#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b63 n ASN 3 N 0.00 -0.01 -3.59 6.43 3.02 -1.26 -5.08 115.26 114.77 2b63 n ASN 3 Ca 0.00 -3.10 -0.16 0.00 -0.03 0.00 0.00 54.58 51.29 2b63 n ASN 3 Cb 0.00 1.39 0.09 0.00 -0.61 0.00 0.00 39.78 40.65 2b63 n ASN 3 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2b63 n THR 4 N -0.71 0.00 -1.54 3.41 -1.04 -1.26 -3.86 114.28 109.28 2b63 n THR 4 Ca 0.03 -0.96 0.00 0.00 -2.04 0.00 0.00 64.05 61.08 2b63 n THR 4 Cb 0.58 -1.19 0.00 0.00 -1.82 0.00 0.00 70.33 67.91 2b63 n THR 4 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2b63 n LEU 5 N 0.00 0.00 -3.62 -4.42 4.77 -1.26 -4.72 117.00 107.75 2b63 n LEU 5 Ca 0.11 -0.16 -0.06 0.00 -0.03 0.00 0.00 56.01 55.86 2b63 n LEU 5 Cb 0.39 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.42 2b63 n LEU 5 CO 0.27 0.22 0.96 0.12 -1.33 0.00 0.00 177.39 177.62 2b63 s PHE 6 N 0.00 -0.22 -0.18 -1.77 5.36 -1.26 -4.59 117.98 115.32 2b63 s PHE 6 Ca 0.00 0.43 -0.13 0.00 -0.96 0.00 0.00 56.93 56.27 2b63 s PHE 6 Cb 0.00 0.46 0.05 0.00 -0.34 0.00 0.00 43.02 43.19 2b63 s PHE 6 CO 0.00 -0.17 0.45 0.34 -1.46 0.00 0.00 175.22 174.38 2b63 s ASP 7 N -0.73 -0.53 0.00 6.13 -1.08 -1.26 -3.85 116.67 115.35 2b63 s ASP 7 Ca 0.04 0.95 0.00 0.00 -0.52 0.00 0.00 52.55 53.02 2b63 s ASP 7 Cb -0.02 0.89 0.00 0.00 -1.46 0.00 0.00 42.92 42.33 2b63 s ASP 7 CO -0.05 -0.18 0.00 -0.67 0.52 0.00 0.00 175.17 174.79 2b63 n ASP 8 N 3.61 0.00 -3.81 -0.34 2.03 -1.20 -5.03 116.55 111.81 2b63 n ASP 8 Ca -0.18 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.00 2b63 n ASP 8 Cb 0.56 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.85 2b63 n ASP 8 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2b63 s ILE 9 N -3.00 0.02 0.08 5.18 1.01 -1.26 -2.66 121.20 120.57 2b63 s ILE 9 Ca 0.00 -0.20 0.04 0.00 0.00 0.00 0.00 60.65 60.49 2b63 s ILE 9 Cb 0.00 -0.36 -0.03 0.00 0.01 0.00 0.00 42.46 42.08 2b63 s ILE 9 CO 0.00 -0.11 -0.12 -0.36 0.00 0.00 0.00 174.94 174.35 2b63 s PHE 10 N -0.36 1.10 -0.23 3.97 0.40 0.02 -2.61 117.98 120.27 2b63 s PHE 10 Ca -0.05 -0.54 -0.04 0.00 -0.60 0.00 0.00 56.93 55.71 2b63 s PHE 10 Cb -0.03 -0.61 0.00 0.00 0.51 0.00 0.00 43.02 42.89 2b63 s PHE 10 CO 0.01 0.03 -0.04 -1.14 0.70 0.00 0.00 175.22 174.78 2b63 s GLN 11 N -2.16 3.21 0.04 0.44 0.74 -0.37 -1.22 119.66 120.35 2b63 s GLN 11 Ca 0.00 -0.73 -0.34 0.00 0.05 0.00 0.00 55.36 54.34 2b63 s GLN 11 Cb -0.07 -3.03 -0.13 0.00 1.10 0.00 0.00 33.01 30.87 2b63 s GLN 11 CO 0.01 -0.27 1.70 0.28 -0.55 0.00 0.00 175.29 176.46 2b63 n VAL 12 N 4.77 0.25 -0.03 1.34 0.31 -1.03 -2.19 118.33 121.76 2b63 n VAL 12 Ca -0.17 -0.05 -0.12 0.00 -0.01 0.00 0.00 64.34 63.99 2b63 n VAL 12 Cb 0.50 -1.64 -0.14 0.00 -0.91 0.00 0.00 33.84 31.65 2b63 n VAL 12 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2b63 n SER 13 N 4.79 1.09 -3.58 4.52 3.41 -0.32 -0.61 113.62 122.91 2b63 n SER 13 Ca 0.20 0.31 -0.08 0.00 -0.26 0.00 0.00 58.87 59.04 2b63 n SER 13 Cb 0.28 -0.14 -0.04 0.00 -0.26 0.00 0.00 64.21 64.05 2b63 n SER 13 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2b63 s GLU 14 N -2.58 0.50 0.06 4.33 2.12 -1.16 -4.68 118.70 117.29 2b63 s GLU 14 Ca -0.10 0.06 0.07 0.00 0.36 0.00 0.00 54.97 55.37 2b63 s GLU 14 Cb 0.08 0.23 -0.03 0.00 0.26 0.00 0.00 34.13 34.66 2b63 s GLU 14 CO 0.81 -0.17 -0.17 0.08 -0.54 0.00 0.00 175.26 175.27 2b63 s VAL 15 N -1.38 2.86 -0.09 3.70 1.01 -1.26 -2.70 120.40 122.53 2b63 s VAL 15 Ca 0.02 -1.24 -0.03 0.00 0.00 0.00 0.00 61.98 60.72 2b63 s VAL 15 Cb -0.01 -2.23 0.05 0.00 0.00 0.00 0.00 36.38 34.19 2b63 s VAL 15 CO -0.02 0.28 0.16 -0.62 0.00 0.00 0.00 175.10 174.90 2b63 s ASP 16 N -1.62 0.82 -0.52 3.32 2.15 -0.91 -4.97 116.67 114.93 2b63 s ASP 16 Ca 0.16 0.29 -0.09 0.00 0.43 0.00 0.00 52.55 53.33 2b63 s ASP 16 Cb -0.11 0.26 0.13 0.00 -0.30 0.00 0.00 42.92 42.90 2b63 s ASP 16 CO 0.07 -0.25 0.40 -2.16 -0.17 0.00 0.00 175.17 173.06 2b63 s PRO 17 N 2.29 2.62 -1.09 4.34 0.04 -1.26 -2.15 135.00 139.79 2b63 s PRO 17 Ca 0.03 -1.91 -0.14 0.00 0.04 0.00 0.00 61.00 59.03 2b63 s PRO 17 Cb -0.12 -3.98 0.19 0.00 0.04 0.00 0.00 34.50 30.63 2b63 s PRO 17 CO -0.06 -1.21 1.23 0.20 0.04 0.00 0.00 177.00 177.20 2b63 s GLY 18 N 2.48 2.52 -1.55 0.56 0.00 -1.26 -4.36 107.32 105.70 2b63 s GLY 18 Ca 0.08 -3.34 -0.05 0.00 0.00 0.00 0.00 44.72 41.41 2b63 s GLY 18 CO -0.02 1.80 0.57 0.54 0.00 0.00 0.00 173.10 175.99 2b63 n ARG 19 N 5.00 -4.64 -3.90 2.90 5.12 -1.26 -4.95 116.66 114.93 