#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 6.72 -0.20 1.61 0.15 -1.26 -5.08 113.70 115.64 1uhc s SER 2 Ca 0.00 0.86 -0.19 0.00 0.70 0.00 0.00 55.95 57.32 1uhc s SER 2 Cb 0.00 -2.21 0.05 0.00 -1.71 0.00 0.00 66.02 62.15 1uhc s SER 2 CO 0.00 0.34 0.54 -0.44 1.20 0.00 0.00 173.24 174.88 1uhc s SER 3 N -1.07 -0.57 0.00 5.45 0.01 -1.26 -5.14 113.70 111.12 1uhc s SER 3 Ca 0.22 1.09 0.00 0.00 1.31 0.00 0.00 55.95 58.57 1uhc s SER 3 Cb -0.16 1.10 0.00 0.00 0.21 0.00 0.00 66.02 67.18 1uhc s SER 3 CO 0.11 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.19 1uhc n GLY 4 N 2.80 -2.35 2.50 3.44 0.00 -1.26 -4.98 105.19 105.34 1uhc n GLY 4 Ca -0.14 -0.06 -0.03 0.00 0.00 0.00 0.00 46.02 45.79 1uhc n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1uhc n SER 5 N 0.00 -4.59 -4.80 1.61 7.64 -1.26 -4.96 113.62 107.27 1uhc n SER 5 Ca 0.00 1.53 -0.31 0.00 1.01 0.00 0.00 58.87 61.11 1uhc n SER 5 Cb 0.00 -4.82 0.08 0.00 -1.01 0.00 0.00 64.21 58.45 1uhc n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1uhc s SER 6 N -0.56 4.77 0.00 6.43 0.15 -1.26 -4.95 113.70 118.28 1uhc s SER 6 Ca -0.14 1.55 0.00 0.00 0.70 0.00 0.00 55.95 58.06 1uhc s SER 6 Cb 0.01 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 61.99 1uhc s SER 6 CO 0.37 -1.82 0.00 0.61 1.20 0.00 0.00 173.24 173.60 1uhc n GLY 7 N -1.80 -0.34 3.95 9.45 0.00 -1.26 -5.14 105.19 110.05 1uhc n GLY 7 Ca 0.08 -0.53 -0.23 0.00 0.00 0.00 0.00 46.02 45.33 1uhc n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uhc s SER 8 N -4.00 5.52 -1.11 1.61 1.04 -1.26 -4.97 113.70 110.53 1uhc s SER 8 Ca 0.00 0.30 -0.22 0.00 0.48 0.00 0.00 55.95 56.51 1uhc s SER 8 Cb 0.00 -1.34 -0.01 0.00 0.10 0.00 0.00 66.02 64.78 1uhc s SER 8 CO 0.00 -0.99 1.78 -1.61 0.98 0.00 0.00 173.24 173.40 1uhc s GLU 9 N -4.77 3.13 0.52 4.02 2.02 -1.26 -4.74 118.70 117.61 1uhc s GLU 9 Ca 0.53 -1.16 0.00 0.00 0.02 0.00 0.00 54.97 54.36 1uhc s GLU 9 Cb -0.10 -5.30 0.00 0.00 0.10 0.00 0.00 34.13 28.83 1uhc s GLU 9 CO 0.40 -3.02 0.00 0.00 0.02 0.00 0.00 175.26 172.67 1uhc n ALA 10 N 11.57 -1.92 -3.57 5.21 0.00 -1.26 -5.08 120.51 125.46 1uhc n ALA 10 Ca 0.42 0.46 -0.07 0.00 0.00 0.00 0.00 53.44 54.26 1uhc n ALA 10 Cb 0.47 -1.35 -0.03 0.00 0.00 0.00 0.00 19.45 18.55 1uhc n ALA 10 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1uhc s GLU 11 N -5.13 0.48 -0.33 0.00 -1.05 -1.26 -5.12 118.70 106.29 1uhc s GLU 11 Ca 0.00 -0.09 -0.43 0.00 -0.15 0.00 0.00 54.97 54.30 1uhc s GLU 11 Cb 0.00 0.22 -0.18 0.00 -0.44 0.00 0.00 34.13 33.73 1uhc s GLU 