#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hpe s PRO 19 N 0.00 2.55 0.04 -1.58 0.04 -1.26 -4.92 135.00 129.87 3hpe s PRO 19 Ca 0.00 -0.65 0.04 0.00 0.04 0.00 0.00 61.00 60.44 3hpe s PRO 19 Cb 0.00 -2.44 -0.02 0.00 0.04 0.00 0.00 34.50 32.08 3hpe s PRO 19 CO 0.00 -0.75 -0.13 0.71 0.04 0.00 0.00 177.00 176.87 3hpe s TYR 20 N -2.82 1.13 -0.11 0.56 2.02 0.57 -4.53 117.35 114.17 3hpe s TYR 20 Ca 0.57 -0.37 0.02 0.00 -0.37 0.00 0.00 57.07 56.92 3hpe s TYR 20 Cb -0.10 -0.67 -0.01 0.00 -0.40 0.00 0.00 41.96 40.78 3hpe s TYR 20 CO 0.39 0.02 -0.18 0.95 -1.57 0.00 0.00 175.55 175.17 3hpe s THR 21 N -0.93 2.62 -0.06 -0.71 -4.23 0.30 -3.82 115.64 108.82 3hpe s THR 21 Ca -0.00 -0.82 -0.30 0.00 -1.18 0.00 0.00 61.69 59.39 3hpe s THR 21 Cb -0.08 -2.06 -0.05 0.00 1.34 0.00 0.00 72.50 71.66 3hpe s THR 21 CO 0.01 0.54 1.44 -0.63 -0.54 0.00 0.00 174.62 175.44 3hpe s ILE 22 N 0.28 3.81 -0.41 2.99 1.01 -1.26 0.08 121.20 127.70 3hpe s ILE 22 Ca -0.13 1.09 -0.29 0.00 0.00 0.00 0.00 60.65 61.33 3hpe s ILE 22 Cb -0.16 -3.70 0.01 0.00 0.01 0.00 0.00 42.46 38.61 3hpe s ILE 22 CO 0.07 -0.05 1.43 -0.62 0.00 0.00 0.00 174.94 175.76 3hpe s ASP 23 N 2.32 6.32 0.40 3.58 3.68 0.78 -4.90 116.67 128.85 3hpe s ASP 23 Ca 0.64 0.85 0.27 0.00 2.13 0.00 0.00 52.55 56.44 3hpe s ASP 23 Cb -0.30 -2.54 0.93 0.00 -1.45 0.00 0.00 42.92 39.57 3hpe s ASP 23 CO 0.24 -1.44 1.80 0.11 0.13 0.00 0.00 175.17 176.01 3hpe h LYS 24 N 10.79 0.00 0.00 4.34 1.79 -1.91 -2.47 116.57 129.11 3hpe h LYS 24 Ca -0.28 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.19 3hpe h LYS 24 Cb 1.11 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.76 3hpe h LYS 24 CO 1.08 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 179.45 3hpe h ALA 25 N 2.15 1.00 0.00 3.86 0.00 -1.96 -3.28 119.26 121.02 3hpe h ALA 25 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hpe h ALA 25 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3hpe h ALA 25 CO 0.00 0.00 -0.01 0.09 0.00 0.00 0.00 179.25 179.33 3hpe n ASN 26 N -2.57 1.67 -4.36 0.00 3.02 -1.09 -5.04 115.26 106.89 3hpe n ASN 26 Ca 0.05 -1.98 -0.30 0.00 -0.03 0.00 0.00 54.58 52.32 3hpe n ASN 26 Cb 0.44 -0.06 -0.14 0.00 -0.61 0.00 0.00 39.78 39.41 3hpe n ASN 26 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3hpe s SER 27 N -1.08 3.23 -0.00 6.41 0.01 -0.95 -4.25 113.70 117.07 3hpe s SER 27 Ca 0.04 -0.66 -0.12 0.00 1.31 0.00 0.00 55.95 56.52 3hpe s SER 27 Cb 0.04 -0.26 0.01 0.00 0.21 0.00 0.00 66.02 66.02 3hpe s SER 27 CO 0.00 0.22 0.24 -0.94 0.41 0.00 0.00 173.24 173.18 3hpe s SER 28 N -1.59 -0.09 -0.25 2.44 1.04 0.24 -4.91 113.70 110.57 3hpe s SER 28 Ca 0.13 -0.07 0.01 0.00 0.48 0.00 0.00 55.95 56.50 3hpe s SER 28 Cb -0.10 0.27 0.07 0.00 0.10 0.00 0.00 66.02 66.36 3hpe s SER 28 CO 0.04 -0.44 -0.04 -0.69 0.98 0.00 0.00 173.24 173.09 3hpe s VAL 29 N -1.51 1.62 0.17 5.02 1.01 -1.26 -0.79 120.40 124.65 3hpe s VAL 29 Ca -0.13 -1.39 0.08 0.00 0.00 0.00 0.00 61.98 60.55 3hpe s VAL 29 Cb -0.05 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 3hpe s VAL 29 CO 0.02 -0.19 -0.08 0.26 0.00 0.00 0.00 175.10 175.11 3hpe s TRP 30 N 1.33 2.68 0.17 5.22 0.52 0.43 -2.26 118.94 127.02 3hpe s TRP 30 Ca -0.03 -0.20 0.06 0.00 0.02 0.00 0.00 56.10 55.95 3hpe s TRP 30 Cb -0.19 -1.32 -0.04 0.00 -1.15 0.00 0.00 33.47 30.77 3hpe s TRP 30 CO -0.08 0.50 -0.13 -0.59 0.02 0.00 0.00 176.95 176.67 3hpe s PHE 31 N -1.63 1.50 -0.02 -1.98 -0.12 -0.67 -1.29 117.98 113.76 3hpe s PHE 31 Ca 0.25 -0.63 0.00 0.00 -0.05 0.00 0.00 56.93 56.50 3hpe s PHE 31 Cb -0.09 -0.73 0.03 0.00 -0.63 0.00 0.00 43.02 41.59 3hpe s PHE 31 CO 0.15 0.22 0.02 -2.00 -0.05 0.00 0.00 175.22 173.56 3hpe s GLU 32 N -3.45 0.03 0.00 1.99 2.12 0.18 -1.91 118.70 117.65 3hpe s GLU 32 Ca 0.17 0.15 0.01 0.00 0.36 0.00 0.00 54.97 55.67 3hpe s GLU 32 Cb -0.01 -0.27 -0.01 0.00 0.26 0.00 0.00 34.13 34.11 3hpe s GLU 32 CO 0.04 -0.15 -0.05 0.54 -0.54 0.00 0.00 175.26 175.10 3hpe s VAL 33 N 0.97 0.36 0.24 3.70 0.11 -0.04 -1.66 120.40 124.07 3hpe s VAL 33 Ca -0.08 -0.28 -0.31 0.00 -2.93 0.00 0.00 61.98 58.38 3hpe s VAL 33 Cb -0.12 -0.33 -0.11 0.00 -1.53 0.00 0.00 36.38 34.30 3hpe s VAL 33 CO -0.02 0.04 1.56 -0.54 -3.33 0.00 0.00 175.10 172.81 3hpe s LYS 34 N -0.26 4.19 -0.20 1.54 -0.14 -1.26 -0.62 119.74 122.99 3hpe s LYS 34 Ca 0.00 2.44 -0.02 0.00 -1.36 0.00 0.00 55.97 57.04 3hpe s LYS 34 Cb -0.03 -3.09 -0.00 0.00 -1.68 0.00 0.00 37.83 33.03 3hpe s LYS 34 CO -0.00 -0.58 -0.10 -1.58 -0.76 0.00 0.00 175.35 172.34 3hpe s HIS 35 N 0.42 2.89 -1.46 3.18 5.65 0.42 -0.53 115.29 125.87 3hpe s HIS 35 Ca 0.65 -1.08 -0.09 0.00 0.25 0.00 0.00 55.06 54.79 3hpe s HIS 35 Cb -0.45 -2.02 0.03 0.00 -1.18 0.00 0.00 32.58 28.96 3hpe s HIS 35 CO 0.40 -0.57 0.90 1.19 -0.65 0.00 0.00 174.74 176.01 3hpe n PHE 36 N 4.57 -2.37 0.00 3.88 3.72 -0.55 -1.98 117.46 124.74 3hpe n PHE 36 Ca -0.19 0.79 0.00 0.00 -0.05 0.00 0.00 57.45 58.00 3hpe n PHE 36 Cb 0.51 -4.40 0.00 0.00 -0.94 0.00 0.00 39.48 34.65 3hpe n PHE 36 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3hpe n LYS 37 N -4.52 0.00 -0.00 -1.08 5.02 -1.23 -4.57 118.16 111.78 3hpe n LYS 37 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 3hpe n LYS 37 Cb 0.57 -0.26 -0.01 0.00 -0.02 0.00 0.00 35.03 35.30 3hpe n LYS 37 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3hpe n PHE 38 N 0.00 0.00 -3.67 2.13 3.01 -1.17 -4.93 117.46 112.83 3hpe n PHE 38 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.09 3hpe n PHE 38 Cb 0.00 -0.04 -0.07 0.00 -0.01 0.00 0.00 39.48 39.37 3hpe n PHE 38 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 