2b63 n ARG 19 Ca 0.29 0.88 -0.30 0.00 -1.93 0.00 0.00 57.85 56.79 2b63 n ARG 19 Cb 0.44 -5.73 -0.14 0.00 -1.16 0.00 0.00 32.46 25.87 2b63 n ARG 19 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 2b63 s TYR 20 N -3.15 2.91 0.50 -1.55 4.12 -1.26 -4.99 117.35 113.92 2b63 s TYR 20 Ca 0.30 -2.98 0.23 0.00 0.02 0.00 0.00 57.07 54.63 2b63 s TYR 20 Cb -0.13 -2.60 1.29 0.00 -1.52 0.00 0.00 41.96 39.00 2b63 s TYR 20 CO 0.37 -0.76 1.95 -0.91 0.02 0.00 0.00 175.55 176.22 2b63 h ASN 21 N 6.61 0.13 -0.02 2.29 2.35 -1.94 -3.16 115.58 121.84 2b63 h ASN 21 Ca -0.06 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 2b63 h ASN 21 Cb 0.91 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.26 2b63 h ASN 21 CO 0.63 0.07 0.00 0.29 -1.65 0.00 0.00 177.43 176.77 2b63 n LYS 22 N -4.40 -0.08 -3.70 0.81 5.02 -1.26 -5.00 118.16 109.55 2b63 n LYS 22 Ca 0.13 -0.86 -0.12 0.00 -2.02 0.00 0.00 58.31 55.44 2b63 n LYS 22 Cb 0.64 -1.10 -0.10 0.00 -0.02 0.00 0.00 35.03 34.45 2b63 n LYS 22 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2b63 s VAL 23 N -0.45 -0.01 0.22 -0.18 1.01 -1.20 -3.61 120.40 116.18 2b63 s VAL 23 Ca 0.06 0.03 0.11 0.00 0.00 0.00 0.00 61.98 62.19 2b63 s VAL 23 Cb 0.04 -0.67 -0.05 0.00 0.00 0.00 0.00 36.38 35.71 2b63 s VAL 23 CO 0.06 0.01 -0.21 0.00 0.00 0.00 0.00 175.10 174.97 2b63 s ARG 25 N -2.97 3.78 -0.11 0.00 3.52 -0.91 -0.57 118.95 121.69 2b63 s ARG 25 Ca 0.24 -0.44 0.01 0.00 -0.13 0.00 0.00 55.73 55.41 2b63 s ARG 25 Cb -0.07 -3.15 -0.02 0.00 -1.56 0.00 0.00 34.95 30.15 2b63 s ARG 25 CO 0.12 0.12 -0.14 0.42 -0.81 0.00 0.00 175.30 175.00 2b63 s ILE 26 N 0.76 2.95 -0.23 4.11 1.01 0.80 -2.14 121.20 128.46 2b63 s ILE 26 Ca 0.02 -0.71 -0.02 0.00 0.00 0.00 0.00 60.65 59.94 2b63 s ILE 26 Cb -0.14 -2.21 0.02 0.00 0.01 0.00 0.00 42.46 40.14 2b63 s ILE 26 CO 0.02 0.54 -0.07 -1.61 0.00 0.00 0.00 174.94 173.82 2b63 s GLU 27 N 0.12 3.01 0.11 2.79 2.02 -1.10 -0.92 118.70 124.73 2b63 s GLU 27 Ca -0.07 -0.86 0.04 0.00 0.02 0.00 0.00 54.97 54.10 2b63 s GLU 27 Cb -0.15 -2.94 -0.04 0.00 0.10 0.00 0.00 34.13 31.10 2b63 s GLU 27 CO 0.05 -0.32 -0.10 0.00 0.02 0.00 0.00 175.26 174.91 2b63 s ALA 28 N 1.37 1.18 0.58 5.21 0.00 -1.04 -1.17 121.76 127.89 2b63 s ALA 28 Ca 0.02 -1.27 0.10 0.00 0.00 0.00 0.00 51.96 50.81 2b63 s ALA 28 Cb -0.15 0.04 0.09 0.00 0.00 0.00 0.00 23.12 23.10 2b63 s ALA 28 CO -0.05 -0.07 0.79 0.00 0.00 0.00 0.00 175.76 176.43 2b63 s ALA 29 N -2.76 4.72 0.01 0.00 0.00 -0.93 -1.77 121.76 121.04 2b63 s ALA 29 Ca 0.09 -2.15 0.01 0.00 0.00 0.00 0.00 51.96 49.90 2b63 s ALA 29 Cb -0.01 -1.43 -0.04 0.00 0.00 0.00 0.00 23.12 21.64 2b63 s ALA 29 CO -0.00 -0.88 0.04 0.45 0.00 0.00 0.00 175.76 175.37 2b63 s SER 30 N -4.67 5.40 -0.93 0.00 0.15 -1.22 -1.24 113.70 111.18 2b63 s SER 30 Ca 0.62 0.05 -0.02 0.00 0.70 0.00 0.00 55.95 57.30 2b63 s SER 30 Cb -0.05 -1.47 0.31 0.00 -1.71 0.00 0.00 66.02 63.09 2b63 s SER 30 CO 0.39 0.26 2.00 0.41 1.20 0.00 0.00 173.24 177.50 2b63 n THR 31 N 1.18 4.79 0.00 6.45 -1.04 -1.07 -4.64 114.28 119.95 2b63 n THR 31 Ca -0.13 -4.98 0.00 0.00 -2.04 0.00 0.00 64.05 56.90 2b63 n THR 31 Cb 0.53 -1.44 0.00 0.00 -1.82 0.00 0.00 70.33 67.60 2b63 n THR 31 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2b63 n THR 32 N -0.14 0.00 -2.80 12.58 -1.04 -1.26 -4.93 114.28 116.69 2b63 n THR 32 Ca 0.51 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 62.11 2b63 n THR 32 Cb 0.26 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.74 2b63 n THR 32 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2b63 s GLN 33 N 1.05 4.49 0.00 -2.82 1.11 -1.26 -4.92 119.66 117.31 2b63 s GLN 33 Ca 0.00 1.25 0.00 0.00 0.01 0.00 0.00 55.36 56.62 2b63 s GLN 33 Cb 0.00 -3.48 0.00 0.00 -1.01 0.00 0.00 33.01 28.52 2b63 s GLN 33 CO 0.00 -0.09 0.79 -0.25 0.01 0.00 0.00 175.29 175.75 2b63 n ASP 34 N 4.17 2.30 0.02 5.90 8.00 -1.26 -3.33 116.55 132.35 2b63 n ASP 34 Ca 0.05 -1.47 -0.00 0.00 0.71 0.00 0.00 54.79 54.07 2b63 n ASP 34 Cb 0.50 -0.41 -0.00 0.00 -0.02 0.00 0.00 41.12 41.20 2b63 n ASP 34 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2b63 n GLN 35 N 0.79 0.03 -1.46 -1.24 6.02 -1.26 -4.98 117.38 115.29 2b63 n GLN 35 Ca 0.00 0.01 -0.17 0.00 -0.01 0.00 0.00 57.00 56.83 2b63 n GLN 35 Cb 0.35 -0.33 -0.16 0.00 1.02 0.00 0.00 30.24 31.12 2b63 n GLN 35 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b63 s LYS 37 N 7.26 2.23 0.02 0.00 1.02 -1.15 -3.39 119.74 125.73 2b63 s LYS 37 Ca 1.05 -1.18 -0.20 0.00 0.02 0.00 0.00 55.97 55.66 2b63 s LYS 37 Cb -0.55 -2.52 0.04 0.00 -0.52 0.00 0.00 37.83 34.28 2b63 s LYS 37 CO 0.37 -0.93 0.44 -1.17 -0.92 0.00 0.00 175.35 173.15 2b63 s LEU 38 N -4.80 0.29 -0.14 3.17 2.96 -0.73 -3.41 118.68 116.02 2b63 s LEU 38 Ca 0.61 0.15 -0.06 0.00 -0.22 0.00 0.00 54.13 54.61 2b63 s LEU 38 Cb -0.07 1.80 0.06 0.00 0.50 0.00 0.00 46.19 48.47 2b63 s LEU 38 CO 0.40 -0.61 0.32 -0.89 -1.32 0.00 0.00 176.35 174.24 2b63 s THR 39 N -1.99 -0.22 -0.21 3.68 2.01 -1.02 -2.49 115.64 115.40 2b63 s THR 39 Ca -0.08 0.17 -0.18 0.00 0.31 0.00 0.00 61.69 61.91 2b63 s THR 39 Cb -0.02 -0.49 0.06 0.00 0.01 0.00 0.00 72.50 72.06 2b63 s THR 39 CO 0.01 0.07 0.56 -0.22 -0.69 0.00 0.00 174.62 174.35 2b63 s LEU 40 N 1.79 -0.17 0.19 4.42 2.96 -0.10 -0.60 118.68 127.16 2b63 s LEU 40 Ca -0.06 1.13 -0.26 0.00 -0.22 0.00 0.00 54.13 54.72 2b63 s LEU 40 Cb -0.11 1.90 -0.08 0.00 0.50 0.00 0.00 46.19 48.40 2b63 s LEU 40 CO -0.10 -0.20 0.82 -1.81 -1.32 0.00 0.00 176.35 173.74 2b63 s ASP 41 N 0.45 7.44 0.08 3.68 1.01 -0.95 -0.14 116.67 128.23 2b63 s ASP 41 Ca -0.01 1.72 -0.09 0.00 0.71 0.00 0.00 52.55 54.87 2b63 s ASP 41 Cb -0.04 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.36 2b63 s ASP 41 CO -0.01 0.19 0.20 -0.63 0.21 0.00 0.00 175.17 175.12 2b63 s ILE 42 N -1.17 0.13 -1.16 0.77 1.01 0.26 -4.81 121.20 116.23 2b63 s ILE 42 Ca 0.37 -1.09 -0.16 0.00 0.00 0.00 0.00 60.65 59.77 2b63 s ILE 42 Cb -0.24 -1.23 0.14 0.00 0.01 0.00 0.00 42.46 41.15 2b63 s ILE 42 CO 0.27 -0.60 1.42 0.21 0.00 0.00 0.00 174.94 176.24 2b63 s ASN 43 N -2.67 6.93 0.00 3.58 3.84 -1.26 -1.97 114.94 123.39 2b63 s ASN 43 Ca 0.02 -2.67 0.00 0.00 0.21 0.00 0.00 52.86 50.42 2b63 s ASN 43 Cb 0.03 -2.43 0.00 0.00 -0.55 0.00 0.00 41.25 38.30 2b63 s ASN 43 CO -0.09 -0.90 0.17 0.52 -2.79 0.00 0.00 177.10 174.01 2b63 n VAL 44 N 5.12 0.00 -0.07 -5.21 0.31 -1.24 -1.59 118.33 115.65 2b63 n VAL 44 Ca 0.36 0.00 -0.07 0.00 -0.01 0.00 0.00 64.34 64.61 2b63 n VAL 44 Cb 0.45 -0.38 -0.11 0.00 -0.91 0.00 0.00 33.84 32.88 2b63 n VAL 44 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2b63 n GLU 45 N -0.43 1.59 0.00 5.55 2.13 -1.25 -4.02 120.64 124.21 2b63 n GLU 45 Ca 0.00 -0.00 0.08 0.00 0.66 0.00 0.00 57.16 57.90 2b63 n GLU 45 Cb 0.00 -1.37 -0.04 0.00 0.27 0.00 0.00 31.44 30.30 2b63 n GLU 45 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2b63 n LEU 46 N -2.56 1.21 -2.83 4.31 4.77 -0.62 -4.71 117.00 116.57 2b63 n LEU 46 Ca -0.24 -0.64 -0.11 0.00 -0.03 0.00 0.00 56.01 54.99 2b63 n LEU 46 Cb 0.96 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 42.09 2b63 n LEU 46 CO 0.30 0.25 0.14 0.33 -1.33 0.00 0.00 177.39 177.08 2b63 n PHE 47 N -0.72 -2.65 -1.18 -1.77 7.35 -0.64 -5.03 117.46 112.81 2b63 n PHE 47 Ca 0.05 -2.19 -0.38 0.00 -0.76 0.00 0.00 57.45 54.17 2b63 n PHE 47 Cb 0.30 1.21 0.03 0.00 0.35 0.00 0.00 39.48 41.37 2b63 n PHE 47 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 2b63 n PRO 48 N 1.26 0.06 -3.64 -7.13 -0.02 -1.26 -4.51 135.00 119.77 2b63 n PRO 48 Ca 0.11 0.03 -0.11 0.00 -2.02 0.00 0.00 63.50 61.51 2b63 n PRO 48 Cb 0.63 -1.17 -0.07 0.00 -0.02 0.00 0.00 33.50 32.87 2b63 n PRO 48 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2b63 s VAL 49 N -1.98 -0.00 0.30 -1.45 1.01 -1.26 -5.02 120.40 111.99 2b63 s VAL 49 Ca 0.54 0.00 0.06 0.00 0.00 0.00 0.00 61.98 62.58 2b63 s VAL 49 Cb -0.38 -0.98 -0.06 0.00 0.00 0.00 0.00 36.38 34.97 2b63 s VAL 49 CO 0.69 0.00 -0.03 0.00 0.00 0.00 0.00 175.10 175.77 2b63 s ALA 50 N 1.01 2.39 0.50 5.51 0.00 -1.26 -5.00 121.76 124.91 2b63 s ALA 50 Ca -0.05 -1.96 -0.19 0.00 0.00 0.00 0.00 51.96 49.76 2b63 s ALA 50 Cb -0.05 0.29 -0.13 0.00 0.00 0.00 0.00 23.12 23.23 2b63 s ALA 50 CO -0.09 -0.13 0.14 0.00 0.00 0.00 0.00 175.76 175.67 2b63 n ALA 51 N -0.63 -2.39 -3.47 0.00 0.00 -1.26 -4.00 120.51 108.77 2b63 n ALA 51 Ca -0.05 -0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.05 2b63 n ALA 51 Cb 0.64 -1.56 0.03 0.00 0.00 0.00 0.00 19.45 18.56 2b63 n ALA 51 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2b63 n GLN 52 N 0.97 -1.70 -4.25 0.00 6.02 0.22 -4.92 117.38 113.72 2b63 n GLN 52 Ca 0.10 1.34 -0.14 0.00 -0.01 0.00 0.00 57.00 58.28 2b63 n GLN 52 Cb 0.46 -1.89 -0.10 0.00 1.02 0.00 0.00 30.24 29.73 2b63 n GLN 52 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2b63 s ASP 53 N -1.40 1.64 -0.52 1.08 1.01 -1.26 -4.81 116.67 112.42 2b63 s ASP 53 Ca 0.33 -1.06 -0.16 0.00 0.71 0.00 