11 CO 0.00 -0.19 1.56 0.41 0.95 0.00 0.00 175.26 177.99 1uhc n GLY 12 N 0.12 0.36 2.62 -3.83 0.00 -1.26 -4.92 105.19 98.29 1uhc n GLY 12 Ca -0.04 0.93 -0.29 0.00 0.00 0.00 0.00 46.02 46.62 1uhc n GLY 12 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1uhc s ASN 13 N 2.64 3.61 0.45 1.61 3.84 -1.26 -5.12 114.94 120.70 1uhc s ASN 13 Ca 1.00 -1.86 -0.23 0.00 0.21 0.00 0.00 52.86 51.98 1uhc s ASN 13 Cb -1.30 -0.67 -0.08 0.00 -0.55 0.00 0.00 41.25 38.65 1uhc s ASN 13 CO 0.72 -0.37 1.11 -1.10 -2.79 0.00 0.00 177.10 174.67 1uhc s GLN 14 N 1.37 3.87 -0.24 0.43 -0.21 -1.26 -5.04 119.66 118.58 1uhc s GLN 14 Ca 0.13 1.64 -0.04 0.00 0.02 0.00 0.00 55.36 57.10 1uhc s GLN 14 Cb -0.20 -2.39 0.13 0.00 1.00 0.00 0.00 33.01 31.55 1uhc s GLN 14 CO -0.17 -0.43 0.44 0.08 -2.12 0.00 0.00 175.29 173.09 1uhc s VAL 15 N -1.64 -0.71 0.05 1.09 1.01 -1.26 -4.96 120.40 113.99 1uhc s VAL 15 Ca 0.63 0.02 0.04 0.00 0.00 0.00 0.00 61.98 62.66 1uhc s VAL 15 Cb -0.25 -0.81 -0.02 0.00 0.00 0.00 0.00 36.38 35.30 1uhc s VAL 15 CO 0.30 -0.04 -0.11 -0.31 0.00 0.00 0.00 175.10 174.94 1uhc s TYR 16 N 2.64 0.98 0.08 5.22 1.51 -1.26 -2.75 117.35 123.76 1uhc s TYR 16 Ca 0.08 -0.43 0.06 0.00 -1.01 0.00 0.00 57.07 55.78 1uhc s TYR 16 Cb -0.14 -0.57 -0.03 0.00 -0.11 0.00 0.00 41.96 41.11 1uhc s TYR 16 CO -0.16 -0.00 -0.17 -0.59 -1.11 0.00 0.00 175.55 173.52 1uhc s PHE 17 N -1.16 1.45 0.21 2.71 -0.12 -0.89 -1.56 117.98 118.62 1uhc s PHE 17 Ca -0.04 -0.43 -0.31 0.00 -0.05 0.00 0.00 56.93 56.09 1uhc s PHE 17 Cb -0.09 -0.81 -0.11 0.00 -0.63 0.00 0.00 43.02 41.38 1uhc s PHE 17 CO 0.01 0.11 1.64 0.00 -0.05 0.00 0.00 175.22 176.93 1uhc s ALA 18 N -1.19 3.84 0.12 1.99 0.00 -0.33 -1.45 121.76 124.74 1uhc s ALA 18 Ca 0.02 1.50 -0.16 0.00 0.00 0.00 0.00 51.96 53.31 1uhc s ALA 18 Cb -0.10 -3.66 -0.02 0.00 0.00 0.00 0.00 23.12 19.34 1uhc s ALA 18 CO 0.03 -0.87 1.62 0.28 0.00 0.00 0.00 175.76 176.82 1uhc h VAL 19 N 3.81 1.23 -3.56 0.00 2.07 -1.65 1.55 116.25 119.70 1uhc h VAL 19 Ca -0.44 -0.78 -0.32 0.00 0.82 0.00 0.00 66.70 65.98 1uhc h VAL 19 Cb 1.21 1.02 -0.15 0.00 -1.52 0.00 0.00 31.29 31.85 1uhc h VAL 19 CO 0.91 0.27 -0.67 -0.31 0.02 0.00 0.00 177.57 177.79 1uhc s TYR 20 N -5.28 1.33 -0.39 1.57 2.02 -1.26 -3.95 117.35 111.39 1uhc s TYR 20 Ca -0.13 -0.95 -0.28 0.00 -0.37 0.00 0.00 57.07 55.34 1uhc s TYR 20 Cb 0.10 -0.75 -0.03 0.00 -0.40 0.00 0.00 41.96 40.87 1uhc s TYR 20 CO 0.76 -0.11 1.96 0.99 -1.57 0.00 0.00 175.55 177.59 1uhc s THR 21 N -3.53 3.31 0.07 -0.71 2.01 -1.26 -3.97 115.64 111.56 1uhc s