#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uhc s SER 2 N 0.00 3.89 0.18 1.61 0.01 -1.26 -5.16 113.70 112.98 1uhc s SER 2 Ca 0.00 -1.30 0.01 0.00 1.31 0.00 0.00 55.95 55.97 1uhc s SER 2 Cb 0.00 -0.40 -0.05 0.00 0.21 0.00 0.00 66.02 65.79 1uhc s SER 2 CO 0.00 -0.39 0.04 -0.44 0.41 0.00 0.00 173.24 172.85 1uhc s SER 3 N -3.70 0.99 0.41 2.44 0.01 -1.26 -5.17 113.70 107.42 1uhc s SER 3 Ca 0.35 -1.23 0.00 0.00 1.31 0.00 0.00 55.95 56.38 1uhc s SER 3 Cb 0.08 0.17 0.00 0.00 0.21 0.00 0.00 66.02 66.48 1uhc s SER 3 CO 0.18 -0.64 0.00 0.61 0.41 0.00 0.00 173.24 173.80 1uhc n GLY 4 N -0.26 -1.70 3.10 3.44 0.00 -1.26 -5.01 105.19 103.50 1uhc n GLY 4 Ca -0.05 -1.51 -0.36 0.00 0.00 0.00 0.00 46.02 44.10 1uhc n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1uhc s SER 5 N -1.30 5.20 -0.01 1.61 0.15 -1.26 -5.03 113.70 113.05 1uhc s SER 5 Ca 0.00 -2.27 -0.30 0.00 0.70 0.00 0.00 55.95 54.08 1uhc s SER 5 Cb 0.00 -1.82 0.12 0.00 -1.71 0.00 0.00 66.02 62.61 1uhc s SER 5 CO 0.00 -0.48 1.28 -0.94 1.20 0.00 0.00 173.24 174.29 1uhc s SER 6 N 1.44 -0.06 0.00 5.45 1.04 -1.26 -5.16 113.70 115.15 1uhc s SER 6 Ca 0.11 -0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.40 1uhc s SER 6 Cb -0.22 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.07 1uhc s SER 6 CO -0.04 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.47 1uhc n GLY 7 N -0.48 -0.16 2.48 7.32 0.00 -1.26 -5.12 105.19 107.97 1uhc n GLY 7 Ca -0.08 0.78 -0.28 0.00 0.00 0.00 0.00 46.02 46.43 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 0.00 2.64 -0.24 1.61 0.01 -1.26 -5.09 113.70 111.36 1uhc s SER 8 Ca 0.00 -2.50 -0.27 0.00 1.31 0.00 0.00 55.95 54.49 1uhc s SER 8 Cb 0.00 -0.49 0.14 0.00 0.21 0.00 0.00 66.02 65.87 1uhc s SER 8 CO 0.00 -0.26 1.09 -1.83 0.41 0.00 0.00 173.24 172.65 1uhc s GLU 9 N 0.67 0.45 -0.39 12.44 -1.05 -1.26 -5.00 118.70 124.56 1uhc s GLU 9 Ca 0.22 0.35 0.02 0.00 -0.15 0.00 0.00 54.97 55.41 1uhc s GLU 9 Cb -0.15 0.22 0.12 0.00 -0.44 0.00 0.00 34.13 33.87 1uhc s GLU 9 CO -0.05 -0.09 0.17 0.00 0.95 0.00 0.00 175.26 176.24 1uhc s ALA 10 N -0.29 2.16 -0.40 -0.84 0.00 -1.26 -4.91 121.76 116.21 1uhc s ALA 10 Ca 0.02 -2.36 -0.20 0.00 0.00 0.00 0.00 51.96 49.43 1uhc s ALA 10 Cb -0.03 -1.84 0.03 0.00 0.00 0.00 0.00 23.12 21.27 1uhc s ALA 10 CO -0.05 -1.89 0.53 0.39 0.00 0.00 0.00 175.76 174.74 1uhc n GLU 11 N 4.01 -2.29 -3.49 0.00 1.02 -1.26 -5.04 120.64 113.58 1uhc n GLU 11 Ca 0.04 1.96 0.00 0.00 -0.02 0.00 0.00 57.16 59.14 1uhc n GLU 11 Cb 0.38 -4.50 -0.04 0.00 -0.02 0.00 0.00 31.44 27.25 1uhc n GLU 11 