#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r93 n ASN 3 N 0.00 1.51 -4.66 4.04 3.02 -1.26 -4.73 115.26 113.17 2r93 n ASN 3 Ca 0.00 -0.21 -0.27 0.00 -0.03 0.00 0.00 54.58 54.07 2r93 n ASN 3 Cb 0.00 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.07 2r93 n ASN 3 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2r93 s THR 4 N 0.13 2.13 0.00 3.41 2.01 -1.26 -4.34 115.64 117.72 2r93 s THR 4 Ca 0.00 -1.89 0.00 0.00 0.31 0.00 0.00 61.69 60.11 2r93 s THR 4 Cb 0.00 -2.99 0.00 0.00 0.01 0.00 0.00 72.50 69.52 2r93 s THR 4 CO 0.00 -0.01 0.01 0.18 -0.69 0.00 0.00 174.62 174.11 2r93 n LEU 5 N -1.07 0.01 -3.62 4.42 4.77 -1.26 -4.75 117.00 115.50 2r93 n LEU 5 Ca -0.04 -0.02 -0.10 0.00 -0.03 0.00 0.00 56.01 55.83 2r93 n LEU 5 Cb 0.66 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.68 2r93 n LEU 5 CO 0.48 0.00 0.73 0.12 -1.33 0.00 0.00 177.39 177.39 2r93 s PHE 6 N -0.01 -0.47 -0.07 -1.77 5.36 -1.26 -4.67 117.98 115.09 2r93 s PHE 6 Ca 0.00 1.06 -0.06 0.00 -0.96 0.00 0.00 56.93 56.97 2r93 s PHE 6 Cb 0.00 0.38 0.02 0.00 -0.34 0.00 0.00 43.02 43.08 2r93 s PHE 6 CO 0.00 -0.27 0.19 0.34 -1.46 0.00 0.00 175.22 174.02 2r93 s ASP 7 N -0.10 -0.20 0.00 6.13 -1.08 -1.26 -3.31 116.67 116.86 2r93 s ASP 7 Ca 0.02 0.39 0.00 0.00 -0.52 0.00 0.00 52.55 52.44 2r93 s ASP 7 Cb -0.04 0.39 0.00 0.00 -1.46 0.00 0.00 42.92 41.81 2r93 s ASP 7 CO -0.04 -0.07 0.00 -0.67 0.52 0.00 0.00 175.17 174.91 2r93 n ASP 8 N 3.06 0.00 -3.70 -0.34 2.03 -1.08 -5.01 116.55 111.51 2r93 n ASP 8 Ca -0.13 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.04 2r93 n ASP 8 Cb 0.58 0.00 -0.14 0.00 -0.72 0.00 0.00 41.12 40.85 2r93 n ASP 8 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2r93 s ILE 9 N -2.45 -0.18 0.46 5.18 1.01 -1.26 -2.00 121.20 121.96 2r93 s ILE 9 Ca 0.00 0.22 0.01 0.00 0.00 0.00 0.00 60.65 60.88 2r93 s ILE 9 Cb 0.00 -0.38 0.01 0.00 0.01 0.00 0.00 42.46 42.10 2r93 s ILE 9 CO 0.00 0.09 0.08 0.49 0.00 0.00 0.00 174.94 175.60 2r93 n PHE 10 N 4.70 0.66 -3.68 3.97 3.01 -0.69 -2.76 117.46 122.67 2r93 n PHE 10 Ca -0.17 -2.21 -0.19 0.00 1.01 0.00 0.00 57.45 55.89 2r93 n PHE 10 Cb 0.51 -0.32 -0.18 0.00 -0.01 0.00 0.00 39.48 39.48 2r93 n PHE 10 CO 0.00 0.00 0.00 -1.14 1.01 0.00 0.00 176.76 176.63 2r93 s GLN 11 N -3.73 -0.07 -0.40 -1.08 0.74 -1.02 -2.97 119.66 111.13 2r93 s GLN 11 Ca 0.06 0.37 -0.28 0.00 0.05 0.00 0.00 55.36 55.57 2r93 s GLN 11 Cb -0.01 -0.47 -0.07 0.00 1.10 0.00 0.00 33.01 33.56 2r93 s GLN 11 CO 0.04 -0.31 2.34 0.28 -0.55 0.00 0.00 175.29 177.09 2r93 n VAL 12 N 5.19 0.10 0.20 1.34 0.31 -1.24 -2.61 118.33 121.61 2r93 n VAL 12 Ca -0.06 -0.59 0.06 0.00 -0.01 0.00 0.00 64.34 63.74 2r93 n VAL 12 Cb 0.50 -2.52 0.41 0.00 -0.91 0.00 0.00 33.84 31.32 2r93 n VAL 12 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2r93 h SER 13 N 16.96 0.00 -3.23 4.52 4.64 -0.19 0.16 113.55 136.41 2r93 h SER 13 Ca -0.30 0.00 0.22 0.00 -0.47 0.00 0.00 61.79 61.24 2r93 h SER 13 Cb 1.26 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 63.09 2r93 h SER 13 CO 1.08 0.33 0.91 -0.70 -0.87 0.00 0.00 176.83 177.58 2r93 s GLU 14 N -3.83 0.12 -0.05 4.77 2.12 -1.17 -4.81 118.70 115.84 2r93 s GLU 14 Ca -0.01 0.03 0.04 0.00 0.36 0.00 0.00 54.97 55.39 2r93 s GLU 14 Cb 0.12 0.06 -0.02 0.00 0.26 0.00 0.00 34.13 34.54 2r93 s GLU 14 CO 0.68 -0.04 -0.16 0.08 -0.54 0.00 0.00 175.26 175.28 2r93 s VAL 15 N -1.03 2.89 -0.08 3.70 1.01 -1.26 -2.52 120.40 123.11 2r93 s VAL 15 Ca 0.08 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.27 2r93 s VAL 15 Cb -0.01 -2.11 0.02 0.00 0.00 0.00 0.00 36.38 34.28 2r93 s VAL 15 CO -0.07 0.59 -0.07 -0.62 0.00 0.00 0.00 175.10 174.93 2r93 s ASP 16 N -0.66 1.71 -0.73 3.32 2.15 -0.98 -5.01 116.67 116.47 2r93 s ASP 16 Ca 0.10 -0.23 -0.05 0.00 0.43 0.00 0.00 52.55 52.80 2r93 s ASP 16 Cb -0.11 -0.69 0.19 0.00 -0.30 0.00 0.00 42.92 42.01 2r93 s ASP 16 CO 0.00 -0.07 0.59 -2.16 -0.17 0.00 0.00 175.17 173.36 2r93 s PRO 17 N 1.28 2.96 -1.46 4.34 0.04 -1.26 -2.35 135.00 138.54 2r93 s PRO 17 Ca -0.04 -2.70 -0.11 0.00 0.04 0.00 0.00 61.00 58.19 2r93 s PRO 17 Cb -0.14 -3.93 0.03 0.00 0.04 0.00 0.00 34.50 30.50 2r93 s PRO 17 CO -0.03 -1.22 2.38 0.41 0.04 0.00 0.00 177.00 178.58 2r93 n GLY 18 N 3.30 4.51 3.07 0.56 0.00 -1.26 -4.36 105.19 111.01 2r93 n GLY 18 Ca 0.12 -1.69 -0.18 0.00 0.00 0.00 0.00 46.02 44.27 2r93 n GLY 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r93 n ARG 19 N 4.68 -5.98 -3.64 1.61 1.74 -1.26 -4.98 116.66 108.84 2r93 n ARG 19 Ca 0.58 0.63 -0.27 0.00 -0.77 0.00 0.00 57.85 58.02 2r93 n ARG 19 Cb 0.33 -5.07 -0.10 0.00 -1.02 0.00 0.00 32.46 26.59 2r93 n ARG 19 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2r93 n TYR 20 N -4.31 2.30 0.25 -1.55 0.53 -1.26 -4.98 117.16 108.14 2r93 n TYR 20 Ca -0.02 -4.04 0.00 0.00 -1.02 0.00 0.00 57.90 52.83 2r93 n TYR 20 Cb 0.55 -0.43 0.01 0.00 -1.03 0.00 0.00 39.34 38.44 2r93 n TYR 20 CO 0.00 0.00 0.00 -0.91 -1.02 0.00 0.00 176.86 174.93 2r93 h ASN 21 N 5.03 0.00 0.00 7.72 2.35 -1.94 -0.99 115.58 127.75 2r93 h ASN 21 Ca 0.18 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.93 2r93 h ASN 21 Cb 0.77 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.14 2r93 h ASN 21 CO 0.66 0.00 0.00 0.29 -1.65 0.00 0.00 177.43 176.73 2r93 n LYS 22 N -2.13 0.69 -3.67 0.81 5.02 -1.26 -5.00 118.16 112.62 2r93 n LYS 22 Ca -0.00 -0.72 -0.14 0.00 -2.02 0.00 0.00 58.31 55.43 2r93 n LYS 22 Cb 0.87 -0.62 -0.08 0.00 -0.02 0.00 0.00 35.03 35.18 2r93 n LYS 22 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2r93 s VAL 23 N -0.23 0.00 0.06 -0.18 1.01 -0.38 -3.19 120.40 117.51 2r93 s VAL 23 Ca 0.00 -0.04 0.02 0.00 0.00 0.00 0.00 61.98 61.96 2r93 s VAL 23 Cb 0.00 -0.79 -0.03 0.00 0.00 0.00 0.00 36.38 35.56 2r93 s VAL 23 CO 0.00 -0.02 -0.07 0.00 0.00 0.00 0.00 175.10 175.01 2r93 s ARG 25 N -2.61 4.04 0.11 0.00 3.52 -0.99 0.15 118.95 123.18 2r93 s ARG 25 Ca -0.01 -0.29 0.07 0.00 -0.13 0.00 0.00 55.73 55.38 2r93 s ARG 25 Cb -0.03 -3.44 -0.04 0.00 -1.56 0.00 0.00 34.95 29.88 2r93 s ARG 25 CO -0.02 0.13 -0.10 0.42 -0.81 0.00 0.00 175.30 174.91 2r93 s ILE 26 N 0.84 3.32 -0.10 4.11 1.01 0.17 -2.31 121.20 128.25 2r93 s ILE 26 Ca 0.07 -1.33 0.00 0.00 0.00 0.00 0.00 60.65 59.39 2r93 s ILE 26 Cb -0.13 -2.56 0.02 0.00 0.01 0.00 0.00 42.46 39.80 2r93 s ILE 26 CO 0.03 0.08 -0.08 -1.61 0.00 0.00 0.00 174.94 173.35 2r93 s GLU 27 N -2.29 1.51 0.12 2.79 2.02 -1.05 -0.24 118.70 121.56 2r93 s GLU 27 Ca 0.22 -0.28 0.03 0.00 0.02 0.00 0.00 54.97 54.96 2r93 s GLU 27 Cb -0.11 -1.48 -0.04 0.00 0.10 0.00 0.00 34.13 32.60 2r93 s GLU 27 CO 0.14 -0.18 -0.07 0.00 0.02 0.00 0.00 175.26 175.16 2r93 s ALA 28 N 1.40 1.19 0.51 5.21 0.00 -0.67 0.61 121.76 130.01 2r93 s ALA 28 Ca -0.01 -1.42 0.08 0.00 0.00 0.00 0.00 51.96 50.60 2r93 s ALA 28 Cb -0.13 0.14 0.04 0.00 0.00 0.00 0.00 23.12 23.17 2r93 s ALA 28 CO -0.05 -0.19 0.54 0.00 0.00 0.00 0.00 175.76 176.06 2r93 s ALA 29 N -3.51 4.44 -0.09 0.00 0.00 -1.07 -1.34 121.76 120.19 2r93 s ALA 29 Ca 0.15 -1.73 -0.03 0.00 0.00 0.00 0.00 51.96 50.35 2r93 s ALA 29 Cb 0.04 -1.10 -0.03 0.00 0.00 0.00 0.00 23.12 22.02 2r93 s ALA 29 CO -0.02 -0.51 0.03 0.45 0.00 0.00 0.00 175.76 175.70 2r93 s SER 30 N -4.37 5.44 -0.35 0.00 0.15 -1.03 -2.43 113.70 111.10 2r93 s SER 30 Ca 0.48 0.20 -0.01 0.00 0.70 0.00 0.00 55.95 57.32 2r93 s SER 30 Cb -0.04 -1.57 0.25 0.00 -1.71 0.00 0.00 66.02 62.94 2r93 s SER 30 CO 0.29 0.38 1.98 0.41 1.20 0.00 0.00 173.24 177.51 2r93 n THR 31 N 2.08 2.82 0.00 6.45 -1.04 -1.11 -4.46 114.28 119.02 2r93 n THR 31 Ca -0.19 -1.73 0.00 0.00 -2.04 0.00 0.00 64.05 60.09 2r93 n THR 31 Cb 0.54 -1.28 0.00 0.00 -1.82 0.00 0.00 70.33 67.77 2r93 n THR 31 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2r93 n THR 32 N 0.18 0.00 -3.00 12.58 -1.04 -1.26 -5.02 114.28 116.71 2r93 n THR 32 Ca 0.33 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 62.00 2r93 n THR 32 Cb 0.62 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 69.07 2r93 n THR 32 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2r93 s GLN 33 N 0.00 4.18 -0.38 -2.82 1.11 -1.26 -4.95 119.66 115.54 2r93 s GLN 33 Ca 0.00 0.91 0.01 0.00 0.01 0.00 0.00 55.36 56.29 2r93 s GLN 33 Cb 0.00 -2.49 0.41 0.00 -1.01 0.00 0.00 33.01 29.92 2r93 s GLN 33 CO 0.00 0.16 1.79 -0.25 0.01 0.00 0.00 175.29 177.01 2r93 n ASP 34 N -0.13 4.89 0.00 5.90 8.00 -1.26 -3.78 116.55 130.17 2r93 n ASP 34 Ca 0.03 -3.22 0.00 0.00 0.71 0.00 0.00 54.79 52.31 2r93 n ASP 34 Cb 0.53 -0.85 0.00 0.00 -0.02 0.00 0.00 41.12 40.78 2r93 n ASP 34 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2r93 n GLN 35 N -0.48 1.55 -2.05 -1.24 6.02 -1.26 -5.00 117.38 114.93 2r93 n GLN 35 Ca 0.43 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 57.15 2r93 n GLN 35 Cb 1.05 -0.74 -0.05 0.00 1.02 0.00 0.00 30.24 31.51 2r93 n GLN 35 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2r93 s LYS 37 N 7.00 3.44 -0.06 0.00 1.02 -1.22 -2.47 119.74 127.44 2r93 s LYS 37 Ca 0.70 -0.75 -0.05 0.00 0.02 0.00 0.00 55.97 55.89 2r93 s LYS 37 Cb -0.07 -2.88 0.02 