THR 21 Ca 0.24 0.28 0.00 0.00 0.31 0.00 0.00 61.69 62.53 1uhc s THR 21 Cb 0.05 -3.51 -0.04 0.00 0.01 0.00 0.00 72.50 69.01 1uhc s THR 21 CO 0.05 -0.39 0.22 0.12 -0.69 0.00 0.00 174.62 173.92 1uhc s PHE 22 N 8.30 3.51 0.04 4.92 5.36 -0.83 -4.85 117.98 134.43 1uhc s PHE 22 Ca 0.83 0.23 0.07 0.00 -0.96 0.00 0.00 56.93 57.10 1uhc s PHE 22 Cb -0.21 -1.75 -0.02 0.00 -0.34 0.00 0.00 43.02 40.70 1uhc s PHE 22 CO 0.30 0.58 -0.20 0.21 -1.46 0.00 0.00 175.22 174.66 1uhc s LYS 23 N -2.59 1.35 0.98 10.12 2.47 -1.26 -1.76 119.74 129.04 1uhc s LYS 23 Ca 0.35 -0.89 -0.14 0.00 -1.56 0.00 0.00 55.97 53.74 1uhc s LYS 23 Cb -0.13 -1.43 0.18 0.00 -1.46 0.00 0.00 37.83 34.99 1uhc s LYS 23 CO 0.28 0.37 1.14 0.00 0.16 0.00 0.00 175.35 177.30 1uhc s ALA 24 N -0.77 1.49 0.00 3.13 0.00 -1.25 -4.87 121.76 119.49 1uhc s ALA 24 Ca 0.07 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 51.40 1uhc s ALA 24 Cb -0.08 -3.00 0.00 0.00 0.00 0.00 0.00 23.12 20.03 1uhc s ALA 24 CO 0.01 -2.59 0.00 0.54 0.00 0.00 0.00 175.76 173.72 1uhc n ARG 25 N -3.99 0.00 -3.48 0.00 3.00 -1.26 -5.00 116.66 105.93 1uhc n ARG 25 Ca 0.08 0.00 -0.19 0.00 -0.01 0.00 0.00 57.85 57.73 1uhc n ARG 25 Cb 0.59 0.00 -0.00 0.00 0.00 0.00 0.00 32.46 33.05 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 -0.92 5.99 0.00 0.55 -0.87 -1.26 -4.97 114.94 113.45 1uhc s ASN 26 Ca 0.00 -0.15 0.11 0.00 -1.57 0.00 0.00 52.86 51.25 1uhc s ASN 26 Cb 0.00 -1.29 0.66 0.00 -0.02 0.00 0.00 41.25 40.60 1uhc s ASN 26 CO 0.00 -0.42 1.23 -0.81 -2.57 0.00 0.00 177.10 174.53 1uhc n PRO 27 N -1.64 0.75 -1.81 -0.60 -0.04 -1.26 -2.45 135.00 127.95 1uhc n PRO 27 Ca -0.01 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.43 1uhc n PRO 27 Cb 0.58 -1.23 0.07 0.00 -0.04 0.00 0.00 33.50 32.88 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 -0.73 2.11 -4.25 3.54 3.02 -1.26 -5.06 115.26 112.63 1uhc n ASN 28 Ca 0.08 -2.76 -0.14 0.00 -0.03 0.00 0.00 54.58 51.73 1uhc n ASN 28 Cb 0.04 -0.41 -0.10 0.00 -0.61 0.00 0.00 39.78 38.70 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 -2.51 1.05 0.08 3.52 2.02 -1.03 -1.83 118.70 120.00 1uhc s GLU 29 Ca 0.36 -1.43 0.07 0.00 0.02 0.00 0.00 54.97 54.00 1uhc s GLU 29 Cb 0.37 -0.63 -0.03 0.00 0.10 0.00 0.00 34.13 33.93 1uhc s GLU 29 CO -0.07 0.08 -0.19 -1.17 0.02 0.00 0.00 175.26 173.93 1uhc s LEU 30 N -3.10 2.26 -0.25 1.80 2.96 -1.24 -4.63 118.68 116.49 1uhc s LEU 30 Ca 0.16 -0.63 -0.13 0.00 -0.22 0.00 0.00 54.13 53.31 1uhc s LEU 30 Cb 0.02 -0.81 -0.04 0.00 0.50 0.00 0.00 46.19 45.85 1uhc s LEU 