1.14 0.82 0.00 0.00 -1.73 0.00 0.00 68.15 68.38 1uhc h THR 47 CO -0.48 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.40 1uhc n GLY 48 N -1.42 0.15 3.68 5.82 0.00 0.49 -5.04 105.19 108.87 1uhc n GLY 48 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1uhc n GLY 48 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1uhc s ASN 49 N -2.06 6.55 -0.27 1.61 2.47 -1.25 -4.65 114.94 117.34 1uhc s ASN 49 Ca 0.00 2.53 -0.02 0.00 0.42 0.00 0.00 52.86 55.79 1uhc s ASN 49 Cb 0.00 -2.56 0.08 0.00 -1.45 0.00 0.00 41.25 37.32 1uhc s ASN 49 CO 0.00 -0.94 2.45 0.35 -3.72 0.00 0.00 177.10 175.25 1uhc n THR 50 N 4.93 2.87 -0.04 -5.21 -2.24 -1.26 -1.81 114.28 111.52 1uhc n THR 50 Ca 0.17 -1.88 -0.05 0.00 -2.27 0.00 0.00 64.05 60.02 1uhc n THR 50 Cb 0.40 -1.52 -0.04 0.00 -2.10 0.00 0.00 70.33 67.07 1uhc n THR 50 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1uhc n GLU 51 N 0.94 0.48 -3.76 -0.78 1.02 -1.26 -4.90 120.64 112.37 1uhc n GLU 51 Ca 0.33 0.04 -0.36 0.00 -0.02 0.00 0.00 57.16 57.16 1uhc n GLU 51 Cb 0.60 -1.16 -0.09 0.00 -0.02 0.00 0.00 31.44 30.77 1uhc n GLU 51 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1uhc s TRP 52 N -2.16 3.32 -0.15 -0.32 0.52 -1.25 -1.78 118.94 117.12 1uhc s TRP 52 Ca -0.10 0.20 -0.06 0.00 0.02 0.00 0.00 56.10 56.16 1uhc s TRP 52 Cb 0.03 -2.19 -0.04 0.00 -1.15 0.00 0.00 33.47 30.12 1uhc s TRP 52 CO 0.19 0.14 0.05 -1.58 0.02 0.00 0.00 176.95 175.77 1uhc s TRP 53 N 0.70 3.26 -0.52 -1.98 0.52 0.22 -3.01 118.94 118.12 1uhc s TRP 53 Ca 0.07 0.14 -0.28 0.00 0.02 0.00 0.00 56.10 56.05 1uhc s TRP 53 Cb -0.12 -1.97 0.02 0.00 -1.15 0.00 0.00 33.47 30.25 1uhc s TRP 53 CO 0.01 0.31 1.24 -1.17 0.02 0.00 0.00 176.95 177.36 1uhc s LEU 54 N -0.17 3.52 0.00 2.99 2.96 0.50 -0.87 118.68 127.61 1uhc s LEU 54 Ca 0.07 0.35 0.02 0.00 -0.22 0.00 0.00 54.13 54.35 1uhc s LEU 54 Cb -0.12 -3.32 -0.04 0.00 0.50 0.00 0.00 46.19 43.21 1uhc s LEU 54 CO 0.01 -1.44 -0.02 0.00 -1.32 0.00 0.00 176.35 173.58 1uhc s ALA 55 N 5.04 3.19 -0.25 5.97 0.00 0.08 0.15 121.76 135.95 1uhc s ALA 55 Ca 0.49 -0.98 0.01 0.00 0.00 0.00 0.00 51.96 51.48 1uhc s ALA 55 Cb -0.09 -1.27 0.06 0.00 0.00 0.00 0.00 23.12 21.83 1uhc s ALA 55 CO 0.28 0.63 -0.05 -2.00 0.00 0.00 0.00 175.76 174.63 1uhc s GLU 56 N -1.51 1.68 -0.27 0.00 2.12 -0.91 -1.07 118.70 118.74 1uhc s GLU 56 Ca 0.19 -1.11 0.01 0.00 0.36 0.00 0.00 54.97 54.41 1uhc s GLU 56 Cb -0.11 -2.65 0.05 0.00 0.26 0.00 0.00 34.13 31.67 1uhc s GLU 56 CO 0.09 -0.63 -0.07 0.08 -0.54 0.00 0.00 175.26 174.19 1uhc s VAL 57 N 1.32 2.53 -0.64 3.70 1.01 -0.47 -3.73 120.40 124.12 1uhc s VAL 57 Ca -0.05 -1.46 -0.06 0.00 0.00 0.00 0.00 61.98 60.42 1uhc s VAL 57 Cb -0.19 -2.44 0.01 0.00 0.00 0.00 0.00 36.38 33.76 1uhc s VAL 57 CO -0.07 -0.01 0.66 0.59 0.00 0.00 0.00 