#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o13 s ILE 3 N 0.00 2.98 -0.07 1.39 1.01 0.23 -0.99 121.20 125.76 1o13 s ILE 3 Ca 0.00 -0.73 0.01 0.00 0.00 0.00 0.00 60.65 59.92 1o13 s ILE 3 Cb 0.00 -2.19 -0.03 0.00 0.01 0.00 0.00 42.46 40.25 1o13 s ILE 3 CO 0.00 0.57 -0.07 0.00 0.00 0.00 0.00 174.94 175.44 1o13 s ALA 4 N -0.38 2.99 -0.03 9.38 0.00 0.22 -0.45 121.76 133.48 1o13 s ALA 4 Ca 0.04 -0.89 -0.01 0.00 0.00 0.00 0.00 51.96 51.10 1o13 s ALA 4 Cb -0.12 -1.24 0.03 0.00 0.00 0.00 0.00 23.12 21.79 1o13 s ALA 4 CO 0.02 0.57 0.05 0.42 0.00 0.00 0.00 175.76 176.82 1o13 s ILE 5 N -0.81 -0.08 0.12 0.00 1.09 -0.60 -1.03 121.20 119.89 1o13 s ILE 5 Ca 0.12 0.35 -0.30 0.00 -1.10 0.00 0.00 60.65 59.72 1o13 s ILE 5 Cb -0.11 -0.14 -0.07 0.00 -1.06 0.00 0.00 42.46 41.09 1o13 s ILE 5 CO 0.01 0.15 1.16 -2.16 -0.10 0.00 0.00 174.94 174.01 1o13 s PRO 6 N 1.80 4.49 0.11 2.79 0.04 -1.26 -0.46 135.00 142.52 1o13 s PRO 6 Ca 0.00 1.76 0.06 0.00 0.04 0.00 0.00 61.00 62.87 1o13 s PRO 6 Cb -0.12 -3.31 -0.04 0.00 0.04 0.00 0.00 34.50 31.07 1o13 s PRO 6 CO -0.03 -0.12 -0.15 0.14 0.04 0.00 0.00 177.00 176.87 1o13 s VAL 7 N 0.47 1.37 -0.49 -0.36 -7.23 -0.25 -0.24 120.40 113.66 1o13 s VAL 7 Ca 0.55 -1.60 0.23 0.00 -1.81 0.00 0.00 61.98 59.35 1o13 s VAL 7 Cb -0.30 -1.44 -0.01 0.00 0.56 0.00 0.00 36.38 35.19 1o13 s VAL 7 CO 0.32 -0.31 1.15 -1.54 -0.31 0.00 0.00 175.10 174.42 1o13 n SER 8 N 0.79 0.72 -3.78 4.85 3.41 -0.65 -2.74 113.62 116.22 1o13 n SER 8 Ca -0.17 0.12 -0.12 0.00 -0.26 0.00 0.00 58.87 58.44 1o13 n SER 8 Cb 0.56 0.42 -0.08 0.00 -0.26 0.00 0.00 64.21 64.84 1o13 n SER 8 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1o13 s GLU 9 N -3.24 0.75 -0.56 4.33 2.02 -1.26 -4.75 118.70 115.98 1o13 s GLU 9 Ca 0.03 -0.47 -0.20 0.00 0.02 0.00 0.00 54.97 54.36 1o13 s GLU 9 Cb 0.12 0.32 0.08 0.00 0.10 0.00 0.00 34.13 34.75 1o13 s GLU 9 CO 0.76 -0.23 0.72 1.21 0.02 0.00 0.00 175.26 177.74 1o13 s ASN 10 N -1.91 6.21 -0.21 -0.19 2.47 -1.26 -4.37 114.94 115.68 1o13 s ASN 10 Ca -0.07 -1.09 0.14 0.00 0.42 0.00 0.00 52.86 52.26 1o13 s ASN 10 Cb -0.02 -2.32 0.45 0.00 -1.45 0.00 0.00 41.25 37.91 1o13 s ASN 10 CO -0.02 -1.07 1.18 0.54 -3.72 0.00 0.00 177.10 174.01 1o13 n ARG 11 N 6.51 2.01 0.00 0.43 5.12 -1.26 -4.97 116.66 124.50 1o13 n ARG 11 Ca -0.07 -3.41 0.00 0.00 -1.93 0.00 0.00 57.85 52.45 1o13 n ARG 11 Cb 0.44 -1.56 0.00 0.00 -1.16 0.00 0.00 32.46 30.18 1o13 n ARG 11 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1o13 n GLY 12 N -0.63 3.35 0.31 -0.13 0.00 -1.26 -0.89 105.19 105.94 1o13 n GLY 12 Ca 0.23 -0.11 0.20 0.00 0.00 0.00 0.00 46.02 46.34 1o13 n GLY 12 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1o13 h LYS 13 N 0.00 0.00 -0.62 1.61 2.10 -1.98 -1.72 116.57 115.95 1o13 h LYS 13 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1o13 h LYS 13 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1o13 h LYS 13 CO 0.00 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.20 1o13 n ASP 14 N -3.03 3.81 -4.71 7.07 8.00 -0.07 -1.66 116.55 125.95 1o13 n ASP 14 Ca -0.02 -2.29 -0.42 0.00 0.71 0.00 0.00 54.79 52.77 1o13 n ASP 14 Cb 0.16 -0.50 -0.03 0.00 -0.02 0.00 0.00 41.12 40.73 1o13 n ASP 14 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1o13 s SER 15 N -0.85 6.59 0.19 -2.24 0.01 -0.65 -4.68 113.70 112.07 1o13 s SER 15 Ca 0.41 2.59 -0.30 0.00 1.31 0.00 0.00 55.95 59.96 1o13 s SER 15 Cb 0.26 -2.59 -0.08 0.00 0.21 0.00 0.00 66.02 63.82 1o13 s SER 15 CO 0.21 -0.83 1.12 -2.16 0.41 0.00 0.00 