0.00 52.55 52.37 2b63 s ASP 53 Cb -0.03 0.02 0.10 0.00 1.01 0.00 0.00 42.92 44.02 2b63 s ASP 53 CO 0.76 -0.40 0.49 -0.94 0.21 0.00 0.00 175.17 175.28 2b63 s SER 54 N -3.17 6.18 -0.05 0.27 1.04 -1.26 -2.47 113.70 114.24 2b63 s SER 54 Ca 0.18 -1.52 -0.02 0.00 0.48 0.00 0.00 55.95 55.08 2b63 s SER 54 Cb 0.04 -2.21 -0.04 0.00 0.10 0.00 0.00 66.02 63.91 2b63 s SER 54 CO 0.01 -0.80 0.05 -0.76 0.98 0.00 0.00 173.24 172.72 2b63 s LEU 55 N 1.79 3.83 -0.24 2.42 1.43 -0.36 -4.80 118.68 122.75 2b63 s LEU 55 Ca 0.05 0.19 -0.09 0.00 -1.03 0.00 0.00 54.13 53.24 2b63 s LEU 55 Cb -0.27 -2.05 -0.04 0.00 0.03 0.00 0.00 46.19 43.86 2b63 s LEU 55 CO 0.05 0.34 0.13 -0.89 0.23 0.00 0.00 176.35 176.21 2b63 s THR 56 N -1.04 5.05 -0.09 5.49 2.01 -1.24 -0.80 115.64 125.01 2b63 s THR 56 Ca 0.18 0.07 0.02 0.00 0.31 0.00 0.00 61.69 62.27 2b63 s THR 56 Cb -0.12 -3.36 -0.02 0.00 0.01 0.00 0.00 72.50 69.02 2b63 s THR 56 CO 0.08 0.34 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.51 2b63 s VAL 57 N 1.22 3.00 0.04 3.82 1.01 -1.09 -3.44 120.40 124.96 2b63 s VAL 57 Ca 0.06 -0.71 -0.01 0.00 0.00 0.00 0.00 61.98 61.32 2b63 s VAL 57 Cb -0.14 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.99 2b63 s VAL 57 CO 0.05 0.56 -0.03 -0.89 0.00 0.00 0.00 175.10 174.79 2b63 s THR 58 N -0.14 0.18 0.00 3.92 2.01 -1.17 -3.20 115.64 117.23 2b63 s THR 58 Ca -0.01 -1.51 0.00 0.00 0.31 0.00 0.00 61.69 60.48 2b63 s THR 58 Cb -0.14 -1.11 0.00 0.00 0.01 0.00 0.00 72.50 71.27 2b63 s THR 58 CO 0.03 -0.83 0.00 -0.38 -0.69 0.00 0.00 174.62 172.75 2b63 n ILE 59 N 0.59 0.00 0.00 1.82 -0.00 -1.25 -2.34 119.36 118.18 2b63 n ILE 59 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.58 2b63 n ILE 59 Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 40.23 2b63 n ILE 59 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2b63 n ALA 60 N -3.00 0.00 -3.46 -1.39 0.00 -1.26 -4.55 120.51 106.85 2b63 n ALA 60 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.17 2b63 n ALA 60 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 2b63 n ALA 60 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2b63 n SER 61 N -0.34 0.41 0.00 0.00 3.41 -1.25 -2.26 113.62 113.60 2b63 n SER 61 Ca 0.00 -2.61 0.00 0.00 -0.26 0.00 0.00 58.87 56.00 2b63 n SER 61 Cb 0.00 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.34 2b63 n SER 61 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2b63 n SER 62 N 2.40 0.00 -1.49 4.04 3.41 -1.26 -4.38 113.62 116.34 2b63 n SER 62 Ca 0.27 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.88 2b63 n SER 62 Cb 0.46 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 2b63 n SER 62 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2b63 n LEU 63 N 0.00 0.00 0.00 1.04 4.77 -1.26 -5.00 117.00 116.55 2b63 n LEU 63 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2b63 n LEU 63 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2b63 n LEU 63 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.39 176.47 2b63 n THR 76 N -0.56 0.00 -0.47 -5.08 -1.04 -1.26 -4.60 114.28 101.27 2b63 n THR 76 Ca 0.00 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.05 2b63 n THR 76 Cb 0.00 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.49 2b63 n THR 76 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2b63 n ARG 77 N -0.62 -1.12 -2.18 -2.82 1.74 -1.26 -4.85 116.66 105.55 2b63 n ARG 77 Ca 0.00 0.91 -0.42 0.00 -0.77 0.00 0.00 57.85 57.56 2b63 n ARG 77 Cb 0.00 -1.26 -0.03 0.00 -1.02 0.00 0.00 32.46 30.16 2b63 n ARG 77 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2b63 s SER 78 N -4.78 6.80 0.10 0.55 1.04 -1.26 -4.95 113.70 111.20 2b63 s SER 78 Ca 0.00 2.11 -0.31 0.00 0.48 0.00 0.00 55.95 58.23 2b63 s SER 78 Cb 0.00 -2.55 -0.10 0.00 0.10 0.00 0.00 66.02 63.47 2b63 s SER 78 CO 0.00 -0.79 1.82 0.86 0.98 0.00 0.00 173.24 176.11 2b63 s TRP 79 N 3.00 2.03 0.28 5.02 -0.00 -1.26 -4.98 118.94 123.03 2b63 s TRP 79 Ca 0.66 -0.05 -0.19 0.00 -0.00 0.00 0.00 56.10 56.52 2b63 s TRP 79 Cb -0.31 -4.16 -0.09 0.00 -0.00 0.00 0.00 33.47 28.92 2b63 s TRP 79 CO 0.26 -4.83 0.77 1.03 -0.00 0.00 0.00 176.95 174.18 2b63 s ARG 80 N 3.04 4.22 0.00 5.86 0.52 -1.26 -5.08 118.95 126.25 2b63 s ARG 80 Ca 0.81 0.88 0.00 0.00 -0.52 0.00 0.00 55.73 56.90 2b63 s ARG 80 Cb -0.44 -2.70 0.00 0.00 0.52 0.00 0.00 34.95 32.33 2b63 s ARG 80 CO 0.36 0.29 0.00 -2.30 0.02 0.00 0.00 175.30 173.67 2b63 n PRO 81 N 0.31 1.56 0.00 3.54 -0.02 -1.26 -4.99 135.00 134.14 2b63 