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1uhc s GLY 12 N -2.14 -0.29 -0.10 0.62 0.00 -1.26 -5.06 107.32 99.09 1uhc s GLY 12 Ca 0.25 2.89 -0.19 0.00 0.00 0.00 0.00 44.72 47.67 1uhc s GLY 12 CO 0.77 3.09 0.63 -0.57 0.00 0.00 0.00 173.10 177.02 1uhc h ASN 13 N 7.40 -0.06 -2.70 1.64 -0.73 -2.03 -3.46 115.58 115.64 1uhc h ASN 13 Ca -0.18 -0.54 -0.56 0.00 1.87 0.00 0.00 56.30 56.88 1uhc h ASN 13 Cb 1.13 0.01 0.20 0.00 0.27 0.00 0.00 38.32 39.93 1uhc h ASN 13 CO 0.10 0.67 -0.89 0.00 -0.37 0.00 0.00 177.43 176.94 1uhc n GLN 14 N -4.76 0.11 -3.56 6.67 3.00 -1.26 -4.75 117.38 112.84 1uhc n GLN 14 Ca -0.07 0.06 0.01 0.00 -0.01 0.00 0.00 57.00 57.00 1uhc n GLN 14 Cb 0.29 -1.47 -0.06 0.00 0.00 0.00 0.00 30.24 29.00 1uhc n GLN 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1uhc s VAL 15 N -2.00 -0.05 0.05 5.09 0.11 -1.26 -5.07 120.40 117.27 1uhc s VAL 15 Ca 0.57 0.00 0.05 0.00 -2.93 0.00 0.00 61.98 59.67 1uhc s VAL 15 Cb -0.33 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.49 1uhc s VAL 15 CO 0.66 0.00 -0.14 -0.31 -3.33 0.00 0.00 175.10 171.98 1uhc s TYR 16 N 1.37 1.18 0.15 1.54 1.51 -1.25 -0.07 117.35 121.78 1uhc s TYR 16 Ca -0.07 -0.39 0.07 0.00 -1.01 0.00 0.00 57.07 55.67 1uhc s TYR 16 Cb -0.03 -0.69 -0.04 0.00 -0.11 0.00 0.00 41.96 41.10 1uhc s TYR 16 CO -0.13 0.04 -0.15 -0.59 -1.11 0.00 0.00 175.55 173.61 1uhc s PHE 17 N -1.01 1.55 0.11 2.71 -0.12 -1.02 -1.24 117.98 118.96 1uhc s PHE 17 Ca -0.00 -0.56 -0.31 0.00 -0.05 0.00 0.00 56.93 56.00 1uhc s PHE 17 Cb -0.09 -0.77 -0.09 0.00 -0.63 0.00 0.00 43.02 41.44 1uhc s PHE 17 CO 0.02 0.23 1.55 0.00 -0.05 0.00 0.00 175.22 176.96 1uhc s ALA 18 N -2.46 3.69 0.07 1.99 0.00 0.22 -1.18 121.76 124.10 1uhc s ALA 18 Ca 0.14 1.22 -0.16 0.00 0.00 0.00 0.00 51.96 53.17 1uhc s ALA 18 Cb -0.03 -3.63 -0.16 0.00 0.00 0.00 0.00 23.12 19.30 1uhc s ALA 18 CO 0.04 -0.88 1.28 0.28 0.00 0.00 0.00 175.76 176.49 1uhc h VAL 19 N 4.42 1.33 -2.65 0.00 2.07 -1.30 1.58 116.25 121.71 1uhc h VAL 19 Ca -0.42 -1.82 -0.50 0.00 0.82 0.00 0.00 66.70 64.78 1uhc h VAL 19 Cb 1.20 2.04 -0.14 0.00 -1.52 0.00 0.00 31.29 32.88 1uhc h VAL 19 CO 0.91 0.56 -0.62 -0.31 0.02 0.00 0.00 177.57 178.13 1uhc s TYR 20 N -3.80 2.03 -0.61 1.57 2.02 -1.26 -4.34 117.35 112.96 1uhc s TYR 20 Ca -0.12 -0.86 -0.28 0.00 -0.37 0.00 0.00 57.07 55.44 1uhc s TYR 20 Cb 0.07 -1.31 0.03 0.00 -0.40 0.00 0.00 41.96 40.34 1uhc s TYR 20 CO 0.85 0.13 1.22 0.99 -1.57 0.00 0.00 175.55 177.17 1uhc s THR 21 N -3.16 3.94 0.37 -0.71 2.01 -1.26 -3.66 115.64 113.17 1uhc s THR 21 Ca 0.35 0.79 0.04 