30 CO 0.01 0.05 0.29 -0.94 -1.32 0.00 0.00 176.35 174.44 1uhc s SER 31 N -1.69 6.22 0.37 3.68 1.04 -1.26 -3.96 113.70 118.09 1uhc s SER 31 Ca 0.05 0.24 0.03 0.00 0.48 0.00 0.00 55.95 56.75 1uhc s SER 31 Cb -0.10 -2.17 -0.04 0.00 0.10 0.00 0.00 66.02 63.81 1uhc s SER 31 CO 0.03 -0.08 0.10 0.68 0.98 0.00 0.00 173.24 174.95 1uhc s VAL 32 N 1.60 0.84 0.53 5.02 -7.23 -0.72 -4.95 120.40 115.50 1uhc s VAL 32 Ca 0.13 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.33 1uhc s VAL 32 Cb -0.15 -2.52 0.02 0.00 0.56 0.00 0.00 36.38 34.28 1uhc s VAL 32 CO 0.08 0.00 0.22 -0.94 -0.31 0.00 0.00 175.10 174.16 1uhc s SER 33 N -3.55 4.41 0.17 4.85 1.04 -1.26 -1.96 113.70 117.40 1uhc s SER 33 Ca 0.29 -1.44 -0.30 0.00 0.48 0.00 0.00 55.95 54.97 1uhc s SER 33 Cb 0.05 0.50 -0.07 0.00 0.10 0.00 0.00 66.02 66.60 1uhc s SER 33 CO 0.14 -1.01 1.01 0.00 0.98 0.00 0.00 173.24 174.37 1uhc s ALA 34 N -2.83 3.32 -1.57 5.32 0.00 -1.25 -2.81 121.76 121.94 1uhc s ALA 34 Ca 0.20 0.69 0.00 0.00 0.00 0.00 0.00 51.96 52.85 1uhc s ALA 34 Cb -0.01 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.82 1uhc s ALA 34 CO 0.12 -0.05 0.00 0.09 0.00 0.00 0.00 175.76 175.93 1uhc n ASN 35 N 2.28 -5.57 -4.63 0.00 3.02 0.53 -4.86 115.26 106.02 1uhc n ASN 35 Ca 0.01 0.37 -0.41 0.00 -0.03 0.00 0.00 54.58 54.51 1uhc n ASN 35 Cb 0.47 -4.37 -0.05 0.00 -0.61 0.00 0.00 39.78 35.22 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 -3.23 4.09 0.63 3.52 2.00 -1.12 -4.74 119.66 120.81 1uhc s GLN 36 Ca 0.00 0.72 -0.19 0.00 -2.00 0.00 0.00 55.36 53.90 1uhc s GLN 36 Cb 0.00 -3.67 -0.02 0.00 0.80 0.00 0.00 33.01 30.12 1uhc s GLN 36 CO 0.00 -0.54 1.30 0.21 -0.50 0.00 0.00 175.29 175.76 1uhc s LYS 37 N 2.79 2.64 -0.17 1.67 2.20 -1.26 -1.19 119.74 126.42 1uhc s LYS 37 Ca 0.32 2.08 -0.12 0.00 -0.36 0.00 0.00 55.97 57.89 1uhc s LYS 37 Cb -0.15 -1.90 0.05 0.00 -1.51 0.00 0.00 37.83 34.33 1uhc s LYS 37 CO 0.09 -1.53 0.43 -0.48 -0.36 0.00 0.00 175.35 173.51 1uhc s LEU 38 N -4.25 -0.00 -0.52 5.43 0.05 -0.60 -4.86 118.68 113.93 1uhc s LEU 38 Ca 0.81 0.92 -0.28 0.00 0.05 0.00 0.00 54.13 55.63 1uhc s LEU 38 Cb -0.38 1.46 0.03 0.00 -2.05 0.00 0.00 46.19 45.25 1uhc s LEU 38 CO 0.40 -0.18 1.14 -0.75 -0.55 0.00 0.00 176.35 176.41 1uhc s LYS 39 N 1.03 3.62 -0.08 1.48 2.47 -1.24 -4.24 119.74 122.78 1uhc s LYS 39 Ca -0.06 0.40 -0.30 0.00 -1.56 0.00 0.00 55.97 54.45 1uhc s LYS 39 Cb -0.06 -3.95 -0.05 0.00 -1.46 0.00 0.00 37.83 32.30 1uhc s LYS 39 CO -0.09 -1.49 1.70 0.42 0.16 0.00 0.00 175.35 176.06 1uhc s ILE 40 N 4.59 3.52 -0.04 5.43 -1.09 -1.25 -1.70 121.20 130.66 1uhc s ILE 40 Ca 0.45 0.62 0.11 0.00 -2.23 0.00 0.00 60.65 59.60 1uhc s ILE 40 Cb -0.07 -3.43 -0.23 0.00 -1.58 0.00 0.00 42.46 37.14 1uhc s ILE 40 CO 0.29 -0.09 0.68 -0.07 -1.23 0.00 0.00 174.94 174.52 1uhc h LEU 41 N 10.69 0.03 -7.92 2.97 3.38 0.21 -3.48 115.31 121.19 1uhc h LEU 41 Ca -0.40 -0.06 0.09 0.00 0.09 0.00 0.00 57.88 57.60 1uhc h LEU 41 Cb 1.18 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.87 1uhc h LEU 41 CO 0.96 1.06 0.31 -1.61 0.09 0.00 0.00 178.44 179.25 1uhc s GLU 42 N -2.60 1.69 -0.01 1.13 2.02 -1.20 -4.92 118.70 114.80 1uhc s GLU 42 Ca -0.05 -0.96 0.04 0.00 0.02 0.00 0.00 54.97 54.02 1uhc s GLU 42 Cb 0.08 0.55 0.10 0.00 0.10 0.00 0.00 34.13 34.97 1uhc s GLU 42 CO 0.82 -0.78 1.08 1.19 0.02 0.00 0.00 175.26 177.59 1uhc n PHE 43 N -0.48 0.12 -3.65 1.61 3.72 -1.26 -0.71 117.46 116.81 1uhc n PHE 43 Ca -0.05 -0.55 -0.10 0.00 -0.05 0.00 0.00 57.45 56.70 1uhc n PHE 43 Cb 0.60 -0.06 -0.08 0.00 -0.94 0.00 0.00 39.48 39.00 1uhc n PHE 43 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 176.76 175.12 1uhc s LYS 44 N -1.20 0.69 1.11 -1.08 -2.85 -1.17 -4.37 119.74 110.88 1uhc s LYS 44 Ca 0.09 1.05 -0.16 0.00 -1.00 0.00 0.00 55.97 55.94 1uhc s LYS 44 Cb 0.06 0.21 0.24 0.00 -2.06 0.00 0.00 37.83 36.28 1uhc s LYS 44 CO 0.04 -0.13 1.10 0.16 0.10 0.00 0.00 175.35 176.62 1uhc s ASP 45 N 1.09 1.70 0.16 0.03 1.47 -0.66 -4.77 116.67 115.68 1uhc s ASP 45 Ca -0.06 0.89 -0.28 0.00 1.18 0.00 0.00 52.55 54.28 1uhc s ASP 45 Cb -0.05 -1.34 -0.01 0.00 -0.34 0.00 0.00 42.92 41.18 1uhc s ASP 45 CO -0.11 -3.67 1.56 -0.37 0.68 0.00 0.00 175.17 173.27 1uhc h VAL 46 N -2.27 0.07 -1.27 2.11 -1.51 -1.97 0.64 116.25 112.06 1uhc h VAL 46 Ca -0.50 0.00 0.44 0.00 -1.23 0.00 0.00 66.70 65.41 1uhc h VAL 46 Cb 1.31 0.07 -0.13 0.00 -2.13 0.00 0.00 31.29 30.42 1uhc h VAL 46 CO 0.46 0.00 0.82 0.35 -1.23 0.00 0.00 177.57 177.96 1uhc n THR 47 N -5.40 -0.23 0.00 7.19 -2.24 -1.26 -4.70 114.28 107.65 1uhc n THR 47 Ca -0.00 1.64 0.00 0.00 -2.27 0.00 0.00 64.05 63.41 1uhc n THR 47 Cb 0.35 -2.68 0.00 0.00 -2.10 0.00 0.00 70.33 65.89 1uhc n THR 47 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uhc n GLY 48 N -1.48 0.79 3.77 3.38 0.00 0.23 -5.08 105.19 106.80 1uhc n GLY 48 Ca 0.37 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.91 6.53 -0.56 1.61 3.84 -1.25 -4.69 114.94 118.51 1uhc s ASN 49 Ca 0.00 2.89 0.01 0.00 0.21 0.00 0.00 52.86 55.97 1uhc s ASN 49 Cb 0.00 -2.66 0.53 0.00 -0.55 0.00 0.00 41.25 38.57 1uhc s ASN 49 CO 