n PRO 81 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2b63 n PRO 81 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 2b63 n PRO 81 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2b63 n PRO 82 N 0.00 0.00 0.00 0.52 -0.04 -1.26 -4.58 135.00 129.64 2b63 n PRO 82 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2b63 n PRO 82 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2b63 n PRO 82 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2b63 n GLN 83 N 0.00 0.00 0.00 0.54 6.02 -1.26 -4.53 117.38 118.15 2b63 n GLN 83 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2b63 n GLN 83 Cb 0.00 -0.22 0.00 0.00 1.02 0.00 0.00 30.24 31.04 2b63 n GLN 83 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b63 n ALA 84 N 0.00 1.83 0.28 -1.58 0.00 -1.26 -3.75 120.51 116.02 2b63 n ALA 84 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.60 2b63 n ALA 84 Cb 0.00 -1.00 0.91 0.00 0.00 0.00 0.00 19.45 19.36 2b63 n ALA 84 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2b63 h GLY 85 N 2.71 0.00 -4.43 0.00 0.00 -1.97 -2.03 103.07 97.35 2b63 h GLY 85 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.84 2b63 h GLY 85 CO 0.00 0.00 -0.88 1.34 0.00 0.00 0.00 176.54 177.00 2b63 n ASP 86 N -3.83 3.89 -1.16 0.19 -0.08 -1.25 -5.06 116.55 109.26 2b63 n ASP 86 Ca -0.02 -3.35 0.00 0.00 -1.51 0.00 0.00 54.79 49.91 2b63 n ASP 86 Cb 0.13 -0.43 0.00 0.00 2.34 0.00 0.00 41.12 43.16 2b63 n ASP 86 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2b63 n ARG 87 N -0.53 1.11 -1.70 -0.67 1.74 -0.76 -5.11 116.66 110.73 2b63 n ARG 87 Ca 0.32 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.97 2b63 n ARG 87 Cb 0.82 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 32.23 2b63 n ARG 87 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2b63 n SER 88 N -1.65 3.35 -3.26 0.55 3.41 -1.26 -4.97 113.62 109.79 2b63 n SER 88 Ca 0.00 1.12 -0.25 0.00 -0.26 0.00 0.00 58.87 59.48 2b63 n SER 88 Cb 0.00 -1.50 -0.07 0.00 -0.26 0.00 0.00 64.21 62.37 2b63 n SER 88 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2b63 n LEU 89 N 2.61 0.84 -1.03 1.04 4.77 -1.26 -4.93 117.00 119.05 2b63 n LEU 89 Ca 0.12 -4.82 0.00 0.00 -0.03 0.00 0.00 56.01 51.28 2b63 n LEU 89 Cb 0.33 0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.79 2b63 n LEU 89 CO 0.63 2.05 0.25 0.00 -1.33 0.00 0.00 177.39 179.00 2b63 n ALA 90 N 1.40 2.02 -1.65 -1.18 0.00 -1.26 -3.95 120.51 115.88 2b63 n ALA 90 Ca 0.23 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.34 2b63 n ALA 90 Cb 0.50 -1.02 0.06 0.00 0.00 0.00 0.00 19.45 18.99 2b63 n ALA 90 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2b63 n ASP 91 N 0.80 6.92 -0.12 0.00 5.75 -1.26 -4.70 116.55 123.93 2b63 n ASP 91 Ca 0.00 -3.79 0.00 0.00 -0.01 0.00 0.00 54.79 50.99 2b63 n ASP 91 Cb 0.24 -0.83 0.00 0.00 -1.03 0.00 0.00 41.12 39.50 2b63 n ASP 91 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2b63 n ASP 92 N -0.78 0.12 -4.12 -1.12 8.00 -1.25 -4.70 116.55 112.70 2b63 n ASP 92 Ca 0.56 -1.04 -0.21 0.00 0.71 0.00 0.00 54.79 54.81 2b63 n ASP 92 Cb 0.65 -0.06 -0.01 0.00 -0.02 0.00 0.00 41.12 41.67 2b63 n ASP 92 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2b63 n TYR 93 N -0.32 -0.48 -0.06 1.24 4.02 -1.26 -4.98 117.16 115.31 2b63 n TYR 93 Ca 0.00 -1.79 -0.07 0.00 -0.01 0.00 0.00 57.90 56.04 2b63 n TYR 93 Cb 0.03 -0.32 -0.09 0.00 -0.02 0.00 0.00 39.34 38.94 2b63 n TYR 93 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2b63 n ASP 94 N -1.75 2.14 -4.00 7.72 8.00 0.22 -4.95 116.55 123.93 2b63 n ASP 94 Ca -0.04 -0.01 -0.30 0.00 0.71 0.00 0.00 54.79 55.15 2b63 n ASP 94 Cb 0.48 0.65 -0.16 0.00 -0.02 0.00 0.00 41.12 42.06 2b63 n ASP 94 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2b63 s TYR 95 N -2.29 2.08 -0.28 1.24 6.04 -1.13 -5.01 117.35 117.99 2b63 s TYR 95 Ca -0.08 -1.17 -0.03 0.00 0.04 0.00 0.00 57.07 55.83 2b63 s TYR 95 Cb 0.04 -1.54 0.09 0.00 -1.04 0.00 0.00 41.96 39.51 2b63 s TYR 95 CO 0.47 -0.65 0.11 0.08 -1.54 0.00 0.00 175.55 174.02 2b63 s VAL 96 N 1.52 0.21 0.37 3.14 1.01 -1.26 -1.31 120.40 124.08 2b63 s VAL 96 Ca 0.05 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.20 2b63 s VAL 96 Cb -0.13 -1.12 0.07 0.00 0.00 0.00 0.00 36.38 35.20 2b63 s VAL 96 CO -0.10 -0.64 0.51 0.23 0.00 0.00 0.00 175.10 175.10 2b63 n MET 97 N 5.14 0.47 -3.64 2.72 2.81 -0.73 -4.88 117.12 119.01 2b63 n MET 97 Ca -0.05 -1.62 -0.06 0.00 -1.81 0.00 0.00 57.70 54.16 