0.00 0.31 0.00 0.00 61.69 63.18 1uhc s THR 21 Cb 0.08 -4.76 -0.01 0.00 0.01 0.00 0.00 72.50 67.82 1uhc s THR 21 CO 0.15 -1.45 0.53 0.12 -0.69 0.00 0.00 174.62 173.28 1uhc s PHE 22 N 5.17 3.20 0.01 4.92 5.36 -0.56 -4.89 117.98 131.19 1uhc s PHE 22 Ca 0.42 -0.02 -0.00 0.00 -0.96 0.00 0.00 56.93 56.37 1uhc s PHE 22 Cb -0.08 -2.07 -0.01 0.00 -0.34 0.00 0.00 43.02 40.52 1uhc s PHE 22 CO 0.23 -0.09 -0.02 0.21 -1.46 0.00 0.00 175.22 174.09 1uhc s LYS 23 N -4.30 0.23 -0.19 10.12 2.20 -1.26 -2.63 119.74 123.91 1uhc s LYS 23 Ca 0.45 -0.45 -0.26 0.00 -0.36 0.00 0.00 55.97 55.36 1uhc s LYS 23 Cb -0.10 0.08 -0.01 0.00 -1.51 0.00 0.00 37.83 36.29 1uhc s LYS 23 CO 0.33 -0.04 0.86 0.00 -0.36 0.00 0.00 175.35 176.14 1uhc s ALA 24 N -1.07 3.55 -0.08 3.13 0.00 -1.26 -4.79 121.76 121.24 1uhc s ALA 24 Ca -0.12 0.03 0.12 0.00 0.00 0.00 0.00 51.96 52.00 1uhc s ALA 24 Cb -0.07 -3.28 -0.18 0.00 0.00 0.00 0.00 23.12 19.59 1uhc s ALA 24 CO -0.01 -0.73 0.16 0.54 0.00 0.00 0.00 175.76 175.72 1uhc n ARG 25 N 5.46 1.23 -4.06 0.00 3.00 -1.26 -4.92 116.66 116.10 1uhc n ARG 25 Ca 0.05 -0.06 -0.23 0.00 -0.01 0.00 0.00 57.85 57.61 1uhc n ARG 25 Cb 0.48 -1.33 -0.06 0.00 0.00 0.00 0.00 32.46 31.56 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 -4.11 4.86 0.00 0.55 0.01 -1.26 -5.00 114.94 109.99 1uhc s ASN 26 Ca -0.06 -0.66 0.24 0.00 -0.71 0.00 0.00 52.86 51.67 1uhc s ASN 26 Cb 0.06 -0.84 1.37 0.00 0.41 0.00 0.00 41.25 42.25 1uhc s ASN 26 CO 0.54 -0.26 1.78 -0.81 -1.51 0.00 0.00 177.10 176.85 1uhc n PRO 27 N -1.18 0.66 -0.25 -0.60 -0.04 -1.26 -2.14 135.00 130.20 1uhc n PRO 27 Ca -0.03 0.01 0.09 0.00 -0.04 0.00 0.00 63.50 63.53 1uhc n PRO 27 Cb 0.60 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.73 1uhc n PRO 27 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1uhc n ASN 28 N -1.06 2.27 -4.22 3.54 0.23 -1.26 -5.01 115.26 109.75 1uhc n ASN 28 Ca 0.16 -3.32 -0.24 0.00 -0.53 0.00 0.00 54.58 50.66 1uhc n ASN 28 Cb 0.10 -0.47 -0.14 0.00 -2.08 0.00 0.00 39.78 37.20 1uhc n ASN 28 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 1uhc s GLU 29 N -2.98 1.23 -0.06 -3.83 2.02 -0.91 -1.76 118.70 112.41 1uhc s GLU 29 Ca 0.34 -0.90 0.01 0.00 0.02 0.00 0.00 54.97 54.45 1uhc s GLU 29 Cb 0.31 -1.32 -0.03 0.00 0.10 0.00 0.00 34.13 33.19 1uhc s GLU 29 CO 0.01 0.33 -0.08 -1.17 0.02 0.00 0.00 175.26 174.37 1uhc s LEU 30 N -1.21 3.11 -0.06 1.80 2.96 -1.24 -4.70 118.68 119.33 1uhc s LEU 30 Ca 0.06 -0.06 -0.20 0.00 -0.22 0.00 0.00 54.13 53.72 1uhc s LEU 30 Cb -0.09 -1.68 -0.05 0.00 0.50 0.00 0.00 46.19 44.88 1uhc s LEU 