0.00 -0.52 0.00 0.00 37.83 34.38 2r93 s LYS 37 CO -0.00 0.42 0.16 -1.17 -0.92 0.00 0.00 175.35 173.84 2r93 s LEU 38 N -3.99 1.19 -0.11 3.17 2.96 -0.45 -2.67 118.68 118.78 2r93 s LEU 38 Ca 0.34 0.33 0.00 0.00 -0.22 0.00 0.00 54.13 54.59 2r93 s LEU 38 Cb -0.09 0.52 0.02 0.00 0.50 0.00 0.00 46.19 47.14 2r93 s LEU 38 CO 0.29 -0.08 -0.11 -0.89 -1.32 0.00 0.00 176.35 174.24 2r93 s THR 39 N 0.38 1.23 -0.16 3.68 2.01 -0.46 -1.67 115.64 120.64 2r93 s THR 39 Ca -0.02 -0.44 -0.08 0.00 0.31 0.00 0.00 61.69 61.46 2r93 s THR 39 Cb -0.04 -1.18 0.06 0.00 0.01 0.00 0.00 72.50 71.35 2r93 s THR 39 CO -0.02 0.40 0.37 -0.22 -0.69 0.00 0.00 174.62 174.46 2r93 s LEU 40 N 1.40 -0.17 0.28 4.42 2.96 0.66 0.12 118.68 128.36 2r93 s LEU 40 Ca 0.00 0.83 -0.29 0.00 -0.22 0.00 0.00 54.13 54.45 2r93 s LEU 40 Cb -0.13 1.19 -0.09 0.00 0.50 0.00 0.00 46.19 47.65 2r93 s LEU 40 CO -0.06 -0.20 1.05 -1.81 -1.32 0.00 0.00 176.35 174.00 2r93 s ASP 41 N 1.77 7.33 -0.13 3.68 1.01 -1.10 0.43 116.67 129.66 2r93 s ASP 41 Ca -0.07 2.15 -0.16 0.00 0.71 0.00 0.00 52.55 55.19 2r93 s ASP 41 Cb -0.10 -2.62 0.04 0.00 1.01 0.00 0.00 42.92 41.25 2r93 s ASP 41 CO -0.12 -0.09 0.43 -0.63 0.21 0.00 0.00 175.17 174.97 2r93 s ILE 42 N -1.22 0.01 -0.65 0.77 1.01 0.41 -4.84 121.20 116.68 2r93 s ILE 42 Ca 0.45 -0.08 -0.26 0.00 0.00 0.00 0.00 60.65 60.75 2r93 s ILE 42 Cb -0.29 -0.63 -0.05 0.00 0.01 0.00 0.00 42.46 41.50 2r93 s ILE 42 CO 0.37 -0.05 2.07 0.21 0.00 0.00 0.00 174.94 177.55 2r93 s ASN 43 N -0.13 4.89 0.00 3.58 3.84 -1.26 -1.45 114.94 124.41 2r93 s ASN 43 Ca -0.03 0.32 0.00 0.00 0.21 0.00 0.00 52.86 53.36 2r93 s ASN 43 Cb -0.03 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 38.14 2r93 s ASN 43 CO 0.02 -2.73 0.61 0.52 -2.79 0.00 0.00 177.10 172.73 2r93 n VAL 44 N 7.69 0.32 0.00 -5.21 0.31 -1.19 -3.20 118.33 117.04 2r93 n VAL 44 Ca 0.31 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.64 2r93 n VAL 44 Cb 0.51 -0.63 0.00 0.00 -0.91 0.00 0.00 33.84 32.81 2r93 n VAL 44 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2r93 n GLU 45 N 0.22 2.78 -0.13 5.55 2.13 -1.26 -4.20 120.64 125.74 2r93 n GLU 45 Ca 0.00 0.00 0.12 0.00 0.66 0.00 0.00 57.16 57.94 2r93 n GLU 45 Cb 0.31 -0.96 0.19 0.00 0.27 0.00 0.00 31.44 31.24 2r93 n GLU 45 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2r93 n LEU 46 N -2.02 3.28 -2.65 4.31 4.77 -1.21 -4.69 117.00 118.79 2r93 n LEU 46 Ca 0.00 -1.32 -0.03 0.00 -0.03 0.00 0.00 56.01 54.63 2r93 n LEU 46 Cb 0.46 -0.17 0.05 0.00 -2.33 0.00 0.00 43.42 41.44 2r93 n LEU 46 CO 0.00 0.66 0.58 0.33 -1.33 0.00 0.00 177.39 177.63 2r93 n PHE 47 N 1.42 -0.16 -0.73 -1.77 7.35 -1.19 -5.00 117.46 117.38 2r93 n PHE 47 Ca 0.18 -0.54 -0.32 0.00 -0.76 0.00 0.00 57.45 56.00 2r93 n PHE 47 Cb 0.60 1.02 0.15 0.00 0.35 0.00 0.00 39.48 41.60 2r93 n PHE 47 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 2r93 n PRO 48 N 2.16 -0.85 -3.65 -7.13 -0.02 -1.26 -4.54 135.00 119.71 2r93 n PRO 48 Ca 0.07 -0.21 -0.04 0.00 -2.02 0.00 0.00 63.50 61.30 2r93 n PRO 48 Cb 0.68 -1.86 -0.06 0.00 -0.02 0.00 0.00 33.50 32.25 2r93 n PRO 48 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2r93 s VAL 49 N -2.36 -0.73 0.34 -1.45 1.01 -1.26 -5.03 120.40 110.92 2r93 s VAL 49 Ca 0.58 0.03 0.08 0.00 0.00 0.00 0.00 61.98 62.67 2r93 s VAL 49 Cb -0.18 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 2r93 s VAL 49 CO 0.66 0.01 0.20 0.00 0.00 0.00 0.00 175.10 175.97 2r93 s ALA 50 N 2.57 3.62 -0.38 5.51 0.00 -1.26 -4.94 121.76 126.88 2r93 s ALA 50 Ca -0.06 -1.76 -0.39 0.00 0.00 0.00 0.00 51.96 49.74 2r93 s ALA 50 Cb -0.11 -0.89 -0.15 0.00 0.00 0.00 0.00 23.12 21.97 2r93 s ALA 50 CO -0.18 0.03 2.04 0.00 0.00 0.00 0.00 175.76 177.65 2r93 n ALA 51 N -1.23 0.41 -1.82 0.00 0.00 -1.26 -4.11 120.51 112.50 2r93 n ALA 51 Ca -0.03 0.15 -0.00 0.00 0.00 0.00 0.00 53.44 53.56 2r93 n ALA 51 Cb 0.61 -2.31 -0.00 0.00 0.00 0.00 0.00 19.45 17.75 2r93 n ALA 51 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2r93 n GLN 52 N 7.11 -1.04 -4.19 0.00 6.02 0.57 -4.98 117.38 120.87 2r93 n GLN 52 Ca 0.41 1.17 -0.11 0.00 -0.01 0.00 0.00 57.00 58.46 2r93 n GLN 52 Cb 0.11 -2.17 -0.10 0.00 1.02 0.00 0.00 30.24 29.10 2r93 n GLN 52 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2r93 s ASP 53 N -0.37 0.73 -1.01 1.08 1.01 -1.26 -4.84 116.67 112.01 2r93 s ASP 53 Ca -0.02 -1.18 -0.05 0.00 0.71 0.00 0.00 52.55 52.01 2r93 s ASP 53 Cb 0.00 0.21 0.25 0.00 1.01 0.00 0.00 42.92 44.39 2r93 s ASP 53 CO 0.21 -0.65 0.95 -0.94 0.21 0.00 0.00 