#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r92 s ASN 3 N 0.00 4.40 0.56 4.04 0.01 -1.26 -4.75 114.94 117.94 2r92 s ASN 3 Ca 0.00 -1.45 0.04 0.00 -0.71 0.00 0.00 52.86 50.74 2r92 s ASN 3 Cb 0.00 0.50 0.06 0.00 0.41 0.00 0.00 41.25 42.22 2r92 s ASN 3 CO 0.00 -1.01 0.78 -0.89 -1.51 0.00 0.00 177.10 174.47 2r92 s THR 4 N -2.83 2.52 0.00 1.60 2.01 -1.26 -4.04 115.64 113.65 2r92 s THR 4 Ca 0.20 -0.80 0.00 0.00 0.31 0.00 0.00 61.69 61.40 2r92 s THR 4 Cb -0.01 -2.72 0.00 0.00 0.01 0.00 0.00 72.50 69.78 2r92 s THR 4 CO 0.12 0.00 0.15 0.18 -0.69 0.00 0.00 174.62 174.39 2r92 n LEU 5 N -2.31 0.00 -3.63 4.42 4.77 -1.26 -4.74 117.00 114.25 2r92 n LEU 5 Ca 0.11 -0.01 -0.07 0.00 -0.03 0.00 0.00 56.01 56.02 2r92 n LEU 5 Cb 0.60 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.63 2r92 n LEU 5 CO 0.42 0.02 0.93 0.12 -1.33 0.00 0.00 177.39 177.55 2r92 s PHE 6 N 0.00 -0.26 -0.10 -1.77 5.36 -1.26 -4.60 117.98 115.36 2r92 s PHE 6 Ca 0.00 0.57 -0.07 0.00 -0.96 0.00 0.00 56.93 56.47 2r92 s PHE 6 Cb 0.00 0.44 0.03 0.00 -0.34 0.00 0.00 43.02 43.15 2r92 s PHE 6 CO 0.00 -0.17 0.24 0.34 -1.46 0.00 0.00 175.22 174.17 2r92 s ASP 7 N -0.35 -0.25 0.00 6.13 -1.08 -1.26 -3.62 116.67 116.24 2r92 s ASP 7 Ca 0.04 0.49 0.00 0.00 -0.52 0.00 0.00 52.55 52.57 2r92 s ASP 7 Cb -0.03 0.45 0.00 0.00 -1.46 0.00 0.00 42.92 41.87 2r92 s ASP 7 CO -0.07 -0.12 0.00 -0.67 0.52 0.00 0.00 175.17 174.83 2r92 n ASP 8 N 3.53 0.00 -3.99 -0.34 2.03 -1.11 -5.03 116.55 111.63 2r92 n ASP 8 Ca -0.18 0.00 -0.16 0.00 0.52 0.00 0.00 54.79 54.97 2r92 n ASP 8 Cb 0.56 0.00 -0.14 0.00 -0.72 0.00 0.00 41.12 40.82 2r92 n ASP 8 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2r92 s ILE 9 N -2.00 0.49 0.38 5.18 1.01 -1.26 -1.62 121.20 123.37 2r92 s ILE 9 Ca 0.00 -0.43 0.04 0.00 0.00 0.00 0.00 60.65 60.25 2r92 s ILE 9 Cb 0.00 -0.44 -0.04 0.00 0.01 0.00 0.00 42.46 41.99 2r92 s ILE 9 CO 0.00 0.02 0.11 -0.36 0.00 0.00 0.00 174.94 174.71 2r92 s PHE 10 N -0.40 1.81 -0.04 3.97 0.40 -0.64 -2.40 117.98 120.68 2r92 s PHE 10 Ca -0.00 -1.19 -0.01 0.00 -0.60 0.00 0.00 56.93 55.13 2r92 s PHE 10 Cb -0.04 -1.18 0.03 0.00 0.51 0.00 0.00 43.02 42.34 2r92 s PHE 10 CO -0.00 -0.22 0.02 -1.14 0.70 0.00 0.00 175.22 174.59 2r92 s GLN 11 N -3.78 0.17 -0.16 0.44 0.74 -0.97 -2.87 119.66 113.22 2r92 s GLN 11 Ca 0.28 0.20 -0.29 0.00 0.05 0.00 0.00 55.36 55.59 2r92 s GLN 11 Cb 0.04 -0.53 -0.07 0.00 1.10 0.00 0.00 33.01 33.56 2r92 s GLN 11 CO 0.15 -0.23 2.15 0.28 -0.55 0.00 0.00 175.29 177.09 2r92 n VAL 12 N 4.67 0.45 0.24 1.34 0.31 -1.23 -2.41 118.33 121.69 2r92 n VAL 12 Ca -0.16 -0.36 0.12 0.00 -0.01 0.00 0.00 64.34 63.93 2r92 n VAL 12 Cb 0.50 -2.42 0.17 0.00 -0.91 0.00 0.00 33.84 31.18 2r92 n VAL 12 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2r92 