173.24 171.99 1o13 s PRO 16 N 1.42 4.57 0.28 12.44 0.04 -1.26 -0.60 135.00 151.89 1o13 s PRO 16 Ca 0.71 1.77 -0.30 0.00 0.04 0.00 0.00 61.00 63.22 1o13 s PRO 16 Cb -0.43 -3.26 -0.11 0.00 0.04 0.00 0.00 34.50 30.75 1o13 s PRO 16 CO 0.31 0.05 1.50 -1.50 0.04 0.00 0.00 177.00 177.40 1o13 s ILE 17 N -0.32 2.39 0.40 0.56 2.07 -0.88 -1.64 121.20 123.79 1o13 s ILE 17 Ca 0.50 0.34 -0.25 0.00 -1.41 0.00 0.00 60.65 59.83 1o13 s ILE 17 Cb -0.31 -3.22 -0.09 0.00 0.13 0.00 0.00 42.46 38.98 1o13 s ILE 17 CO 0.36 0.06 1.10 -0.55 -1.91 0.00 0.00 174.94 174.00 1o13 s SER 18 N 0.34 6.63 0.25 4.50 0.15 0.67 -4.61 113.70 121.63 1o13 s SER 18 Ca 0.60 2.18 -0.02 0.00 0.70 0.00 0.00 55.95 59.41 1o13 s SER 18 Cb -0.44 -2.60 0.32 0.00 -1.71 0.00 0.00 66.02 61.59 1o13 s SER 18 CO 0.47 -0.59 1.73 -0.08 1.20 0.00 0.00 173.24 175.97 1o13 h GLU 19 N 2.55 0.74 -6.55 5.44 4.81 -1.92 -3.37 114.58 116.28 1o13 h GLU 19 Ca -0.48 -0.23 -0.66 0.00 -0.13 0.00 0.00 59.36 57.86 1o13 h GLU 19 Cb 1.23 -0.07 -0.16 0.00 0.63 0.00 0.00 28.75 30.38 1o13 h GLU 19 CO 0.62 0.81 -0.74 -1.01 -0.73 0.00 0.00 179.01 177.96 1o13 s HIS 20 N -4.84 2.70 -0.06 0.92 3.76 -1.26 -1.96 115.29 114.55 1o13 s HIS 20 Ca -0.09 -0.18 -0.02 0.00 -0.15 0.00 0.00 55.06 54.62 1o13 s HIS 20 Cb 0.14 -1.40 -0.01 0.00 1.11 0.00 0.00 32.58 32.43 1o13 s HIS 20 CO 0.81 0.44 -0.04 0.35 -0.85 0.00 0.00 174.74 175.45 1o13 h PHE 21 N 3.47 0.00 -0.99 1.40 3.57 -1.82 -3.32 116.94 119.25 1o13 h PHE 21 Ca -0.49 0.00 0.16 0.00 3.53 0.00 0.00 57.97 61.17 1o13 h PHE 21 Cb 1.17 0.00 -0.10 0.00 2.79 0.00 0.00 35.95 39.82 1o13 h PHE 21 CO 0.61 0.00 0.60 0.78 -2.23 0.00 0.00 178.31 178.07 1o13 h GLY 22 N -0.52 1.70 -2.30 2.40 0.00 -1.99 -2.52 103.07 99.84 1o13 h GLY 22 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 46.96 1o13 h GLY 22 CO 0.00 0.02 0.00 0.54 0.00 0.00 0.00 176.54 177.10 1o13 n ARG 23 N -4.72 2.48 -1.71 4.80 1.74 -1.26 -4.61 116.66 113.37 1o13 n ARG 23 Ca 0.21 -2.28 -0.42 0.00 -0.77 0.00 0.00 57.85 54.59 1o13 n ARG 23 Cb 0.48 -1.51 -0.01 0.00 -1.02 0.00 0.00 32.46 30.40 1o13 n ARG 23 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1o13 n ALA 24 N 1.39 1.56 0.26 7.54 0.00 -0.95 -4.79 120.51 125.51 1o13 n ALA 24 Ca 0.21 0.36 0.15 0.00 0.00 0.00 0.00 53.44 54.17 1o13 n ALA 24 Cb 0.56 -2.30 0.61 0.00 0.00 0.00 0.00 19.45 18.32 1o13 n ALA 24 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1o13 h PRO 25 N 2.95 0.00 -3.98 0.00 0.13 -1.85 -3.42 132.00 125.83 1o13 h PRO 25 Ca -0.47 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.55 1o13 h PRO 25 Cb 1.27 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.26 1o13 h PRO 25 CO 0.65 0.06 -0.43 0.71 -0.23 0.00 0.00 178.00 178.77 1o13 s TYR 26 N -3.66 0.39 -0.03 1.56 1.51 -1.11 -1.10 117.35 114.92 1o13 s TYR 26 Ca 0.01 -0.80 0.05 0.00 -1.01 0.00 0.00 57.07 55.32 1o13 s TYR 26 Cb 0.09 -0.16 -0.01 0.00 -0.11 0.00 0.00 41.96 41.78 1o13 s TYR 26 CO 0.57 -0.59 -0.18 -0.06 -1.11 0.00 0.00 175.55 174.18 1o13 s PHE 27 N -3.94 1.69 -0.21 2.71 0.08 -0.21 -1.09 117.98 117.02 1o13 s PHE 27 Ca 0.13 -0.39 -0.11 0.00 0.12 0.00 0.00 56.93 56.68 1o13 s PHE 27 Cb 0.05 -1.11 -0.05 0.00 -0.57 0.00 0.00 43.02 41.34 1o13 s PHE 27 CO -0.05 -0.08 0.17 0.00 -0.10 0.00 0.00 175.22 175.15 1o13 s ALA 28 N -0.25 3.65 -0.28 5.36 0.00 0.40 -1.06 121.76 129.58 1o13 s ALA 28 Ca 0.03 -0.71 -0.07 0.00 0.00 0.00 0.00 51.96 51.21 1o13 s ALA 28 Cb -0.09 -2.25 -0.00 0.00 0.00 0.00 0.00 23.12 20.78 1o13 s ALA 28 CO 0.00 0.05 0.08 -0.06 0.00 0.00 