175.17 174.95 2r93 s SER 54 N -3.10 6.64 0.10 0.27 1.04 -1.26 -3.67 113.70 113.72 2r93 s SER 54 Ca 0.23 -3.69 -0.06 0.00 0.48 0.00 0.00 55.95 52.91 2r93 s SER 54 Cb 0.07 -2.05 -0.05 0.00 0.10 0.00 0.00 66.02 64.08 2r93 s SER 54 CO 0.02 -0.22 0.35 -0.76 0.98 0.00 0.00 173.24 173.60 2r93 s LEU 55 N -1.35 4.31 -0.24 2.42 1.43 -1.16 -4.76 118.68 119.33 2r93 s LEU 55 Ca 0.29 0.61 -0.06 0.00 -1.03 0.00 0.00 54.13 53.94 2r93 s LEU 55 Cb -0.08 -3.09 -0.02 0.00 0.03 0.00 0.00 46.19 43.02 2r93 s LEU 55 CO -0.11 0.12 0.04 -0.89 0.23 0.00 0.00 176.35 175.75 2r93 s THR 56 N -1.52 4.07 0.04 5.49 2.01 -1.11 -1.71 115.64 122.91 2r93 s THR 56 Ca 0.36 -0.25 -0.05 0.00 0.31 0.00 0.00 61.69 62.06 2r93 s THR 56 Cb -0.13 -2.89 -0.05 0.00 0.01 0.00 0.00 72.50 69.44 2r93 s THR 56 CO 0.22 0.36 0.27 -0.69 -0.69 0.00 0.00 174.62 174.09 2r93 s VAL 57 N 1.57 5.31 0.23 3.82 1.01 -0.85 -3.22 120.40 128.26 2r93 s VAL 57 Ca 0.06 0.01 -0.14 0.00 0.00 0.00 0.00 61.98 61.91 2r93 s VAL 57 Cb -0.15 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.65 2r93 s VAL 57 CO 0.02 0.26 0.48 -0.89 0.00 0.00 0.00 175.10 174.98 2r93 s THR 58 N -1.40 0.02 0.00 3.92 2.01 -1.10 -2.62 115.64 116.47 2r93 s THR 58 Ca 0.31 -1.22 0.00 0.00 0.31 0.00 0.00 61.69 61.09 2r93 s THR 58 Cb -0.13 -1.99 0.00 0.00 0.01 0.00 0.00 72.50 70.39 2r93 s THR 58 CO 0.20 -0.07 0.00 -0.38 -0.69 0.00 0.00 174.62 173.68 2r93 n ILE 59 N -0.36 0.00 -1.32 1.82 5.41 -1.21 -3.08 119.36 120.63 2r93 n ILE 59 Ca -0.05 0.00 0.05 0.00 1.00 0.00 0.00 62.75 63.75 2r93 n ILE 59 Cb 0.62 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 39.52 2r93 n ILE 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2r93 n ALA 60 N -3.00 -2.26 -3.74 -1.39 0.00 -1.26 -4.49 120.51 104.37 2r93 n ALA 60 Ca 0.00 0.55 -0.30 0.00 0.00 0.00 0.00 53.44 53.69 2r93 n ALA 60 Cb 0.00 -1.35 -0.13 0.00 0.00 0.00 0.00 19.45 17.97 2r93 n ALA 60 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2r93 s SER 61 N -5.65 3.75 0.00 0.00 1.04 -1.26 -2.62 113.70 108.96 2r93 s SER 61 Ca 0.00 -2.57 0.00 0.00 0.48 0.00 0.00 55.95 53.86 2r93 s SER 61 Cb 0.00 -1.08 0.00 0.00 0.10 0.00 0.00 66.02 65.04 2r93 s SER 61 CO 0.00 -0.28 0.00 -1.54 0.98 0.00 0.00 173.24 172.40 2r93 n SER 62 N 3.62 0.00 0.00 7.02 3.41 -1.26 -4.68 113.62 121.73 2r93 n SER 62 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 2r93 n SER 62 Cb 0.35 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 2r93 n SER 62 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2r93 n LEU 63 N 0.00 0.00 0.00 1.04 4.77 -1.26 -4.08 117.00 117.47 2r93 n LEU 63 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2r93 n LEU 63 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2r93 n LEU 63 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.39 176.65 2r93 n ASN 64 N -0.50 0.00 0.00 -1.43 3.02 -1.26 -2.98 115.26 112.11 2r93 n ASN 64 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 2r93 n ASN 64 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 2r93 n ASN 64 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2r93 n LEU 65 N 0.00 0.00 0.00 3.41 4.77 -1.26 -4.70 117.00 119.23 2r93 n LEU 65 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2r93 n LEU 65 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2r93 n LEU 65 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.39 176.47 2r93 n THR 76 N -0.51 0.00 -1.46 -5.08 -1.04 -1.26 -4.98 114.28 99.96 2r93 n THR 76 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2r93 n THR 76 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 2r93 n THR 76 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2r93 n ARG 77 N 0.00 -4.04 -1.28 -2.82 1.74 -1.26 -4.87 116.66 104.13 2r93 n ARG 77 Ca 0.00 3.06 -0.40 0.00 -0.77 0.00 0.00 57.85 59.74 2r93 n ARG 77 Cb 0.00 -3.60 0.00 0.00 -1.02 0.00 0.00 32.46 27.84 2r93 n ARG 77 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2r93 n SER 78 N -1.60 -3.21 -4.70 0.55 3.41 -1.26 -4.92 113.62 101.88 2r93 n SER 78 Ca 0.00 0.74 -0.39 0.00 -0.26 0.00 0.00 58.87 58.95 2r93 n SER 78 Cb 0.19 -0.87 -0.05 0.00 -0.26 0.00 0.00 64.21 63.21 2r93 n SER 78 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 2r93 s TRP 79 N -1.84 3.50 0.39 7.33 -0.00 -1.26 -5.08 118.94 121.99 2r93 s TRP 79 Ca 0.58 1.05 -0.05 0.00 -0.00 0.00 0.00 56.10 57.68 2r93 s TRP 79 Cb -0.57 -2.72 -0.04 0.00 -0.00 0.00 0.00 33.47 30.14 2r93 s TRP 79 CO 0.64 0.05 0.68 1.03 -0.00 0.00 0.00 176.95 179.35 2r93 s ARG 80 N 1.02 3.60 0.00 5.86 0.52 -1.26 -5.11 