2b63 n MET 97 Cb 0.43 -0.26 -0.07 0.00 -0.71 0.00 0.00 33.22 32.61 2b63 n MET 97 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 2b63 s TYR 98 N -1.33 -1.01 0.00 2.03 5.04 -1.26 -1.97 117.35 118.85 2b63 s TYR 98 Ca 0.35 2.00 0.00 0.00 -2.44 0.00 0.00 57.07 56.98 2b63 s TYR 98 Cb -0.02 0.60 0.00 0.00 0.35 0.00 0.00 41.96 42.89 2b63 s TYR 98 CO 0.23 -0.50 0.00 0.41 -1.34 0.00 0.00 175.55 174.35 2b63 n GLY 99 N 4.30 3.91 3.15 8.97 0.00 -1.24 -4.65 105.19 119.63 2b63 n GLY 99 Ca -0.19 -0.23 -0.12 0.00 0.00 0.00 0.00 46.02 45.48 2b63 n GLY 99 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b63 s THR 100 N 0.48 0.06 -0.26 2.61 2.01 0.53 -4.28 115.64 116.79 2b63 s THR 100 Ca 0.00 -0.47 -0.14 0.00 0.31 0.00 0.00 61.69 61.39 2b63 s THR 100 Cb 0.00 -0.46 -0.04 0.00 0.01 0.00 0.00 72.50 72.00 2b63 s THR 100 CO 0.00 -0.26 0.32 0.00 -0.69 0.00 0.00 174.62 173.99 2b63 s ALA 101 N -1.02 3.56 -0.24 7.40 0.00 -1.25 0.67 121.76 130.88 2b63 s ALA 101 Ca -0.11 -0.85 -0.16 0.00 0.00 0.00 0.00 51.96 50.84 2b63 s ALA 101 Cb -0.06 -2.62 -0.16 0.00 0.00 0.00 0.00 23.12 20.29 2b63 s ALA 101 CO 0.02 -0.55 -0.06 2.48 0.00 0.00 0.00 175.76 177.65 2b63 n TYR 102 N 5.08 0.53 -4.33 0.00 0.18 -1.08 -4.79 117.16 112.74 2b63 n TYR 102 Ca -0.10 0.21 -0.18 0.00 1.88 0.00 0.00 57.90 59.71 2b63 n TYR 102 Cb 0.51 -1.05 -0.10 0.00 -0.38 0.00 0.00 39.34 38.32 2b63 n TYR 102 CO 0.00 0.00 0.00 0.21 -2.08 0.00 0.00 176.86 174.99 2b63 s LYS 103 N -2.45 1.29 -0.66 -3.48 2.20 -1.26 -5.01 119.74 110.37 2b63 s LYS 103 Ca -0.33 -1.58 0.05 0.00 -0.36 0.00 0.00 55.97 53.75 2b63 s LYS 103 Cb 0.10 -1.02 0.18 0.00 -1.51 0.00 0.00 37.83 35.58 2b63 s LYS 103 CO 0.56 0.15 0.51 1.19 -0.36 0.00 0.00 175.35 177.39 2b63 n PHE 104 N -0.36 2.78 -1.52 4.03 3.01 -1.26 -1.53 117.46 122.61 2b63 n PHE 104 Ca -0.08 -4.18 -0.31 0.00 1.01 0.00 0.00 57.45 53.90 2b63 n PHE 104 Cb 0.61 -0.52 0.07 0.00 -0.01 0.00 0.00 39.48 39.63 2b63 n PHE 104 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 2b63 s GLU 105 N -1.40 2.46 -0.43 -1.08 2.12 -0.76 -4.92 118.70 114.69 2b63 s GLU 105 Ca 0.27 0.83 0.02 0.00 0.36 0.00 0.00 54.97 56.46 2b63 s GLU 105 Cb -0.01 -1.95 0.13 0.00 0.26 0.00 0.00 34.13 32.56 2b63 s GLU 105 CO -0.16 -1.40 0.22 -1.21 -0.54 0.00 0.00 175.26 172.16 2b63 s GLU 106 N -5.08 1.31 -0.48 4.30 2.02 -1.26 -2.12 118.70 117.40 2b63 s GLU 106 Ca 0.60 -1.97 -0.26 0.00 0.02 0.00 0.00 54.97 53.35 2b63 s GLU 106 Cb -0.15 -2.45 -0.26 0.00 0.10 0.00 0.00 34.13 31.38 2b63 s GLU 106 CO 0.55 -1.13 1.79 0.28 0.02 0.00 0.00 175.26 176.77 2b63 n VAL 107 N 3.67 0.88 -0.24 2.63 0.31 -0.92 -4.82 118.33 119.84 2b63 n VAL 107 Ca 0.07 -0.79 0.03 0.00 -0.01 0.00 0.00 64.34 63.63 2b63 n VAL 107 Cb 0.35 -2.14 -0.01 0.00 -0.91 0.00 0.00 33.84 31.13 2b63 n VAL 107 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2b63 n SER 108 N 9.56 -1.36 0.00 4.52 3.41 -1.26 -4.36 113.62 124.13 2b63 n SER 108 Ca 0.47 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 2b63 n SER 108 Cb 0.42 -1.14 0.00 0.00 -0.26 0.00 0.00 64.21 63.23 2b63 n SER 108 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2b63 n LYS 109 N -1.13 0.00 -1.17 4.33 5.02 -1.26 -1.76 118.16 122.18 2b63 n LYS 109 Ca 0.00 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.09 2b63 n LYS 109 Cb 0.53 0.00 0.20 0.00 -0.02 0.00 0.00 35.03 35.74 2b63 n LYS 109 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2b63 n ASP 110 N -3.58 3.81 -4.77 4.39 5.75 -1.26 -4.94 116.55 115.94 2b63 n ASP 110 Ca 0.00 -3.57 -0.38 0.00 -0.01 0.00 0.00 54.79 50.83 2b63 n ASP 110 Cb 0.00 -0.81 -0.06 0.00 -1.03 0.00 0.00 41.12 39.22 2b63 n ASP 110 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2b63 s LEU 111 N -3.26 4.37 0.13 -2.12 1.43 -0.72 -4.84 118.68 113.67 2b63 s LEU 111 Ca 0.56 0.92 0.10 0.00 -1.03 0.00 0.00 54.13 54.67 2b63 s LEU 111 Cb 0.47 -2.69 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 2b63 s LEU 111 CO 0.11 0.14 -0.23 -0.63 0.23 0.00 0.00 176.35 175.96 2b63 s ILE 112 N -0.13 2.01 -0.03 -0.59 1.01 -0.93 -2.15 121.20 120.38 2b63 s ILE 112 Ca 0.26 -1.72 -0.02 0.00 0.00 0.00 0.00 60.65 59.16 2b63 s ILE 112 Cb -0.16 -1.82 0.02 0.00 0.01 0.00 0.00 42.46 40.50 2b63 s ILE 112 CO 0.12 -0.04 0.08 0.00 0.00 0.00 0.00 174.94 175.10 2b63 s ALA 113 N -1.27 -0.15 -0.10 9.38 0.00 -0.90 -1.45 121.76 127.27 2b63 s ALA 113 Ca 0.12 0.30 0.03 0.00 0.00 0.00 0.00 51.96 52.41 2b63 s ALA 113 Cb -0.09 