0.00 175.76 175.83 1o13 s PHE 29 N 0.58 3.12 -0.24 0.00 0.08 0.95 -1.56 117.98 120.91 1o13 s PHE 29 Ca 0.09 -0.79 -0.05 0.00 0.12 0.00 0.00 56.93 56.30 1o13 s PHE 29 Cb -0.12 -2.25 -0.00 0.00 -0.57 0.00 0.00 43.02 40.07 1o13 s PHE 29 CO 0.01 -0.51 -0.01 0.08 -0.10 0.00 0.00 175.22 174.69 1o13 s VAL 30 N 1.54 3.55 0.06 -0.44 1.01 0.40 -1.00 120.40 125.52 1o13 s VAL 30 Ca 0.04 -0.56 -0.23 0.00 0.00 0.00 0.00 61.98 61.23 1o13 s VAL 30 Cb -0.16 -2.69 -0.06 0.00 0.00 0.00 0.00 36.38 33.46 1o13 s VAL 30 CO 0.03 0.31 0.69 -0.54 0.00 0.00 0.00 175.10 175.59 1o13 s LYS 31 N 1.48 4.41 -0.02 2.72 1.02 -0.17 -0.60 119.74 128.58 1o13 s LYS 31 Ca 0.04 0.94 0.08 0.00 0.02 0.00 0.00 55.97 57.05 1o13 s LYS 31 Cb -0.15 -3.31 -0.02 0.00 -0.52 0.00 0.00 37.83 33.83 1o13 s LYS 31 CO -0.01 0.44 -0.26 0.08 -0.92 0.00 0.00 175.35 174.68 1o13 s VAL 32 N -0.53 2.02 -0.10 3.17 1.01 -1.26 -0.00 120.40 124.71 1o13 s VAL 32 Ca 0.34 -1.09 -0.12 0.00 0.00 0.00 0.00 61.98 61.11 1o13 s VAL 32 Cb -0.20 -1.67 0.03 0.00 0.00 0.00 0.00 36.38 34.53 1o13 s VAL 32 CO 0.21 0.57 0.31 -0.75 0.00 0.00 0.00 175.10 175.45 1o13 s LYS 33 N -0.60 0.43 -1.47 2.72 2.20 -0.12 -4.85 119.74 118.05 1o13 s LYS 33 Ca 0.10 0.30 -0.05 0.00 -0.36 0.00 0.00 55.97 55.96 1o13 s LYS 33 Cb -0.10 0.20 0.02 0.00 -1.51 0.00 0.00 37.83 36.45 1o13 s LYS 33 CO -0.01 -0.07 0.48 0.09 -0.36 0.00 0.00 175.35 175.48 1o13 n ASN 34 N 2.55 -5.33 -2.35 1.43 3.02 -1.26 -1.32 115.26 112.01 1o13 n ASN 34 Ca -0.15 -0.25 -0.20 0.00 -0.03 0.00 0.00 54.58 53.95 1o13 n ASN 34 Cb 0.57 -4.35 -0.01 0.00 -0.61 0.00 0.00 39.78 35.38 1o13 n ASN 34 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1o13 n ASN 35 N -2.37 -5.61 -3.95 6.41 5.15 -1.26 -4.98 115.26 108.65 1o13 n ASN 35 Ca -0.10 0.04 -0.08 0.00 -0.60 0.00 0.00 54.58 53.84 1o13 n ASN 35 Cb 0.61 -4.70 -0.09 0.00 -0.53 0.00 0.00 39.78 35.07 1o13 n ASN 35 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1o13 s ALA 36 N -2.96 0.05 0.26 5.20 0.00 -0.43 -4.94 121.76 118.94 1o13 s ALA 36 Ca 0.00 -0.76 -0.30 0.00 0.00 0.00 0.00 51.96 50.90 1o13 s ALA 36 Cb 0.00 0.33 -0.11 0.00 0.00 0.00 0.00 23.12 23.34 1o13 s ALA 36 CO 0.00 -0.39 1.53 0.42 0.00 0.00 0.00 175.76 177.32 1o13 s ILE 37 N -3.38 2.38 -0.06 0.00 1.01 -1.26 -0.94 121.20 118.96 1o13 s ILE 37 Ca 0.02 0.32 0.04 0.00 0.00 0.00 0.00 60.65 61.02 1o13 s ILE 37 Cb 0.03 -3.20 -0.06 0.00 0.01 0.00 0.00 42.46 39.24 1o13 s ILE 37 CO -0.08 0.05 0.01 0.00 0.00 0.00 0.00 174.94 174.91 1o13 n ALA 38 N 2.49 1.86 -3.57 9.38 0.00 1.00 -4.82 120.51 126.85 1o13 n ALA 38 Ca 0.08 -0.35 -0.16 0.00 0.00 0.00 0.00 53.44 53.01 1o13 n ALA 38 Cb 0.39 0.17 -0.07 0.00 0.00 0.00 0.00 19.45 19.94 1o13 n ALA 38 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1o13 s ASP 39 N -3.83 -0.70 -0.10 0.00 2.15 -1.12 -4.96 116.67 108.11 1o13 s ASP 39 Ca -0.04 1.10 0.01 0.00 0.43 0.00 0.00 52.55 54.05 1o13 s ASP 39 Cb 0.02 1.03 0.02 0.00 -0.30 0.00 0.00 42.92 43.69 1o13 s ASP 39 CO 0.21 -0.41 -0.11 -0.63 -0.17 0.00 0.00 175.17 174.06 1o13 s ILE 40 N -0.34 1.22 -0.21 4.11 1.01 -1.26 -1.00 121.20 124.72 1o13 s ILE 40 Ca -0.05 -0.46 0.02 0.00 0.00 0.00 0.00 60.65 60.16 1o13 s ILE 40 Cb -0.03 -1.16 0.03 0.00 0.01 0.00 0.00 42.46 41.32 1o13 s ILE 40 CO 0.05 0.39 -0.16 -0.55 0.00 0.00 0.00 174.94 174.67 1o13 s SER 41 N 1.22 3.63 -0.23 3.58 0.15 -0.17 -4.96 113.70 116.92 1o13 s SER 41 Ca -0.03 -0.92 -0.15 0.00 0.70 0.00 0.00 55.95 55.55 1o13 s SER 41 Cb -0.14 -1.51 -0.04 0.00 -1.71 0.00 0.00 66.02 62.62 