118.95 123.58 2r93 s ARG 80 Ca 0.31 0.10 0.00 0.00 -0.52 0.00 0.00 55.73 55.62 2r93 s ARG 80 Cb -0.16 -2.50 0.00 0.00 0.52 0.00 0.00 34.95 32.81 2r93 s ARG 80 CO 0.13 -0.00 0.00 -2.30 0.02 0.00 0.00 175.30 173.15 2r93 n PRO 81 N -1.66 3.13 0.00 3.54 -0.02 -1.26 -5.02 135.00 133.70 2r93 n PRO 81 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.47 2r93 n PRO 81 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.03 2r93 n PRO 81 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2r93 n PRO 82 N 0.00 0.00 0.00 0.52 -0.04 -1.26 -4.77 135.00 129.45 2r93 n PRO 82 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2r93 n PRO 82 Cb 0.00 -0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2r93 n PRO 82 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2r93 n GLN 83 N 0.00 0.00 -0.00 0.54 6.02 -1.26 -4.65 117.38 118.03 2r93 n GLN 83 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2r93 n GLN 83 Cb 0.00 -0.30 0.00 0.00 1.02 0.00 0.00 30.24 30.96 2r93 n GLN 83 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2r93 n ALA 84 N 0.00 1.50 0.28 -1.58 0.00 -1.26 -3.79 120.51 115.66 2r93 n ALA 84 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 2r93 n ALA 84 Cb 0.00 -1.24 0.80 0.00 0.00 0.00 0.00 19.45 19.01 2r93 n ALA 84 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2r93 h GLY 85 N 2.48 0.00 0.00 0.00 0.00 -1.97 -3.08 103.07 100.49 2r93 h GLY 85 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2r93 h GLY 85 CO 0.00 0.00 -0.34 1.34 0.00 0.00 0.00 176.54 177.54 2r93 n ASP 86 N -3.81 1.70 -3.88 0.19 -0.08 -1.25 -5.08 116.55 104.34 2r93 n ASP 86 Ca -0.02 -0.23 -0.30 0.00 -1.51 0.00 0.00 54.79 52.72 2r93 n ASP 86 Cb 0.16 0.81 0.24 0.00 2.34 0.00 0.00 41.12 44.67 2r93 n ASP 86 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 2r93 s ARG 87 N -1.15 -1.24 0.29 -0.67 0.52 -1.17 -4.94 118.95 110.60 2r93 s ARG 87 Ca 0.00 0.03 -0.29 0.00 -0.52 0.00 0.00 55.73 54.95 2r93 s ARG 87 Cb 0.00 -1.59 -0.13 0.00 0.52 0.00 0.00 34.95 33.75 2r93 s ARG 87 CO 0.00 -3.74 1.20 -1.13 0.02 0.00 0.00 175.30 171.65 2r93 n SER 88 N -4.80 2.13 -3.20 0.23 3.41 -1.26 -4.96 113.62 105.17 2r93 n SER 88 Ca 0.12 1.18 -0.22 0.00 -0.26 0.00 0.00 58.87 59.69 2r93 n SER 88 Cb 0.59 -1.38 -0.06 0.00 -0.26 0.00 0.00 64.21 63.10 2r93 n SER 88 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2r93 n LEU 89 N 1.31 0.75 -1.68 1.04 4.77 -1.26 -4.95 117.00 116.98 2r93 n LEU 89 Ca 0.09 -4.88 0.00 0.00 -0.03 0.00 0.00 56.01 51.19 2r93 n LEU 89 Cb 0.33 0.55 0.00 0.00 -2.33 0.00 0.00 43.42 41.96 2r93 n LEU 89 CO 0.61 2.15 0.15 0.00 -1.33 0.00 0.00 177.39 178.97 2r93 n ALA 90 N 0.94 1.86 -1.46 -1.18 0.00 -1.16 -3.84 120.51 115.67 2r93 n ALA 90 Ca 0.23 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.52 2r93 n ALA 90 Cb 0.56 -1.61 0.16 0.00 0.00 0.00 0.00 19.45 18.55 2r93 n ALA 90 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2r93 n ASP 91 N 1.66 3.72 -2.02 0.00 5.75 -1.26 -4.84 116.55 119.55 2r93 n ASP 91 Ca 0.00 -3.75 -0.02 0.00 -0.01 0.00 0.00 54.79 51.00 2r93 n ASP 91 Cb 0.08 -0.69 -0.03 0.00 -1.03 0.00 0.00 41.12 39.45 2r93 n ASP 91 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2r93 n ASP 92 N -1.06 2.11 -1.78 -1.12 8.00 -1.25 -4.67 116.55 116.79 2r93 n ASP 92 Ca 0.44 -1.71 -0.06 0.00 0.71 0.00 0.00 54.79 54.18 2r93 n ASP 92 Cb 1.12 -0.50 -0.02 0.00 -0.02 0.00 0.00 41.12 41.69 2r93 n ASP 92 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2r93 n TYR 93 N 2.24 -0.15 -1.63 1.24 4.02 -1.26 -4.92 117.16 116.70 2r93 n TYR 93 Ca 0.07 -0.78 0.06 0.00 -0.01 0.00 0.00 57.90 57.25 2r93 n TYR 93 Cb 0.27 0.06 0.13 0.00 -0.02 0.00 0.00 39.34 39.78 2r93 n TYR 93 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2r93 n ASP 94 N -2.42 1.59 -3.17 7.72 8.00 0.98 -4.97 116.55 124.27 2r93 n ASP 94 Ca 0.01 -3.12 0.05 0.00 0.71 0.00 0.00 54.79 52.44 2r93 n ASP 94 Cb 0.17 -0.42 -0.03 0.00 -0.02 0.00 0.00 41.12 40.82 2r93 n ASP 94 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2r93 s TYR 95 N -2.21 -0.13 -0.11 1.24 6.04 -1.15 -4.88 117.35 116.14 2r93 s TYR 95 Ca 0.31 0.18 -0.02 0.00 0.04 0.00 0.00 57.07 57.58 2r93 s TYR 95 Cb 0.30 0.06 0.04 0.00 -1.04 0.00 0.00 41.96 41.32 2r93 s TYR 95 CO -0.05 -0.07 0.02 0.08 -1.54 0.00 0.00 175.55 174.00 2r93 s VAL 96 N 2.51 0.32 0.00 3.14 1.01 -1.26 -1.20 120.40 124.92 2r93 s VAL 96 Ca -0.04 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.89 2r93 s VAL 96 Cb -0.05 -0.63 0.00 0.00 0.00 0.00 0.00 36.38 35.71 2r93 s