#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ves s TRP 2 N 0.00 -0.25 -0.22 0.00 1.48 -0.69 -5.00 118.94 114.25 1ves s TRP 2 Ca 0.00 0.29 -0.12 0.00 -1.06 0.00 0.00 56.10 55.21 1ves s TRP 2 Cb 0.00 0.18 -0.05 0.00 -1.16 0.00 0.00 33.47 32.44 1ves s TRP 2 CO 0.00 -0.50 0.22 0.08 -4.06 0.00 0.00 176.95 172.69 1ves s VAL 3 N -1.98 5.32 -0.56 -0.66 1.01 -1.26 -0.04 120.40 122.23 1ves s VAL 3 Ca -0.09 0.32 -0.18 0.00 0.00 0.00 0.00 61.98 62.04 1ves s VAL 3 Cb -0.02 -3.56 0.11 0.00 0.00 0.00 0.00 36.38 32.91 1ves s VAL 3 CO 0.01 0.34 0.61 -0.62 0.00 0.00 0.00 175.10 175.44 1ves s ASP 4 N 0.95 6.19 -0.24 3.32 -1.08 0.21 -4.40 116.67 121.62 1ves s ASP 4 Ca 0.11 -1.53 -0.06 0.00 -0.52 0.00 0.00 52.55 50.54 1ves s ASP 4 Cb -0.13 -2.26 -0.02 0.00 -1.46 0.00 0.00 42.92 39.04 1ves s ASP 4 CO 0.05 -0.99 0.03 -1.58 0.52 0.00 0.00 175.17 173.19 1ves s GLN 5 N 2.25 3.56 0.11 4.34 0.74 -1.26 -1.47 119.66 127.93 1ves s GLN 5 Ca 0.08 -0.53 0.06 0.00 0.05 0.00 0.00 55.36 55.03 1ves s GLN 5 Cb -0.26 -3.21 -0.04 0.00 1.10 0.00 0.00 33.01 30.60 1ves s GLN 5 CO 0.05 -0.18 -0.15 0.95 -0.55 0.00 0.00 175.29 175.41 1ves s THR 6 N 1.54 1.38 0.68 -0.34 -4.23 -0.21 -4.40 115.64 110.06 1ves s THR 6 Ca 0.06 -1.61 -0.11 0.00 -1.18 0.00 0.00 61.69 58.85 1ves s THR 6 Cb -0.15 -1.45 -0.00 0.00 1.34 0.00 0.00 72.50 72.24 1ves s THR 6 CO 0.01 -0.31 1.07 -2.16 -0.54 0.00 0.00 174.62 172.70 1ves s PRO 7 N -2.34 3.10 0.13 3.99 0.04 -1.26 -0.31 135.00 138.35 1ves s PRO 7 Ca 0.07 0.56 -0.09 0.00 0.04 0.00 0.00 61.00 61.58 1ves s PRO 7 Cb -0.07 -2.04 -0.08 0.00 0.04 0.00 0.00 34.50 32.35 1ves s PRO 7 CO 0.03 -0.88 1.36 0.00 0.04 0.00 0.00 177.00 177.55 1ves h ARG 8 N -0.54 0.68 -4.95 4.56 3.08 -1.78 -3.38 114.38 112.05 1ves h ARG 8 Ca -0.45 -0.54 -0.31 0.00 0.07 0.00 0.00 59.98 58.75 1ves h ARG 8 Cb 1.23 0.11 -0.17 0.00 0.08 0.00 0.00 29.97 31.22 1ves h ARG 8 CO 0.63 1.16 -0.72 0.95 -1.07 0.00 0.00 179.97 180.92 1ves s THR 9 N -3.75 0.97 -0.10 2.04 -4.23 -1.26 -0.84 115.64 108.46 1ves s THR 9 Ca -0.09 -1.78 -0.20 0.00 -1.18 0.00 0.00 61.69 58.44 1ves s THR 9 Cb 0.09 -1.52 0.05 0.00 1.34 0.00 0.00 72.50 72.46 1ves s THR 9 CO 0.88 -0.65 0.48 0.00 -0.54 0.00 0.00 174.62 174.80 1ves s ALA 10 N -2.82 -1.22 -0.11 3.99 0.00 -0.57 -4.88 121.76 116.15 1ves s ALA 10 Ca 0.09 1.04 0.03 0.00 0.00 0.00 0.00 51.96 53.12 1ves s ALA 10 Cb -0.00 -0.33 0.01 0.00 0.00 0.00 0.00 23.12 22.80 1ves s ALA 10 CO -0.00 -0.28 -0.20 0.99 0.00 0.00 0.00 175.76 176.27 1ves s THR 11 N -0.61 1.80 0.12 0.00 2.01 -1.26 -0.86 115.64 116.84 1ves s THR 11 Ca -0.07 -0.85 0.04 0.00 0.31 0.00 0.00 61.69 61.12 1ves s THR 11 Cb -0.03 -1.59 -0.04 0.00 0.01 0.00 0.00 72.50 70.85 1ves s THR 11 CO 0.04 0.50 -0.10 -0.54 -0.69 0.00 0.00 174.62 173.83 1ves s LYS 12 N 0.66 0.97 0.42 4.92 -0.14 -0.07 -4.98 119.74 121.52 1ves s LYS 12 Ca -0.12 -1.32 -0.02 0.00 -1.36 0.00 0.00 55.97 53.14 1ves s LYS 12 Cb -0.16 -0.60 -0.03 0.00 -1.68 0.00 0.00 37.83 35.36 1ves s LYS 12 CO 0.03 0.08 0.67 -1.21 -0.76 0.00 0.00 175.35 174.16 1ves s GLU 13 N -3.31 3.50 0.45 1.68 2.02 -1.26 -1.69 118.70 120.08 1ves s GLU 13 Ca 0.12 -0.08 -0.25 0.00 0.02 0.00 0.00 54.97 54.77 1ves s GLU 13 Cb 0.00 -2.52 -0.08 0.00 0.10 0.00 0.00 34.13 31.63 1ves s GLU 13 CO 0.00 -0.04 1.41 0.95 0.02 0.00 0.00 175.26 177.60 1ves s THR 14 N -2.53 2.15 0.00 3.63 -4.23 -0.84 -2.50 115.64 111.32 1ves s THR 14 Ca 0.44 0.14 0.00 0.00 -1.18 0.00 0.00 61.69 61.08 1ves s THR 14 Cb -0.10 -3.08 0.00 0.00 1.34 0.00 0.00 72.50 70.66 1ves s THR 14 CO 0.40 0.02 0.00 0.61 -0.54 0.00 0.00 174.62 175.11 1ves n GLY 15 N 0.59 2.91 3.94 3.99 0.00 0.78 -4.88 105.19 112.52 1ves n GLY 15 