175.10 176.28 1uhc n ASN 58 N 4.53 -7.69 -4.04 3.32 4.13 -1.26 -3.26 115.26 110.99 1uhc n ASN 58 Ca -0.14 0.08 -0.35 0.00 1.68 0.00 0.00 54.58 55.84 1uhc n ASN 58 Cb 0.43 -5.12 -0.02 0.00 -1.54 0.00 0.00 39.78 33.53 1uhc n ASN 58 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1uhc n GLY 59 N -1.28 -0.49 2.99 7.41 0.00 -1.26 -4.91 105.19 107.64 1uhc n GLY 59 Ca 0.02 0.23 -0.05 0.00 0.00 0.00 0.00 46.02 46.23 1uhc n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uhc s LYS 60 N -6.98 0.43 0.32 1.61 1.02 -1.20 -5.15 119.74 109.80 1uhc s LYS 60 Ca 0.27 0.53 -0.14 0.00 0.02 0.00 0.00 55.97 56.65 1uhc s LYS 60 Cb -0.15 -0.14 -0.09 0.00 -0.52 0.00 0.00 37.83 36.93 1uhc s LYS 60 CO 0.83 -0.78 0.73 0.15 -0.92 0.00 0.00 175.35 175.35 1uhc s LYS 61 N 2.64 3.96 -0.18 1.68 1.02 -1.26 -1.37 119.74 126.23 1uhc s LYS 61 Ca 0.13 0.62 -0.31 0.00 0.02 0.00 0.00 55.97 56.44 1uhc s LYS 61 Cb -0.14 -2.44 0.14 0.00 -0.52 0.00 0.00 37.83 34.87 1uhc s LYS 61 CO -0.22 0.15 1.11 0.20 -0.92 0.00 0.00 175.35 175.67 1uhc s GLY 62 N -2.37 -0.20 -0.19 -3.33 0.00 -0.23 -4.73 107.32 96.26 1uhc s GLY 62 Ca 0.53 2.07 -0.20 0.00 0.00 0.00 0.00 44.72 47.12 1uhc s GLY 62 CO 0.19 0.90 0.61 -0.19 0.00 0.00 0.00 173.10 174.62 1uhc s TYR 63 N -1.49 3.38 0.29 1.90 2.02 -1.00 -0.74 117.35 121.70 1uhc s TYR 63 Ca 0.03 0.91 0.09 0.00 -0.37 0.00 0.00 57.07 57.74 1uhc s TYR 63 Cb -0.01 -2.78 -0.06 0.00 -0.40 0.00 0.00 41.96 38.72 1uhc s TYR 63 CO -0.03 -0.16 -0.12 0.08 -1.57 0.00 0.00 175.55 173.76 1uhc s VAL 64 N 1.84 2.03 0.35 0.71 1.01 -0.05 -3.94 120.40 122.36 1uhc s VAL 64 Ca 0.28 -2.23 -0.26 0.00 0.00 0.00 0.00 61.98 59.77 1uhc s VAL 64 Cb -0.16 -2.40 -0.09 0.00 0.00 0.00 0.00 36.38 33.73 1uhc s VAL 64 CO 0.10 -0.35 1.06 -2.16 0.00 0.00 0.00 175.10 173.76 1uhc s PRO 65 N -3.63 4.36 0.00 2.72 0.04 -1.26 0.68 135.00 137.91 1uhc s PRO 65 Ca 0.29 1.62 0.30 0.00 0.04 0.00 0.00 61.00 63.25 1uhc s PRO 65 Cb 0.00 -2.80 1.62 0.00 0.04 0.00 0.00 34.50 33.37 1uhc s PRO 65 CO 0.13 0.01 2.07 -1.13 0.04 0.00 0.00 177.00 178.12 1uhc n SER 66 N 0.43 0.00 0.07 6.66 3.41 -0.74 -2.58 113.62 120.88 1uhc n SER 66 Ca 0.03 -0.47 0.07 0.00 -0.26 0.00 0.00 58.87 58.23 1uhc n SER 66 Cb 0.48 -0.17 -0.04 0.00 -0.26 0.00 0.00 64.21 64.22 1uhc n SER 66 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1uhc n ASN 67 N -1.17 0.82 -2.19 4.04 4.13 -1.26 -3.92 115.26 115.72 1uhc n ASN 67 Ca 0.18 0.33 -0.27 0.00 1.68 0.00 0.00 54.58 56.50 1uhc n ASN 67 Cb 0.18 0.40 0.13 0.00 -1.54 0.00 0.00 39.78 38.95 1uhc n ASN 67 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1uhc n TYR 68 N -2.74 2.99 -4.30 3.10 4.02 -1.07 -4.89 117.16 114.28 1uhc n TYR 68 Ca -0.04 -2.34 -0.29 0.00 -0.01 0.00 0.00 57.90 55.22 1uhc n TYR 68 Cb 0.66 -1.10 -0.11 0.00 -0.02 