h SER 13 N 13.61 0.00 0.00 4.52 4.64 -0.49 0.16 113.55 135.99 2r92 h SER 13 Ca -0.43 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2r92 h SER 13 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2r92 h SER 13 CO 0.96 0.00 0.00 1.21 -0.87 0.00 0.00 176.83 178.13 2r92 n GLU 14 N -3.02 0.00 -4.91 4.77 2.13 -1.21 -4.90 120.64 113.51 2r92 n GLU 14 Ca 0.04 0.00 -0.33 0.00 0.66 0.00 0.00 57.16 57.53 2r92 n GLU 14 Cb 0.53 0.00 -0.14 0.00 0.27 0.00 0.00 31.44 32.09 2r92 n GLU 14 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2r92 s VAL 15 N -1.72 2.84 -0.12 6.31 1.01 -1.26 -3.02 120.40 124.45 2r92 s VAL 15 Ca 0.00 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.24 2r92 s VAL 15 Cb 0.00 -2.14 0.01 0.00 0.00 0.00 0.00 36.38 34.25 2r92 s VAL 15 CO 0.00 0.55 -0.16 -0.62 0.00 0.00 0.00 175.10 174.87 2r92 s ASP 16 N -0.02 2.57 -0.81 3.32 2.15 -0.61 -5.00 116.67 118.27 2r92 s ASP 16 Ca -0.04 -0.46 0.02 0.00 0.43 0.00 0.00 52.55 52.49 2r92 s ASP 16 Cb -0.14 -1.16 0.28 0.00 -0.30 0.00 0.00 42.92 41.60 2r92 s ASP 16 CO 0.04 0.02 1.06 -0.81 -0.17 0.00 0.00 175.17 175.32 2r92 n PRO 17 N 4.21 3.37 -0.76 4.34 -0.04 -1.26 -1.93 135.00 142.93 2r92 n PRO 17 Ca -0.19 -4.64 -0.27 0.00 -0.04 0.00 0.00 63.50 58.35 2r92 n PRO 17 Cb 0.51 -2.36 -0.03 0.00 -0.04 0.00 0.00 33.50 31.58 2r92 n PRO 17 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2r92 n GLY 18 N 0.93 2.62 1.86 0.55 0.00 -1.26 -3.99 105.19 105.90 2r92 n GLY 18 Ca 0.29 -0.88 -0.06 0.00 0.00 0.00 0.00 46.02 45.38 2r92 n GLY 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r92 n ARG 19 N 5.38 -2.19 -3.22 1.61 1.74 -1.26 -5.02 116.66 113.70 2r92 n ARG 19 Ca 0.41 0.27 -0.24 0.00 -0.77 0.00 0.00 57.85 57.51 2r92 n ARG 19 Cb 0.21 -3.56 -0.07 0.00 -1.02 0.00 0.00 32.46 28.02 2r92 n ARG 19 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2r92 n TYR 20 N -2.30 0.02 -0.13 -1.55 0.53 -1.26 -4.99 117.16 107.48 2r92 n TYR 20 Ca -0.07 -3.61 0.18 0.00 -1.02 0.00 0.00 57.90 53.38 2r92 n TYR 20 Cb 0.55 -0.35 0.28 0.00 -1.03 0.00 0.00 39.34 38.78 2r92 n TYR 20 CO 0.00 0.00 0.00 0.09 -1.02 0.00 0.00 176.86 175.93 2r92 n ASN 21 N 1.41 0.00 0.00 7.72 3.02 -1.26 -0.60 115.26 125.55 2r92 n ASN 21 Ca 0.22 0.50 0.00 0.00 -0.03 0.00 0.00 54.58 55.27 2r92 n ASN 21 Cb 0.52 -0.17 0.00 0.00 -0.61 0.00 0.00 39.78 39.52 2r92 n ASN 21 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2r92 n LYS 22 N -2.56 1.01 -3.69 3.52 5.02 -1.26 -4.99 118.16 115.21 2r92 n LYS 22 Ca 0.15 -0.92 -0.12 0.00 -2.02 0.00 0.00 58.31 55.40 2r92 n LYS 22 Cb 1.01 -0.91 -0.09 0.00 -0.02 0.00 0.00 35.03 35.02 2r92 n LYS 22 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2r92 s VAL 23 N -0.46 -0.01 0.10 -0.18 1.01 0.23 -3.21 120.40 117.89 2r92 s VAL 23 Ca 