3hpe s ASN 39 N -2.40 6.48 -0.31 4.37 2.47 -0.84 -4.93 114.94 119.78 3hpe s ASN 39 Ca -0.00 0.57 -0.16 0.00 0.42 0.00 0.00 52.86 53.69 3hpe s ASN 39 Cb 0.01 -2.15 -0.02 0.00 -1.45 0.00 0.00 41.25 37.64 3hpe s ASN 39 CO 0.05 0.27 0.40 -1.61 -3.72 0.00 0.00 177.10 172.49 3hpe s GLU 40 N -0.42 3.79 -0.19 0.43 8.01 -1.26 0.16 118.70 129.23 3hpe s GLU 40 Ca 0.17 -0.15 -0.15 0.00 0.01 0.00 0.00 54.97 54.85 3hpe s GLU 40 Cb -0.13 -3.73 -0.04 0.00 -4.31 0.00 0.00 34.13 25.91 3hpe s GLU 40 CO 0.05 -0.43 0.34 0.99 0.01 0.00 0.00 175.26 176.22 3hpe s THR 41 N 2.12 5.25 0.09 3.63 2.01 0.21 -4.91 115.64 124.04 3hpe s THR 41 Ca 0.15 0.61 0.08 0.00 0.31 0.00 0.00 61.69 62.83 3hpe s THR 41 Cb -0.16 -3.68 -0.04 0.00 0.01 0.00 0.00 72.50 68.64 3hpe s THR 41 CO 0.11 0.31 -0.16 -0.13 -0.69 0.00 0.00 174.62 174.07 3hpe s ARG 42 N 0.98 1.98 0.39 4.92 0.52 -1.26 -0.86 118.95 125.61 3hpe s ARG 42 Ca 0.17 -1.07 -0.10 0.00 -0.52 0.00 0.00 55.73 54.22 3hpe s ARG 42 Cb -0.14 -2.20 0.04 0.00 0.52 0.00 0.00 34.95 33.17 3hpe s ARG 42 CO 0.06 0.51 0.68 0.20 0.02 0.00 0.00 175.30 176.77 3hpe s GLY 43 N -1.94 0.89 0.22 -3.53 0.00 -0.80 -4.08 107.32 98.08 3hpe s GLY 43 Ca 0.18 -1.11 0.03 0.00 0.00 0.00 0.00 44.72 43.81 3hpe s GLY 43 CO 0.10 -0.61 0.00 -1.34 0.00 0.00 0.00 173.10 171.25 3hpe s VAL 44 N -2.40 0.91 -0.31 1.40 -7.23 -1.26 -1.68 120.40 109.84 3hpe s VAL 44 Ca 0.22 -2.02 -0.10 0.00 -1.81 0.00 0.00 61.98 58.27 3hpe s VAL 44 Cb -0.03 -2.30 -0.02 0.00 0.56 0.00 0.00 36.38 34.59 3hpe s VAL 44 CO 0.16 -0.35 0.17 -0.36 -0.31 0.00 0.00 175.10 174.41 3hpe s PHE 45 N -3.51 3.19 0.19 2.82 0.40 -0.96 0.13 117.98 120.24 3hpe s PHE 45 Ca 0.28 -0.34 0.26 0.00 -0.60 0.00 0.00 56.93 56.52 3hpe s PHE 45 Cb 0.06 -2.38 1.08 0.00 0.51 0.00 0.00 43.02 42.29 3hpe s PHE 45 CO 0.08 -0.37 1.89 -0.44 0.70 0.00 0.00 175.22 177.08 3hpe h ASP 46 N 8.38 0.00 -3.52 1.36 3.32 -1.57 -3.41 116.42 120.98 3hpe h ASP 46 Ca -0.33 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.12 3hpe h ASP 46 Cb 1.16 0.00 -0.38 0.00 0.22 0.00 0.00 39.33 40.33 3hpe h ASP 46 CO 0.60 0.18 -0.79 -0.55 -1.72 0.00 0.00 179.24 176.97 3hpe s SER 47 N -6.13 3.54 0.15 6.45 0.15 -1.26 -5.09 113.70 111.51 3hpe s SER 47 Ca -0.00 -1.01 -0.07 0.00 0.70 0.00 0.00 55.95 55.57 3hpe s SER 47 Cb 0.11 -1.13 -0.02 0.00 -1.71 0.00 0.00 66.02 63.27 3hpe s SER 47 CO 0.62 -0.21 0.21 0.72 1.20 0.00 0.00 173.24 175.78 3hpe s PHE 48 N 1.45 0.50 0.07 3.44 -0.12 -1.26 -0.88 117.98 121.17 3hpe s PHE 48 Ca -0.04 -0.87 -0.03 0.00 -0.05 0.00 0.00 56.93 55.95 3hpe s PHE 48 Cb -0.18 -0.17 -0.03 0.00 -0.63 0.00 0.00 43.02 42.01 3hpe s PHE 48 CO -0.07 -0.64 0.03 -0.51 -0.05 0.00 0.00 175.22 173.98 3hpe s ASP 49 N -2.98 0.39 0.08 1.98 -0.00 -0.67 -5.00 116.67 110.48 3hpe s ASP 49 Ca 0.18 -0.97 -0.26 0.00 -0.00 0.00 0.00 52.55 51.50 3hpe s ASP 49 Cb 0.05 0.25 0.08 0.00 -0.00 0.00 0.00 42.92 43.29 3hpe s ASP 49 CO -0.01 -0.65 0.83 -0.83 -0.00 0.00 0.00 175.17 174.51 3hpe s GLY 50 N -2.93 -0.42 -0.08 0.21 0.00 -1.26 -0.87 107.32 101.97 3hpe s GLY 50 Ca 0.09 0.62 0.04 0.00 0.00 0.00 0.00 44.72 45.47 3hpe s GLY 50 CO -0.08 0.20 -0.20 1.25 0.00 0.00 0.00 173.10 174.27 3hpe s LYS 51 N -3.35 2.44 -0.04 2.90 2.20 -0.27 -4.76 119.74 118.88 3hpe s LYS 51 Ca 0.06 -0.71 0.01 0.00 -0.36 0.00 0.00 55.97 54.97 3hpe s LYS 51 Cb -0.01 -1.93 0.02 0.00 -1.51 0.00 0.00 37.83 34.39 3hpe s LYS 51 CO -0.06 0.16 -0.06 0.42 -0.36 0.00 0.00 175.35 175.46 3hpe s ILE 52 N 0.34 0.57 -0.07 5.43 1.01 -1.25 -2.39 121.20 124.85 3hpe s ILE 52 Ca -0.14 -0.18 0.01 0.00 0.00 0.00 0.00 60.65 60.33 3hpe s ILE 52 Cb -0.16 -0.56 0.02 0.00 0.01 0.00 0.00 42.46 41.77 3hpe s ILE 52 CO 0.06 0.22 -0.06 -0.62 0.00 0.00 0.00 174.94 174.54 3hpe s ASP 53 N 0.64 1.49 0.09 3.58 -1.08 -0.71 -0.32 116.67 120.37 3hpe s ASP 53 Ca -0.09 -0.20 -0.19 0.00 -0.52 0.00 0.00 52.55 51.55 3hpe s ASP 53 Cb -0.12 -0.61 0.04 0.00 -1.46 0.00 0.00 42.92 40.77 3hpe s ASP 53 CO 0.00 -0.07 0.46 0.00 0.52 0.00 0.00 175.17 176.09 3hpe s ALA 54 N 1.19 -1.15 -0.40 3.66 0.00 -1.26 -0.51 121.76 123.29 3hpe s ALA 54 Ca -0.06 0.29 -0.13 0.00 0.00 0.00 0.00 51.96 52.06 3hpe s ALA 54 Cb -0.14 0.54 0.03 0.00 0.00 0.00 0.00 23.12 23.55 3hpe s ALA 54 CO -0.02 -0.57 0.26 0.34 0.00 0.00 0.00 175.76 175.77 3hpe s ASP 55 N -2.36 5.91 0.37 0.00 3.68 -0.22 -3.09 116.67 120.96 3hpe s ASP 55 Ca -0.02 -0.98 0.05 0.00 2.13 0.00 0.00 52.55 53.73 3hpe s ASP 55 Cb 0.00 -2.09 0.71 0.00 -1.45 0.00 0.00 42.92 40.09 3hpe s ASP 55 CO -0.07 -0.43 1.96 -0.65 0.13 0.00 0.00 175.17 176.12 3hpe h PRO 56 N 8.53 0.56 -6.29 4.34 0.11 -1.95 -0.55 132.00 136.76 3hpe h PRO 56 Ca -0.26 -0.07 -0.56 0.00 0.11 0.00 0.00 66.00 65.22 3hpe h PRO 56 Cb 1.11 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 32.07 3hpe h PRO 56 CO 0.70 0.47 0.05 -0.80 -0.21 0.00 0.00 178.00 178.22 3hpe s ASN 57 N -6.69 7.15 0.00 -2.05 0.02 -1.26 -3.57 114.94 108.54 3hpe s ASN 57 Ca -0.08 1.36 0.00 0.00 -1.02 0.00 0.00 52.86 53.12 3hpe s ASN 57 Cb 0.16 -2.41 0.00 0.00 0.02 0.00 0.00 41.25 39.03 3hpe s ASN 57 CO 0.75 0.19 0.00 0.35 0.02 0.00 0.00 177.10 178.41 3hpe n THR 58 N 2.02 0.00 -3.16 1.60 -2.24 -1.26 -4.48 114.28 106.76 3hpe n THR 58 Ca -0.08 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.48 3hpe n THR 58 Cb 0.50 0.00 0.02 0.00 -2.10 0.00 0.00 70.33 68.75 3hpe n THR 58 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3hpe n LYS 59 N -1.77 -4.17 -3.16 -0.78 5.02 -0.24 -4.97 118.16 108.09 3hpe n LYS 59 Ca 0.00 0.71 -0.39 0.00 -2.02 0.00 0.00 58.31 56.61 3hpe n LYS 59 Cb 