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.84 2b63 s ALA 113 CO 0.06 -0.07 -0.21 0.14 0.00 0.00 0.00 175.76 175.68 2b63 s VAL 114 N 0.40 1.88 0.28 0.00 -7.23 -0.87 -1.84 120.40 113.02 2b63 s VAL 114 Ca -0.03 -0.91 -0.09 0.00 -1.81 0.00 0.00 61.98 59.14 2b63 s VAL 114 Cb -0.04 -1.65 -0.07 0.00 0.56 0.00 0.00 36.38 35.18 2b63 s VAL 114 CO -0.01 0.52 0.60 -0.31 -0.31 0.00 0.00 175.10 175.58 2b63 s TYR 115 N 0.49 3.44 0.00 2.82 1.51 -0.58 -2.45 117.35 122.58 2b63 s TYR 115 Ca -0.16 0.86 -0.04 0.00 -1.01 0.00 0.00 57.07 56.72 2b63 s TYR 115 Cb -0.17 -2.26 -0.00 0.00 -0.11 0.00 0.00 41.96 39.41 2b63 s TYR 115 CO 0.06 0.17 0.06 0.71 -1.11 0.00 0.00 175.55 175.45 2b63 s TYR 116 N -1.99 0.09 -0.04 2.71 1.51 0.10 -2.64 117.35 117.09 2b63 s TYR 116 Ca 0.47 -0.19 -0.01 0.00 -1.01 0.00 0.00 57.07 56.34 2b63 s TYR 116 Cb -0.11 -0.08 0.03 0.00 -0.11 0.00 0.00 41.96 41.69 2b63 s TYR 116 CO 0.25 -0.19 0.07 0.45 -1.11 0.00 0.00 175.55 175.02 2b63 s SER 117 N -1.06 0.01 -0.84 2.29 0.15 0.21 0.14 113.70 114.61 2b63 s SER 117 Ca -0.12 0.13 0.01 0.00 0.70 0.00 0.00 55.95 56.68 2b63 s SER 117 Cb -0.07 0.02 0.30 0.00 -1.71 0.00 0.00 66.02 64.57 2b63 s SER 117 CO 0.00 -0.14 1.24 0.49 1.20 0.00 0.00 173.24 176.04 2b63 n PHE 118 N 4.19 3.15 -3.49 3.44 3.01 0.43 0.20 117.46 128.39 2b63 n PHE 118 Ca -0.27 -3.32 -0.21 0.00 1.01 0.00 0.00 57.45 54.66 2b63 n PHE 118 Cb 0.51 -0.88 0.06 0.00 -0.01 0.00 0.00 39.48 39.15 2b63 n PHE 118 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2b63 n GLY 119 N 0.53 -0.78 0.00 1.37 0.00 -1.26 -3.44 105.19 101.60 2b63 n GLY 119 Ca 0.33 0.37 0.00 0.00 0.00 0.00 0.00 46.02 46.72 2b63 n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b63 n GLY 120 N -1.40 2.63 3.39 -0.02 0.00 -1.26 -5.06 105.19 103.47 2b63 n GLY 120 Ca -0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 2b63 n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b63 s LEU 121 N 0.00 3.27 0.54 0.99 1.43 -1.22 -5.08 118.68 118.61 2b63 s LEU 121 Ca 0.00 -0.30 0.02 0.00 -1.03 0.00 0.00 54.13 52.82 2b63 s LEU 121 Cb 0.00 -1.86 0.03 0.00 0.03 0.00 0.00 46.19 44.40 2b63 s LEU 121 CO 0.00 -0.04 0.76 -0.76 0.23 0.00 0.00 176.35 176.54 2b63 s LEU 122 N 1.56 3.30 -0.27 1.79 1.43 -1.26 0.16 118.68 125.40 2b63 s LEU 122 Ca 0.06 -0.03 -0.24 0.00 -1.03 0.00 0.00 54.13 52.89 2b63 s LEU 122 Cb -0.15 -2.86 0.08 0.00 0.03 0.00 0.00 46.19 43.29 2b63 s LEU 122 CO 0.01 -1.11 0.76 -0.32 0.23 0.00 0.00 176.35 175.92 2b63 s MET 123 N -4.73 0.78 -0.09 1.70 -2.45 0.38 -2.25 119.30 112.63 2b63 s MET 123 Ca 0.57 0.96 0.02 0.00 -1.25 0.00 0.00 55.69 55.99 2b63 s MET 123 Cb -0.10 0.36 0.01 0.00 1.25 0.00 0.00 34.83 36.35 2b63 s MET 123 CO 0.38 -0.10 -0.14 0.50 1.05 0.00 0.00 175.02 176.71 2b63 s ARG 124 N 0.50 1.97 0.04 4.11 3.52 0.23 0.01 118.95 129.33 2b63 s ARG 124 Ca -0.01 -0.48 0.08 0.00 -0.13 0.00 0.00 55.73 55.18 2b63 s ARG 124 Cb -0.05 -1.67 -0.03 0.00 -1.56 0.00 0.00 34.95 31.64 2b63 s ARG 124 CO -0.02 -0.02 -0.21 -1.17 -0.81 0.00 0.00 175.30 173.07 2b63 s LEU 125 N 0.87 2.47 -0.06 -0.88 2.96 -1.02 -2.42 118.68 120.59 2b63 s LEU 125 Ca -0.10 -0.47 -0.04 0.00 -0.22 0.00 0.00 54.13 53.31 2b63 s LEU 125 Cb -0.15 -1.44 0.03 0.00 0.50 0.00 0.00 46.19 45.12 2b63 s LEU 125 CO 0.01 0.26 0.14 -0.70 -1.32 0.00 0.00 176.35 174.74 2b63 s GLU 126 N -1.34 0.12 0.00 1.98 2.12 -1.22 -2.06 118.70 118.30 2b63 s GLU 126 Ca 0.14 0.27 0.00 0.00 0.36 0.00 0.00 54.97 55.74 2b63 s GLU 126 Cb -0.10 -0.06 0.00 0.00 0.26 0.00 0.00 34.13 34.23 2b63 s GLU 126 CO 0.04 -0.09 0.00 0.41 -0.54 0.00 0.00 175.26 175.08 2b63 n GLY 127 N 3.62 -0.39 0.00 -1.50 0.00 -0.53 -2.94 105.19 103.45 2b63 n GLY 127 Ca -0.20 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2b63 n GLY 127 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2b63 n ASN 128 N 0.00 0.00 -0.43 1.61 2.85 -1.26 -2.18 115.26 115.85 2b63 n ASN 128 Ca 0.00 0.00 0.10 0.00 -0.11 0.00 0.00 54.58 54.57 2b63 n ASN 128 Cb 0.00 0.00 0.41 0.00 1.24 0.00 0.00 39.78 41.43 2b63 n ASN 128 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2b63 n TYR 129 N 0.00 0.17 -1.61 1.20 0.18 -1.26 -3.90 117.16 111.93 2b63 n TYR 129 Ca 0.00 -0.08 -0.36 0.00 1.88 0.00 0.00 57.90 59.34 2b63 n TYR 129 Cb 0.00 0.00 0.06 0.00 -0.38 0.00 0.00 39.34 39.02 2b63 n TYR 129 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2b63 n ARG 130 N 0.07 2.78 0.27 -3.48 3.00 -1.26 -4.60 116.66 113.45 2b63 n ARG 130 Ca 0.15 -3.45 0.14 0.00 -0.01 0.00 