0.00 0.02 0.07 0.00 0.00 0.00 0.00 61.98 62.07 2r92 s VAL 23 Cb 0.00 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.60 2r92 s VAL 23 CO 0.00 0.01 -0.18 0.00 0.00 0.00 0.00 175.10 174.93 2r92 s ARG 25 N -1.96 3.59 0.15 0.00 3.52 -0.81 0.24 118.95 123.68 2r92 s ARG 25 Ca 0.04 0.01 0.06 0.00 -0.13 0.00 0.00 55.73 55.71 2r92 s ARG 25 Cb -0.09 -3.16 -0.04 0.00 -1.56 0.00 0.00 34.95 30.10 2r92 s ARG 25 CO 0.03 0.71 -0.13 0.42 -0.81 0.00 0.00 175.30 175.53 2r92 s ILE 26 N -1.14 1.36 -0.03 4.11 1.01 0.10 -1.57 121.20 125.05 2r92 s ILE 26 Ca 0.21 -1.92 0.01 0.00 0.00 0.00 0.00 60.65 58.95 2r92 s ILE 26 Cb -0.13 -1.73 0.02 0.00 0.01 0.00 0.00 42.46 40.63 2r92 s ILE 26 CO 0.10 -0.55 -0.02 -1.61 0.00 0.00 0.00 174.94 172.87 2r92 s GLU 27 N -3.18 0.42 0.14 2.79 2.02 -1.17 0.39 118.70 120.11 2r92 s GLU 27 Ca 0.14 -0.01 -0.06 0.00 0.02 0.00 0.00 54.97 55.07 2r92 s GLU 27 Cb -0.02 -0.52 -0.02 0.00 0.10 0.00 0.00 34.13 33.67 2r92 s GLU 27 CO 0.03 -0.08 0.18 0.00 0.02 0.00 0.00 175.26 175.41 2r92 s ALA 28 N 0.78 0.30 0.52 5.21 0.00 -0.70 0.32 121.76 128.19 2r92 s ALA 28 Ca -0.08 -1.07 0.08 0.00 0.00 0.00 0.00 51.96 50.88 2r92 s ALA 28 Cb -0.12 0.79 0.04 0.00 0.00 0.00 0.00 23.12 23.83 2r92 s ALA 28 CO -0.01 -0.56 0.57 0.00 0.00 0.00 0.00 175.76 175.76 2r92 s ALA 29 N -3.98 4.49 -0.01 0.00 0.00 -1.01 -1.61 121.76 119.63 2r92 s ALA 29 Ca 0.17 -1.76 -0.01 0.00 0.00 0.00 0.00 51.96 50.37 2r92 s ALA 29 Cb 0.05 -1.15 -0.04 0.00 0.00 0.00 0.00 23.12 21.98 2r92 s ALA 29 CO -0.01 -0.56 0.10 0.45 0.00 0.00 0.00 175.76 175.74 2r92 s SER 30 N -4.41 5.83 -0.78 0.00 0.15 -1.08 -2.30 113.70 111.11 2r92 s SER 30 Ca 0.49 0.20 -0.03 0.00 0.70 0.00 0.00 55.95 57.31 2r92 s SER 30 Cb -0.04 -1.72 0.23 0.00 -1.71 0.00 0.00 66.02 62.78 2r92 s SER 30 CO 0.30 0.28 2.28 0.41 1.20 0.00 0.00 173.24 177.71 2r92 n THR 31 N 1.18 3.93 0.00 6.45 -1.04 -1.01 -4.56 114.28 119.23 2r92 n THR 31 Ca -0.13 -4.07 0.00 0.00 -2.04 0.00 0.00 64.05 57.81 2r92 n THR 31 Cb 0.53 -1.46 0.00 0.00 -1.82 0.00 0.00 70.33 67.58 2r92 n THR 31 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2r92 n THR 32 N 0.16 0.00 -2.98 12.58 -1.04 -1.26 -4.96 114.28 116.78 2r92 n THR 32 Ca 0.52 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 62.14 2r92 n THR 32 Cb 0.34 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.79 2r92 n THR 32 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2r92 s GLN 33 N 0.00 4.57 -0.09 -2.82 1.11 -1.26 -4.93 119.66 116.24 2r92 s GLN 33 Ca 0.00 1.16 0.00 0.00 0.01 0.00 0.00 55.36 56.53 2r92 s GLN 33 Cb 0.00 -3.27 0.11 0.00 -1.01 0.00 0.00 33.01 28.84 2r92 s GLN 33 CO 0.00 0.56 1.42 -0.25 0.01 0.00 0.00 175.29 177.02 2r92 n ASP 34 N 1.65 3.92 0.00 5.90 8.00 -1.26 -3.39 116.55 131.37 2r92 n ASP 34 Ca -0.05 -2.40 0.00 0.00 0.71 0.00 0.00 54.79 53.04 2r92 n ASP 34 Cb 0.49 -0.72 0.00 0.00 -0.02 0.00 0.00 41.12 40.86 2r92 n ASP 34 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2r92 n GLN 35 N 0.46 0.00 -1.77 -1.24 6.02 -1.26 -4.98 117.38 114.60 2r92 n GLN 35 Ca 0.11 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.91 2r92 n GLN 35 Cb 0.66 -0.82 -0.07 0.00 1.02 0.00 0.00 30.24 31.03 2r92 n GLN 35 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2r92 s LYS 37 N 8.00 3.49 -0.07 0.00 1.02 -1.21 -2.65 119.74 128.31 2r92 s LYS 37 Ca 0.81 -0.38 -0.07 0.00 0.02 0.00 0.00 55.97 56.35 2r92 s LYS 37 Cb -0.08 -2.70 0.02 0.00 -0.52 0.00 0.00 37.83 34.54 2r92 s LYS 37 CO 0.08 0.20 0.20 -1.17 -0.92 0.00 0.00 175.35 173.73 2r92 s LEU 38 N -4.19 1.26 -0.09 3.17 2.96 -0.64 -2.61 118.68 118.54 2r92 s LEU 38 Ca 0.39 0.37 -0.00 0.00 -0.22 0.00 0.00 54.13 54.67 2r92 s LEU 38 Cb -0.10 0.68 0.02 0.00 0.50 0.00 0.00 46.19 47.30 2r92 s LEU 38 CO 0.35 -0.08 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.35 2r92 s THR 39 N 0.04 0.76 -0.19 3.68 2.01 -0.25 -1.73 115.64 119.96 2r92 s THR 39 Ca -0.01 -0.14 -0.10 0.00 0.31 0.00 0.00 61.69 61.75 2r92 s THR 39 Cb -0.02 -0.82 0.07 0.00 0.01 0.00 0.00 72.50 71.74 2r92 s THR 39 CO 0.00 0.32 0.46 -0.22 -0.69 0.00 0.00 174.62 174.49 2r92 s LEU 40 N 1.67 -0.30 0.60 4.42 2.96 0.16 0.10 118.68 128.29 2r92 s LEU 40 Ca 0.02 1.01 -0.15 0.00 -0.22 0.00 0.00 54.13 54.79 2r92 s LEU 40 Cb -0.13 1.53 -0.03 0.00 0.50 0.00 0.00 46.19 48.05 2r92 s LEU 40 CO -0.06 -0.20 1.05 -1.81 -1.32 0.00 0.00 176.35 174.01 2r92 s ASP 41 N 1.58 5.78 -0.28 3.68 1.01 -0.99 0.01 116.67 127.46 2r92 s ASP 41 Ca -0.09 1.79 -0.21 0.00 0.71 0.00 0.00 52.55 54.75 2r92 s ASP 41 Cb -0.08 -2.53 0.10 0.00 1.01 0.00 0.00 42.92 41.42 2r92 s ASP 41 CO -0.14 -1.17 0.85 -0.63 0.21 0.00 0.00 175.17 174.29 2r92 s ILE 42 N -2.52 0.00 -0.65 0.77 1.01 0.14 -4.85 121.20 115.10 2r92 s ILE 42 Ca 0.63 0.00 -0.26 0.00 0.00 0.00 0.00 60.65 61.02 2r92 s ILE 42 Cb -0.16 -1.00 -0.06 0.00 0.01 0.00 0.00 42.46 41.25 2r92 s ILE 42 CO 0.38 0.00 2.15 0.21 0.00 0.00 0.00 174.94 177.68 2r92 s ASN 43 N 0.89 4.74 0.00 3.58 3.84 -1.26 -1.91 114.94 124.82 2r92 s ASN 43 Ca -0.04 0.37 0.00 0.00 0.21 0.00 0.00 52.86 53.40 2r92 s ASN 43 Cb -0.05 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 38.12 2r92 s ASN 43 CO -0.10 -2.86 1.92 0.52 -2.79 0.00 0.00 177.10 173.80 2r92 n VAL 44 N 7.84 1.92 0.00 -5.21 0.31 -1.20 -2.73 118.33 119.27 2r92 n VAL 44 Ca 0.33 -0.48 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 2r92 n VAL 44 Cb 0.51 -1.48 0.00 0.00 -0.91 0.00 0.00 33.84 31.96 2r92 n VAL 44 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2r92 n GLU 45 N 1.52 0.25 0.00 5.55 2.13 -1.26 -4.51 120.64 124.31 2r92 n