VAL 96 CO -0.12 0.08 0.00 0.23 0.00 0.00 0.00 175.10 175.29 2r93 n MET 97 N 5.15 2.35 -3.53 2.72 2.81 -1.14 -4.93 117.12 120.55 2r93 n MET 97 Ca -0.07 0.00 -0.00 0.00 -1.81 0.00 0.00 57.70 55.82 2r93 n MET 97 Cb 0.49 0.00 -0.05 0.00 -0.71 0.00 0.00 33.22 32.95 2r93 n MET 97 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 2r93 s TYR 98 N 0.74 -0.52 0.00 2.03 5.04 -1.26 -2.74 117.35 120.65 2r93 s TYR 98 Ca 0.00 0.97 0.00 0.00 -2.44 0.00 0.00 57.07 55.60 2r93 s TYR 98 Cb 0.00 0.31 0.00 0.00 0.35 0.00 0.00 41.96 42.62 2r93 s TYR 98 CO 0.00 -0.26 0.00 0.41 -1.34 0.00 0.00 175.55 174.36 2r93 n GLY 99 N 4.12 4.21 3.40 8.97 0.00 -1.23 -4.37 105.19 120.29 2r93 n GLY 99 Ca -0.14 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.43 2r93 n GLY 99 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r93 s THR 100 N 0.69 0.04 -0.16 2.61 2.01 0.27 -4.28 115.64 116.82 2r93 s THR 100 Ca 0.00 -0.54 -0.08 0.00 0.31 0.00 0.00 61.69 61.38 2r93 s THR 100 Cb 0.00 -1.28 -0.04 0.00 0.01 0.00 0.00 72.50 71.19 2r93 s THR 100 CO 0.00 -0.19 0.11 0.00 -0.69 0.00 0.00 174.62 173.85 2r93 s ALA 101 N -3.82 3.66 -0.19 7.40 0.00 -1.26 0.12 121.76 127.67 2r93 s ALA 101 Ca 0.05 -0.69 -0.17 0.00 0.00 0.00 0.00 51.96 51.14 2r93 s ALA 101 Cb 0.00 -2.00 -0.07 0.00 0.00 0.00 0.00 23.12 21.06 2r93 s ALA 101 CO -0.09 0.35 -0.34 2.48 0.00 0.00 0.00 175.76 178.16 2r93 n TYR 102 N 2.90 0.05 -4.39 0.00 -0.00 -1.07 -4.81 117.16 109.83 2r93 n TYR 102 Ca -0.18 0.02 -0.25 0.00 -0.00 0.00 0.00 57.90 57.49 2r93 n TYR 102 Cb 0.53 -0.59 -0.10 0.00 -0.00 0.00 0.00 39.34 39.18 2r93 n TYR 102 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.86 177.07 2r93 s LYS 103 N -2.82 1.80 -0.58 -3.48 2.20 -1.26 -5.02 119.74 110.58 2r93 s LYS 103 Ca -0.30 -1.54 0.06 0.00 -0.36 0.00 0.00 55.97 53.83 2r93 s LYS 103 Cb 0.05 -1.93 0.31 0.00 -1.51 0.00 0.00 37.83 34.76 2r93 s LYS 103 CO 0.43 0.38 0.86 1.19 -0.36 0.00 0.00 175.35 177.85 2r93 n PHE 104 N -0.26 3.52 -0.59 4.03 3.01 -1.26 -1.88 117.46 124.03 2r93 n PHE 104 Ca -0.09 -4.02 -0.28 0.00 1.01 0.00 0.00 57.45 54.07 2r93 n PHE 104 Cb 0.58 -0.50 0.18 0.00 -0.01 0.00 0.00 39.48 39.73 2r93 n PHE 104 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 2r93 n GLU 105 N 0.17 -2.11 -3.39 -1.08 2.13 -1.13 -4.83 120.64 110.39 2r93 n GLU 105 Ca 0.30 -0.61 -0.26 0.00 0.66 0.00 0.00 57.16 57.25 2r93 n GLU 105 Cb 0.42 -1.67 -0.10 0.00 0.27 0.00 0.00 31.44 30.36 2r93 n GLU 105 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 2r93 s GLU 106 N -3.61 0.73 -0.98 5.31 2.12 -1.26 -3.29 118.70 117.73 2r93 s GLU 106 Ca 0.52 -1.62 -0.25 0.00 0.36 0.00 0.00 54.97 53.98 2r93 s GLU 106 Cb -0.10 -1.24 -0.11 0.00 0.26 0.00 0.00 34.13 32.94 2r93 s GLU 106 CO 0.56 -1.29 2.07 0.08 -0.54 0.00 0.00 175.26 176.14 2r93 s VAL 107 N 0.64 3.31 0.00 3.70 1.01 -0.36 -4.83 120.40 123.88 2r93 s VAL 107 Ca 0.25 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.85 2r93 s VAL 107 Cb -0.09 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 32.36 2r93 s VAL 107 CO -0.09 -0.61 0.00 -1.54 0.00 0.00 0.00 175.10 172.86 2r93 n SER 108 N 16.06 0.00 0.00 3.32 3.41 -1.26 -4.10 113.62 131.05 2r93 n SER 108 Ca 0.43 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 2r93 n SER 108 Cb 0.46 -0.88 0.00 0.00 -0.26 0.00 0.00 64.21 63.53 2r93 n SER 108 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2r93 n LYS 109 N -1.66 0.00 -3.10 4.33 5.02 -1.26 -2.53 118.16 118.96 2r93 n LYS 109 Ca 0.00 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.05 2r93 n LYS 109 Cb 0.05 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.02 2r93 n LYS 109 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2r93 n ASP 110 N 5.86 2.72 -3.92 4.39 5.75 -1.26 -4.99 116.55 125.10 2r93 n ASP 110 Ca 0.00 -3.33 -0.30 0.00 -0.01 0.00 0.00 54.79 51.15 2r93 n ASP 110 Cb 0.00 -0.60 -0.14 0.00 -1.03 0.00 0.00 41.12 39.35 2r93 n ASP 110 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2r93 s LEU 111 N -2.79 4.10 -0.18 -2.12 1.43 -1.05 -4.67 118.68 113.41 2r93 s LEU 111 Ca 0.44 -2.87 -0.22 0.00 -1.03 0.00 0.00 54.13 50.45 2r93 s LEU 111 Cb 0.28 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.93 2r93 s LEU 111 CO -0.10 -0.25 0.66 -0.63 0.23 0.00 0.00 176.35 176.26 2r93 s ILE 112 N -0.08 5.01 -0.13 -0.59 1.01 -1.19 -1.22 121.20 124.00 2r93 s ILE 112 Ca 0.16 1.27 0.02 0.00 0.00 0.00 0.00 60.65 62.10 2r93 s ILE 112 Cb -0.25 -3.98 0.01 0.00 0.01 0.00 0.00 42.46 38.25 2r93 s ILE 112 CO -0.01 0.12 -0.19 0.00 0.00 