30 CO 0.02 0.35 0.55 -0.44 -1.32 0.00 0.00 176.35 175.51 1uhc s SER 31 N -0.85 6.84 0.23 3.68 0.01 -1.26 -4.22 113.70 118.12 1uhc s SER 31 Ca 0.13 1.00 0.02 0.00 1.31 0.00 0.00 55.95 58.40 1uhc s SER 31 Cb -0.11 -2.33 -0.05 0.00 0.21 0.00 0.00 66.02 63.74 1uhc s SER 31 CO 0.02 0.04 0.05 0.68 0.41 0.00 0.00 173.24 174.43 1uhc s VAL 32 N 0.26 0.68 0.45 3.43 -7.23 -1.08 -4.91 120.40 112.00 1uhc s VAL 32 Ca 0.29 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.53 1uhc s VAL 32 Cb -0.17 -2.41 -0.02 0.00 0.56 0.00 0.00 36.38 34.34 1uhc s VAL 32 CO 0.14 -0.22 0.31 -0.94 -0.31 0.00 0.00 175.10 174.08 1uhc s SER 33 N -3.27 4.71 0.03 4.85 1.04 -1.26 -1.49 113.70 118.31 1uhc s SER 33 Ca 0.31 -1.00 -0.30 0.00 0.48 0.00 0.00 55.95 55.44 1uhc s SER 33 Cb 0.07 -0.29 -0.04 0.00 0.10 0.00 0.00 66.02 65.86 1uhc s SER 33 CO 0.09 -0.73 1.08 0.00 0.98 0.00 0.00 173.24 174.67 1uhc s ALA 34 N -2.60 3.27 0.00 5.32 0.00 -1.24 -2.45 121.76 124.06 1uhc s ALA 34 Ca 0.42 0.68 0.00 0.00 0.00 0.00 0.00 51.96 53.06 1uhc s ALA 34 Cb -0.00 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.73 1uhc s ALA 34 CO 0.24 -0.31 0.00 0.09 0.00 0.00 0.00 175.76 175.78 1uhc n ASN 35 N 3.83 0.00 -4.70 0.00 3.02 0.54 -4.92 115.26 113.02 1uhc n ASN 35 Ca 0.07 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.20 1uhc n ASN 35 Cb 0.49 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.63 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 -0.18 4.27 0.55 3.52 0.74 -1.02 -4.59 119.66 122.95 1uhc s GLN 36 Ca 0.00 2.15 -0.18 0.00 0.05 0.00 0.00 55.36 57.38 1uhc s GLN 36 Cb 0.00 -3.37 -0.05 0.00 1.10 0.00 0.00 33.01 30.68 1uhc s GLN 36 CO 0.00 -0.55 1.08 0.21 -0.55 0.00 0.00 175.29 175.47 1uhc s LYS 37 N 1.69 3.43 -0.22 1.67 2.20 -1.26 0.71 119.74 127.96 1uhc s LYS 37 Ca 0.67 1.39 -0.24 0.00 -0.36 0.00 0.00 55.97 57.44 1uhc s LYS 37 Cb -0.37 -2.04 0.06 0.00 -1.51 0.00 0.00 37.83 33.97 1uhc s LYS 37 CO 0.30 -0.75 0.65 -0.48 -0.36 0.00 0.00 175.35 174.72 1uhc s LEU 38 N -4.00 -0.50 -0.51 5.43 0.05 -0.37 -4.82 118.68 113.96 1uhc s LEU 38 Ca 0.68 1.22 -0.21 0.00 0.05 0.00 0.00 54.13 55.87 1uhc s LEU 38 Cb -0.19 2.27 0.05 0.00 -2.05 0.00 0.00 46.19 46.27 1uhc s LEU 38 CO 0.29 -0.28 0.71 -0.75 -0.55 0.00 0.00 176.35 175.77 1uhc s LYS 39 N 0.12 3.20 -0.86 1.48 2.47 -1.07 -3.92 119.74 121.16 1uhc s LYS 39 Ca -0.02 -0.66 -0.25 0.00 -1.56 0.00 0.00 55.97 53.49 1uhc s LYS 39 Cb -0.04 -4.07 -0.08 0.00 -1.46 0.00 0.00 37.83 32.18 1uhc s LYS 39 CO 0.02 -1.27 2.12 0.42 0.16 0.00 0.00 175.35 176.80 1uhc s ILE 40 N 3.02 3.28 0.02 