0.00 -0.72 1.94 0.35 -2.79 0.00 0.00 177.10 175.87 1uhc n THR 50 N 0.64 3.40 -0.05 -5.21 -2.24 -1.26 -1.66 114.28 107.90 1uhc n THR 50 Ca 0.01 -2.63 0.02 0.00 -2.27 0.00 0.00 64.05 59.17 1uhc n THR 50 Cb 0.40 -0.88 -0.16 0.00 -2.10 0.00 0.00 70.33 67.59 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 -1.00 0.67 -4.80 -0.78 -0.58 -1.26 -4.91 120.64 107.98 1uhc n GLU 51 Ca 0.60 -0.11 -0.30 0.00 -0.42 0.00 0.00 57.16 56.93 1uhc n GLU 51 Cb 1.04 -1.53 -0.14 0.00 -0.57 0.00 0.00 31.44 30.24 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 -3.07 2.43 0.06 -0.32 0.52 -1.26 -1.82 118.94 115.48 1uhc s TRP 52 Ca -0.09 -0.34 0.08 0.00 0.02 0.00 0.00 56.10 55.77 1uhc s TRP 52 Cb 0.10 -1.43 -0.03 0.00 -1.15 0.00 0.00 33.47 30.97 1uhc s TRP 52 CO 0.87 0.18 -0.19 -1.58 0.02 0.00 0.00 176.95 176.25 1uhc s TRP 53 N -0.85 2.52 -0.13 -1.98 0.52 0.32 -3.04 118.94 116.31 1uhc s TRP 53 Ca 0.13 -0.28 -0.23 0.00 0.02 0.00 0.00 56.10 55.74 1uhc s TRP 53 Cb -0.10 -1.43 -0.03 0.00 -1.15 0.00 0.00 33.47 30.76 1uhc s TRP 53 CO 0.03 0.27 0.73 -1.17 0.02 0.00 0.00 176.95 176.83 1uhc s LEU 54 N -1.58 4.23 0.01 2.99 0.20 0.11 0.20 118.68 124.85 1uhc s LEU 54 Ca 0.15 1.11 0.04 0.00 0.69 0.00 0.00 54.13 56.12 1uhc s LEU 54 Cb -0.10 -3.09 -0.01 0.00 -0.43 0.00 0.00 46.19 42.55 1uhc s LEU 54 CO 0.06 -0.24 -0.12 0.00 -0.29 0.00 0.00 176.35 175.75 1uhc s ALA 55 N 1.47 1.02 -0.29 5.97 0.00 0.89 0.21 121.76 131.04 1uhc s ALA 55 Ca 0.36 -0.63 0.01 0.00 0.00 0.00 0.00 51.96 51.70 1uhc s ALA 55 Cb -0.17 -0.21 0.09 0.00 0.00 0.00 0.00 23.12 22.83 1uhc s ALA 55 CO 0.15 0.22 0.04 -2.00 0.00 0.00 0.00 175.76 174.17 1uhc s GLU 56 N -0.63 1.14 0.00 0.00 2.12 -0.69 -1.28 118.70 119.36 1uhc s GLU 56 Ca 0.03 -1.21 0.00 0.00 0.36 0.00 0.00 54.97 54.15 1uhc s GLU 56 Cb -0.06 -2.46 0.00 0.00 0.26 0.00 0.00 34.13 31.87 1uhc s GLU 56 CO 0.00 -0.85 0.00 0.28 -0.54 0.00 0.00 175.26 174.15 1uhc n VAL 57 N 4.66 0.00 -1.21 3.70 0.31 -1.15 -3.69 118.33 120.96 1uhc n VAL 57 Ca -0.04 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.10 1uhc n VAL 57 Cb 0.43 -0.08 -0.12 0.00 -0.91 0.00 0.00 33.84 33.16 1uhc n VAL 57 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1uhc n ASN 58 N 0.00 5.91 0.00 4.52 2.85 -1.26 -4.57 115.26 122.71 1uhc n ASN 58 Ca 0.00 -2.74 0.00 0.00 -0.11 0.00 0.00 54.58 51.73 1uhc n ASN 58 Cb 0.00 -1.36 0.00 0.00 1.24 0.00 0.00 39.78 39.66 1uhc n ASN 58 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1uhc n GLY 59 N 2.00 2.88 3.58 8.20 0.00 -1.26 -4.97 105.19 115.62 1uhc n GLY 