GLU 45 Ca 0.00 0.00 0.13 0.00 0.66 0.00 0.00 57.16 57.95 2r92 n GLU 45 Cb 0.48 -0.65 0.25 0.00 0.27 0.00 0.00 31.44 31.78 2r92 n GLU 45 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2r92 n LEU 46 N -1.64 1.98 -2.80 4.31 4.77 -1.16 -4.65 117.00 117.82 2r92 n LEU 46 Ca 0.00 -0.66 -0.01 0.00 -0.03 0.00 0.00 56.01 55.31 2r92 n LEU 46 Cb 0.15 -0.02 0.01 0.00 -2.33 0.00 0.00 43.42 41.23 2r92 n LEU 46 CO 0.00 0.34 0.36 0.12 -1.33 0.00 0.00 177.39 176.88 2r92 s PHE 47 N -2.21 -0.76 0.99 -1.77 5.36 -1.11 -5.00 117.98 113.49 2r92 s PHE 47 Ca 0.28 -0.07 -0.12 0.00 -0.96 0.00 0.00 56.93 56.05 2r92 s PHE 47 Cb 0.20 0.14 0.13 0.00 -0.34 0.00 0.00 43.02 43.15 2r92 s PHE 47 CO 0.42 -0.56 0.73 -2.30 -1.46 0.00 0.00 175.22 172.05 2r92 n PRO 48 N 3.29 -0.84 -3.58 10.12 -0.02 -1.26 -4.33 135.00 138.38 2r92 n PRO 48 Ca 0.10 -0.20 -0.00 0.00 -2.02 0.00 0.00 63.50 61.38 2r92 n PRO 48 Cb 0.62 -2.08 -0.04 0.00 -0.02 0.00 0.00 33.50 31.98 2r92 n PRO 48 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2r92 s VAL 49 N -2.47 -0.85 0.23 -1.45 1.01 -1.26 -5.02 120.40 110.59 2r92 s VAL 49 Ca 0.62 0.00 0.08 0.00 0.00 0.00 0.00 61.98 62.68 2r92 s VAL 49 Cb -0.21 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.13 2r92 s VAL 49 CO 0.63 0.00 0.09 0.00 0.00 0.00 0.00 175.10 175.82 2r92 s ALA 50 N 2.75 3.38 0.17 5.51 0.00 -1.26 -4.98 121.76 127.33 2r92 s ALA 50 Ca -0.05 -1.45 -0.31 0.00 0.00 0.00 0.00 51.96 50.15 2r92 s ALA 50 Cb -0.10 -1.09 -0.17 0.00 0.00 0.00 0.00 23.12 21.76 2r92 s ALA 50 CO -0.19 0.34 0.84 0.00 0.00 0.00 0.00 175.76 176.76 2r92 n ALA 51 N -0.76 -2.11 -2.70 0.00 0.00 -1.26 -4.26 120.51 109.43 2r92 n ALA 51 Ca -0.08 0.47 -0.03 0.00 0.00 0.00 0.00 53.44 53.79 2r92 n ALA 51 Cb 0.57 -1.80 -0.03 0.00 0.00 0.00 0.00 19.45 18.20 2r92 n ALA 51 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2r92 n GLN 52 N 1.22 -3.90 -3.94 0.00 6.02 0.57 -4.93 117.38 112.41 2r92 n GLN 52 Ca 0.16 3.02 -0.09 0.00 -0.01 0.00 0.00 57.00 60.09 2r92 n GLN 52 Cb 0.23 -4.78 -0.08 0.00 1.02 0.00 0.00 30.24 26.64 2r92 n GLN 52 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2r92 s ASP 53 N -0.96 0.12 -1.03 1.08 1.01 -1.26 -4.80 116.67 110.82 2r92 s ASP 53 Ca -0.17 -0.81 -0.06 0.00 0.71 0.00 0.00 52.55 52.22 2r92 s ASP 53 Cb 0.01 0.37 0.26 0.00 1.01 0.00 0.00 42.92 44.57 2r92 s ASP 53 CO 0.72 -0.79 1.05 -1.54 0.21 0.00 0.00 175.17 174.81 2r92 n SER 54 N -0.12 5.17 -4.88 0.27 3.41 -1.26 -3.54 113.62 112.68 2r92 n SER 54 Ca -0.11 -3.13 -0.32 0.00 -0.26 0.00 0.00 58.87 55.06 2r92 n SER 54 Cb 0.63 -1.24 -0.05 0.00 -0.26 0.00 0.00 64.21 63.28 2r92 n SER 54 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2r92 s LEU 55 N -1.54 4.15 -0.31 1.04 1.43 -1.14 -4.72 118.68 117.58 2r92 s LEU 55 Ca 0.30 0.91 -0.01 0.00 -1.03 0.00 0.00 54.13 54.30 2r92 s LEU 55 Cb -0.07 -3.68 0.06 0.00 0.03 0.00 0.00 46.19 42.53 2r92 s LEU 55 CO -0.07 -0.09 0.02 -0.89 0.23 0.00 0.00 176.35 175.55 2r92 s THR 56 N -1.85 2.90 0.18 5.49 2.01 -1.15 -1.61 115.64 121.60 2r92 s THR 56 Ca 0.47 -1.56 -0.20 0.00 0.31 0.00 0.00 61.69 60.71 2r92 s THR 56 Cb -0.11 -2.74 -0.08 0.00 0.01 0.00 0.00 72.50 69.58 2r92 s THR 56 CO 0.22 -0.21 0.69 -0.69 -0.69 0.00 0.00 174.62 173.94 2r92 s VAL 57 N 1.20 4.58 0.34 3.82 1.01 -0.64 -3.60 120.40 127.11 2r92 s VAL 57 Ca -0.03 1.32 0.00 0.00 0.00 0.00 0.00 61.98 63.28 2r92 s VAL 57 Cb -0.20 -3.91 -0.01 0.00 0.00 0.00 0.00 36.38 32.26 2r92 s VAL 57 CO -0.02 0.34 0.43 -0.89 0.00 0.00 0.00 175.10 174.95 2r92 s THR 58 N -1.36 0.00 0.00 3.92 2.01 -1.16 -2.77 115.64 116.28 2r92 s THR 58 Ca 0.38 -1.71 0.00 0.00 0.31 0.00 0.00 61.69 60.68 2r92 s THR 58 Cb -0.18 -2.62 0.00 0.00 0.01 0.00 0.00 72.50 69.71 2r92 s THR 58 CO 0.22 0.00 0.00 -0.38 -0.69 0.00 0.00 174.62 173.77 2r92 n ILE 59 N -0.59 0.00 -0.71 1.82 5.41 -1.24 -3.35 119.36 120.70 2r92 n ILE 59 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.78 2r92 n ILE 59 Cb 0.62 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.55 2r92 n ILE 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2r92 n ALA 60 N -3.00 -1.45 -3.00 -1.39 0.00 -1.26 -4.48 120.51 105.93 2r92 n ALA 60 Ca 0.00 0.21 -0.33 0.00 0.00 0.00 0.00 53.44 53.32 2r92 n ALA 60 Cb 0.00 -0.92 -0.03 0.00 0.00 0.00 0.00 19.45 18.50 2r92 n ALA 60 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2r92 n SER 61 N -1.41 5.32 0.00 0.00 3.41 -1.26 -2.32 113.62 117.36 2r92 n SER 61 Ca 0.00 -3.59 0.00 0.00 -0.26 0.00 0.00 58.87 55.02 2r92 n SER 61 Cb 0.09 -0.85 0.00 0.00 -0.26 0.00 0.00 64.21 63.19 2r92 n SER 61 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2r92 n SER 62 N 0.32 0.00 -0.41 4.04 3.41 -1.26 -4.74 113.62 114.98 2r92 n SER 62 Ca 0.34 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.95 2r92 n SER 62 Cb 0.35 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 2r92 n SER 62 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2r92 n LEU 63 N 0.00 0.20 0.00 1.04 4.77 -1.26 -4.13 117.00 117.62 2r92 n LEU 63 Ca 0.00 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 2r92 n LEU 63 Cb 0.00 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 2r92 n LEU 63 CO 0.00 0.05 0.02 0.59 -1.33 0.00 0.00 177.39 176.72 2r92 n ASN 64 N 0.21 0.00 0.00 -1.43 3.02 -1.26 -3.09 115.26 112.71 2r92 n ASN 64 Ca 0.00 0.04 0.00 0.00 -0.03 0.00 0.00 54.58 54.59 2r92 n ASN 64 Cb 0.05 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 2r92 n ASN 64 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2r92 n LEU 65 N -0.10 0.00 0.00 3.41 4.77 -1.26 -4.65 117.00 119.16 2r92 