1o13 s SER 41 CO -0.04 -0.07 0.36 -0.69 1.20 0.00 0.00 173.24 174.01 1o13 s VAL 42 N 1.22 5.21 0.01 4.45 1.01 -1.26 -0.03 120.40 131.01 1o13 s VAL 42 Ca -0.00 0.60 0.06 0.00 0.00 0.00 0.00 61.98 62.64 1o13 s VAL 42 Cb -0.16 -3.69 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 1o13 s VAL 42 CO -0.10 0.23 -0.17 -1.61 0.00 0.00 0.00 175.10 173.45 1o13 s GLU 43 N 1.52 1.29 0.42 2.72 2.02 -0.22 -4.99 118.70 121.45 1o13 s GLU 43 Ca 0.16 -0.74 -0.26 0.00 0.02 0.00 0.00 54.97 54.16 1o13 s GLU 43 Cb -0.15 -1.30 -0.08 0.00 0.10 0.00 0.00 34.13 32.70 1o13 s GLU 43 CO 0.08 0.34 1.33 -1.21 0.02 0.00 0.00 175.26 175.83 1o13 s GLU 44 N -0.78 3.87 -0.43 1.61 2.02 -1.26 -1.04 118.70 122.69 1o13 s GLU 44 Ca 0.06 2.22 -0.23 0.00 0.02 0.00 0.00 54.97 57.03 1o13 s GLU 44 Cb -0.07 -2.71 0.02 0.00 0.10 0.00 0.00 34.13 31.46 1o13 s GLU 44 CO 0.00 -0.59 0.79 1.21 0.02 0.00 0.00 175.26 176.69 1o13 s ASN 45 N -0.69 6.44 0.58 -0.19 2.47 -0.26 -4.74 114.94 118.54 1o13 s ASN 45 Ca 0.58 0.00 0.27 0.00 0.42 0.00 0.00 52.86 54.13 1o13 s ASN 45 Cb -0.39 -2.39 1.71 0.00 -1.45 0.00 0.00 41.25 38.72 1o13 s ASN 45 CO 0.50 -0.88 2.22 -0.65 -3.72 0.00 0.00 177.10 174.58 1o13 h PRO 46 N 8.87 0.00 -0.19 0.43 0.11 -1.92 -1.24 132.00 138.06 1o13 h PRO 46 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1o13 h PRO 46 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1o13 h PRO 46 CO 0.95 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 180.02 1o13 n LEU 47 N -3.98 1.20 0.01 2.35 7.99 -1.26 -3.46 117.00 119.84 1o13 n LEU 47 Ca -0.03 -0.57 0.13 0.00 -0.01 0.00 0.00 56.01 55.53 1o13 n LEU 47 Cb 0.10 -0.13 0.36 0.00 -0.11 0.00 0.00 43.42 43.65 1o13 n LEU 47 CO 0.29 0.29 0.61 0.00 -1.51 0.00 0.00 177.39 177.07 1o13 n ALA 48 N 0.11 3.09 -1.59 -1.18 0.00 -0.47 -4.60 120.51 115.88 1o13 n ALA 48 Ca 0.10 -0.26 -0.35 0.00 0.00 0.00 0.00 53.44 52.94 1o13 n ALA 48 Cb 0.21 -1.24 0.05 0.00 0.00 0.00 0.00 19.45 18.47 1o13 n ALA 48 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1o13 s GLN 49 N -3.02 2.73 0.21 0.00 -1.52 -1.23 -4.94 119.66 111.90 1o13 s GLN 49 Ca 0.12 1.70 -0.31 0.00 -1.95 0.00 0.00 55.36 54.92 1o13 s GLN 49 Cb 0.18 -1.91 -0.10 0.00 -0.22 0.00 0.00 33.01 30.96 1o13 s GLN 49 CO 0.65 -1.37 1.47 0.34 -0.25 0.00 0.00 175.29 176.13 1o13 s ASP 50 N -1.93 6.66 -1.59 5.90 -1.08 -1.26 -2.81 116.67 120.55 1o13 s ASP 50 Ca 0.74 2.62 0.00 0.00 -0.52 0.00 0.00 52.55 55.39 1o13 s ASP 50 Cb -0.28 -2.61 0.00 0.00 -1.46 0.00 0.00 42.92 38.57 1o13 s ASP 50 CO 0.38 -0.73 0.00 1.41 0.52 0.00 0.00 175.17 176.75 1o13 n HIS 51 N 2.94 -0.78 -4.35 -5.34 8.25 -1.26 -5.00 115.22 109.67 1o13 n HIS 51 Ca 0.09 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.34 1o13 n HIS 51 Cb 0.40 -3.55 -0.16 0.00 1.12 0.00 0.00 29.99 27.80 1o13 n HIS 51 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1o13 s VAL 52 N -2.89 0.78 0.20 1.59 1.01 -1.12 -5.15 120.40 114.82 1o13 s VAL 52 Ca 0.00 -0.28 -0.23 0.00 0.00 0.00 0.00 61.98 61.47 1o13 s VAL 52 Cb 0.00 -0.74 0.05 0.00 0.00 0.00 0.00 36.38 35.68 1o13 s VAL 52 CO 0.00 0.27 0.77 -1.38 0.00 0.00 0.00 175.10 174.76 1o13 s HIS 53 N 0.70 -0.26 0.00 5.22 -3.43 -1.26 -4.57 115.29 111.70 1o13 s HIS 53 Ca -0.11 -0.09 0.00 0.00 -0.80 0.00 0.00 55.06 54.05 1o13 s HIS 53 Cb -0.14 0.65 0.00 0.00 -1.43 0.00 0.00 32.58 31.66 1o13 s HIS 53 CO 0.02 -1.00 0.00 0.41 -2.00 0.00 0.00 174.74 172.16 1o13 n GLY 54 N -0.43 2.86 3.59 -1.38 0.00 -1.26 -5.01 105.19 103.56 1o13 n GLY 54 Ca -0.07 -1.52 -0.26 0.00 0.00 