0.00 -5.50 -0.05 0.00 -0.02 0.00 0.00 35.03 29.46 3hpe n LYS 59 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hpe s ALA 60 N -3.05 3.42 -0.13 7.82 0.00 -1.06 -4.90 121.76 123.86 3hpe s ALA 60 Ca 0.34 -0.06 -0.24 0.00 0.00 0.00 0.00 51.96 52.01 3hpe s ALA 60 Cb -0.16 -2.84 -0.03 0.00 0.00 0.00 0.00 23.12 20.09 3hpe s ALA 60 CO 0.42 -0.14 0.73 -0.51 0.00 0.00 0.00 175.76 176.26 3hpe s LEU 61 N 0.92 4.23 -0.23 0.00 1.43 -1.26 -1.05 118.68 122.72 3hpe s LEU 61 Ca 0.32 1.11 -0.05 0.00 -1.03 0.00 0.00 54.13 54.48 3hpe s LEU 61 Cb -0.16 -3.09 -0.12 0.00 0.03 0.00 0.00 46.19 42.84 3hpe s LEU 61 CO 0.14 -0.24 -0.25 -3.20 0.23 0.00 0.00 176.35 173.02 3hpe n ASN 62 N 4.53 1.97 -4.10 2.29 5.15 0.33 -4.71 115.26 120.72 3hpe n ASN 62 Ca 0.01 0.09 -0.26 0.00 -0.60 0.00 0.00 54.58 53.81 3hpe n ASN 62 Cb 0.50 -0.52 -0.16 0.00 -0.53 0.00 0.00 39.78 39.07 3hpe n ASN 62 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3hpe s VAL 63 N -2.44 1.37 -0.28 3.44 1.01 -0.95 -4.95 120.40 117.61 3hpe s VAL 63 Ca -0.31 -0.66 -0.01 0.00 0.00 0.00 0.00 61.98 61.00 3hpe s VAL 63 Cb 0.10 -1.20 0.17 0.00 0.00 0.00 0.00 36.38 35.46 3hpe s VAL 63 CO 0.46 0.40 0.51 0.12 0.00 0.00 0.00 175.10 176.59 3hpe s PHE 64 N 0.26 -1.32 0.05 5.22 2.19 -1.24 -1.73 117.98 121.40 3hpe s PHE 64 Ca -0.08 1.22 -0.02 0.00 0.33 0.00 0.00 56.93 58.38 3hpe s PHE 64 Cb -0.13 0.29 -0.03 0.00 -1.31 0.00 0.00 43.02 41.84 3hpe s PHE 64 CO 0.03 -0.86 0.00 -1.83 1.83 0.00 0.00 175.22 174.39 3hpe s GLU 65 N 2.72 0.57 0.20 10.12 -1.05 -1.00 0.19 118.70 130.45 3hpe s GLU 65 Ca 0.16 -1.04 -0.23 0.00 -0.15 0.00 0.00 54.97 53.71 3hpe s GLU 65 Cb -0.14 0.20 0.05 0.00 -0.44 0.00 0.00 34.13 33.80 3hpe s GLU 65 CO -0.21 -0.12 0.81 0.20 0.95 0.00 0.00 175.26 176.89 3hpe s GLY 66 N -2.57 -0.22 -0.00 -3.83 0.00 0.29 -1.11 107.32 99.88 3hpe s GLY 66 Ca 0.01 0.02 0.01 0.00 0.00 0.00 0.00 44.72 44.77 3hpe s GLY 66 CO -0.08 -0.00 -0.04 0.54 0.00 0.00 0.00 173.10 173.52 3hpe s LYS 67 N -3.62 0.33 0.06 2.90 1.02 -0.05 -0.92 119.74 119.47 3hpe s LYS 67 Ca 0.10 -0.14 0.06 0.00 0.02 0.00 0.00 55.97 56.01 3hpe s LYS 67 Cb -0.03 -0.32 -0.04 0.00 -0.52 0.00 0.00 37.83 36.92 3hpe s LYS 67 CO 0.02 0.09 -0.12 0.96 -0.92 0.00 0.00 175.35 175.38 3hpe s ILE 68 N -0.09 3.26 -0.38 2.17 -4.36 0.12 -1.66 121.20 120.26 3hpe s ILE 68 Ca 0.01 -1.14 -0.17 0.00 -0.26 0.00 0.00 60.65 59.09 3hpe s ILE 68 Cb -0.02 -2.46 0.01 0.00 1.25 0.00 0.00 42.46 41.24 3hpe s ILE 68 CO -0.00 0.23 0.45 -1.81 0.24 0.00 0.00 174.94 174.05 3hpe s ASP 69 N -1.82 6.22 0.48 4.36 1.01 -0.06 -1.38 116.67 125.48 3hpe s ASP 69 Ca 0.18 -0.39 0.24 0.00 0.71 0.00 0.00 52.55 53.29 3hpe s ASP 69 Cb -0.11 -2.23 1.23 0.00 1.01 0.00 0.00 42.92 42.82 3hpe s ASP 69 CO 0.10 -0.50 2.00 0.40 0.21 0.00 0.00 175.17 177.37 3hpe h ILE 70 N 5.66 0.72 0.00 0.77 1.08 -1.53 -0.80 117.51 123.40 3hpe h ILE 70 Ca -0.28 -0.73 0.00 0.00 -0.39 0.00 0.00 64.86 63.47 3hpe h ILE 70 Cb 1.12 1.45 0.00 0.00 -3.07 0.00 0.00 36.82 36.32 3hpe h ILE 70 CO 0.77 0.17 0.00 2.29 -0.69 0.00 0.00 178.15 180.69 3hpe n LYS 71 N -3.74 0.02 -0.15 2.37 2.85 -1.26 -2.32 118.16 115.93 3hpe n LYS 71 Ca -0.02 0.16 0.11 0.00 -1.05 0.00 0.00 58.31 57.52 3hpe n LYS 71 Cb 0.29 -1.52 0.27 0.00 -0.65 0.00 0.00 35.03 33.41 3hpe n LYS 71 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 3hpe n SER 72 N -1.55 2.81 -4.52 -5.58 3.41 -0.31 -4.97 113.62 102.91 3hpe n SER 72 Ca 0.05 -1.90 -0.48 0.00 -0.26 0.00 0.00 58.87 56.28 3hpe n SER 72 Cb 0.25 -0.20 -0.03 0.00 -0.26 0.00 0.00 64.21 63.96 3hpe n SER 72 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hpe n ILE 73 N 1.07 1.56 0.00 -1.33 3.06 -0.98 -1.45 119.36 121.30 3hpe n ILE 73 Ca 0.18 -0.39 0.00 0.00 -2.50 0.00 0.00 62.75 60.04 3hpe n ILE 73 Cb 0.51 -0.59 0.00 0.00 0.54 0.00 0.00 39.64 40.10 3hpe n ILE 73 CO 0.00 0.00 0.00 -3.20 -2.50 0.00 0.00 176.55 170.85 3hpe n ASN 74 N 1.69 0.00 0.00 9.51 2.85 0.34 -4.87 115.26 124.78 3hpe n ASN 74 Ca 0.14 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.61 3hpe n ASN 74 Cb 0.26 -0.04 0.00 0.00 1.24 0.00 0.00 39.78 41.24 3hpe n ASN 74 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 3hpe n THR 75 N -1.60 0.00 -3.09 -0.44 -1.04 -1.26 -4.17 114.28 102.69 3hpe n THR 75 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.88 3hpe n THR 75 Cb 0.00 0.00 0.07 0.00 -1.82 0.00 0.00 70.33 68.58 3hpe n THR 75 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 3hpe n ARG 76 N -1.19 -3.84 -3.19 -2.82 1.74 -1.26 -4.96 116.66 101.14 3hpe n ARG 76 Ca 0.00 0.72 0.05 0.00 -0.77 0.00 0.00 57.85 57.85 3hpe n ARG 76 Cb 0.00 -5.24 -0.03 0.00 -1.02 0.00 0.00 32.46 26.18 3hpe n ARG 76 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3hpe s ASN 77 N -3.76 -0.28 0.08 0.55 3.84 -1.26 -5.07 114.94 109.05 3hpe s ASN 77 Ca 0.18 0.24 -0.23 0.00 0.21 0.00 0.00 52.86 53.26 3hpe s ASN 77 Cb -0.02 1.26 -0.15 0.00 -0.55 0.00 0.00 41.25 41.78 3hpe s ASN 77 CO 0.62 -0.05 1.69 0.50 -2.79 0.00 0.00 177.10 177.06 3hpe h LYS 78 N 7.72 0.01 -0.11 0.43 3.64 -1.95 -1.93 116.57 124.39 3hpe h LYS 78 Ca -0.13 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.30 3hpe h LYS 78 Cb 1.16 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.92 3hpe h LYS 78 CO -0.08 0.06 -0.30 -0.22 -2.27 0.00 0.00 179.45 176.65 3hpe h LYS 79 N -0.04 -0.37 -0.71 1.90 3.64 -2.00 -0.04 116.57 118.95 3hpe h LYS 79 Ca 0.00 0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.41 3hpe h LYS 79 Cb 0.05 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.92 3hpe h LYS 79 CO -0.00 -0.25 0.47 -0.09 -2.27 0.00 0.00 179.45 177.31 3hpe h ARG 80 N -0.39 0.94 -0.25 1.90 2.43 -1.98 -2.12 114.38 114.92 3hpe h ARG 80 Ca 0.09 -0.06 -0.18 0.00 -0.81 0.00 0.00 59.98 59.02 3hpe h ARG 80 Cb 0.53 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 29.86 3hpe h ARG 80 CO -0.32 0.63 -0.56 -0.44 -1.51 0.00 0.00 179.97 177.76 3hpe h ASP 81 N 0.97 0.85 -0.00 -3.80 3.32 -0.45 0.06 116.42 117.37 3hpe h ASP 81 Ca 0.26 -0.46 0.01 0.00 0.02 0.00 0.00 57.03 56.86 3hpe h ASP 81 Cb -0.11 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.20 3hpe h ASP 81 CO -0.06 1.23 -0.02 0.44 -1.72 0.00 0.00 179.24 179.11 3hpe h ASP 82 N 0.58 -0.07 -0.31 6.45 3.32 -0.99 -1.98 116.42 123.42 3hpe h ASP 82 Ca 0.01 0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.13 3hpe h ASP 82 Cb 1.15 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.71 3hpe h ASP 82 CO 0.12 -0.04 0.21 -0.74 -1.72 0.00 0.00 179.24 177.07 3hpe h HIS 83 N -0.04 0.14 -0.00 4.55 2.76 -1.09 -2.57 115.15 118.89 3hpe h HIS 83 Ca 0.01 0.00 -0.11 0.00 -2.20 0.00 0.00 60.37 58.07 3hpe h HIS 83 Cb 0.06 -0.05 -0.02 0.00 1.55 0.00 0.00 27.41 28.96 3hpe h HIS 83 CO -0.10 0.08 -0.54 -0.07 -1.30 0.00 0.00 177.93 175.99 3hpe h LEU 84 N 0.14 0.01 0.00 0.26 3.38 -0.25 -3.15 115.31 115.71 3hpe h LEU 84 Ca 0.14 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3hpe h LEU 84 Cb 0.38 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3hpe h LEU 84 CO -0.02 0.55 -0.23 0.11 0.09 0.00 0.00 178.44 178.94 3hpe h LYS 85 N 0.01 0.00 -7.08 1.13 1.57 -1.06 -0.01 116.57 111.13 3hpe h LYS 85 Ca -0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 3hpe h LYS 85 Cb 0.96 0.00 0.21 0.00 0.08 0.00 0.00 32.23 33.48 3hpe h LYS 85 CO 0.07 0.00 -0.10 2.41 -0.57 0.00 0.00 179.45 181.26 3hpe n THR 86 N -2.53 0.00 0.26 -0.16 -1.04 -1.06 -0.14 114.28 109.61 3hpe n THR 86 Ca 0.04 -0.09 0.18 0.00 -2.04 0.00 0.00 64.05 62.13 3hpe n THR 86 Cb 0.48 -0.85 0.84 0.00 -1.82 0.00 0.00 70.33 68.97 3hpe n THR 86 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3hpe h ALA 87 N -1.82 1.57 0.00 2.41 0.00 -1.89 0.16 119.26 119.68 3hpe h ALA 87 Ca -0.44 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.40 3hpe h ALA 87 Cb 1.28 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 3hpe h ALA 87 CO 0.39 -0.37 -0.29 0.93 0.00 0.00 0.00 179.25 179.90 3hpe h GLU 88 N 0.00 0.00 0.00 0.00 5.08 -1.91 -3.43 114.58 114.32 3hpe h GLU 88 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3hpe h GLU 88 Cb 0.68 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.93 3hpe h GLU 88 CO -0.00 0.29 0.00 1.19 -1.00 0.00 0.00 179.01 179.49 3hpe n PHE 89 N -3.94 0.00 0.09 4.33 3.72 -0.80 -3.14 117.46 117.72 3hpe n PHE 89 Ca -0.02 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.33 3hpe n PHE 89 Cb 0.36 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 38.98 3hpe n PHE 89 CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 176.76 177.45 3hpe h PHE 90 N 0.00 0.25 -5.46 1.38 -1.00 -0.79 -3.37 116.94 107.94 3hpe h PHE 90 Ca 0.00 -0.11 -0.27 0.00 2.81 0.00 0.00 57.97 60.40 3hpe h PHE 90 Cb 0.00 -0.04 0.19 0.00 3.61 0.00 0.00 35.95 39.71 3hpe h PHE 90 CO 0.00 0.83 -0.81 -3.47 -1.61 0.00 0.00 178.31 173.24 3hpe n ASP 91 N -3.78 -5.07 -0.33 2.17 -0.08 0.50 -4.65 116.55 105.31 3hpe n ASP 91 Ca -0.03 -0.67 0.19 0.00 -1.51 0.00 0.00 54.79 52.78 3hpe n ASP 91 Cb 0.69 -5.10 0.44 0.00 2.34 0.00 0.00 41.12 39.49 3hpe n ASP 91 CO 0.00 0.00 0.00 1.62 0.12 0.00 0.00 177.20 178.94 3hpe h VAL 92 N -1.33 0.58 -0.62 5.18 3.04 -0.73 -0.01 116.25 122.36 3hpe h VAL 92 Ca -0.59 -0.18 0.08 0.00 -1.01 0.00 0.00 66.70 65.00 3hpe h VAL 92 Cb 1.31 0.02 -0.07 0.00 -2.01 0.00 0.00 31.29 30.55 3hpe h VAL 92 CO 0.45 0.09 0.28 1.62 -1.01 0.00 0.00 177.57 179.00 3hpe h VAL 93 N 0.52 0.84 0.03 1.51 3.04 -1.91 -2.44 116.25 117.83 3hpe h VAL 93 Ca 0.59 -0.17 -0.26 0.00 -1.01 0.00 0.00 66.70 65.85 3hpe h VAL 93 Cb 1.29 0.30 -0.03 0.00 -2.01 0.00 0.00 31.29 30.83 3hpe h VAL 93 CO -0.35 0.09 -1.36 0.50 -1.01 0.00 0.00 177.57 175.45 3hpe h LYS 94 N 0.50 0.06 -2.83 4.17 3.64 -1.41 -3.41 116.57 117.28 3hpe h LYS 94 Ca 0.30 -0.11 -0.60 0.00 -1.27 0.00 0.00 60.65 58.97 3hpe h LYS 94 Cb 0.32 0.04 -0.40 0.00 -0.41 0.00 0.00 32.23 31.78 3hpe h LYS 94 CO -0.26 0.87 -0.77 0.71 -2.27 0.00 0.00 179.45 177.73 3hpe s TYR 95 N -2.65 1.90 0.01 1.91 2.02 -0.48 -4.98 117.35 115.08 3hpe s TYR 95 Ca -0.03 -2.45 0.32 0.00 -0.37 0.00 0.00 57.07 54.54 3hpe s TYR 95 Cb 0.09 -1.71 1.29 0.00 -0.40 0.00 0.00 41.96 41.23 3hpe s TYR 95 CO 0.83 -0.76 1.94 -1.00 -1.57 0.00 0.00 175.55 174.99 3hpe h PRO 96 N 6.35 0.00 -6.08 -1.71 0.14 -1.69 -3.39 132.00 125.63 3hpe h PRO 96 Ca 0.08 0.00 -0.54 0.00 0.14 0.00 0.00 66.00 65.67 3hpe h PRO 96 Cb 0.90 0.00 -0.20 0.00 0.14 0.00 0.00 31.00 31.84 3hpe h PRO 96 CO 0.47 0.00 -0.81 0.15 0.14 0.00 0.00 178.00 177.95 3hpe s LYS 97 N -3.61 1.19 0.13 0.86 1.02 -1.26 -1.37 119.74 116.70 3hpe s LYS 97 Ca 0.02 -1.27 0.07 0.00 0.02 0.00 0.00 55.97 54.81 3hpe s LYS 97 Cb 0.09 -1.37 -0.04 0.00 -0.52 0.00 0.00 37.83 35.99 3hpe s LYS 97 CO 0.53 0.30 -0.09 0.20 -0.92 0.00 0.00 175.35 175.38 3hpe s GLY 98 N -2.25 1.77 0.01 -3.33 0.00 -0.48 -4.57 107.32 98.47 3hpe s GLY 98 Ca 0.11 -1.31 -0.05 0.00 0.00 0.00 0.00 44.72 43.47 3hpe s GLY 98 CO 0.05 -1.30 0.08 -1.35 0.00 0.00 0.00 173.10 170.58 3hpe s SER 99 N -2.45 0.10 -0.04 1.64 1.04 -0.51 0.14 113.70 113.62 3hpe s SER 99 Ca 0.23 -0.31 -0.00 0.00 0.48 0.00 0.00 55.95 56.35 3hpe s SER 99 Cb -0.10 0.17 0.03 0.00 0.10 0.00 0.00 66.02 66.21 3hpe s SER 99 CO 0.15 -0.35 0.00 0.12 