0.00 0.00 174.94 174.87 2r93 s ALA 113 N 1.78 2.01 -0.06 9.38 0.00 -1.21 -3.33 121.76 130.34 2r93 s ALA 113 Ca 0.31 -0.95 -0.02 0.00 0.00 0.00 0.00 51.96 51.30 2r93 s ALA 113 Cb -0.16 -0.95 -0.04 0.00 0.00 0.00 0.00 23.12 21.98 2r93 s ALA 113 CO 0.11 -0.09 0.05 0.14 0.00 0.00 0.00 175.76 175.97 2r93 s VAL 114 N 0.96 4.64 -0.06 0.00 -7.23 -1.18 -2.86 120.40 114.69 2r93 s VAL 114 Ca -0.05 -0.25 -0.06 0.00 -1.81 0.00 0.00 61.98 59.80 2r93 s VAL 114 Cb -0.15 -3.03 -0.04 0.00 0.56 0.00 0.00 36.38 33.72 2r93 s VAL 114 CO -0.03 0.51 0.20 -0.31 -0.31 0.00 0.00 175.10 175.15 2r93 s TYR 115 N -1.03 3.59 0.03 2.82 1.51 -0.79 -2.27 117.35 121.22 2r93 s TYR 115 Ca 0.17 0.53 0.05 0.00 -1.01 0.00 0.00 57.07 56.81 2r93 s TYR 115 Cb -0.12 -1.95 -0.02 0.00 -0.11 0.00 0.00 41.96 39.77 2r93 s TYR 115 CO 0.07 0.68 -0.15 0.71 -1.11 0.00 0.00 175.55 175.76 2r93 s TYR 116 N -1.17 1.27 -0.06 2.71 1.51 0.12 -2.61 117.35 119.13 2r93 s TYR 116 Ca 0.22 -0.34 -0.00 0.00 -1.01 0.00 0.00 57.07 55.94 2r93 s TYR 116 Cb -0.13 -0.76 0.02 0.00 -0.11 0.00 0.00 41.96 40.98 2r93 s TYR 116 CO 0.11 0.03 -0.02 0.45 -1.11 0.00 0.00 175.55 175.01 2r93 s SER 117 N -1.01 1.19 -0.45 2.29 0.15 0.32 0.01 113.70 116.20 2r93 s SER 117 Ca 0.03 -0.10 -0.01 0.00 0.70 0.00 0.00 55.95 56.57 2r93 s SER 117 Cb -0.07 -0.43 0.12 0.00 -1.71 0.00 0.00 66.02 63.92 2r93 s SER 117 CO 0.01 -0.12 0.22 -0.36 1.20 0.00 0.00 173.24 174.19 2r93 s PHE 118 N 1.38 3.56 -0.02 3.44 0.40 0.32 0.97 117.98 128.02 2r93 s PHE 118 Ca -0.04 -2.68 0.00 0.00 -0.60 0.00 0.00 56.93 53.61 2r93 s PHE 118 Cb -0.13 -3.11 0.00 0.00 0.51 0.00 0.00 43.02 40.28 2r93 s PHE 118 CO -0.03 -0.92 0.00 0.41 0.70 0.00 0.00 175.22 175.38 2r93 n GLY 119 N 4.16 0.02 0.00 4.36 0.00 -1.26 -0.07 105.19 112.40 2r93 n GLY 119 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2r93 n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r93 n GLY 120 N 0.30 -0.60 3.21 -0.02 0.00 -1.26 -5.10 105.19 101.71 2r93 n GLY 120 Ca -0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 2r93 n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r93 s LEU 121 N 0.00 5.11 1.10 0.99 1.43 0.90 -5.09 118.68 123.11 2r93 s LEU 121 Ca 0.00 -1.69 -0.17 0.00 -1.03 0.00 0.00 54.13 51.24 2r93 s LEU 121 Cb 0.00 -1.91 0.24 0.00 0.03 0.00 0.00 46.19 44.55 2r93 s LEU 121 CO 0.00 -0.53 1.14 -0.76 0.23 0.00 0.00 176.35 176.44 2r93 s LEU 122 N 1.31 1.30 -0.29 1.79 1.43 -1.26 -0.52 118.68 122.44 2r93 s LEU 122 Ca 0.04 0.70 -0.25 0.00 -1.03 0.00 0.00 54.13 53.59 2r93 s LEU 122 Cb -0.23 -2.63 0.17 0.00 0.03 0.00 0.00 46.19 43.53 2r93 s LEU 122 CO -0.01 -3.57 1.32 -0.32 0.23 0.00 0.00 176.35 174.01 2r93 s MET 123 N -5.39 0.19 -0.02 1.70 -2.45 0.10 -2.70 119.30 110.73 2r93 s MET 123 Ca 0.70 0.21 0.04 0.00 -1.25 0.00 0.00 55.69 55.39 2r93 s MET 123 Cb -0.11 0.09 -0.01 0.00 1.25 0.00 0.00 34.83 36.06 2r93 s MET 123 CO 0.55 -0.03 -0.14 0.50 1.05 0.00 0.00 175.02 176.96 2r93 s ARG 124 N 0.02 1.30 0.20 4.11 3.52 0.12 0.12 118.95 128.34 2r93 s ARG 124 Ca 0.06 -0.50 0.08 0.00 -0.13 0.00 0.00 55.73 55.23 2r93 s ARG 124 Cb -0.05 -1.21 -0.05 0.00 -1.56 0.00 0.00 34.95 32.09 2r93 s ARG 124 CO -0.12 0.26 -0.14 -1.17 -0.81 0.00 0.00 175.30 173.31 2r93 s LEU 125 N -0.14 2.55 -0.09 -0.88 2.96 -0.96 -1.36 118.68 120.77 2r93 s LEU 125 Ca 0.01 -1.02 -0.20 0.00 -0.22 0.00 0.00 54.13 52.70 2r93 s LEU 125 Cb -0.08 -0.66 0.04 0.00 0.50 0.00 0.00 46.19 46.00 2r93 s LEU 125 CO 0.00 -0.18 0.48 -0.70 -1.32 0.00 0.00 176.35 174.63 2r93 s GLU 126 N -3.65 0.74 0.00 1.98 2.12 -1.09 -3.09 118.70 115.71 2r93 s GLU 126 Ca 0.22 0.26 0.00 0.00 0.36 0.00 0.00 54.97 55.81 2r93 s GLU 126 Cb -0.01 0.34 0.00 0.00 0.26 0.00 0.00 34.13 34.73 2r93 s GLU 126 CO 0.07 -0.18 0.00 0.41 -0.54 0.00 0.00 175.26 175.02 2r93 n GLY 127 N 1.76 -0.58 0.00 -1.50 0.00 -1.21 -3.43 105.19 100.23 2r93 n GLY 127 Ca -0.18 0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2r93 n GLY 127 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2r93 n ASN 128 N 0.00 0.00 0.00 1.61 2.85 -1.26 -3.18 115.26 115.28 2r93 n ASN 128 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2r93 n ASN 128 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 2r93 n ASN 128 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2r93 n TYR 129 N 0.00 0.00 -1.58 1.20 0.18 -1.26 -4.86 117.16 110.84 2r93 n TYR 129 Ca 0.00 0.00 -0.32 0.00 1.88 0.00 0.00 57.90 59.46 2r93 n TYR 129 Cb 0.00 0.00 -0.05 0.00 -0.38 0.00 0.00 39.34 38.91 2r93 n TYR 129 