0.00 0.00 46.02 44.17 1o13 n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o13 n ALA 55 N 1.04 -1.23 -0.03 4.61 0.00 -1.26 -4.89 120.51 118.75 1o13 n ALA 55 Ca 0.00 0.31 -0.06 0.00 0.00 0.00 0.00 53.44 53.69 1o13 n ALA 55 Cb 0.00 -4.82 0.13 0.00 0.00 0.00 0.00 19.45 14.76 1o13 n ALA 55 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1o13 h VAL 56 N -2.22 1.28 -0.32 0.00 2.07 -1.95 -2.21 116.25 112.90 1o13 h VAL 56 Ca -0.56 -1.38 -0.03 0.00 0.82 0.00 0.00 66.70 65.55 1o13 h VAL 56 Cb 1.37 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 32.47 1o13 h VAL 56 CO 0.60 0.45 0.08 -0.65 0.02 0.00 0.00 177.57 178.06 1o13 h PRO 57 N 0.54 0.47 -0.59 1.57 0.11 -1.92 -1.45 132.00 130.73 1o13 h PRO 57 Ca 0.07 -0.07 -0.09 0.00 0.11 0.00 0.00 66.00 66.02 1o13 h PRO 57 Cb 0.76 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.77 1o13 h PRO 57 CO 0.06 0.44 0.02 -0.91 -0.21 0.00 0.00 178.00 177.40 1o13 h ASN 58 N 0.46 0.98 -0.51 -2.05 4.21 -1.81 0.15 115.58 117.02 1o13 h ASN 58 Ca 0.11 -0.26 -0.03 0.00 1.21 0.00 0.00 56.30 57.33 1o13 h ASN 58 Cb 0.19 -0.26 -0.02 0.00 -1.12 0.00 0.00 38.32 37.10 1o13 h ASN 58 CO -0.00 1.03 0.21 0.15 -1.29 0.00 0.00 177.43 177.53 1o13 h PHE 59 N 0.93 0.76 -0.33 1.19 3.04 -0.84 0.15 116.94 121.84 1o13 h PHE 59 Ca 0.17 -0.05 -0.01 0.00 3.98 0.00 0.00 57.97 62.06 1o13 h PHE 59 Cb 0.52 -0.23 -0.02 0.00 2.56 0.00 0.00 35.95 38.78 1o13 h PHE 59 CO 0.03 0.62 0.19 0.28 -2.02 0.00 0.00 178.31 177.41 1o13 h VAL 60 N 0.68 1.13 -0.63 1.41 2.07 -0.83 -2.62 116.25 117.46 1o13 h VAL 60 Ca 0.17 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 1o13 h VAL 60 Cb 0.18 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 1o13 h VAL 60 CO -0.02 0.13 0.36 0.50 0.02 0.00 0.00 177.57 178.56 1o13 h LYS 61 N 0.42 0.87 -0.97 1.57 1.63 -0.79 -2.62 116.57 116.67 1o13 h LYS 61 Ca 0.12 -0.10 0.17 0.00 -0.85 0.00 0.00 60.65 60.00 1o13 h LYS 61 Cb 0.05 -0.17 -0.09 0.00 -0.60 0.00 0.00 32.23 31.41 1o13 h LYS 61 CO -0.02 0.65 0.61 0.93 -3.45 0.00 0.00 179.45 178.17 1o13 h GLU 62 N 0.86 0.69 0.00 1.90 5.08 -0.64 0.69 114.58 123.16 1o13 h GLU 62 Ca 0.22 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1o13 h GLU 62 Cb 0.02 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.12 1o13 h GLU 62 CO -0.04 0.46 0.00 1.63 -1.00 0.00 0.00 179.01 180.06 1o13 n LYS 63 N -4.65 0.85 -0.24 2.33 4.76 -0.99 -4.89 118.16 115.33 1o13 n LYS 63 Ca 0.21 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.65 1o13 n LYS 63 Cb 0.55 -1.27 0.00 0.00 -1.84 0.00 0.00 35.03 32.47 1o13 n LYS 63 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1o13 n GLY 64 N 0.53 0.68 3.73 0.72 0.00 0.23 -5.05 105.19 106.04 1o13 n GLY 64 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1o13 n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o13 s ALA 65 N -2.52 3.80 -0.38 4.61 0.00 -1.21 -4.42 121.76 121.64 1o13 s ALA 65 Ca 0.00 1.51 0.14 0.00 0.00 0.00 0.00 51.96 53.61 1o13 s ALA 65 Cb 0.00 -3.65 -0.18 0.00 0.00 0.00 0.00 23.12 19.29 1o13 s ALA 65 CO 0.00 -0.90 0.47 0.39 0.00 0.00 0.00 175.76 175.72 1o13 n GLU 66 N 3.09 1.56 -3.79 0.00 -0.58 -0.16 -4.71 120.64 116.05 1o13 n GLU 66 Ca 0.11 -0.06 -0.13 0.00 -0.42 0.00 0.00 57.16 56.67 1o13 n GLU 66 Cb 0.37 -1.24 -0.10 0.00 -0.57 0.00 0.00 31.44 29.91 1o13 n GLU 66 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1o13 s LEU 67 N -3.24 1.03 -0.04 -4.62 2.96 -1.21 -2.03 118.68 111.53 1o13 s LEU 67 Ca 0.01 0.21 0.03 0.00 -0.22 0.00 0.00 54.13 54.16 1o13 s LEU 67 