0.98 0.00 0.00 173.24 174.14 3hpe s PHE 100 N -1.44 0.42 -0.15 5.02 2.19 -0.10 -0.20 117.98 123.72 3hpe s PHE 100 Ca -0.15 -0.03 0.02 0.00 0.33 0.00 0.00 56.93 57.10 3hpe s PHE 100 Cb -0.08 -0.55 0.02 0.00 -1.31 0.00 0.00 43.02 41.10 3hpe s PHE 100 CO 0.01 -0.19 -0.19 0.15 1.83 0.00 0.00 175.22 176.82 3hpe s LYS 101 N 1.40 2.81 0.06 10.12 -0.14 -0.74 -0.54 119.74 132.72 3hpe s LYS 101 Ca -0.04 -0.77 -0.31 0.00 -1.36 0.00 0.00 55.97 53.49 3hpe s LYS 101 Cb -0.13 -2.37 -0.07 0.00 -1.68 0.00 0.00 37.83 33.59 3hpe s LYS 101 CO -0.03 -0.11 1.39 1.41 -0.76 0.00 0.00 175.35 177.25 3hpe s MET 102 N 1.08 4.31 -0.01 1.68 -2.45 0.13 -1.27 119.30 122.77 3hpe s MET 102 Ca -0.01 2.01 0.11 0.00 -1.25 0.00 0.00 55.69 56.54 3hpe s MET 102 Cb -0.14 -3.40 -0.14 0.00 1.25 0.00 0.00 34.83 32.40 3hpe s MET 102 CO -0.07 -0.49 0.36 -2.37 1.05 0.00 0.00 175.02 173.51 3hpe n THR 103 N 4.27 0.00 -3.64 10.11 5.66 0.12 -4.74 114.28 126.05 3hpe n THR 103 Ca 0.12 -0.25 -0.05 0.00 -3.05 0.00 0.00 64.05 60.82 3hpe n THR 103 Cb 0.43 0.69 -0.07 0.00 -1.55 0.00 0.00 70.33 69.83 3hpe n THR 103 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 3hpe s LYS 104 N -2.31 0.47 -0.09 1.09 2.20 -0.95 -5.01 119.74 115.14 3hpe s LYS 104 Ca 0.01 0.73 0.03 0.00 -0.36 0.00 0.00 55.97 56.37 3hpe s LYS 104 Cb 0.08 0.14 -0.01 0.00 -1.51 0.00 0.00 37.83 36.52 3hpe s LYS 104 CO 0.44 -0.08 -0.18 -0.47 -0.36 0.00 0.00 175.35 174.70 3hpe s TYR 105 N 1.04 2.65 -0.26 4.03 6.14 -1.26 -0.78 117.35 128.91 3hpe s TYR 105 Ca -0.05 -0.60 -0.04 0.00 0.64 0.00 0.00 57.07 57.02 3hpe s TYR 105 Cb -0.04 -1.71 0.15 0.00 0.42 0.00 0.00 41.96 40.77 3hpe s TYR 105 CO -0.13 -0.14 0.50 -1.83 0.64 0.00 0.00 175.55 174.58 3hpe s GLU 106 N -0.04 0.45 -1.28 4.97 -1.05 -0.77 -4.98 118.70 115.99 3hpe s GLU 106 Ca -0.05 0.89 -0.14 0.00 -0.15 0.00 0.00 54.97 55.53 3hpe s GLU 106 Cb -0.14 0.18 0.00 0.00 -0.44 0.00 0.00 34.13 33.73 3hpe s GLU 106 CO 0.04 -0.52 0.57 -0.25 0.95 0.00 0.00 175.26 176.06 3hpe n ASP 107 N 5.40 -2.73 0.00 0.83 9.92 -1.26 -0.93 116.55 127.79 3hpe n ASP 107 Ca -0.04 -1.09 0.00 0.00 -0.53 0.00 0.00 54.79 53.13 3hpe n ASP 107 Cb 0.50 -2.81 0.00 0.00 -0.64 0.00 0.00 41.12 38.17 3hpe n ASP 107 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3hpe n GLY 108 N -1.94 1.01 3.57 0.44 0.00 -1.26 -5.00 105.19 102.00 3hpe n GLY 108 Ca -0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 3hpe n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hpe s LYS 109 N -0.65 3.91 -0.49 1.61 1.02 -0.10 -0.26 119.74 124.78 3hpe s LYS 109 Ca 0.00 -0.35 -0.12 0.00 0.02 0.00 0.00 55.97 55.52 3hpe s LYS 109 Cb 0.00 -3.55 0.11 0.00 -0.52 0.00 0.00 37.83 33.87 3hpe s LYS 109 CO 0.00 -0.12 0.39 0.42 -0.92 0.00 0.00 175.35 175.12 3hpe s ILE 110 N 1.54 4.70 0.03 2.17 1.01 0.36 -1.85 121.20 129.16 3hpe s ILE 110 Ca 0.07 -1.52 -0.20 0.00 0.00 0.00 0.00 60.65 58.99 3hpe s ILE 110 Cb -0.15 -3.99 -0.06 0.00 0.01 0.00 0.00 42.46 38.27 3hpe s ILE 110 CO 0.08 -0.74 0.59 -1.00 0.00 0.00 0.00 174.94 173.87 3hpe s HIS 111 N 1.49 3.74 0.12 3.97 3.76 0.04 -0.77 115.29 127.64 3hpe s HIS 111 Ca 0.04 1.24 -0.26 0.00 -0.15 0.00 0.00 55.06 55.93 3hpe s HIS 111 Cb -0.27 -2.57 0.08 0.00 1.11 0.00 0.00 32.58 30.93 3hpe s HIS 111 CO 0.02 0.45 1.05 0.20 -0.85 0.00 0.00 174.74 175.61 3hpe s GLY 112 N -0.59 -0.23 -0.28 -2.22 0.00 -0.20 0.15 107.32 103.95 3hpe s GLY 112 Ca 0.30 0.19 -0.10 0.00 0.00 0.00 0.00 44.72 45.11 3hpe s GLY 112 CO 0.18 0.40 0.16 0.99 0.00 0.00 0.00 173.10 174.83 3hpe s ASP 113 N -3.02 5.72 -0.15 1.64 1.01 -0.40 -0.43 116.67 121.04 3hpe s ASP 113 Ca 0.14 -0.15 -0.08 0.00 0.71 0.00 0.00 52.55 53.18 3hpe s ASP 113 Cb -0.00 -2.05 -0.04 0.00 1.01 0.00 0.00 42.92 41.83 3hpe s ASP 113 CO 0.01 -0.07 0.11 -0.22 0.21 0.00 0.00 175.17 175.21 3hpe s LEU 114 N 1.70 4.17 -0.07 1.23 2.96 -0.59 -1.78 118.68 126.29 3hpe s LEU 114 Ca 0.07 0.30 0.02 0.00 -0.22 0.00 0.00 54.13 54.30 3hpe s LEU 114 Cb -0.16 -2.04 0.02 0.00 0.50 0.00 0.00 46.19 44.51 3hpe s LEU 114 CO 0.08 0.30 -0.11 -0.89 -1.32 0.00 0.00 176.35 174.41 3hpe s THR 115 N -0.37 1.10 -0.19 3.68 2.01 0.72 -1.52 115.64 121.07 3hpe s THR 115 Ca 0.11 -0.43 -0.14 0.00 0.31 0.00 0.00 61.69 61.53 3hpe s THR 115 Cb -0.12 -1.03 0.06 0.00 0.01 0.00 0.00 72.50 71.42 3hpe s THR 115 CO 0.01 0.35 0.49 -0.76 -0.69 0.00 0.00 174.62 174.03 3hpe s LEU 116 N 0.87 -0.11 -1.35 4.42 1.02 -0.21 -1.43 118.68 121.90 3hpe s LEU 116 Ca -0.11 1.03 -0.05 0.00 0.02 0.00 0.00 54.13 55.03 3hpe s LEU 116 Cb -0.15 1.67 0.03 0.00 0.02 0.00 0.00 46.19 47.76 3hpe s LEU 116 CO 0.01 -0.19 0.35 1.57 0.02 0.00 0.00 176.35 178.12 3hpe n HIS 117 N 3.51 -1.68 -0.96 0.29 -0.00 -1.26 -1.14 115.22 113.98 3hpe n HIS 117 Ca -0.18 0.32 0.00 0.00 0.46 0.00 0.00 57.72 58.32 3hpe n HIS 117 Cb 0.56 -3.44 0.00 0.00 -0.12 0.00 0.00 29.99 27.00 3hpe n HIS 117 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3hpe n GLY 118 N -1.16 0.86 3.52 1.57 0.00 -1.26 -4.95 105.19 103.77 3hpe n GLY 118 Ca -0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 3hpe n GLY 118 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hpe s VAL 119 N -3.54 3.33 -0.09 1.61 1.01 -0.29 -5.13 120.40 117.30 3hpe s VAL 119 Ca 0.00 -0.63 0.05 0.00 0.00 0.00 0.00 61.98 61.40 3hpe s VAL 119 Cb 0.00 -2.33 -0.00 0.00 0.00 0.00 0.00 36.38 34.05 3hpe s VAL 119 CO 0.00 0.59 -0.24 -0.89 0.00 0.00 0.00 175.10 174.57 3hpe s THR 120 N -0.77 2.13 0.01 3.92 2.01 -1.26 -1.04 115.64 120.65 3hpe s THR 120 Ca 0.12 -1.01 0.02 0.00 0.31 0.00 0.00 61.69 61.12 3hpe s THR 120 Cb -0.11 -1.80 -0.01 0.00 0.01 