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2r93 n ARG 130 N 0.00 3.42 0.08 -3.48 3.00 -1.26 -4.51 116.66 113.91 2r93 n ARG 130 Ca 0.00 -2.55 -0.00 0.00 -0.01 0.00 0.00 57.85 55.29 2r93 n ARG 130 Cb 0.04 -2.42 0.29 0.00 0.00 0.00 0.00 32.46 30.38 2r93 n ARG 130 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.63 176.72 2r93 h ASN 131 N 3.96 0.30 0.00 0.55 2.35 -1.95 -2.68 115.58 118.11 2r93 h ASN 131 Ca 0.57 -0.09 -0.04 0.00 -0.55 0.00 0.00 56.30 56.19 2r93 h ASN 131 Cb 0.60 -0.08 -0.08 0.00 0.05 0.00 0.00 38.32 38.81 2r93 h ASN 131 CO 1.17 0.54 -0.58 0.18 -1.65 0.00 0.00 177.43 177.09 2r93 n LEU 132 N -4.16 2.27 0.05 1.61 4.77 -1.26 -4.82 117.00 115.45 2r93 n LEU 132 Ca -0.01 -3.39 0.00 0.00 -0.03 0.00 0.00 56.01 52.59 2r93 n LEU 132 Cb 0.36 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 2r93 n LEU 132 CO 0.40 1.14 0.00 0.59 -1.33 0.00 0.00 177.39 178.19 2r93 n ASN 133 N -0.78 0.82 -4.56 -1.43 3.02 -1.13 -4.98 115.26 106.22 2r93 n ASN 133 Ca 0.16 0.14 -0.22 0.00 -0.03 0.00 0.00 54.58 54.63 2r93 n ASN 133 Cb 0.78 -0.23 -0.06 0.00 -0.61 0.00 0.00 39.78 39.67 2r93 n ASN 133 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2r93 s ASN 134 N -5.73 4.68 0.87 6.41 0.01 -1.02 -4.96 114.94 115.19 2r93 s ASN 134 Ca 0.00 -0.47 -0.11 0.00 -0.71 0.00 0.00 52.86 51.57 2r93 s ASN 134 Cb 0.00 -2.56 0.12 0.00 0.41 0.00 0.00 41.25 39.22 2r93 s ASN 134 CO 0.00 -3.19 1.10 -0.76 -1.51 0.00 0.00 177.10 172.74 2r93 s LEU 135 N 11.86 2.59 -0.10 0.60 1.43 -1.26 -4.92 118.68 128.88 2r93 s LEU 135 Ca 0.78 1.79 0.17 0.00 -1.03 0.00 0.00 54.13 55.83 2r93 s LEU 135 Cb -0.09 -4.27 0.66 0.00 0.03 0.00 0.00 46.19 42.53 2r93 s LEU 135 CO 0.03 -2.63 1.55 0.29 0.23 0.00 0.00 176.35 175.82 2r93 n LYS 136 N -3.90 3.45 -1.82 1.70 5.02 -1.26 -4.99 118.16 116.36 2r93 n LYS 136 Ca 0.09 -2.61 -0.30 0.00 -2.02 0.00 0.00 58.31 53.47 2r93 n LYS 136 Cb 0.54 -1.83 0.05 0.00 -0.02 0.00 0.00 35.03 33.77 2r93 n LYS 136 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2r93 s GLN 137 N -1.78 2.72 0.02 1.97 -0.21 -1.26 -4.88 119.66 116.23 2r93 s GLN 137 Ca 0.47 0.50 -0.25 0.00 0.02 0.00 0.00 55.36 56.10 2r93 s GLN 137 Cb 0.30 -2.00 -0.17 0.00 1.00 0.00 0.00 33.01 32.14 2r93 s GLN 137 CO 0.23 -1.14 1.33 1.49 -2.12 0.00 0.00 175.29 175.08 2r93 h GLU 138 N -0.74 -0.31 -6.36 2.91 4.81 -1.90 -3.36 114.58 109.64 2r93 h GLU 138 Ca -0.45 0.02 -0.63 0.00 -0.13 0.00 0.00 59.36 58.17 2r93 h GLU 138 Cb 1.26 0.07 0.10 0.00 0.63 0.00 0.00 28.75 30.80 2r93 h GLU 138 CO 0.63 -0.01 0.10 0.09 -0.73 0.00 0.00 179.01 179.09 2r93 n ASN 139 N -5.10 0.99 0.00 1.04 3.02 -1.26 -3.92 115.26 110.03 2r93 n ASN 139 Ca -0.09 1.16 0.00 0.00 -0.03 0.00 0.00 54.58 55.62 2r93 n ASN 139 Cb 0.24 -1.22 0.00 0.00 -0.61 0.00 0.00 39.78 38.19 2r93 n ASN 139 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2r93 n ALA 140 N 0.67 0.00 -2.39 5.41 0.00 -1.26 -4.90 120.51 118.04 2r93 n ALA 140 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.17 2r93 n ALA 140 Cb 0.28 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.68 2r93 n ALA 140 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2r93 s TYR 141 N 0.00 3.74 0.34 0.00 1.51 -1.08 -3.58 117.35 118.28 2r93 s TYR 141 Ca 0.00 1.44 0.02 0.00 -1.01 0.00 0.00 57.07 57.52 2r93 s TYR 141 Cb 0.00 -2.79 -0.03 0.00 -0.11 0.00 0.00 41.96 39.03 2r93 s TYR 141 CO 0.00 0.29 0.52 -1.17 -1.11 0.00 0.00 175.55 174.08 2r93 s LEU 142 N -0.11 4.03 -0.14 -1.29 2.96 -1.11 -4.28 118.68 118.74 2r93 s LEU 142 Ca 0.37 0.29 -0.13 0.00 -0.22 0.00 0.00 54.13 54.44 2r93 s LEU 142 Cb -0.20 -3.14 0.04 0.00 0.50 0.00 0.00 46.19 43.38 2r93 s LEU 142 CO 0.22 -0.31 0.38 -0.76 -1.32 0.00 0.00 176.35 174.56 2r93 s LEU 143 N -4.26 0.54 -0.00 -0.68 1.02 -1.18 -2.90 118.68 111.22 2r93 s LEU 143 Ca 0.40 0.77 -0.02 0.00 0.02 0.00 0.00 54.13 55.30 2r93 s LEU 143 Cb -0.09 1.30 -0.01 0.00 0.02 0.00 0.00 46.19 47.41 2r93 s LEU 143 CO 0.34 -0.13 0.03 -0.63 0.02 0.00 0.00 176.35 175.98 2r93 s ILE 144 N 0.22 0.05 -0.04 -0.59 1.01 -0.34 -2.70 121.20 118.81 2r93 s ILE 144 Ca -0.00 -0.41 -0.10 0.00 0.00 0.00 0.00 60.65 60.14 2r93 s ILE 144 Cb -0.03 -0.18 0.02 0.00 0.01 0.00 0.00 42.46 42.28 2r93 s ILE 144 CO 0.00 -0.23 0.23 0.00 0.00 0.00 0.00 174.94 174.95 2r93 s ARG 145 N -0.68 0.46 0.00 2.79 1.70 -1.20 -0.01 118.95 122.02 2r93 s ARG 145 Ca -0.07 -0.06 0.00 0.00 -0.47 0.00 0.00 55.73 55.13 2r93 s ARG 145 Cb -0.05 0.21 0.00 0.00 -0.57 0.00 0.00 34.95 34.54 2r93 s ARG 145 CO -0.00 -0.10 0.00 0.54 -1.08 0.00 0.00 175.30 174.65