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1ves n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ves s GLU 16 N -0.61 0.58 0.15 1.61 2.02 -1.04 -3.95 118.70 117.46 1ves s GLU 16 Ca 0.00 -0.50 0.10 0.00 0.02 0.00 0.00 54.97 54.59 1ves s GLU 16 Cb 0.00 -1.87 -0.04 0.00 0.10 0.00 0.00 34.13 32.32 1ves s GLU 16 CO 0.00 -2.43 -0.20 -1.12 0.02 0.00 0.00 175.26 171.53 1ves s SER 17 N -4.91 3.72 -0.08 -0.19 0.01 -1.26 -1.16 113.70 109.83 1ves s SER 17 Ca 0.75 -0.67 0.05 0.00 1.31 0.00 0.00 55.95 57.38 1ves s SER 17 Cb -0.03 -0.44 -0.01 0.00 0.21 0.00 0.00 66.02 65.75 1ves s SER 17 CO 0.53 0.16 -0.23 -0.22 0.41 0.00 0.00 173.24 173.89 1ves s LEU 18 N -2.34 2.18 -0.18 2.44 0.20 -0.26 -4.97 118.68 115.76 1ves s LEU 18 Ca 0.19 -0.49 -0.04 0.00 0.69 0.00 0.00 54.13 54.48 1ves s LEU 18 Cb -0.10 -1.42 -0.02 0.00 -0.43 0.00 0.00 46.19 44.22 1ves s LEU 18 CO 0.10 0.22 -0.04 -0.89 -0.29 0.00 0.00 176.35 175.45 1ves s THR 19 N 0.00 3.75 -0.16 3.68 2.01 -1.26 -0.62 115.64 123.05 1ves s THR 19 Ca -0.08 -0.40 -0.03 0.00 0.31 0.00 0.00 61.69 61.49 1ves s THR 19 Cb -0.15 -2.66 -0.02 0.00 0.01 0.00 0.00 72.50 69.67 1ves s THR 19 CO 0.05 0.47 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.76 1ves s ILE 20 N 0.72 3.69 -0.12 1.82 1.01 0.23 -4.54 121.20 124.01 1ves s ILE 20 Ca -0.02 -0.43 -0.01 0.00 0.00 0.00 0.00 60.65 60.19 1ves s ILE 20 Cb -0.14 -2.61 -0.02 0.00 0.01 0.00 0.00 42.46 39.69 1ves s ILE 20 CO 0.02 0.49 -0.07 0.20 0.00 0.00 0.00 174.94 175.58 1ves s ASN 21 N 0.46 4.54 -0.04 3.58 0.01 0.58 -1.33 114.94 122.75 1ves s ASN 21 Ca -0.05 -0.15 0.06 0.00 -0.71 0.00 0.00 52.86 52.01 1ves s ASN 21 Cb -0.15 -1.55 -0.01 0.00 0.41 0.00 0.00 41.25 39.95 1ves s ASN 21 CO 0.03 0.22 -0.21 0.00 -1.51 0.00 0.00 177.10 175.63 1ves s VAL 23 N -0.23 0.91 -0.34 0.00 1.01 -0.54 -1.32 120.40 119.88 1ves s VAL 23 Ca 0.01 -0.28 -0.29 0.00 0.00 0.00 0.00 61.98 61.42 1ves s VAL 23 Cb -0.11 -0.90 0.01 0.00 0.00 0.00 0.00 36.38 35.37 1ves s VAL 23 CO 0.02 0.33 1.32 -0.22 0.00 0.00 0.00 175.10 176.54 1ves s LEU 24 N 1.24 3.78 -0.05 3.92 0.20 0.23 -0.62 118.68 127.38 1ves s LEU 24 Ca -0.05 1.05 -0.03 0.00 0.69 0.00 0.00 54.13 55.79 1ves s LEU 24 Cb -0.14 -3.54 -0.04 0.00 -0.43 0.00 0.00 46.19 42.04 1ves s LEU 24 CO -0.02 -1.18 0.12 -0.13 -0.29 0.00 0.00 176.35 174.84 1ves s ARG 25 N 4.39 3.27 -1.26 1.98 1.81 0.94 -4.63 118.95 125.44 1ves s ARG 25 Ca 0.57 -0.32 -0.03 0.00 -1.72 0.00 0.00 55.73 54.22 1ves s ARG 25 Cb -0.15 -3.02 -0.01 0.00 -0.45 0.00 0.00 34.95 31.33 1ves s ARG 25 CO 0.26 0.70 0.73 -3.47 -0.68 0.00 0.00 175.30 172.84 1ves n ASP 26 N 1.50 -2.17 -4.77 0.23 4.64 -1.26 -1.71 116.55 113.01 1ves n ASP 26 Ca -0.15 -0.84 -0.38 0.00 -1.38 0.00 0.00 54.79 52.03 1ves n ASP 26 Cb 0.53 -4.06 -0.04 0.00 -1.04 0.00 0.00 41.12 36.52 1ves n ASP 26 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1ves s ALA 27 N -3.62 3.24 -0.25 -1.67 0.00 -1.26 -3.07 121.76 115.13 1ves s ALA 27 Ca 0.10 0.81 -0.05 0.00 0.00 0.00 0.00 51.96 52.82 1ves s ALA 27 Cb -0.03 -3.30 -0.16 0.00 0.00 0.00 0.00 23.12 19.62 1ves s ALA 27 CO 0.81 -0.21 -0.19 0.43 0.00 0.00 0.00 175.76 176.61 1ves n SER 28 N 0.54 1.98 -4.74 0.00 7.64 -1.26 -4.98 113.62 112.81 1ves n SER 28 Ca 0.02 0.07 -0.22 0.00 1.01 0.00 0.00 58.87 59.75 1ves n SER 28 Cb 0.47 -0.61 -0.06 0.00 -1.01 0.00 0.00 64.21 63.00 1ves n SER 28 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1ves s PHE 29 N -2.51 2.89 0.02 1.43 0.08 -1.26 -5.09 117.98 113.54 1ves s PHE 29 Ca -0.35 -0.18 -0.29 0.00 0.12 0.00 0.00 56.93 56.23 1ves s PHE 29 Cb 0.10 -1.32 -0.04 0.00 -0.57 0.00 0.00 43.02 41.19 1ves s PHE 29 CO 0.58 0.55 0.93 -1.21 -0.10 0.00 0.00 175.22 175.98 1ves s GLU 30 N -3.77 4.58 0.07 0.44 2.02 -1.26 -4.99 118.70 115.78 1ves s GLU 30 Ca 0.33 1.35 -0.31 0.00 0.02 0.00 0.00 54.97 56.36 1ves s GLU 30 Cb -0.07 -3.43 -0.08 0.00 0.10 0.00 0.00 34.13 30.65 1ves s GLU 30 CO 0.22 0.05 1.72 -1.17 0.02 0.00 0.00 175.26 176.11 1ves s LEU 31 N 0.66 4.38 -0.16 1.80 2.96 -1.26 -4.56 118.68 122.50 1ves s LEU 31 Ca 0.48 2.54 -0.07 0.00 -0.22 0.00 0.00 54.13 56.86 1ves s LEU 31 Cb -0.21 -3.56 -0.07 0.00 0.50 0.00 0.00 46.19 42.85 1ves s LEU 31 CO 0.27 -0.93 -0.19 0.29 -1.32 0.00 0.00 176.35 174.46 1ves n LYS 32 N 5.96 0.34 -4.18 1.98 4.76 -0.52 -5.03 118.16 121.46 1ves n LYS 32 Ca 0.17 0.14 -0.12 0.00 -2.87 0.00 0.00 58.31 55.63 1ves n LYS 32 Cb 0.40 -1.09 -0.09 0.00 -1.84 0.00 0.00 35.03 32.41 1ves n LYS 32 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1ves s ASP 33 N -6.29 0.19 0.04 4.39 2.15 -1.15 -5.02 116.67 110.96 1ves s ASP 33 Ca -0.22 -1.36 -0.02 0.00 0.43 0.00 0.00 52.55 51.38 1ves s ASP 33 Cb 0.08 0.41 -0.02 0.00 -0.30 0.00 0.00 42.92 43.08 1ves s ASP 33 CO 0.29 -0.88 0.00 0.42 -0.17 0.00 0.00 175.17 174.83 1ves s THR 34 N -4.11 0.15 0.04 1.71 -4.23 -1.26 -1.31 115.64 106.63 1ves s THR 34 Ca 0.37 -1.27 -0.01 0.00 -1.18 0.00 0.00 61.69 59.60 1ves s THR 34 Cb 0.06 -0.87 -0.03 0.00 1.34 0.00 0.00 72.50 73.00 1ves s THR 34 CO 0.12 -0.70 -0.02 -0.83 -0.54 0.00 0.00 174.62 172.65 1ves s GLY 35 N -2.15 0.38 -0.03 3.99 0.00 -0.20 -4.97 107.32 104.33 1ves s GLY 35 Ca -0.05 -0.97 0.03 0.00 0.00 0.00 0.00 44.72 43.73 1ves s GLY 35 CO -0.05 -1.07 -0.11 -0.98 0.00 0.00 0.00 173.10 170.89 1ves s TRP 36 N -3.04 1.14 0.07 1.90 0.52 -1.26 -0.45 118.94 117.82 1ves s TRP 36 Ca -0.01 -0.31 0.03 0.00 0.02 0.00 0.00 56.10 55.82 1ves s TRP 36 Cb 0.02 -0.81 -0.03 0.00 -1.15 0.00 0.00 33.47 31.50 1ves s TRP 36 CO -0.07 -0.13 -0.09 0.71 0.02 0.00 0.00 176.95 177.39 1ves s TYR 37 N 0.23 0.84 -0.07 -1.98 2.02 0.50 -1.12 117.35 117.78 1ves s TYR 37 Ca -0.05 -0.61 -0.07 0.00 -0.37 0.00 0.00 57.07 55.98 1ves s TYR 37 Cb -0.10 -0.49 0.02 0.00 -0.40 0.00 0.00 41.96 40.99 1ves s TYR 37 CO 0.01 -0.07 0.20 -0.98 -1.57 0.00 0.00 175.55 173.14 1ves s ARG 38 N -2.26 0.22 -0.38 -0.62 1.70 -0.10 -0.53 118.95 116.98 1ves s ARG 38 Ca -0.02 0.29 -0.10 0.00 -0.47 0.00 0.00 55.73 55.42 1ves s ARG 38 Cb -0.06 0.09 0.03 0.00 -0.57 0.00 0.00 34.95 34.45 1ves s ARG 38 CO -0.01 -0.04 0.20 0.99 -1.08 0.00 0.00 175.30 175.37 1ves s THR 39 N 0.20 4.47 0.57 4.99 2.01 -0.44 -0.77 115.64 126.66 1ves s THR 39 Ca -0.01 -0.94 -0.15 0.00 0.31 0.00 0.00 61.69 60.90 1ves s THR 39 Cb -0.02 -3.53 -0.05 0.00 0.01 0.00 0.00 72.50 68.91 1ves s THR 39 CO -0.00 -0.26 1.02 -1.59 -0.69 0.00 0.00 174.62 173.10 1ves s LYS 40 N 1.53 3.59 0.25 4.92 -2.85 -1.26 -1.52 119.74 124.39 1ves s LYS 40 Ca 0.02 1.04 -0.30 0.00 -1.00 0.00 0.00 55.97 55.73 1ves s LYS 40 Cb -0.20 -2.08 -0.14 0.00 -2.06 0.00 0.00 37.83 33.35 1ves s LYS 40 CO 0.06 -0.58 1.09 -0.11 0.10 0.00 0.00 175.35 175.92 1ves n LEU 41 N -1.98 1.87 0.00 2.77 -0.00 -0.62 -1.81 117.00 117.23 1ves n LEU 41 Ca 0.07 1.17 0.00 0.00 -0.00 0.00 0.00 56.01 57.25 1ves n LEU 41 Cb 0.53 -1.28 0.00 0.00 -0.00 0.00 0.00 43.42 42.67 1ves n LEU 41 CO 0.48 -1.27 0.00 0.61 -0.00 0.00 0.00 177.39 177.21 1ves n GLY 42 N 1.53 1.97 3.25 -3.96 0.00 -1.26 -5.02 105.19 101.69 1ves n GLY 42 Ca 0.11 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 1ves n GLY 42 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ves s SER 43 N -3.32 2.36 0.00 1.61 0.15 -0.75 -5.03 113.70 108.72 1ves s SER 43 Ca 0.00 -0.58 0.23 0.00 0.70 0.00 0.00 55.95 56.30 1ves s SER 43 Cb 0.00 -0.16 0.16 0.00 -1.71 0.00 0.00 