59 Ca 0.47 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.15 2.99 0.29 1.61 -0.14 -1.26 -4.96 119.74 118.13 1uhc s LYS 60 Ca 0.00 1.06 -0.19 0.00 -1.36 0.00 0.00 55.97 55.48 1uhc s LYS 60 Cb 0.00 -4.29 -0.09 0.00 -1.68 0.00 0.00 37.83 31.77 1uhc s LYS 60 CO 0.00 -2.27 0.78 0.15 -0.76 0.00 0.00 175.35 173.25 1uhc s LYS 61 N 6.32 4.20 -0.22 1.68 1.02 -1.26 -2.91 119.74 128.56 1uhc s LYS 61 Ca 0.74 0.88 -0.34 0.00 0.02 0.00 0.00 55.97 57.28 1uhc s LYS 61 Cb -0.18 -2.63 0.15 0.00 -0.52 0.00 0.00 37.83 34.65 1uhc s LYS 61 CO 0.28 0.25 1.24 0.20 -0.92 0.00 0.00 175.35 176.40 1uhc s GLY 62 N -1.93 -0.19 -0.02 -3.33 0.00 -0.41 -4.69 107.32 96.75 1uhc s GLY 62 Ca 0.50 1.95 -0.19 0.00 0.00 0.00 0.00 44.72 46.99 1uhc s GLY 62 CO 0.19 0.72 0.53 -0.19 0.00 0.00 0.00 173.10 174.35 1uhc s TYR 63 N -1.94 3.67 0.36 1.90 2.02 -0.76 -0.07 117.35 122.52 1uhc s TYR 63 Ca 0.09 1.09 0.09 0.00 -0.37 0.00 0.00 57.07 57.97 1uhc s TYR 63 Cb -0.01 -2.52 -0.07 0.00 -0.40 0.00 0.00 41.96 38.96 1uhc s TYR 63 CO -0.05 0.39 -0.06 0.08 -1.57 0.00 0.00 175.55 174.35 1uhc s VAL 64 N -0.28 2.15 0.35 0.71 1.01 0.53 -3.71 120.40 121.15 1uhc s VAL 64 Ca 0.28 -2.14 -0.26 0.00 0.00 0.00 0.00 61.98 59.85 1uhc s VAL 64 Cb -0.17 -2.74 -0.09 0.00 0.00 0.00 0.00 36.38 33.37 1uhc s VAL 64 CO 0.15 -0.14 1.07 -2.16 0.00 0.00 0.00 175.10 174.01 1uhc s PRO 65 N -3.64 4.37 0.00 2.72 0.04 -1.26 0.12 135.00 137.34 1uhc s PRO 65 Ca 0.33 1.63 0.28 0.00 0.04 0.00 0.00 61.00 63.28 1uhc s PRO 65 Cb 0.05 -2.82 1.62 0.00 0.04 0.00 0.00 34.50 33.39 1uhc s PRO 65 CO 0.17 0.01 2.00 -1.13 0.04 0.00 0.00 177.00 178.10 1uhc n SER 66 N 0.47 0.00 0.05 6.66 3.41 -0.75 -2.32 113.62 121.13 1uhc n SER 66 Ca 0.02 -0.73 0.10 0.00 -0.26 0.00 0.00 58.87 58.00 1uhc n SER 66 Cb 0.48 -0.05 -0.08 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 -1.05 0.50 -2.15 4.04 5.15 -1.26 -4.08 115.26 116.41 1uhc n ASN 67 Ca 0.20 0.20 -0.27 0.00 -0.60 0.00 0.00 54.58 54.10 1uhc n ASN 67 Cb 0.12 1.04 0.12 0.00 -0.53 0.00 0.00 39.78 40.53 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 -2.53 2.92 -4.37 1.20 4.02 -0.98 -4.89 117.16 112.53 1uhc n TYR 68 Ca -0.03 -2.44 -0.26 0.00 -0.01 0.00 0.00 57.90 55.16 1uhc n TYR 68 Cb 0.60 -1.09 -0.10 0.00 -0.02 0.00 0.00 39.34 38.72 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 -4.15 2.80 -0.01 -0.72 -1.09 -1.25 -2.02 121.20 114.75 1uhc s ILE 69 Ca 0.59 -1.92 -0.12 0.00 -2.23 0.00 0.00 60.65 56.97 1uhc s ILE 69 Cb 0.48 -2.39 0.01 0.00 -1.58 0.00 0.00 42.46 38.99 1uhc s ILE 69 CO 