0.00 57.85 54.68 2b63 n ARG 130 Cb 0.27 -2.28 0.78 0.00 0.00 0.00 0.00 32.46 31.22 2b63 n ARG 130 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.63 176.72 2b63 h ASN 131 N 2.38 0.00 0.00 0.55 2.35 -1.93 -2.96 115.58 115.97 2b63 h ASN 131 Ca 0.57 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.32 2b63 h ASN 131 Cb 0.57 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.94 2b63 h ASN 131 CO 1.48 0.09 0.00 0.18 -1.65 0.00 0.00 177.43 177.53 2b63 n LEU 132 N -3.59 0.52 -0.09 1.61 4.77 -1.26 -4.80 117.00 114.16 2b63 n LEU 132 Ca -0.02 -0.63 -0.15 0.00 -0.03 0.00 0.00 56.01 55.18 2b63 n LEU 132 Cb 0.22 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.22 2b63 n LEU 132 CO 0.29 0.13 -0.32 0.78 -1.33 0.00 0.00 177.39 176.94 2b63 h ASN 133 N 0.00 0.00 -3.03 -1.43 2.35 -1.85 -3.45 115.58 108.18 2b63 h ASN 133 Ca 0.00 -0.42 -0.57 0.00 -0.55 0.00 0.00 56.30 54.76 2b63 h ASN 133 Cb 0.09 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.42 2b63 h ASN 133 CO 0.00 1.18 1.13 0.20 -1.65 0.00 0.00 177.43 178.29 2b63 s ASN 134 N -6.40 6.24 0.00 5.81 0.01 -1.13 -4.94 114.94 114.53 2b63 s ASN 134 Ca -0.22 1.09 0.00 0.00 -0.71 0.00 0.00 52.86 53.02 2b63 s ASN 134 Cb 0.03 -2.53 0.00 0.00 0.41 0.00 0.00 41.25 39.16 2b63 s ASN 134 CO 0.47 -1.46 0.00 0.18 -1.51 0.00 0.00 177.10 174.78 2b63 n LEU 135 N 9.10 0.00 -1.84 0.60 4.77 -1.26 -4.96 117.00 123.41 2b63 n LEU 135 Ca 0.19 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.15 2b63 n LEU 135 Cb 0.47 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.58 2b63 n LEU 135 CO 0.69 0.00 0.25 0.29 -1.33 0.00 0.00 177.39 177.29 2b63 n LYS 136 N 0.00 0.61 -3.85 3.23 5.02 -1.26 -5.13 118.16 116.78 2b63 n LYS 136 Ca 0.00 -1.83 -0.23 0.00 -2.02 0.00 0.00 58.31 54.23 2b63 n LYS 136 Cb 0.00 -0.07 -0.05 0.00 -0.02 0.00 0.00 35.03 34.89 2b63 n LYS 136 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2b63 s GLN 137 N -0.71 2.36 0.03 1.97 -0.21 -1.26 -5.01 119.66 116.82 2b63 s GLN 137 Ca 0.17 -1.74 -0.28 0.00 0.02 0.00 0.00 55.36 53.53 2b63 s GLN 137 Cb 0.27 -2.17 -0.16 0.00 1.00 0.00 0.00 33.01 31.95 2b63 s GLN 137 CO -0.08 -0.22 1.27 1.49 -2.12 0.00 0.00 175.29 175.63 2b63 h GLU 138 N 1.16 -0.77 -5.98 2.91 4.81 -1.87 -3.34 114.58 111.52 2b63 h GLU 138 Ca -0.41 0.05 -0.80 0.00 -0.13 0.00 0.00 59.36 58.07 2b63 h GLU 138 Cb 1.27 0.17 0.04 0.00 0.63 0.00 0.00 28.75 30.86 2b63 h GLU 138 CO 0.63 -0.46 0.17 0.09 -0.73 0.00 0.00 179.01 178.71 2b63 n ASN 139 N -5.35 0.20 0.00 1.04 3.02 -1.26 -3.99 115.26 108.92 2b63 n ASN 139 Ca -0.12 1.16 0.00 0.00 -0.03 0.00 0.00 54.58 55.59 2b63 n ASN 139 Cb 0.35 -0.91 0.00 0.00 -0.61 0.00 0.00 39.78 38.61 2b63 n ASN 139 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2b63 n ALA 140 N 1.93 0.00 -2.43 5.41 0.00 -1.26 -4.91 120.51 119.25 2b63 n ALA 140 Ca 0.22 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.27 2b63 n ALA 140 Cb 0.06 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.45 2b63 n ALA 140 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2b63 s TYR 141 N 0.00 3.71 0.08 0.00 1.51 -0.96 -3.60 117.35 118.10 2b63 s TYR 141 Ca 0.00 1.27 0.01 0.00 -1.01 0.00 0.00 57.07 57.34 2b63 s TYR 141 Cb 0.00 -2.64 -0.04 0.00 -0.11 0.00 0.00 41.96 39.17 2b63 s TYR 141 CO 0.00 0.37 0.18 -1.17 -1.11 0.00 0.00 175.55 173.82 2b63 s LEU 142 N -0.31 4.16 0.04 -1.29 2.96 -0.83 -4.09 118.68 119.33 2b63 s LEU 142 Ca 0.32 0.16 -0.01 0.00 -0.22 0.00 0.00 54.13 54.38 2b63 s LEU 142 Cb -0.19 -2.79 -0.03 0.00 0.50 0.00 0.00 46.19 43.68 2b63 s LEU 142 CO 0.19 0.15 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.59 2b63 s LEU 143 N -2.59 2.34 0.00 -0.68 1.02 -0.99 -1.78 118.68 116.01 2b63 s LEU 143 Ca 0.33 -0.81 -0.25 0.00 0.02 0.00 0.00 54.13 53.42 2b63 s LEU 143 Cb -0.12 0.22 0.06 0.00 0.02 0.00 0.00 46.19 46.36 2b63 s LEU 143 CO 0.26 -0.51 0.56 -0.63 0.02 0.00 0.00 176.35 176.05 2b63 s ILE 144 N -3.11 0.02 -0.13 -0.59 1.01 -0.43 -3.06 121.20 114.91 2b63 s ILE 144 Ca -0.01 -0.16 -0.16 0.00 0.00 0.00 0.00 60.65 60.32 2b63 s ILE 144 Cb 0.02 -0.94 0.04 0.00 0.01 0.00 0.00 42.46 41.60 2b63 s ILE 144 CO -0.07 -0.09 0.44 0.00 0.00 0.00 0.00 174.94 175.22 2b63 s ARG 145 N -1.81 0.58 0.00 2.79 1.70 -1.22 -0.61 118.95 120.38 2b63 s ARG 145 Ca -0.09 0.46 0.00 0.00 -0.47 0.00 0.00 55.73 55.63 2b63 s ARG 145 Cb -0.01 0.28 0.00 0.00 -0.57 0.00 0.00 34.95 34.65 2b63 s ARG 145 CO 0.04 -0.10 0.00 0.54 -1.08 0.00 0.00 175.30 174.69