66.02 64.31 1ves s SER 43 CO 0.00 0.09 1.18 0.41 1.20 0.00 0.00 173.24 176.12 1ves n THR 44 N 1.52 0.00 -3.26 6.45 -1.04 -1.26 -4.54 114.28 112.15 1ves n THR 44 Ca -0.18 -0.11 -0.40 0.00 -2.04 0.00 0.00 64.05 61.32 1ves n THR 44 Cb 0.54 0.83 -0.08 0.00 -1.82 0.00 0.00 70.33 69.80 1ves n THR 44 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1ves s ASN 45 N -2.73 6.39 0.06 8.00 3.84 -1.26 -5.05 114.94 124.18 1ves s ASN 45 Ca 0.15 0.44 -0.30 0.00 0.21 0.00 0.00 52.86 53.36 1ves s ASN 45 Cb 0.18 -2.27 -0.05 0.00 -0.55 0.00 0.00 41.25 38.56 1ves s ASN 45 CO 0.68 -0.28 1.13 -0.70 -2.79 0.00 0.00 177.10 175.13 1ves s GLU 46 N 2.28 4.48 0.10 0.43 2.12 -1.26 -4.47 118.70 122.37 1ves s GLU 46 Ca 0.20 1.67 0.05 0.00 0.36 0.00 0.00 54.97 57.25 1ves s GLU 46 Cb -0.16 -3.37 -0.03 0.00 0.26 0.00 0.00 34.13 30.83 1ves s GLU 46 CO 0.10 -0.17 -0.13 1.14 -0.54 0.00 0.00 175.26 175.66 1ves s GLN 47 N 0.90 0.90 0.46 4.30 -2.07 0.05 -4.93 119.66 119.27 1ves s GLN 47 Ca 0.56 -1.11 -0.24 0.00 -1.82 0.00 0.00 55.36 52.75 1ves s GLN 47 Cb -0.27 -0.79 -0.07 0.00 -1.09 0.00 0.00 33.01 30.79 1ves s GLN 47 CO 0.29 0.16 1.24 0.45 -1.32 0.00 0.00 175.29 176.11 1ves s SER 48 N -2.18 6.04 -0.24 12.60 0.15 -1.26 -0.93 113.70 127.88 1ves s SER 48 Ca 0.04 2.49 -0.09 0.00 0.70 0.00 0.00 55.95 59.09 1ves s SER 48 Cb -0.06 -2.62 -0.04 0.00 -1.71 0.00 0.00 66.02 61.58 1ves s SER 48 CO 0.02 -1.02 0.13 -0.63 1.20 0.00 0.00 173.24 172.94 1ves s ILE 49 N -1.41 5.03 -0.15 6.45 1.01 -0.27 -4.87 121.20 126.98 1ves s ILE 49 Ca 0.63 0.07 -0.29 0.00 0.00 0.00 0.00 60.65 61.06 1ves s ILE 49 Cb -0.34 -3.35 -0.00 0.00 0.01 0.00 0.00 42.46 38.78 1ves s ILE 49 CO 0.41 0.34 1.04 -0.44 0.00 0.00 0.00 174.94 176.29 1ves s SER 50 N 1.24 7.17 0.02 3.58 0.01 -1.26 -4.66 113.70 119.79 1ves s SER 50 Ca 0.06 1.49 -0.30 0.00 1.31 0.00 0.00 55.95 58.51 1ves s SER 50 Cb -0.14 -2.55 -0.05 0.00 0.21 0.00 0.00 66.02 63.48 1ves s SER 50 CO 0.05 -0.55 1.31 -0.63 0.41 0.00 0.00 173.24 173.83 1ves s ILE 51 N 2.55 3.84 0.00 1.44 -1.09 -1.26 -4.83 121.20 121.85 1ves s ILE 51 Ca 0.47 1.26 0.00 0.00 -2.23 0.00 0.00 60.65 60.16 1ves s ILE 51 Cb -0.17 -3.81 0.00 0.00 -1.58 0.00 0.00 42.46 36.89 1ves s ILE 51 CO 0.13 0.04 0.00 0.61 -1.23 0.00 0.00 174.94 174.49 1ves n GLY 52 N 3.46 4.09 7.00 6.18 0.00 0.28 -5.04 105.19 121.16 1ves n GLY 52 Ca 0.11 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 45.05 1ves n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ves n GLY 53 N -1.59 2.50 0.26 -0.02 0.00 -1.26 -1.98 105.19 103.10 1ves n GLY 53 Ca 0.00 0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.19 1ves n GLY 53 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1ves h ARG 54 N 0.00 0.00 -4.40 1.61 3.08 -1.93 -3.42 114.38 109.32 1ves h ARG 54 Ca 0.00 0.00 -0.73 0.00 0.07 0.00 0.00 59.98 59.32 1ves h ARG 54 Cb 0.00 0.00 -0.23 0.00 0.08 0.00 0.00 29.97 29.82 1ves h ARG 54 CO 0.00 0.10 -0.40 0.71 -1.07 0.00 0.00 179.97 179.32 1ves s TYR 55 N -3.79 3.26 -0.23 3.04 1.51 -0.84 -1.80 117.35 118.51 1ves s TYR 55 Ca -0.00 -0.98 0.00 0.00 -1.01 0.00 0.00 57.07 55.08 1ves s TYR 55 Cb 0.10 -2.93 0.03 0.00 -0.11 0.00 0.00 41.96 39.05 1ves s TYR 55 CO 0.58 -0.75 -0.12 0.08 -1.11 0.00 0.00 175.55 174.23 1ves s VAL 56 N 1.60 2.47 -0.13 0.71 1.01 -0.66 -0.55 120.40 124.86 1ves s VAL 56 Ca 0.04 -1.10 -0.06 0.00 0.00 0.00 0.00 61.98 60.86 1ves s VAL 56 Cb -0.22 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 1ves s VAL 56 CO 0.06 0.28 0.10 -0.70 0.00 0.00 0.00 175.10 174.85 1ves s GLU 57 N 1.27 3.47 -0.14 2.72 2.12 -1.26 -0.70 118.70 126.19 1ves s GLU 57 Ca 0.00 -0.21 0.02 0.00 0.36 0.00 0.00 54.97 55.14 1ves