0.03 -0.17 0.24 -0.13 -1.23 0.00 0.00 174.94 173.68 1uhc s ARG 70 N -2.92 0.59 -0.18 2.79 1.81 -0.53 -4.58 118.95 115.93 1uhc s ARG 70 Ca 0.24 -0.27 -0.08 0.00 -1.72 0.00 0.00 55.73 53.90 1uhc s ARG 70 Cb -0.08 0.26 -0.04 0.00 -0.45 0.00 0.00 34.95 34.64 1uhc s ARG 70 CO 0.13 -0.15 0.08 0.21 -0.68 0.00 0.00 175.30 174.89 1uhc s LYS 71 N -1.34 3.98 0.13 3.54 2.20 -1.26 -2.09 119.74 124.90 1uhc s LYS 71 Ca -0.14 -0.30 -0.03 0.00 -0.36 0.00 0.00 55.97 55.14 1uhc s LYS 71 Cb -0.06 -3.26 -0.05 0.00 -1.51 0.00 0.00 37.83 32.95 1uhc s LYS 71 CO 0.03 0.32 0.33 -0.08 -0.36 0.00 0.00 175.35 175.59 1uhc s THR 72 N 0.25 5.24 0.08 3.43 -1.32 -1.11 -4.98 115.64 117.23 1uhc s THR 72 Ca 0.05 -0.16 -0.00 0.00 -1.21 0.00 0.00 61.69 60.37 1uhc s THR 72 Cb -0.12 -3.64 -0.00 0.00 -1.51 0.00 0.00 72.50 67.22 1uhc s THR 72 CO -0.00 0.03 -0.01 -0.62 -2.21 0.00 0.00 174.62 171.81 1uhc n GLU 73 N 0.01 0.01 0.00 7.08 1.02 -1.26 -4.92 120.64 122.59 1uhc n GLU 73 Ca -0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 1uhc n GLU 73 Cb 0.52 -0.52 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1uhc n GLU 73 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1uhc n SER 74 N -3.46 2.54 -3.64 1.62 7.64 -1.26 -5.12 113.62 111.94 1uhc n SER 74 Ca -0.00 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.85 1uhc n SER 74 Cb 0.07 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.22 1uhc n SER 74 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1uhc s GLY 75 N -4.21 0.11 0.60 0.23 0.00 -1.26 -4.97 107.32 97.82 1uhc s GLY 75 Ca 0.00 2.91 -0.15 0.00 0.00 0.00 0.00 44.72 47.48 1uhc s GLY 75 CO 0.00 1.29 1.05 2.56 0.00 0.00 0.00 173.10 178.00 1uhc s PRO 76 N -0.79 3.31 0.26 2.90 0.04 -1.26 -5.06 135.00 134.41 1uhc s PRO 76 Ca 0.08 1.13 0.03 0.00 0.04 0.00 0.00 61.00 62.28 1uhc s PRO 76 Cb -0.02 -2.04 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 1uhc s PRO 76 CO -0.09 -0.81 0.41 -1.12 0.04 0.00 0.00 177.00 175.43 1uhc s SER 77 N -3.02 6.32 0.04 6.66 0.01 -1.26 -5.12 113.70 117.32 1uhc s SER 77 Ca 0.62 0.20 -0.07 0.00 1.31 0.00 0.00 55.95 58.00 1uhc s SER 77 Cb -0.15 -1.92 -0.00 0.00 0.21 0.00 0.00 66.02 64.16 1uhc s SER 77 CO 0.40 -0.12 0.14 -0.94 0.41 0.00 0.00 173.24 173.13 1uhc s SER 78 N -3.90 0.10 0.00 2.44 1.04 -1.26 -5.01 113.70 107.11 1uhc s SER 78 Ca 0.36 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.36 1uhc s SER 78 Cb -0.09 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.28 1uhc s SER 78 CO 0.31 -0.52 0.31 0.61 0.98 0.00 0.00 173.24 174.94