0.00 0.00 72.50 70.59 3hpe s THR 120 CO 0.01 0.56 -0.06 -0.54 -0.69 0.00 0.00 174.62 173.90 3hpe s LYS 121 N 0.15 0.43 0.36 4.92 -0.14 -0.57 -4.96 119.74 119.91 3hpe s LYS 121 Ca -0.13 -0.41 -0.26 0.00 -1.36 0.00 0.00 55.97 53.81 3hpe s LYS 121 Cb -0.16 -0.31 -0.09 0.00 -1.68 0.00 0.00 37.83 35.59 3hpe s LYS 121 CO 0.07 0.07 1.13 -1.25 -0.76 0.00 0.00 175.35 174.61 3hpe s PRO 122 N -0.72 4.28 0.19 -1.68 0.04 -1.26 -1.55 135.00 134.30 3hpe s PRO 122 Ca -0.04 1.77 -0.06 0.00 0.04 0.00 0.00 61.00 62.71 3hpe s PRO 122 Cb -0.05 -2.82 -0.02 0.00 0.04 0.00 0.00 34.50 31.64 3hpe s PRO 122 CO -0.00 -0.11 0.25 0.14 0.04 0.00 0.00 177.00 177.33 3hpe s VAL 123 N -1.38 0.03 -0.11 -0.36 -7.23 0.43 -4.90 120.40 106.88 3hpe s VAL 123 Ca 0.53 -1.67 0.00 0.00 -1.81 0.00 0.00 61.98 59.04 3hpe s VAL 123 Cb -0.30 -2.18 0.02 0.00 0.56 0.00 0.00 36.38 34.48 3hpe s VAL 123 CO 0.38 -0.14 -0.10 -0.69 -0.31 0.00 0.00 175.10 174.23 3hpe s VAL 124 N -4.06 1.19 -0.13 1.32 1.01 -1.26 -1.03 120.40 117.44 3hpe s VAL 124 Ca 0.27 -0.42 -0.08 0.00 0.00 0.00 0.00 61.98 61.75 3hpe s VAL 124 Cb 0.04 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 3hpe s VAL 124 CO 0.07 0.39 0.14 -0.76 0.00 0.00 0.00 175.10 174.94 3hpe s LEU 125 N 1.41 4.36 -0.11 3.92 1.02 0.05 -4.68 118.68 124.64 3hpe s LEU 125 Ca 0.00 0.44 -0.23 0.00 0.02 0.00 0.00 54.13 54.36 3hpe s LEU 125 Cb -0.13 -2.08 -0.03 0.00 0.02 0.00 0.00 46.19 43.97 3hpe s LEU 125 CO -0.06 0.37 0.69 -0.70 0.02 0.00 0.00 176.35 176.67 3hpe s GLU 126 N -0.80 4.37 0.20 1.70 2.56 0.80 -0.49 118.70 127.04 3hpe s GLU 126 Ca 0.14 0.82 0.06 0.00 0.00 0.00 0.00 54.97 55.99 3hpe s GLU 126 Cb -0.12 -3.49 -0.05 0.00 2.00 0.00 0.00 34.13 32.47 3hpe s GLU 126 CO 0.03 -0.04 -0.10 0.00 -0.56 0.00 0.00 175.26 174.59 3hpe s ALA 127 N 1.19 1.89 -0.08 6.30 0.00 0.64 -0.74 121.76 130.96 3hpe s ALA 127 Ca 0.35 -1.66 -0.03 0.00 0.00 0.00 0.00 51.96 50.62 3hpe s ALA 127 Cb -0.17 0.05 0.04 0.00 0.00 0.00 0.00 23.12 23.05 3hpe s ALA 127 CO 0.15 -0.03 0.16 0.21 0.00 0.00 0.00 175.76 176.25 3hpe s LYS 128 N -3.71 0.09 -0.10 0.00 2.20 0.53 -4.67 119.74 114.09 3hpe s LYS 128 Ca 0.23 0.45 0.02 0.00 -0.36 0.00 0.00 55.97 56.30 3hpe s LYS 128 Cb 0.01 -0.19 -0.01 0.00 -1.51 0.00 0.00 37.83 36.13 3hpe s LYS 128 CO 0.06 -0.20 -0.17 0.42 -0.36 0.00 0.00 175.35 175.10 3hpe s ILE 129 N 1.48 2.74 -0.10 5.43 -1.09 -1.26 -1.29 121.20 127.11 3hpe s ILE 129 Ca -0.06 -0.79 0.04 0.00 -2.23 0.00 0.00 60.65 57.61 3hpe s ILE 129 Cb -0.12 -2.11 -0.00 0.00 -1.58 0.00 0.00 42.46 38.65 3hpe s ILE 129 CO -0.06 0.55 -0.24 -1.10 -1.23 0.00 0.00 174.94 172.85 3hpe s GLN 130 N 0.14 2.99 0.00 2.79 -1.52 -0.41 -5.01 119.66 118.65 3hpe s GLN 130 Ca -0.09 -0.88 0.00 0.00 -1.95 0.00 0.00 55.36 52.44 3hpe s GLN 130 Cb -0.15 -2.28 0.00 0.00 -0.22 0.00 0.00 33.01 30.35 3hpe s GLN 130 CO 0.05 0.20 0.00 0.00 -0.25 0.00 0.00 175.29 175.30 3hpe n ALA 131 N 3.45 0.00 -1.82 6.09 0.00 -1.26 -1.12 120.51 125.85 3hpe n ALA 131 Ca -0.19 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.85 3hpe n ALA 131 Cb 0.53 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.94 3hpe n ALA 131 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hpe s PRO 132 N -2.00 4.62 0.24 0.00 0.04 -1.26 -4.81 135.00 131.83 3hpe s PRO 132 Ca 0.00 1.81 0.12 0.00 0.04 0.00 0.00 61.00 62.96 3hpe s PRO 132 Cb 0.00 -3.20 -0.05 0.00 0.04 0.00 0.00 34.50 31.29 3hpe s PRO 132 CO 0.00 0.17 -0.22 -0.51 0.04 0.00 0.00 177.00 176.48 3hpe s LEU 133 N -1.22 2.53 -0.12 -3.56 2.01 -0.19 -4.99 118.68 113.14 3hpe s LEU 133 Ca 0.46 -0.95 0.03 0.00 0.01 0.00 0.00 54.13 53.68 3hpe s LEU 133 Cb -0.32 -1.14 0.01 0.00 0.01 0.00 0.00 46.19 44.75 3hpe s LEU 133 CO 0.40 0.08 -0.22 -1.58 1.01 0.00 0.00 176.35 176.04 3hpe s GLN 134 N -3.13 2.90 -0.12 1.70 0.74 -1.26 -0.44 119.66 120.06 3hpe s GLN 134 Ca 0.26 -0.82 -0.29 0.00 0.05 0.00 0.00 55.36 54.56 3hpe s GLN 134 Cb -0.06 -2.31 -0.05 0.00 1.10 0.00 0.00 33.01 31.69 3hpe s GLN 134 CO 0.13 0.04 1.67 1.21 -0.55 0.00 0.00 175.29 177.79 3hpe s ASN 135 N 0.69 6.50 0.00 6.67 3.84 0.26 -4.85 114.94 128.06 3hpe s ASN 135 Ca -0.11 2.01 0.10 0.00 0.21 0.00 0.00 52.86 55.08 3hpe s ASN 135 Cb -0.16 -2.53 0.45 0.00 -0.55 0.00 0.00 41.25 38.46 3hpe s ASN 135 CO 0.01 -1.09 1.33 -0.81 -2.79 0.00 0.00 177.10 173.75 3hpe n PRO 136 N 7.40 0.01 0.00 0.43 -0.04 -1.26 -1.67 135.00 139.87 3hpe n PRO 136 Ca 0.18 0.31 0.00 0.00 -0.04 0.00 0.00 63.50 63.96 3hpe n PRO 136 Cb 0.44 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.40 3hpe n PRO 136 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3hpe n MET 137 N -1.49 0.00 -0.06 0.54 2.81 -1.26 -4.65 117.12 113.01 3hpe n MET 137 Ca 0.03 0.20 0.09 0.00 -1.81 0.00 0.00 57.70 56.20 3hpe n MET 137 Cb 0.12 -0.63 0.38 0.00 -0.71 0.00 0.00 33.22 32.38 3hpe n MET 137 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 3hpe n ASN 138 N -1.88 1.00 0.00 7.83 0.23 -1.24 -4.91 115.26 116.30 3hpe n ASN 138 Ca 0.00 -1.67 0.00 0.00 -0.53 0.00 0.00 54.58 52.38 3hpe n ASN 138 Cb 0.00 -0.08 0.00 0.00 -2.08 0.00 0.00 39.78 37.62 3hpe n ASN 138 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3hpe n LYS 139 N -0.09 -1.53 -3.00 -3.83 4.76 -0.67 -4.99 118.16 108.82 3hpe n LYS 139 Ca 0.14 0.38 -0.35 0.00 -2.87 0.00 0.00 58.31 55.61 3hpe n LYS 139 Cb 0.21 -4.69 -0.06 0.00 -1.84 0.00 0.00 35.03 28.65 3hpe n LYS 139 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 3hpe s LYS 140 N -1.64 4.25 0.11 1.97 1.02 -1.26 -4.65 119.74 119.54 3hpe s LYS 140 Ca 0.00 0.95 -0.28 0.00 0.02 0.00 0.00 55.97 56.66 3hpe s