s GLU 57 Cb -0.16 -3.14 0.01 0.00 0.26 0.00 0.00 34.13 31.11 1ves s GLU 57 CO -0.07 0.67 -0.20 0.99 -0.54 0.00 0.00 175.26 176.11 1ves s THR 58 N -0.73 1.92 -0.13 -1.70 2.01 -0.37 -4.99 115.64 111.65 1ves s THR 58 Ca 0.13 -0.89 0.03 0.00 0.31 0.00 0.00 61.69 61.26 1ves s THR 58 Cb -0.12 -1.71 0.01 0.00 0.01 0.00 0.00 72.50 70.69 1ves s THR 58 CO 0.03 0.52 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.58 1ves s VAL 59 N 0.91 1.94 -0.39 3.82 1.01 -1.26 -1.26 120.40 125.17 1ves s VAL 59 Ca -0.06 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.01 1ves s VAL 59 Cb -0.15 -1.72 0.11 0.00 0.00 0.00 0.00 36.38 34.62 1ves s VAL 59 CO -0.03 0.53 0.14 0.20 0.00 0.00 0.00 175.10 175.94 1ves s ASN 60 N 0.76 4.95 0.33 3.32 -0.87 0.48 -5.00 114.94 118.92 1ves s ASN 60 Ca -0.09 -2.20 0.06 0.00 -1.57 0.00 0.00 52.86 49.07 1ves s ASN 60 Cb -0.16 -1.72 0.57 0.00 -0.02 0.00 0.00 41.25 39.92 1ves s ASN 60 CO 0.00 -0.43 1.80 0.11 -2.57 0.00 0.00 177.10 176.00 1ves h LYS 61 N 7.69 0.33 -0.48 -0.60 1.57 -1.96 -1.98 116.57 121.13 1ves h LYS 61 Ca -0.08 -0.11 -0.09 0.00 -1.87 0.00 0.00 60.65 58.51 1ves h LYS 61 Cb 1.02 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.28 1ves h LYS 61 CO 0.61 0.55 -0.05 0.78 -0.57 0.00 0.00 179.45 180.77 1ves h GLY 62 N 0.97 0.91 -1.49 3.86 0.00 -1.94 -2.26 103.07 103.12 1ves h GLY 62 Ca 0.05 -0.66 0.00 0.00 0.00 0.00 0.00 47.33 46.72 1ves h GLY 62 CO 0.04 0.61 0.00 -1.14 0.00 0.00 0.00 176.54 176.05 1ves n SER 63 N -4.18 2.44 -2.96 0.19 3.41 -1.09 -4.94 113.62 106.48 1ves n SER 63 Ca 0.02 -1.86 -0.21 0.00 -0.26 0.00 0.00 58.87 56.56 1ves n SER 63 Cb 0.34 -0.19 0.01 0.00 -0.26 0.00 0.00 64.21 64.12 1ves n SER 63 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ves n LYS 64 N 0.83 -3.72 -4.66 4.33 5.02 -0.83 -4.79 118.16 114.34 1ves n LYS 64 Ca 0.17 0.76 -0.32 0.00 -2.02 0.00 0.00 58.31 56.89 1ves n LYS 64 Cb 0.44 -5.52 -0.12 0.00 -0.02 0.00 0.00 35.03 29.82 1ves n LYS 64 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1ves s SER 65 N -2.53 4.32 -0.15 4.39 0.01 -0.81 -0.60 113.70 118.33 1ves s SER 65 Ca 0.25 -0.18 -0.09 0.00 1.31 0.00 0.00 55.95 57.24 1ves s SER 65 Cb -0.12 -0.96 0.05 0.00 0.21 0.00 0.00 66.02 65.21 1ves s SER 65 CO 0.31 0.32 0.38 0.72 0.41 0.00 0.00 173.24 175.37 1ves s PHE 66 N -0.87 -0.52 0.04 2.43 -0.71 -0.43 -0.38 117.98 117.53 1ves s PHE 66 Ca 0.14 1.15 0.04 0.00 -1.04 0.00 0.00 56.93 57.22 1ves s PHE 66 Cb -0.11 0.20 -0.02 0.00 -1.21 0.00 0.00 43.02 41.89 1ves s PHE 66 CO 0.04 -0.30 -0.12 -1.12 -1.34 0.00 0.00 175.22 172.38 1ves s SER 67 N 1.15 1.46 -0.12 1.98 0.01 -0.39 -0.39 113.70 117.40 1ves s SER 67 Ca -0.08 -0.44 0.03 0.00 1.31 0.00 0.00 55.95 56.78 1ves s SER 67 Cb -0.08 -0.08 0.00 0.00 0.21 0.00 0.00 66.02 66.07 1ves s SER 67 CO -0.10 0.00 -0.22 -0.22 0.41 0.00 0.00 173.24 173.12 1ves s LEU 68 N -1.11 2.15 -0.20 2.44 0.20 -0.44 -1.24 118.68 120.48 1ves s LEU 68 Ca 0.00 -0.56 -0.03 0.00 0.69 0.00 0.00 54.13 54.23 1ves s LEU 68 Cb -0.08 -1.44 -0.01 0.00 -0.43 0.00 0.00 46.19 44.23 1ves s LEU 68 CO 0.01 0.13 -0.05 -0.60 -0.29 0.00 0.00 176.35 175.54 1ves s ARG 69 N 0.55 3.42 -0.27 1.98 3.52 0.13 -0.60 118.95 127.67 1ves s ARG 69 Ca -0.13 -0.62 -0.06 0.00 -0.13 0.00 0.00 55.73 54.78 1ves s ARG 69 Cb -0.17 -2.94 -0.00 0.00 -1.56 0.00 0.00 34.95 30.27 1ves s ARG 69 CO 0.04 -0.08 0.06 0.42 -0.81 0.00 0.00 175.30 174.93 1ves s ILE 70 N 1.17 3.97 0.34 4.11 1.01 0.21 -1.65 121.20 130.37 1ves s ILE 70 Ca 0.02 -0.52 0.02 0.00 0.00 0.00 0.00 60.65 60.18 1ves s ILE 70 Cb -0.14 -2.96 -0.02 0.00 0.01 0.00 0.00 42.46 39.34 1ves s ILE 70 CO -0.01 0.20 0.52 -0.94 0.00 0.00 0.00 174.94 174.72 