Cb 0.10 1.02 0.00 0.00 0.50 0.00 0.00 46.19 47.82 1o13 s LEU 67 CO 0.58 -0.29 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.51 1o13 s VAL 68 N -0.76 1.05 -0.19 1.68 1.01 -0.04 -0.61 120.40 122.55 1o13 s VAL 68 Ca -0.08 -0.48 -0.02 0.00 0.00 0.00 0.00 61.98 61.39 1o13 s VAL 68 Cb -0.04 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.39 1o13 s VAL 68 CO 0.02 0.32 -0.09 -0.63 0.00 0.00 0.00 175.10 174.72 1o13 s ILE 69 N 0.30 3.12 0.31 2.22 1.01 -0.19 -1.13 121.20 126.84 1o13 s ILE 69 Ca -0.07 -0.60 0.03 0.00 0.00 0.00 0.00 60.65 60.02 1o13 s ILE 69 Cb -0.12 -2.37 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 1o13 s ILE 69 CO 0.02 0.47 0.16 0.68 0.00 0.00 0.00 174.94 176.27 1o13 s VAL 70 N 1.07 0.32 0.00 2.92 -7.23 0.31 -4.16 120.40 113.63 1o13 s VAL 70 Ca 0.00 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.17 1o13 s VAL 70 Cb -0.15 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.29 1o13 s VAL 70 CO -0.02 0.00 0.00 -1.14 -0.31 0.00 0.00 175.10 173.63 1o13 n ARG 71 N -0.60 0.00 -4.14 4.82 0.63 -1.26 -1.17 116.66 114.94 1o13 n ARG 71 Ca 0.01 0.02 -0.27 0.00 -0.92 0.00 0.00 57.85 56.69 1o13 n ARG 71 Cb 0.65 -0.27 -0.07 0.00 0.45 0.00 0.00 32.46 33.22 1o13 n ARG 71 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1o13 s GLY 72 N -1.81 1.78 -0.16 5.14 0.00 -0.83 -0.92 107.32 110.52 1o13 s GLY 72 Ca 0.00 -1.25 -0.29 0.00 0.00 0.00 0.00 44.72 43.17 1o13 s GLY 72 CO 0.00 -1.26 0.92 -1.50 0.00 0.00 0.00 173.10 171.27 1o13 s ILE 73 N -1.63 0.00 0.54 0.90 2.07 -1.26 -2.92 121.20 118.89 1o13 s ILE 73 Ca 0.28 0.00 -0.13 0.00 -1.41 0.00 0.00 60.65 59.39 1o13 s ILE 73 Cb -0.10 -1.00 -0.06 0.00 0.13 0.00 0.00 42.46 41.43 1o13 s ILE 73 CO 0.20 0.00 0.96 -0.83 -1.91 0.00 0.00 174.94 173.36 1o13 s GLY 74 N -0.86 1.86 0.31 1.50 0.00 -1.26 -4.93 107.32 103.94 1o13 s GLY 74 Ca -0.03 -0.02 0.01 0.00 0.00 0.00 0.00 44.72 44.68 1o13 s GLY 74 CO 0.02 0.24 1.94 3.21 0.00 0.00 0.00 173.10 178.51 1o13 h ARG 75 N 0.46 0.97 -0.24 2.90 3.08 -2.02 -1.24 114.38 118.29 1o13 h ARG 75 Ca -0.46 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 59.53 1o13 h ARG 75 Cb 1.19 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 31.01 1o13 h ARG 75 CO 0.62 0.64 0.15 0.00 -1.07 0.00 0.00 179.97 180.31 1o13 h ARG 76 N 1.00 0.33 -0.59 0.04 3.08 -1.99 0.40 114.38 116.65 1o13 h ARG 76 Ca 0.35 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 60.30 1o13 h ARG 76 Cb 0.11 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 1o13 h ARG 76 CO -0.11 0.26 0.10 0.00 -1.07 0.00 0.00 179.97 179.14 1o13 h ALA 77 N 1.05 0.79 -0.51 0.04 0.00 -1.84 -0.19 119.26 118.60 1o13 h ALA 77 Ca 0.09 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1o13 h ALA 77 Cb 0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1o13 h ALA 77 CO -0.02 0.53 0.33 0.82 0.00 0.00 0.00 179.25 180.92 1o13 h ILE 78 N 0.88 1.13 -0.63 0.00 2.04 -0.98 -0.26 117.51 119.70 1o13 h ILE 78 Ca 0.18 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.78 1o13 h ILE 78 Cb 0.42 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 36.86 1o13 h ILE 78 CO 0.01 0.13 0.30 0.00 0.00 0.00 0.00 178.15 178.59 1o13 h ALA 79 N 1.18 0.81 -0.65 1.87 0.00 -0.61 -0.88 119.26 120.99 1o13 h ALA 79 Ca 0.18 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1o13 h ALA 79 Cb -0.08 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 1o13 h ALA 79 CO -0.04 0.37 0.24 0.00 0.00 0.00 0.00 179.25 179.82 1o13 h ALA 80 N 1.13 0.84 -0.38 0.00 0.00 -0.49 -0.27 