5.43 -1.09 -1.26 -1.32 121.20 129.28 1uhc s ILE 40 Ca 0.20 -0.23 -0.12 0.00 -2.23 0.00 0.00 60.65 58.27 1uhc s ILE 40 Cb -0.17 -3.64 -0.06 0.00 -1.58 0.00 0.00 42.46 37.02 1uhc s ILE 40 CO 0.15 -0.60 1.18 -0.07 -1.23 0.00 0.00 174.94 174.37 1uhc h LEU 41 N 19.64 -0.42 0.00 2.97 3.38 0.17 -3.46 115.31 137.58 1uhc h LEU 41 Ca 0.06 0.03 -0.59 0.00 0.09 0.00 0.00 57.88 57.47 1uhc h LEU 41 Cb 1.00 0.13 -0.12 0.00 0.09 0.00 0.00 40.66 41.77 1uhc h LEU 41 CO 1.13 -0.24 -0.44 -0.62 0.09 0.00 0.00 178.44 178.37 1uhc n GLU 42 N -3.26 0.78 -1.06 1.13 1.02 -1.18 -4.96 120.64 113.11 1uhc n GLU 42 Ca -0.04 -3.37 -0.01 0.00 -0.02 0.00 0.00 57.16 53.72 1uhc n GLU 42 Cb 0.16 1.17 0.15 0.00 -0.02 0.00 0.00 31.44 32.89 1uhc n GLU 42 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1uhc n PHE 43 N -1.08 0.60 -3.33 -0.32 3.01 -1.26 -2.58 117.46 112.50 1uhc n PHE 43 Ca -0.15 -1.56 0.00 0.00 1.01 0.00 0.00 57.45 56.75 1uhc n PHE 43 Cb 0.59 -0.26 0.00 0.00 -0.01 0.00 0.00 39.48 39.80 1uhc n PHE 43 CO 0.00 0.00 0.00 0.36 1.01 0.00 0.00 176.76 178.13 1uhc n LYS 44 N -0.84 0.00 -2.94 -1.08 -0.00 -0.93 -4.31 118.16 108.06 1uhc n LYS 44 Ca 0.22 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.45 1uhc n LYS 44 Cb 0.80 0.00 -0.02 0.00 -0.00 0.00 0.00 35.03 35.81 1uhc n LYS 44 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1uhc n ASP 45 N -1.66 -0.68 0.00 -5.58 5.68 -1.14 -4.03 116.55 109.14 1uhc n ASP 45 Ca 0.00 -2.06 0.00 0.00 -0.50 0.00 0.00 54.79 52.23 1uhc n ASP 45 Cb 0.00 1.31 0.00 0.00 -1.14 0.00 0.00 41.12 41.29 1uhc n ASP 45 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 1uhc n VAL 46 N -0.32 0.00 -0.31 2.12 0.24 -1.26 0.68 118.33 119.48 1uhc n VAL 46 Ca 0.01 1.06 0.14 0.00 -2.04 0.00 0.00 64.34 63.51 1uhc n VAL 46 Cb 0.32 -1.49 0.27 0.00 -1.47 0.00 0.00 33.84 31.47 1uhc n VAL 46 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 1uhc n THR 47 N -1.83 -0.37 0.00 3.34 5.66 -1.26 -4.76 114.28 115.06 1uhc n THR 47 Ca 0.00 1.94 0.00 0.00 -3.05 0.00 0.00 64.05 62.94 1uhc n THR 47 Cb 0.00 -2.84 0.00 0.00 -1.55 0.00 0.00 70.33 65.94 1uhc n THR 47 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1uhc n GLY 48 N -1.44 1.90 3.13 1.09 0.00 0.21 -5.11 105.19 104.98 1uhc n GLY 48 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.88 1uhc n GLY 48 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1uhc n ASN 49 N 0.00 -2.69 -0.47 1.61 0.23 -1.26 -4.34 115.26 108.34 1uhc n ASN 49 Ca 0.00 -0.07 0.07 0.00 -0.53 0.00 0.00 54.58 54.05 1uhc n ASN 49 Cb 0.00 -0.72 0.19 0.00 -2.08 0.00 