1ves s SER 71 N 1.53 6.16 -1.14 3.58 1.04 -0.74 -1.10 113.70 123.02 1ves s SER 71 Ca 0.04 0.24 -0.19 0.00 0.48 0.00 0.00 55.95 56.53 1ves s SER 71 Cb -0.16 -1.77 -0.01 0.00 0.10 0.00 0.00 66.02 64.17 1ves s SER 71 CO 0.02 -0.35 0.80 -0.67 0.98 0.00 0.00 173.24 174.01 1ves n ASP 72 N -1.74 -5.22 -4.78 7.02 2.03 -0.93 -4.87 116.55 108.07 1ves n ASP 72 Ca -0.04 -0.99 -0.36 0.00 0.52 0.00 0.00 54.79 53.92 1ves n ASP 72 Cb 0.57 -3.55 -0.02 0.00 -0.72 0.00 0.00 41.12 37.40 1ves n ASP 72 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1ves s LEU 73 N -6.40 3.98 0.34 -2.67 1.43 -0.31 -4.59 118.68 110.46 1ves s LEU 73 Ca 0.45 2.20 0.06 0.00 -1.03 0.00 0.00 54.13 55.81 1ves s LEU 73 Cb -0.15 -4.31 -0.07 0.00 0.03 0.00 0.00 46.19 41.69 1ves s LEU 73 CO 0.85 -0.87 -0.00 0.00 0.23 0.00 0.00 176.35 176.56 1ves s ARG 74 N -2.79 1.72 0.46 1.70 3.03 -1.26 -0.16 118.95 121.65 1ves s ARG 74 Ca 0.64 -1.93 0.23 0.00 2.03 0.00 0.00 55.73 56.70 1ves s ARG 74 Cb -0.25 -1.24 1.10 0.00 -1.03 0.00 0.00 34.95 33.52 1ves s ARG 74 CO 0.31 -0.05 1.92 -0.39 -1.13 0.00 0.00 175.30 175.96 1ves h VAL 75 N 2.06 0.69 0.00 4.99 -1.51 -1.97 -1.58 116.25 118.93 1ves h VAL 75 Ca -0.42 -0.94 0.00 0.00 -1.23 0.00 0.00 66.70 64.12 1ves h VAL 75 Cb 1.24 1.59 0.00 0.00 -2.13 0.00 0.00 31.29 31.99 1ves h VAL 75 CO 0.72 0.21 0.00 1.05 -1.23 0.00 0.00 177.57 178.32 1ves h GLU 76 N 0.00 0.00 0.00 5.19 9.09 -1.97 -2.18 114.58 124.71 1ves h GLU 76 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1ves h GLU 76 Cb 0.58 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.68 1ves h GLU 76 CO 0.03 0.00 0.00 -0.44 0.05 0.00 0.00 179.01 178.65 1ves h ASP 77 N 0.00 0.00 -3.90 3.06 3.32 -1.69 -3.41 116.42 113.80 1ves h ASP 77 Ca 0.00 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.49 1ves h ASP 77 Cb 0.57 0.00 0.15 0.00 0.22 0.00 0.00 39.33 40.27 1ves h ASP 77 CO 0.00 0.00 0.47 -1.54 -1.72 0.00 0.00 179.24 176.45 1ves n SER 78 N -2.58 2.13 0.00 6.45 3.41 -0.82 -4.88 113.62 117.33 1ves n SER 78 Ca 0.01 0.92 0.00 0.00 -0.26 0.00 0.00 58.87 59.53 1ves n SER 78 Cb 0.21 -1.53 0.00 0.00 -0.26 0.00 0.00 64.21 62.64 1ves n SER 78 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ves n GLY 79 N 0.91 -0.25 3.55 5.00 0.00 -0.53 -1.59 105.19 112.28 1ves n GLY 79 Ca 0.12 -1.60 -0.35 0.00 0.00 0.00 0.00 46.02 44.20 1ves n GLY 79 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ves s THR 80 N -2.32 4.40 -0.08 2.61 2.01 -0.58 -0.72 115.64 120.96 1ves s THR 80 Ca 0.00 -0.17 0.01 0.00 0.31 0.00 0.00 61.69 61.84 1ves s THR 80 Cb 0.00 -2.98 -0.03 0.00 0.01 0.00 0.00 72.50 69.50 1ves s THR 80 CO 0.00 0.45 -0.08 -0.31 -0.69 0.00 0.00 174.62 173.99 1ves s TYR 81 N 0.61 2.92 -0.01 4.92 2.02 -0.29 -1.33 117.35 126.19 1ves s TYR 81 Ca 0.01 -0.07 0.02 0.00 -0.37 0.00 0.00 57.07 56.66 1ves s TYR 81 Cb -0.13 -1.74 0.00 0.00 -0.40 0.00 0.00 41.96 39.69 1ves s TYR 81 CO 0.02 0.24 -0.06 0.15 -1.57 0.00 0.00 175.55 174.33 1ves s LYS 82 N -0.59 0.56 0.27 -0.62 1.02 0.31 -0.72 119.74 119.97 1ves s LYS 82 Ca 0.09 -0.20 0.06 0.00 0.02 0.00 0.00 55.97 55.94 1ves s LYS 82 Cb -0.12 -0.55 -0.02 0.00 -0.52 0.00 0.00 37.83 36.62 1ves s LYS 82 CO 0.02 0.10 0.38 0.00 -0.92 0.00 0.00 175.35 174.92 1ves s GLN 84 N -4.03 0.25 0.27 0.00 0.74 0.41 -0.60 119.66 116.70 1ves s GLN 84 Ca 0.38 0.43 -0.12 0.00 0.05 0.00 0.00 55.36 56.10 1ves s GLN 84 Cb -0.09 0.02 -0.08 0.00 1.10 0.00 0.00 33.01 33.96 1ves s GLN 84 CO 0.29 -0.09 0.64 0.00 -0.55 0.00 0.00 175.29 175.57 1ves s ALA 85 N 0.67 3.45 0.05 1.58 0.00 -0.18 -1.03 121.76 126.29 1ves s ALA 85 Ca -0.04 -0.13 0.05 0.00 0.00 0.00 0.00 51.96 51.84 1ves s ALA 85 Cb -0.06 -2.59 -0.02 0.00 0.00 0.00 0.00 23.12 20.45 1ves s ALA 85 CO -0.04 0.42 -0.14 -0.06 0.00 0.00 0.00 175.76 175.94 1ves s PHE 86 N -1.90 1.22 0.41 0.00 0.40 -0.43 0.00 117.98 117.69 1ves s PHE 86 Ca 0.51 -0.39 0.04 0.00 -0.60 0.00 0.00 56.93 56.48 1ves s PHE 86 Cb -0.11 -0.71 -0.02 0.00 0.51 0.00 0.00 43.02 42.69 1ves s PHE 86 CO 0.19 0.04 0.12 0.71 0.70 0.00 0.00 175.22 176.99 1ves s TYR 87 N -0.99 1.80 0.03 0.36 4.12 -0.23 -1.44 117.35 120.99 1ves s TYR 87 Ca 0.00 -1.26 0.02 0.00 0.02 0.00 0.00 57.07 55.85 1ves s TYR 87 Cb -0.09 -1.19 -0.02 0.00 -1.52 0.00 0.00 41.96 39.15 1ves s TYR 87 CO 0.02 -0.26 -0.06 -1.54 0.02 0.00 0.00 175.55 173.72 1ves s SER 88 N -3.62 0.66 -0.08 2.29 1.04 -1.26 -0.04 113.70 112.68 1ves s SER 88 Ca 0.23 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 56.20 1ves s SER 88 Cb 0.03 0.04 -0.03 0.00 0.10 0.00 0.00 66.02 66.15 1ves s SER 88 CO 0.14 -0.18 -0.07 -0.76 0.98 0.00 0.00 173.24 173.34 1ves s LEU 89 N -1.31 3.13 0.73 2.42 1.02 0.27 -4.95 118.68 120.00 1ves s LEU 89 Ca -0.09 -0.06 -0.13 0.00 0.02 0.00 0.00 54.13 53.86 1ves s LEU 89 Cb -0.09 -1.69 0.04 0.00 0.02 0.00 0.00 46.19 44.47 1ves s LEU 89 CO 0.00 0.32 1.12 -2.16 0.02 0.00 0.00 176.35 175.66 1ves s PRO 90 N -0.58 2.32 0.28 1.29 0.04 -1.26 -1.79 135.00 135.30 1ves s PRO 90 Ca 0.09 1.40 0.04 0.00 0.04 0.00 0.00 61.00 62.56 1ves s PRO 90 Cb -0.12 -1.89 -0.06 0.00 0.04 0.00 0.00 34.50 32.48 1ves s PRO 90 CO 0.02 -1.63 0.03 -0.51 0.04 0.00 0.00 177.00 174.95 1ves s LEU 91 N -5.44 2.13 -1.03 -3.56 1.43 -1.26 -4.82 118.68 106.13 1ves s LEU 91 Ca 0.66 -1.30 -0.05 0.00 -1.03 0.00 0.00 54.13 52.41 1ves s LEU 91 Cb -0.21 -0.30 0.11 0.00 0.03 0.00 0.00 46.19 45.82 1ves s LEU 91 CO 0.48 -0.57 2.48 0.61 0.23 0.00 0.00 176.35 179.59 1ves n GLY 92 N -0.55 4.99 3.64 -3.19 0.00 -1.26 -4.85 105.19 103.97 1ves n GLY 92 Ca -0.03 -2.03 -0.02 0.00 0.00 0.00 0.00 46.02 43.94 1ves n GLY 92 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ves s ASP 93 N 0.28 -0.41 0.73 1.61 3.68 -1.26 -5.15 116.67 116.15 1ves s ASP 93 Ca 0.55 0.67 0.00 0.00 2.13 0.00 0.00 52.55 55.90 1ves s ASP 93 Cb 0.25 1.10 0.00 0.00 -1.45 0.00 0.00 42.92 42.82 1ves s ASP 93 CO -0.14 -0.11 0.00 -1.22 0.13 0.00 0.00 175.17 173.83 1ves n TYR 94 N 3.37 0.00 -0.18 -5.34 4.02 -1.26 -2.56 117.16 115.21 1ves n TYR 94 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.72 1ves n TYR 94 Cb 0.57 0.05 0.00 0.00 -0.02 0.00 0.00 39.34 39.95 1ves n TYR 94 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1ves n ASN 95 N -1.54 0.00 -3.99 7.72 3.02 -1.26 -5.00 115.26 114.20 1ves n ASN 95 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.24 1ves n ASN 95 Cb 0.00 -0.16 -0.16 0.00 -0.61 0.00 0.00 39.78 38.85 1ves n ASN 95 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1ves s TYR 96 N -2.99 2.46 0.42 3.10 4.12 -1.06 -5.13 117.35 118.27 1ves s TYR 96 Ca 0.00 -1.65 0.04 0.00 0.02 0.00 0.00 57.07 55.48 1ves s TYR 96 Cb 0.00 -1.65 0.04 0.00 -1.52 0.00 0.00 41.96 38.83 1ves s TYR 96 CO 0.00 -0.75 0.32 0.45 0.02 0.00 0.00 175.55 175.58 1ves n SER 97 N 4.67 2.31 -4.09 2.29 2.88 -1.26 -4.38 113.62 116.03 1ves n SER 97 Ca -0.14 -2.42 -0.34 0.00 -1.33 0.00 0.00 58.87 54.63 1ves n SER 97 Cb 0.46 -0.04 -0.13 0.00 -0.75 0.00 0.00 64.21 63.75 1ves n SER 97 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 1ves s LEU 98 N 0.00 4.65 0.13 2.46 0.20 -0.74 -4.98 118.68 120.40 1ves s LEU 98 Ca 0.24 -1.86 -0.30 0.00 0.69 0.00 0.00 54.13 52.90 1ves s LEU 98 Cb -0.02 -1.71 -0.06 0.00 -0.43 0.00 0.00 46.19 43.96 1ves s LEU 98 CO 0.15 -0.40 1.04 -0.22 -0.29 0.00 0.00 176.35 176.64 1ves s LEU 99 N 1.08 4.48 0.01 -0.68 0.20 -1.26 -0.56 118.68 121.95 1ves s LEU 99 Ca 0.05 1.94 -0.03 0.00 0.69 0.00 0.00 54.13 56.78 1ves s LEU 99 Cb -0.21 -3.59 -0.01 0.00 -0.43 0.00 0.00 46.19 41.95 1ves s LEU 99 CO -0.05 -0.18 0.05 0.72 -0.29 0.00 0.00 176.35 176.60 1ves s PHE 100 N 0.01 0.17 0.15 5.38 -0.12 0.94 -4.97 117.98 119.55 1ves s PHE 100 Ca 0.49 -0.38 -0.31 0.00 -0.05 0.00 0.00 56.93 56.68 1ves s PHE 100 Cb -0.26 -0.13 -0.10 0.00 -0.63 0.00 0.00 43.02 41.90 1ves s PHE 100 CO 0.32 -0.24 1.58 1.03 -0.05 0.00 0.00 175.22 177.85 1ves s ARG 101 N -1.53 4.22 0.00 1.99 0.52 -1.26 -1.07 118.95 121.82 1ves s ARG 101 Ca -0.15 2.35 0.00 0.00 -0.52 0.00 0.00 55.73 57.41 1ves s ARG 101 Cb -0.08 -3.23 0.00 0.00 0.52 0.00 0.00 34.95 32.16 1ves s ARG 101 CO -0.00 -0.62 0.00 0.41 0.02 0.00 0.00 175.30 175.11 1ves n GLY 102 N 3.78 3.37 3.79 -3.53 0.00 0.10 -4.85 105.19 107.85 1ves n GLY 102 Ca 0.14 -1.92 -0.34 0.00 0.00 0.00 0.00 46.02 43.90 1ves n GLY 102 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ves s GLU 103 N 2.96 3.68 -0.01 1.61 8.01 -1.25 -4.61 118.70 129.09 1ves s GLU 103 Ca 0.00 1.45 0.04 0.00 0.01 0.00 0.00 54.97 56.47 1ves s GLU 103 Cb 0.00 -2.09 -0.03 0.00 -4.31 0.00 0.00 34.13 27.70 1ves s GLU 103 CO 0.00 -0.54 -0.13 0.21 0.01 0.00 0.00 175.26 174.81 1ves s LYS 104 N -3.21 2.41 0.84 1.61 2.20 -1.26 -1.01 119.74 121.32 1ves s LYS 104 Ca 0.68 -0.77 -0.10 0.00 -0.36 0.00 0.00 55.97 55.42 1ves s LYS 104 Cb -0.19 -2.37 0.10 0.00 -1.51 0.00 0.00 37.83 33.87 1ves s LYS 104 CO 0.22 0.60 1.12 0.20 -0.36 0.00 0.00 175.35 177.13 1ves s GLY 105 N -1.09 1.69 0.03 5.54 0.00 0.23 -4.48 107.32 109.24 1ves s GLY 105 Ca 0.14 0.44 0.28 0.00 0.00 0.00 0.00 44.72 45.58 1ves s GLY 105 CO 0.04 0.83 1.89 0.00 0.00 0.00 0.00 173.10 175.85 1ves n ALA 106 N -3.88 2.28 0.00 3.20 0.00 -1.26 -4.67 120.51 116.19 1ves n ALA 106 Ca 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1ves n ALA 106 Cb 0.52 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.52 1ves n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ves n GLY 107 N 1.39 2.66 3.01 0.00 0.00 -1.26 -5.03 105.19 105.96 1ves n GLY 107 Ca 0.07 -1.86 -0.30 0.00 0.00 0.00 0.00 46.02 43.92 1ves n GLY 107 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ves s THR 108 N -2.64 1.56 -0.54 2.61 2.01 0.10 -4.46 115.64 114.28 1ves s THR 108 Ca 0.00 -0.66 -0.20 0.00 0.31 0.00 0.00 61.69 61.14 1ves s THR 108 Cb 0.00 -1.49 0.07 0.00 0.01 0.00 0.00 72.50 71.09 1ves s THR 108 CO 0.00 0.42 0.69 0.00 -0.69 0.00 0.00 174.62 175.04 1ves s ALA 109 N 1.49 3.36 -0.11 7.40 0.00 -0.02 -1.14 121.76 132.73 1ves s ALA 109 Ca 0.04 -1.82 -0.12 0.00 0.00 0.00 0.00 51.96 50.06 1ves s ALA 109 Cb -0.13 -3.46 -0.05 0.00 0.00 0.00 0.00 23.12 19.48 1ves s ALA 109 CO -0.10 -2.17 0.28 -1.17 0.00 0.00 0.00 175.76 172.59 1ves s LEU 110 N 2.84 4.34 -0.18 0.00 2.96 0.10 -1.51 118.68 127.23 1ves s LEU 110 Ca 0.16 0.60 0.01 0.00 -0.22 0.00 0.00 54.13 54.68 1ves s LEU 110 Cb -0.20 -2.34 0.03 0.00 0.50 0.00 0.00 46.19 44.18 1ves s LEU 110 CO 0.11 0.24 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.31 1ves s THR 111 N -0.29 1.96 -0.17 3.68 2.01 -0.04 -1.46 115.64 121.32 1ves s THR 111 Ca 0.17 -0.97 -0.02 0.00 0.31 0.00 0.00 61.69 61.18 1ves s THR 111 Cb -0.14 -1.83 -0.01 0.00 0.01 0.00 0.00 72.50 70.53 1ves s THR 111 CO 0.06 0.43 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.64 1ves s VAL 112 N 1.31 3.19 0.00 3.82 1.01 -1.26 -0.89 120.40 127.59 1ves s VAL 112 Ca 0.03 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 61.43 1ves s VAL 112 Cb -0.14 -2.40 0.00 0.00 0.00 0.00 0.00 36.38 33.84 1ves s VAL 112 CO -0.11 0.48 0.00 1.17 0.00 0.00 0.00 175.10 176.64