n LEU 65 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2r92 n LEU 65 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2r92 n LEU 65 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.39 176.47 2r92 n THR 76 N -1.62 0.00 -1.56 -5.08 -1.04 -1.26 -5.06 114.28 98.67 2r92 n THR 76 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2r92 n THR 76 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 2r92 n THR 76 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2r92 n ARG 77 N 0.00 -4.47 -0.95 -2.82 1.74 -1.26 -4.90 116.66 104.00 2r92 n ARG 77 Ca 0.00 3.34 -0.35 0.00 -0.77 0.00 0.00 57.85 60.07 2r92 n ARG 77 Cb 0.00 -3.78 0.03 0.00 -1.02 0.00 0.00 32.46 27.70 2r92 n ARG 77 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2r92 n SER 78 N -0.98 -4.61 -4.56 0.55 3.41 -1.26 -4.93 113.62 101.25 2r92 n SER 78 Ca 0.00 0.10 -0.37 0.00 -0.26 0.00 0.00 58.87 58.35 2r92 n SER 78 Cb 0.02 -0.62 -0.11 0.00 -0.26 0.00 0.00 64.21 63.24 2r92 n SER 78 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 2r92 s TRP 79 N -1.90 3.19 0.31 7.33 -0.00 -1.26 -5.10 118.94 121.51 2r92 s TRP 79 Ca 0.36 -0.07 -0.14 0.00 -0.00 0.00 0.00 56.10 56.26 2r92 s TRP 79 Cb -0.06 -2.26 -0.08 0.00 -0.00 0.00 0.00 33.47 31.06 2r92 s TRP 79 CO 0.72 -0.14 0.71 1.03 -0.00 0.00 0.00 176.95 179.27 2r92 s ARG 80 N 1.36 3.95 0.00 5.86 0.52 -1.26 -5.10 118.95 124.28 2r92 s ARG 80 Ca 0.06 0.58 0.00 0.00 -0.52 0.00 0.00 55.73 55.85 2r92 s ARG 80 Cb -0.15 -2.46 0.00 0.00 0.52 0.00 0.00 34.95 32.86 2r92 s ARG 80 CO 0.06 0.17 0.00 -2.30 0.02 0.00 0.00 175.30 173.24 2r92 n PRO 81 N -0.40 1.95 0.00 3.54 -0.02 -1.26 -5.04 135.00 133.77 2r92 n PRO 81 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 2r92 n PRO 81 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.01 2r92 n PRO 81 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2r92 n PRO 82 N 0.00 0.00 0.00 0.52 -0.04 -1.26 -4.76 135.00 129.46 2r92 n PRO 82 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2r92 n PRO 82 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2r92 n PRO 82 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2r92 n GLN 83 N 0.00 0.00 0.00 0.54 6.02 -1.26 -4.65 117.38 118.03 2r92 n GLN 83 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2r92 n GLN 83 Cb 0.00 -0.26 0.00 0.00 1.02 0.00 0.00 30.24 31.00 2r92 n GLN 83 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2r92 n ALA 84 N 0.00 1.36 0.08 -1.58 0.00 -1.26 -3.90 120.51 115.22 2r92 n ALA 84 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.64 2r92 n ALA 84 Cb 0.00 -1.00 0.75 0.00 0.00 0.00 0.00 19.45 19.20 2r92 n ALA 84 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2r92 h GLY 85 N 1.75 0.00 0.00 0.00 0.00 -1.96 -1.33 103.07 101.53 2r92 h GLY 85 