119.26 120.10 1o13 h ALA 80 Ca 0.21 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1o13 h ALA 80 Cb 0.12 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1o13 h ALA 80 CO -0.03 0.48 0.06 0.74 0.00 0.00 0.00 179.25 180.50 1o13 h PHE 81 N 0.92 0.67 -0.74 0.00 0.04 -0.76 -2.95 116.94 114.13 1o13 h PHE 81 Ca 0.21 -0.09 0.03 0.00 2.80 0.00 0.00 57.97 60.92 1o13 h PHE 81 Cb 0.23 -0.18 -0.05 0.00 2.20 0.00 0.00 35.95 38.15 1o13 h PHE 81 CO 0.02 0.67 0.46 0.93 -0.60 0.00 0.00 178.31 179.79 1o13 h GLU 82 N 0.47 0.87 -1.84 1.51 5.08 -0.91 -0.01 114.58 119.76 1o13 h GLU 82 Ca 0.11 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1o13 h GLU 82 Cb 0.37 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1o13 h GLU 82 CO 0.01 0.58 0.00 0.00 -1.00 0.00 0.00 179.01 178.59 1o13 n ALA 83 N -2.32 1.97 -2.59 3.43 0.00 -0.13 -4.45 120.51 116.41 1o13 n ALA 83 Ca 0.08 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.55 1o13 n ALA 83 Cb 0.09 -1.30 0.03 0.00 0.00 0.00 0.00 19.45 18.27 1o13 n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o13 n GLY 85 N 1.28 1.33 3.28 0.00 0.00 -0.75 -5.09 105.19 105.23 1o13 n GLY 85 Ca 0.00 -0.93 -0.34 0.00 0.00 0.00 0.00 46.02 44.75 1o13 n GLY 85 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1o13 s VAL 86 N -1.24 2.96 0.29 1.61 1.01 -0.09 -4.94 120.40 120.01 1o13 s VAL 86 Ca 0.32 -0.65 -0.28 0.00 0.00 0.00 0.00 61.98 61.37 1o13 s VAL 86 Cb 0.37 -2.30 -0.09 0.00 0.00 0.00 0.00 36.38 34.35 1o13 s VAL 86 CO -0.13 0.48 1.03 -0.54 0.00 0.00 0.00 175.10 175.94 1o13 s LYS 87 N 1.13 4.61 -0.09 2.72 -0.14 -0.86 -3.83 119.74 123.29 1o13 s LYS 87 Ca 0.01 1.62 0.05 0.00 -1.36 0.00 0.00 55.97 56.29 1o13 s LYS 87 Cb -0.14 -3.07 -0.00 0.00 -1.68 0.00 0.00 37.83 32.93 1o13 s LYS 87 CO -0.03 0.24 -0.24 0.08 -0.76 0.00 0.00 175.35 174.64 1o13 s VAL 88 N -1.29 2.08 -0.16 3.17 1.01 -1.26 -0.86 120.40 123.09 1o13 s VAL 88 Ca 0.46 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 61.43 1o13 s VAL 88 Cb -0.27 -1.78 0.02 0.00 0.00 0.00 0.00 36.38 34.35 1o13 s VAL 88 CO 0.35 0.56 -0.18 -0.63 0.00 0.00 0.00 175.10 175.20 1o13 s ILE 89 N 0.16 1.86 0.44 2.22 1.01 -0.28 -4.98 121.20 121.64 1o13 s ILE 89 Ca -0.13 -0.83 0.07 0.00 0.00 0.00 0.00 60.65 59.76 1o13 s ILE 89 Cb -0.16 -1.69 -0.01 0.00 0.01 0.00 0.00 42.46 40.60 1o13 s ILE 89 CO 0.07 0.51 0.38 -0.54 0.00 0.00 0.00 174.94 175.36 1o13 s LYS 90 N 1.24 2.46 -0.95 2.79 1.02 -1.26 -0.53 119.74 124.51 1o13 s LYS 90 Ca 0.02 -1.63 0.00 0.00 0.02 0.00 0.00 55.97 54.37 1o13 s LYS 90 Cb -0.14 -2.32 0.00 0.00 -0.52 0.00 0.00 37.83 34.86 1o13 s LYS 90 CO -0.09 -0.28 0.00 0.41 -0.92 0.00 0.00 175.35 174.47 1o13 n GLY 91 N -1.58 0.70 3.90 -3.33 0.00 -0.10 -4.89 105.19 99.89 1o13 n GLY 91 Ca 0.03 -0.55 -0.28 0.00 0.00 0.00 0.00 46.02 45.21 1o13 n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o13 s ALA 92 N -2.40 3.18 -0.14 4.61 0.00 -0.32 -4.94 121.76 121.75 1o13 s ALA 92 Ca 0.00 -0.47 -0.13 0.00 0.00 0.00 0.00 51.96 51.36 1o13 s ALA 92 Cb 0.00 -2.79 0.04 0.00 0.00 0.00 0.00 23.12 20.37 1o13 s ALA 92 CO 0.00 -0.80 0.38 -1.12 0.00 0.00 0.00 175.76 174.22 1o13 s SER 93 N -4.27 -0.40 0.00 0.00 0.01 -1.26 -4.34 113.70 103.45 1o13 s SER 93 Ca 0.54 0.77 0.00 0.00 1.31 0.00 0.00 55.95 58.57 1o13 s SER 93 Cb -0.11 0.77 0.00 0.00 0.21 0.00 0.00 66.02 66.89 1o13 s SER 93 CO 0.48 -0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.61 1o13 n GLY 94 N 2.95 0.66 3.94 3.44 0.00 -1.26 -4.70 105.19 110.21 1o13 n GLY 94 Ca -0.14 -2.10 -0.26 0.00 0.00 0.00 0.00 46.02 43.52 1o13 n GLY 94 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1o13 s THR 95 N -1.04 2.19 0.14 2.61 -4.23 -1.26 -2.06 115.64 111.98 1o13 s THR 95 Ca 0.00 -0.26 -0.19 0.00 -1.18 0.00 0.00 61.69 60.07 1o13 s THR 95 Cb 0.00 -2.93 -0.01 0.00 1.34 0.00 0.00 72.50 70.90 1o13 s THR 95 CO 0.00 0.00 1.72 0.58 -0.54 0.00 0.00 174.62 176.38 1o13 h VAL 96 N -0.80 0.84 -0.33 2.29 2.07 -0.89 -0.93 116.25 118.50 1o13 h VAL 96 Ca -0.43 -0.03 0.04 0.00 0.82 0.00 0.00 66.70 67.09 1o13 h VAL 96 Cb 1.29 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 31.76 1o13 h VAL 96 CO 0.53 0.02 0.11 -0.08 0.02 0.00 0.00 177.57 178.18 1o13 h GLU 97 N 0.10 0.25 -0.14 1.57 4.81 -1.61 -1.88 114.58 117.68 1o13 h GLU 97 Ca 0.12 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1o13 h GLU 97 Cb 0.15 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 1o13 h GLU 97 CO -0.19 0.16 0.07 0.93 -0.73 0.00 0.00 179.01 179.25 1o13 h GLU 98 N 0.26 0.20 -0.27 1.92 5.08 -1.73 -1.73 114.58 118.31 1o13 h GLU 98 Ca 0.15 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.37 1o13 h GLU 98 Cb 0.12 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1o13 h GLU 98 CO -0.15 0.25 -0.29 -0.39 -1.00 0.00 0.00 179.01 177.43 1o13 h VAL 99 N 0.10 1.28 -0.37 3.13 -1.51 -1.06 0.85 116.25 118.67 1o13 h VAL 99 Ca 0.05 -1.37 -0.11 0.00 -1.23 0.00 0.00 66.70 64.04 1o13 h VAL 99 Cb 0.11 1.39 -0.01 0.00 -2.13 0.00 0.00 31.29 30.65 1o13 h VAL 99 CO -0.01 0.44 -0.21 0.58 -1.23 0.00 0.00 177.57 177.14 1o13 h VAL 100 N 0.47 1.28 -0.13 7.19 2.07 -1.33 -1.05 116.25 124.75 1o13 h VAL 100 Ca 0.06 -1.34 -0.07 0.00 0.82 0.00 0.00 66.70 66.17 1o13 h VAL 100 Cb 0.74 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 1o13 h VAL 100 CO 0.06 0.44 -0.21 0.78 0.02 0.00 0.00 177.57 178.66 1o13 h ASN 101 N 0.58 0.22 -0.32 0.57 2.35 -1.03 0.18 115.58 118.13 1o13 h ASN 101 Ca 0.08 -0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 55.73 1o13 h ASN 101 Cb 0.76 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 39.06 1o13 h ASN 101 CO 0.06 0.45 0.03 1.56 -1.65 0.00 0.00 177.43 177.88 1o13 h GLN 102 N 0.21 0.54 -0.00 0.81 4.20 -0.63 -0.83 115.11 119.41 1o13 h GLN 102 Ca 0.04 -0.16 0.01 0.00 0.06 0.00 0.00 58.65 58.60 1o13 h GLN 102 Cb 0.50 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 1o13 h GLN 102 CO 0.03 0.65 -0.04 -0.92 -0.67 0.00 0.00 178.83 177.88 1o13 h TYR 103 N 0.36 -0.11 -0.01 2.96 5.03 -0.57 0.20 116.97 124.82 1o13 h TYR 103 Ca 0.10 0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.37 1o13 h TYR 103 Cb 0.38 0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.71 1o13 h TYR 103 CO 0.03 -0.07 -0.17 -0.07 -1.32 0.00 0.00 178.16 176.55 1o13 h LEU 104 N -0.08 0.02 -1.57 2.82 3.38 -0.87 -2.18 115.31 116.82 1o13 h LEU 104 Ca 0.02 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1o13 h LEU 104 Cb 0.10 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1o13 h LEU 104 CO -0.05 0.19 0.00 -1.54 0.09 0.00 0.00 178.44 177.13 1o13 n SER 105 N -4.33 2.33 -0.15 -0.43 3.41 -0.33 -4.93 113.62 109.21 1o13 n SER 105 Ca -0.02 -1.87 -0.02 0.00 -0.26 0.00 0.00 58.87 56.70 1o13 n SER 105 Cb 0.24 -0.20 -0.01 0.00 -0.26 0.00 0.00 64.21 63.98 1o13 n SER 105 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1o13 n GLY 106 N 1.25 0.55 0.17 5.00 0.00 -0.82 -5.05 105.19 106.29 1o13 n GLY 106 Ca 0.17 -0.59 0.15 0.00 0.00 0.00 0.00 46.02 45.75 1o13 n GLY 106 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26