0.00 39.78 37.17 1uhc n ASN 49 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1uhc n THR 50 N -3.98 2.09 1.01 5.53 -2.24 -1.26 -2.91 114.28 112.53 1uhc n THR 50 Ca -0.01 -2.96 0.11 0.00 -2.27 0.00 0.00 64.05 58.92 1uhc n THR 50 Cb 0.69 -0.22 0.01 0.00 -2.10 0.00 0.00 70.33 68.71 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 -1.18 0.12 -4.69 -0.78 -0.58 -1.26 -4.87 120.64 107.39 1uhc n GLU 51 Ca 0.18 -0.09 -0.23 0.00 -0.42 0.00 0.00 57.16 56.60 1uhc n GLU 51 Cb 0.68 -1.50 -0.15 0.00 -0.57 0.00 0.00 31.44 29.90 1uhc n GLU 51 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1uhc s TRP 52 N -2.95 1.35 0.02 -0.32 0.52 -1.26 -2.10 118.94 114.21 1uhc s TRP 52 Ca 0.10 -0.27 0.07 0.00 0.02 0.00 0.00 56.10 56.02 1uhc s TRP 52 Cb 0.17 -0.88 -0.03 0.00 -1.15 0.00 0.00 33.47 31.58 1uhc s TRP 52 CO 0.79 -0.04 -0.19 -1.58 0.02 0.00 0.00 176.95 175.95 1uhc s TRP 53 N -0.29 2.53 -0.74 -1.98 0.51 0.34 -2.18 118.94 117.13 1uhc s TRP 53 Ca 0.05 -0.27 -0.20 0.00 -2.12 0.00 0.00 56.10 53.55 1uhc s TRP 53 Cb -0.06 -1.48 0.10 0.00 -0.81 0.00 0.00 33.47 31.22 1uhc s TRP 53 CO -0.00 0.21 0.96 -1.17 -0.51 0.00 0.00 176.95 176.43 1uhc s LEU 54 N -1.25 4.89 -0.08 2.99 2.96 -1.06 -0.11 118.68 127.02 1uhc s LEU 54 Ca 0.13 -1.50 -0.10 0.00 -0.22 0.00 0.00 54.13 52.45 1uhc s LEU 54 Cb -0.10 -2.38 -0.05 0.00 0.50 0.00 0.00 46.19 44.16 1uhc s LEU 54 CO 0.04 -1.22 0.23 0.00 -1.32 0.00 0.00 176.35 174.08 1uhc s ALA 55 N 3.19 3.81 -0.22 5.97 0.00 -1.14 0.19 121.76 133.57 1uhc s ALA 55 Ca 0.23 -0.50 0.02 0.00 0.00 0.00 0.00 51.96 51.71 1uhc s ALA 55 Cb -0.14 -2.12 0.04 0.00 0.00 0.00 0.00 23.12 20.90 1uhc s ALA 55 CO 0.02 0.55 -0.16 -2.00 0.00 0.00 0.00 175.76 174.18 1uhc s GLU 56 N -0.98 2.61 0.00 0.00 2.12 -0.43 -3.21 118.70 118.81 1uhc s GLU 56 Ca 0.18 -1.06 0.00 0.00 0.36 0.00 0.00 54.97 54.44 1uhc s GLU 56 Cb -0.13 -2.71 0.00 0.00 0.26 0.00 0.00 34.13 31.55 1uhc s GLU 56 CO 0.07 -0.38 0.00 0.28 -0.54 0.00 0.00 175.26 174.69 1uhc n VAL 57 N 4.54 0.00 -2.67 3.70 0.31 -1.13 -2.59 118.33 120.48 1uhc n VAL 57 Ca -0.18 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 63.76 1uhc n VAL 57 Cb 0.46 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 33.41 1uhc n VAL 57 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1uhc n ASN 58 N 0.00 7.07 0.00 4.52 3.02 -1.26 -4.72 115.26 123.89 1uhc n ASN 58 Ca 0.00 -3.69 0.00 0.00 -0.03 0.00 0.00 54.58 50.86 1uhc n ASN 58 Cb 0.00 -1.11 0.00 0.00 -0.61 0.00 0.00 39.78 38.06 1uhc n ASN 58 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uhc n GLY 59 N -0.06 2.67 3.60 7.41 0.00 -1.26 -4.97 105.19 112.57 1uhc n GLY 59 Ca 0.45 -0.03 -0.43 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00 3.39 -0.13 1.61 -0.14 -1.26 -4.97 119.74 118.24 1uhc s LYS 60 Ca 0.00 1.46 -0.06 0.00 -1.36 0.00 0.00 55.97 56.01 1uhc s LYS 60 Cb 0.00 -4.18 -0.04 0.00 -1.68 0.00 0.00 37.83 31.93 1uhc s LYS 60 CO 0.00 -1.79 0.09 0.15 -0.76 0.00 0.00 175.35 173.05 1uhc s LYS 61 N 5.54 3.54 -0.04 1.68 1.02 -1.26 -2.85 119.74 127.37 1uhc s LYS 61 Ca 0.79 -0.24 -0.29 0.00 0.02 0.00 0.00 55.97 56.25 1uhc s LYS 61 Cb -0.23 -3.14 0.10 0.00 -0.52 0.00 0.00 37.83 34.04 1uhc s LYS 61 CO 0.34 0.61 0.84 0.20 -0.92 0.00 0.00 175.35 176.41 1uhc s GLY 62 N -0.56 -0.45 -0.05 -3.33 0.00 -1.20 -4.74 107.32 96.99 1uhc s GLY 62 Ca 0.12 1.32 -0.30 0.00 0.00 0.00 0.00 44.72 45.86 1uhc s GLY 62 CO 0.02 0.67 1.01 -0.19 0.00 0.00 0.00 173.10 174.61 1uhc s TYR 63 N -2.15 3.56 0.29 1.90 2.02 -0.72 -2.87 117.35 119.38 1uhc s TYR 63 Ca -0.01 1.62 0.08 0.00 -0.37 0.00 0.00 57.07 58.39 1uhc s TYR 63 Cb -0.01 -3.17 -0.06 0.00 -0.40 0.00 0.00 41.96 38.32 1uhc s TYR 63 CO -0.02 -0.20 -0.10 0.08 -1.57 0.00 0.00 175.55 173.74 1uhc s VAL 64 N 1.55 1.92 0.36 0.71 1.01 0.85 -3.62 120.40 123.17 1uhc s VAL 64 Ca 0.51 -2.19 -0.26 0.00 0.00 0.00 0.00 61.98 60.04 1uhc s VAL 64 Cb -0.20 -2.43 -0.09 0.00 0.00 0.00 0.00 36.38 33.66 1uhc s VAL 64 CO 0.23 -0.32 1.06 -2.16 0.00 0.00 0.00 175.10 173.91 1uhc s PRO 65 N -3.66 4.31 0.00 2.72 0.04 -1.26 0.13 135.00 137.28 1uhc s PRO 65 Ca 0.29 1.60 0.30 0.00 0.04 0.00 0.00 61.00 63.24 1uhc s PRO 65 Cb 0.02 -2.74 1.59 0.00 0.04 0.00 0.00 34.50 33.40 1uhc s PRO 65 CO 0.13 -0.03 2.06 -1.13 0.04 0.00 0.00 177.00 178.07 1uhc n SER 66 N 0.32 0.24 0.08 6.66 3.41 -0.89 -2.82 113.62 120.61 1uhc n SER 66 Ca 0.03 -0.74 0.10 0.00 -0.26 0.00 0.00 58.87 58.00 1uhc n SER 66 Cb 0.48 -0.09 -0.04 0.00 -0.26 0.00 0.00 64.21 64.30 1uhc n SER 66 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1uhc n ASN 67 N -0.96 0.70 -2.03 4.04 5.15 -1.26 -3.85 115.26 117.05 1uhc n ASN 67 Ca 0.19 0.27 -0.04 0.00 -0.60 0.00 0.00 54.58 54.40 1uhc n ASN 67 Cb 0.20 0.69 0.32 0.00 -0.53 0.00 0.00 39.78 40.46 1uhc n ASN 67 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 1uhc n TYR 68 N -2.63 2.46 -4.16 1.20 4.02 -1.13 -4.89 117.16 112.04 1uhc n TYR 68 Ca -0.02 -1.14 -0.23 0.00 -0.01 0.00 0.00 57.90 56.50 1uhc n TYR 68 Cb 0.59 -0.68 -0.05 0.00 -0.02 0.00 0.00 39.34 39.18 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 -2.97 4.19 0.06 -0.72 -1.09 -1.25 -0.97 121.20 118.45 1uhc s ILE 