LYS 140 Cb 0.00 -2.62 -0.06 0.00 -0.52 0.00 0.00 37.83 34.63 3hpe s LYS 140 CO 0.00 0.23 0.89 -2.00 -0.92 0.00 0.00 175.35 173.56 3hpe s GLU 141 N -2.47 4.65 0.19 1.68 2.12 -1.26 -0.58 118.70 123.04 3hpe s GLU 141 Ca 0.51 1.33 0.03 0.00 0.36 0.00 0.00 54.97 57.20 3hpe s GLU 141 Cb -0.14 -3.36 -0.01 0.00 0.26 0.00 0.00 34.13 30.88 3hpe s GLU 141 CO 0.19 0.28 0.19 1.97 -0.54 0.00 0.00 175.26 177.35 3hpe n PHE 142 N 2.60 -0.56 -3.87 5.30 -1.74 0.41 -2.28 117.46 117.32 3hpe n PHE 142 Ca 0.00 -1.58 -0.11 0.00 -0.56 0.00 0.00 57.45 55.20 3hpe n PHE 142 Cb 0.49 0.20 -0.11 0.00 1.52 0.00 0.00 39.48 41.58 3hpe n PHE 142 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3hpe s MET 143 N -2.72 0.34 -0.21 3.97 0.23 -0.48 -1.02 119.30 119.41 3hpe s MET 143 Ca 0.22 -0.24 -0.09 0.00 -1.03 0.00 0.00 55.69 54.55 3hpe s MET 143 Cb 0.01 0.14 -0.05 0.00 -1.53 0.00 0.00 34.83 33.41 3hpe s MET 143 CO 0.16 -0.07 0.11 0.08 -2.03 0.00 0.00 175.02 173.27 3hpe s VAL 144 N -0.90 5.13 -0.18 5.16 1.01 -0.28 -0.62 120.40 129.73 3hpe s VAL 144 Ca -0.10 0.09 -0.01 0.00 0.00 0.00 0.00 61.98 61.97 3hpe s VAL 144 Cb -0.06 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 32.97 3hpe s VAL 144 CO 0.01 0.41 -0.14 -0.22 0.00 0.00 0.00 175.10 175.16 3hpe s LEU 145 N 0.66 2.50 -0.05 3.92 0.20 -0.15 -1.28 118.68 124.48 3hpe s LEU 145 Ca 0.06 -0.49 0.04 0.00 0.69 0.00 0.00 54.13 54.43 3hpe s LEU 145 Cb -0.12 -1.59 -0.00 0.00 -0.43 0.00 0.00 46.19 44.05 3hpe s LEU 145 CO 0.01 0.04 -0.18 -1.10 -0.29 0.00 0.00 176.35 174.84 3hpe s GLN 146 N 1.07 1.94 0.02 1.98 -0.21 -0.41 0.51 119.66 124.56 3hpe s GLN 146 Ca -0.00 -0.62 -0.02 0.00 0.02 0.00 0.00 55.36 54.73 3hpe s GLN 146 Cb -0.14 -1.64 -0.02 0.00 1.00 0.00 0.00 33.01 32.21 3hpe s GLN 146 CO -0.04 0.22 0.01 0.00 -2.12 0.00 0.00 175.29 173.36 3hpe s ALA 147 N 0.14 0.06 -0.05 6.09 0.00 0.25 -0.34 121.76 127.91 3hpe s ALA 147 Ca -0.07 -0.56 -0.03 0.00 0.00 0.00 0.00 51.96 51.30 3hpe s ALA 147 Cb -0.13 0.17 0.02 0.00 0.00 0.00 0.00 23.12 23.18 3hpe s ALA 147 CO 0.03 -0.21 0.11 -1.21 0.00 0.00 0.00 175.76 174.49 3hpe s GLU 148 N -1.82 0.10 0.35 0.00 2.02 0.09 0.55 118.70 119.98 3hpe s GLU 148 Ca -0.12 0.23 0.04 0.00 0.02 0.00 0.00 54.97 55.13 3hpe s GLU 148 Cb -0.07 -0.05 -0.01 0.00 0.10 0.00 0.00 34.13 34.10 3hpe s GLU 148 CO -0.02 -0.08 0.38 0.20 0.02 0.00 0.00 175.26 175.76 3hpe s GLY 149 N 0.54 2.02 -0.02 -1.39 0.00 0.23 -0.14 107.32 108.55 3hpe s GLY 149 Ca -0.04 -1.86 -0.05 0.00 0.00 0.00 0.00 44.72 42.77 3hpe s GLY 149 CO -0.02 -1.27 0.11 -1.59 0.00 0.00 0.00 173.10 170.33 3hpe s LYS 150 N -3.17 0.27 0.07 2.90 -2.85 -1.26 -0.87 119.74 114.84 3hpe s LYS 150 Ca 0.36 -0.09 -0.01 0.00 -1.00 0.00 0.00 55.97 55.23 3hpe s LYS 150 Cb 0.01 0.12 -0.04 0.00 -2.06 0.00 0.00 37.83 35.85 3hpe s LYS 150 CO 0.26 -0.05 -0.01 0.96 0.10 0.00 0.00 175.35 176.60 3hpe s ILE 151 N -0.56 0.22 -0.28 3.79 -4.36 -0.44 -4.95 121.20 114.63 3hpe s ILE 151 Ca -0.06 -1.84 -0.16 0.00 -0.26 0.00 0.00 60.65 58.33 3hpe s ILE 151 Cb -0.04 -1.64 -0.03 0.00 1.25 0.00 0.00 42.46 42.00 3hpe s ILE 151 CO 0.00 -0.88 0.42 0.21 0.24 0.00 0.00 174.94 174.93 3hpe s ASN 152 N -2.95 6.30 0.45 4.36 3.84 -1.26 0.05 114.94 125.73 3hpe s ASN 152 Ca 0.11 0.29 0.16 0.00 0.21 0.00 0.00 52.86 53.63 3hpe s ASN 152 Cb 0.08 -2.23 1.11 0.00 -0.55 0.00 0.00 41.25 39.66 3hpe s ASN 152 CO -0.07 -0.25 1.97 0.08 -2.79 0.00 0.00 177.10 176.04 3hpe h ARG 153 N 8.18 0.31 0.00 0.43 0.11 -1.17 -1.64 114.38 120.61 3hpe h ARG 153 Ca -0.30 -0.02 -0.04 0.00 0.10 0.00 0.00 59.98 59.72 3hpe h ARG 153 Cb 1.15 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 32.16 3hpe h ARG 153 CO 0.68 0.21 -0.18 0.87 0.10 0.00 0.00 179.97 181.65 3hpe h LYS 154 N 0.32 0.00 0.00 0.08 1.57 -1.77 -1.58 116.57 115.19 3hpe h LYS 154 Ca 0.29 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.04 3hpe h LYS 154 Cb 0.69 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.99 3hpe h LYS 154 CO -0.07 0.18 -0.11 -0.44 -0.57 0.00 0.00 179.45 178.43 3hpe h ASP 155 N 0.00 0.00 -0.64 0.86 3.32 -1.67 -1.23 116.42 117.06 3hpe h ASP 155 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hpe h ASP 155 Cb 0.59 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.14 3hpe h ASP 155 CO 0.02 0.11 0.00 0.49 -1.72 0.00 0.00 179.24 178.15 3hpe n PHE 156 N -3.52 0.85 -2.32 4.55 3.72 -0.68 -4.95 117.46 115.12 3hpe n PHE 156 Ca -0.01 -0.43 -0.18 0.00 -0.05 0.00 0.00 57.45 56.78 3hpe n PHE 156 Cb 0.25 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.78 3hpe n PHE 156 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hpe n GLY 157 N 1.63 -0.32 3.47 1.37 0.00 -0.46 -4.70 105.19 106.17 3hpe n GLY 157 Ca 0.23 -0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 3hpe n GLY 157 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hpe s ILE 158 N -2.91 4.90 -0.26 -0.61 1.01 -0.70 -4.50 121.20 118.13 3hpe s ILE 158 Ca 0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 60.65 60.30 3hpe s ILE 158 Cb 0.00 -4.24 0.00 0.00 0.01 0.00 0.00 42.46 38.23 3hpe s ILE 158 CO 0.00 -0.70 0.22 0.61 0.00 0.00 0.00 174.94 175.07 3hpe n GLY 159 N 5.13 0.55 0.36 6.18 0.00 -1.19 -4.16 105.19 112.06 3hpe n GLY 159 Ca -0.06 -0.46 0.18 0.00 0.00 0.00 0.00 46.02 45.69 3hpe n GLY 159 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hpe h LYS 160 N -0.49 0.00 -0.00 1.61 1.57 -1.80 -0.99 116.57 116.46 3hpe h LYS 160 Ca -0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 3hpe h LYS 160 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 3hpe h LYS 160 CO 0.11 0.00 -0.33 0.25 -0.57 0.00 0.00 179.45 178.91 3hpe n THR 161 N -3.67 0.00 -3.57 -0.16 -2.24 -1.26 -4.75 114.28 98.62 3hpe n THR 161 Ca 0.03 -0.05 -0.39 0.00 -2.27 0.00 0.00 64.05 61.37 3hpe n THR 161 Cb 0.44 0.20 -0.11 0.00 -2.10 0.00 0.00 70.33 68.76 3hpe n THR 161 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 3hpe s PHE 162 N -2.75 3.22 0.63 4.78 0.08 -0.38 -5.08 117.98 118.48 3hpe s PHE 162 Ca 0.18 -0.04 -0.16 0.00 0.12 0.00 0.00 56.93 57.03 3hpe s PHE 162 Cb 0.19 -2.41 -0.02 0.00 -0.57 0.00 0.00 43.02 40.21 3hpe s PHE 162 CO 0.59 -0.25 1.11 0.45 -0.10 0.00 0.00 175.22 177.02 3hpe s SER 163 N 1.74 5.31 0.57 1.36 0.15 -1.26 -4.81 113.70 116.76 3hpe s SER 163 Ca 0.07 2.03 0.26 0.00 0.70 0.00 0.00 55.95 59.00 3hpe s SER 163 Cb -0.17 -2.56 1.64 0.00 -1.71 0.00 0.00 66.02 63.23 3hpe s SER 163 CO 0.11 -1.50 2.17 -0.78 1.20 0.00 0.00 173.24 174.44 3hpe h ASP 164 N 0.34 0.00 1.11 5.45 3.58 -1.94 -0.98 116.42 123.97 3hpe h ASP 164 Ca -0.48 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.97 3hpe h ASP 164 Cb 1.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.30 3hpe h ASP 164 CO 0.55 0.00 0.00 0.00 -2.88 0.00 0.00 179.24 176.91 3hpe h ALA 165 N 1.91 1.00 0.00 -0.78 0.00 -1.97 -3.21 119.26 116.22 3hpe h ALA 165 Ca 0.04 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.73 3hpe h ALA 165 Cb 0.21 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3hpe h ALA 165 CO -0.00 0.00 -1.63 0.28 0.00 0.00 0.00 179.25 177.90 3hpe n VAL 166 N -2.47 1.12 -4.05 0.00 0.31 -0.45 -3.52 118.33 109.26 3hpe n VAL 166 Ca 0.03 -0.12 -0.32 0.00 -0.01 0.00 0.00 64.34 63.93 3hpe n VAL 166 Cb 0.33 -1.84 -0.16 0.00 -0.91 0.00 0.00 33.84 31.26 3hpe n VAL 166 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3hpe s VAL 167 N -2.41 1.97 0.12 2.52 1.01 -0.71 -1.48 120.40 121.42 3hpe s VAL 167 Ca -0.24 -1.28 -0.34 0.00 0.00 0.00 0.00 61.98 60.12 3hpe s VAL 167 Cb 0.08 -2.00 -0.17 0.00 0.00 0.00 0.00 36.38 34.28 3hpe s VAL 167 CO 0.31 0.16 1.04 0.61 0.00 0.00 0.00 175.10 177.22 3hpe n GLY 168 N 4.56 -0.31 0.27 4.51 0.00 0.31 -3.87 105.19 110.65 3hpe n GLY 168 Ca -0.16 0.58 0.01 0.00 0.00 0.00 0.00 46.02 46.45 3hpe n GLY 168 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3hpe h ASP 169 N 2.97 0.44 -3.26 1.61 3.32 -1.90 -3.44 116.42 116.15 3hpe h ASP 169 Ca -0.43 -0.08 -0.58 0.00 0.02 0.00 0.00 57.03 55.97 3hpe h ASP 169 Cb 1.38 -0.12 -0.06 0.00 0.22 0.00 0.00 39.33 40.76 3hpe h ASP 169 CO 0.67 0.51 -0.07 -0.70 -1.72 0.00 0.00 179.24 177.93 3hpe s GLU 170 N -4.98 4.25 -0.15 3.56 2.12 -1.26 -0.58 118.70 121.65 3hpe s GLU 170 Ca -0.07 0.64 0.00 0.00 0.36 0.00 0.00 54.97 55.90 3hpe s GLU 170 Cb 0.16 -3.33 0.03 0.00 0.26 0.00 0.00 34.13 31.25 3hpe s GLU 170 CO 0.76 0.41 -0.11 0.08 -0.54 0.00 0.00 175.26 175.86 3hpe s VAL 171 N -0.30 1.40 0.00 3.70 1.01 0.11 -4.49 120.40 121.83 3hpe s VAL 171 Ca 0.29 -0.60 -0.29 0.00 0.00 0.00 0.00 61.98 61.38 3hpe s VAL 171 Cb -0.18 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 3hpe s VAL 171 CO 0.16 0.36 0.93 -0.75 0.00 0.00 0.00 175.10 175.80 3hpe s LYS 172 N 1.54 4.56 -0.15 2.72 2.20 -0.67 -1.32 119.74 128.62 3hpe s LYS 172 Ca 0.04 1.34 -0.02 0.00 -0.36 0.00 0.00 55.97 56.97 3hpe s LYS 172 Cb -0.13 -3.45 -0.02 0.00 -1.51 0.00 0.00 37.83 32.72 3hpe s LYS 172 CO -0.09 0.00 -0.08 0.42 -0.36 0.00 0.00 175.35 175.24 3hpe s ILE 173 N 0.84 3.41 -0.06 5.43 -1.09 -0.05 -0.65 121.20 129.03 3hpe s ILE 173 Ca 0.49 -0.53 0.01 0.00 -2.23 0.00 0.00 60.65 58.40 3hpe s ILE 173 Cb -0.21 -2.47 0.02 0.00 -1.58 0.00 0.00 42.46 38.22 3hpe s ILE 173 CO 0.27 0.50 -0.08 -1.61 -1.23 0.00 0.00 174.94 172.79 3hpe s GLU 174 N 0.50 1.21 -0.12 2.79 2.02 -0.41 -0.60 118.70 124.07 3hpe s GLU 174 Ca -0.06 -0.23 -0.02 0.00 0.02 0.00 0.00 54.97 54.68 3hpe s GLU 174 Cb -0.15 -1.10 -0.03 0.00 0.10 0.00 0.00 34.13 32.95 3hpe s GLU 174 CO 0.04 -0.05 -0.06 -0.51 0.02 0.00 0.00 175.26 174.69 3hpe s LEU 175 N 0.87 3.13 -0.28 1.80 1.43 0.19 -0.43 118.68 125.39 3hpe s LEU 175 Ca -0.11 -0.13 -0.00 0.00 -1.03 0.00 0.00 54.13 52.85 3hpe s LEU 175 Cb -0.15 -1.72 0.09 0.00 0.03 0.00 0.00 46.19 44.44 3hpe s LEU 175 CO 0.01 0.23 0.06 -0.54 0.23 0.00 0.00 176.35 176.34 3hpe s LYS 176 N -0.04 0.93 -0.06 1.70 1.02 0.03 -0.58 119.74 122.74 3hpe s LYS 176 Ca 0.00 -1.02 0.05 0.00 0.02 0.00 0.00 55.97 55.03 3hpe s LYS 176 Cb -0.13 -2.23 -0.01 0.00 -0.52 0.00 0.00 37.83 34.93 3hpe s LYS 176 CO 0.03 -0.85 -0.23 -0.51 -0.92 0.00 0.00 175.35 172.87 3hpe s LEU 177 N 1.55 2.21 -0.17 3.17 1.43 0.18 0.80 118.68 127.86 3hpe s LEU 177 Ca 0.05 -0.45 -0.02 0.00 -1.03 0.00 0.00 54.13 52.68 3hpe s LEU 177 Cb -0.18 -1.41 -0.01 0.00 0.03 0.00 0.00 46.19 44.62 3hpe s LEU 177 CO -0.17 0.26 -0.09 -1.61 0.23 0.00 0.00 176.35 174.96 3hpe s GLU 178 N -0.24 3.39 -0.06 1.70 2.02 -1.26 -0.97 118.70 123.27 3hpe s GLU 178 Ca -0.01 -0.65 0.02 0.00 0.02 0.00 0.00 54.97 54.34 3hpe s GLU 178 Cb -0.13 -2.80 0.02 0.00 0.10 0.00 0.00 34.13 31.32 3hpe s GLU 178 CO 0.03 0.04 -0.10 0.00 0.02 0.00 0.00 175.26 175.25 3hpe s ALA 179 N 0.83 1.14 -0.12 5.21 0.00 0.21 -0.15 121.76 128.88 3hpe s ALA 179 Ca -0.03 -0.35 -0.17 0.00 0.00 0.00 0.00 51.96 51.41 3hpe s ALA 179 Cb -0.15 -0.57 -0.04 0.00 0.00 0.00 0.00 23.12 22.36 3hpe s ALA 179 CO 0.01 0.04 0.42 0.71 0.00 0.00 0.00 175.76 176.94 3hpe s TYR 180 N 0.81 3.51 -1.29 0.00 2.02 0.11 -1.38 117.35 121.13 3hpe s TYR 180 Ca -0.12 0.81 0.00 0.00 -0.37 0.00 0.00 57.07 57.39 3hpe s TYR 180 Cb -0.15 -2.47 0.00 0.00 -0.40 0.00 0.00 41.96 38.94 3hpe s TYR 180 CO 0.02 0.23 0.32 0.00 -1.57 0.00 0.00 175.55 174.55