0.00 0.00 39.34 38.77 1uhc n TYR 68 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1uhc s ILE 69 N -3.98 2.95 0.06 -0.72 -1.09 -1.25 -2.03 121.20 115.14 1uhc s ILE 69 Ca 0.59 -1.54 -0.04 0.00 -2.23 0.00 0.00 60.65 57.43 1uhc s ILE 69 Cb 0.48 -2.38 -0.02 0.00 -1.58 0.00 0.00 42.46 38.96 1uhc s ILE 69 CO 0.05 0.05 0.06 -0.13 -1.23 0.00 0.00 174.94 173.74 1uhc s ARG 70 N -2.32 0.69 -0.13 2.79 1.81 0.70 -4.59 118.95 117.90 1uhc s ARG 70 Ca 0.20 -1.07 0.02 0.00 -1.72 0.00 0.00 55.73 53.16 1uhc s ARG 70 Cb -0.10 0.26 0.01 0.00 -0.45 0.00 0.00 34.95 34.67 1uhc s ARG 70 CO 0.12 -0.17 -0.20 0.21 -0.68 0.00 0.00 175.30 174.58 1uhc s LYS 71 N -3.72 2.78 0.45 3.54 2.20 -1.26 -1.14 119.74 122.60 1uhc s LYS 71 Ca 0.05 -0.77 -0.15 0.00 -0.36 0.00 0.00 55.97 54.74 1uhc s LYS 71 Cb 0.06 -2.28 -0.08 0.00 -1.51 0.00 0.00 37.83 34.02 1uhc s LYS 71 CO -0.10 -0.04 0.89 -0.08 -0.36 0.00 0.00 175.35 175.66 1uhc s THR 72 N 0.90 4.63 -0.08 3.43 -1.32 -0.97 -4.71 115.64 117.52 1uhc s THR 72 Ca -0.06 1.00 -0.06 0.00 -1.21 0.00 0.00 61.69 61.36 1uhc s THR 72 Cb -0.15 -3.71 0.02 0.00 -1.51 0.00 0.00 72.50 67.15 1uhc s THR 72 CO -0.03 -0.57 0.11 1.21 -2.21 0.00 0.00 174.62 173.14 1uhc n GLU 73 N -1.33 -4.25 -3.66 7.08 0.00 -1.26 -4.88 120.64 112.34 1uhc n GLU 73 Ca 0.05 3.16 -0.39 0.00 0.00 0.00 0.00 57.16 59.97 1uhc n GLU 73 Cb 0.54 -4.25 -0.11 0.00 0.00 0.00 0.00 31.44 27.62 1uhc n GLU 73 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1uhc s SER 74 N -0.53 5.51 0.99 4.31 0.15 -1.26 -5.08 113.70 117.78 1uhc s SER 74 Ca -0.13 -1.44 -0.16 0.00 0.70 0.00 0.00 55.95 54.91 1uhc s SER 74 Cb 0.01 -1.94 -0.13 0.00 -1.71 0.00 0.00 66.02 62.26 1uhc s SER 74 CO 0.36 -0.47 -0.64 0.61 1.20 0.00 0.00 173.24 174.29 1uhc n GLY 75 N 4.86 -4.31 3.75 9.45 0.00 -1.26 -4.86 105.19 112.82 1uhc n GLY 75 Ca -0.10 -0.79 -0.40 0.00 0.00 0.00 0.00 46.02 44.73 1uhc n GLY 75 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uhc s PRO 76 N -2.20 4.65 -0.36 1.61 0.04 -1.26 -4.99 135.00 132.48 1uhc s PRO 76 Ca 0.42 1.76 -0.04 0.00 0.04 0.00 0.00 61.00 63.18 1uhc s PRO 76 Cb -0.19 -3.22 0.20 0.00 0.04 0.00 0.00 34.50 31.33 1uhc s PRO 76 CO 0.81 0.21 0.97 0.45 0.04 0.00 0.00 177.00 179.47 1uhc s SER 77 N -0.73 -0.61 0.25 6.66 0.15 -1.26 -5.11 113.70 113.05 1uhc s SER 77 Ca 0.45 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.62 1uhc s SER 77 Cb -0.31 0.78 0.00 0.00 -1.71 0.00 0.00 66.02 64.78 1uhc s SER 77 CO 0.39 -0.05 0.00 -0.24 1.20 0.00 0.00 173.24 174.54 1uhc n SER 78 N 3.34 -8.37 0.00 5.45 2.88 -1.26 -5.29 113.62 110.37 1uhc n SER 78 Ca 0.10 1.21 0.00 0.00 -1.33 0.00 0.00 58.87 58.85 1uhc n SER 78 Cb 0.62 -4.52 0.00 0.00 -0.75 0.00 0.00 64.21 59.56 1uhc n SER 78 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42