69 Ca 0.56 -1.48 -0.07 0.00 -2.23 0.00 0.00 60.65 57.43 1uhc s ILE 69 Cb 0.44 -3.23 -0.01 0.00 -1.58 0.00 0.00 42.46 38.08 1uhc s ILE 69 CO 0.14 -0.31 0.15 -0.13 -1.23 0.00 0.00 174.94 173.56 1uhc s ARG 70 N -3.65 0.71 -0.21 2.79 1.81 -0.33 -4.58 118.95 115.49 1uhc s ARG 70 Ca 0.32 -0.81 -0.07 0.00 -1.72 0.00 0.00 55.73 53.44 1uhc s ARG 70 Cb -0.08 0.28 -0.03 0.00 -0.45 0.00 0.00 34.95 34.67 1uhc s ARG 70 CO 0.23 -0.20 0.06 0.21 -0.68 0.00 0.00 175.30 174.92 1uhc s LYS 71 N -3.09 3.80 0.37 3.54 2.20 -1.26 -2.43 119.74 122.87 1uhc s LYS 71 Ca -0.01 -0.42 0.07 0.00 -0.36 0.00 0.00 55.97 55.26 1uhc s LYS 71 Cb 0.02 -3.25 -0.02 0.00 -1.51 0.00 0.00 37.83 33.06 1uhc s LYS 71 CO -0.07 0.05 0.38 0.99 -0.36 0.00 0.00 175.35 176.34 1uhc s THR 72 N 0.98 3.26 0.30 3.43 2.01 0.89 -4.96 115.64 121.55 1uhc s THR 72 Ca 0.04 -1.26 0.09 0.00 0.31 0.00 0.00 61.69 60.86 1uhc s THR 72 Cb -0.14 -3.13 -0.04 0.00 0.01 0.00 0.00 72.50 69.19 1uhc s THR 72 CO 0.03 -0.09 0.05 -1.83 -0.69 0.00 0.00 174.62 172.08 1uhc s GLU 73 N -4.11 2.31 0.26 4.92 -1.05 -1.26 -4.54 118.70 115.23 1uhc s GLU 73 Ca 0.46 -1.48 0.07 0.00 -0.15 0.00 0.00 54.97 53.86 1uhc s GLU 73 Cb -0.06 -2.15 -0.03 0.00 -0.44 0.00 0.00 34.13 31.45 1uhc s GLU 73 CO 0.28 0.26 0.25 -1.54 0.95 0.00 0.00 175.26 175.46 1uhc s SER 74 N -3.74 5.70 0.00 0.83 1.04 -1.26 -5.02 113.70 111.25 1uhc s SER 74 Ca 0.34 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.57 1uhc s SER 74 Cb -0.04 -1.47 0.00 0.00 0.10 0.00 0.00 66.02 64.60 1uhc s SER 74 CO 0.21 -0.08 0.00 0.61 0.98 0.00 0.00 173.24 174.96 1uhc n GLY 75 N -1.25 5.49 3.59 7.32 0.00 -1.26 -5.09 105.19 113.98 1uhc n GLY 75 Ca -0.08 -1.38 -0.42 0.00 0.00 0.00 0.00 46.02 44.14 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 1.48 3.45 0.07 1.61 0.04 -1.26 -4.99 135.00 135.40 1uhc s PRO 76 Ca 0.00 0.79 0.07 0.00 0.04 0.00 0.00 61.00 61.90 1uhc s PRO 76 Cb 0.00 -4.08 -0.03 0.00 0.04 0.00 0.00 34.50 30.44 1uhc s PRO 76 CO 0.00 -1.74 -0.18 -1.12 0.04 0.00 0.00 177.00 174.00 1uhc s SER 77 N 4.32 2.17 -0.17 6.66 0.01 -1.26 -5.12 113.70 120.31 1uhc s SER 77 Ca 0.59 -0.59 -0.19 0.00 1.31 0.00 0.00 55.95 57.07 1uhc s SER 77 Cb -0.13 -0.13 -0.03 0.00 0.21 0.00 0.00 66.02 65.94 1uhc s SER 77 CO 0.30 0.05 0.53 -0.94 0.41 0.00 0.00 173.24 173.58 1uhc s SER 78 N -1.56 6.63 0.00 2.44 1.04 -1.26 -5.30 113.70 115.68 1uhc s SER 78 Ca 0.04 0.76 0.00 0.00 0.48 0.00 0.00 55.95 57.23 1uhc s SER 78 Cb -0.09 -2.30 0.00 0.00 0.10 0.00 0.00 66.02 63.72 1uhc s SER 78 CO 0.03 -0.13 0.00 0.61 0.98 0.00 0.00 173.24 174.72