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2r92 h GLY 85 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 176.54 177.88 2r92 n ASP 86 N -3.86 0.49 -4.18 0.19 -0.08 -1.25 -5.08 116.55 102.77 2r92 n ASP 86 Ca 0.07 -0.79 -0.29 0.00 -1.51 0.00 0.00 54.79 52.27 2r92 n ASP 86 Cb 0.58 0.24 0.18 0.00 2.34 0.00 0.00 41.12 44.47 2r92 n ASP 86 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 2r92 s ARG 87 N -0.24 0.73 0.45 -0.67 0.52 -0.50 -5.01 118.95 114.23 2r92 s ARG 87 Ca 0.00 -0.47 -0.23 0.00 -0.52 0.00 0.00 55.73 54.51 2r92 s ARG 87 Cb 0.00 -1.89 -0.10 0.00 0.52 0.00 0.00 34.95 33.49 2r92 s ARG 87 CO 0.00 -2.33 0.98 -1.13 0.02 0.00 0.00 175.30 172.84 2r92 n SER 88 N -3.69 1.10 -2.87 0.23 3.41 -1.26 -4.94 113.62 105.60 2r92 n SER 88 Ca 0.15 0.99 -0.12 0.00 -0.26 0.00 0.00 58.87 59.62 2r92 n SER 88 Cb 0.60 -1.35 0.02 0.00 -0.26 0.00 0.00 64.21 63.21 2r92 n SER 88 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2r92 n LEU 89 N 0.32 -2.02 -1.38 1.04 4.77 -1.26 -4.97 117.00 113.50 2r92 n LEU 89 Ca 0.10 -3.71 0.00 0.00 -0.03 0.00 0.00 56.01 52.37 2r92 n LEU 89 Cb 0.41 0.79 0.00 0.00 -2.33 0.00 0.00 43.42 42.28 2r92 n LEU 89 CO 0.55 2.02 0.05 0.00 -1.33 0.00 0.00 177.39 178.69 2r92 n ALA 90 N 1.54 1.61 -1.16 -1.18 0.00 -1.18 -3.87 120.51 116.28 2r92 n ALA 90 Ca 0.12 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.32 2r92 n ALA 90 Cb 0.60 -1.37 0.17 0.00 0.00 0.00 0.00 19.45 18.85 2r92 n ALA 90 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2r92 n ASP 91 N 1.36 4.04 -1.87 0.00 5.75 -1.26 -4.78 116.55 119.79 2r92 n ASP 91 Ca 0.00 -3.57 -0.00 0.00 -0.01 0.00 0.00 54.79 51.21 2r92 n ASP 91 Cb 0.04 -0.84 -0.00 0.00 -1.03 0.00 0.00 41.12 39.28 2r92 n ASP 91 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2r92 n ASP 92 N -1.07 1.78 -1.13 -1.12 8.00 -1.25 -4.67 116.55 117.09 2r92 n ASP 92 Ca 0.58 -1.50 0.00 0.00 0.71 0.00 0.00 54.79 54.58 2r92 n ASP 92 Cb 1.56 -0.38 0.00 0.00 -0.02 0.00 0.00 41.12 42.27 2r92 n ASP 92 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2r92 n TYR 93 N 1.91 0.00 -1.28 1.24 4.02 -1.26 -4.93 117.16 116.86 2r92 n TYR 93 Ca 0.01 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.98 2r92 n TYR 93 Cb 0.18 0.00 0.12 0.00 -0.02 0.00 0.00 39.34 39.62 2r92 n TYR 93 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2r92 n ASP 94 N -2.73 1.90 -3.20 7.72 8.00 0.28 -4.96 116.55 123.56 2r92 n ASP 94 Ca 0.00 -2.95 0.04 0.00 0.71 0.00 0.00 54.79 52.59 2r92 n ASP 94 Cb 0.00 -0.40 -0.03 0.00 -0.02 0.00 0.00 41.12 40.67 2r92 n ASP 94 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2r92 s TYR 95 N -2.39 -0.30 -0.18 1.24 6.04 -1.07 -4.87 117.35 115.82 2r92 s TYR 95 Ca 0.27 0.41 -0.01 0.00 0.04 0.00 0.00 57.07 57.78 2r92 s TYR 95 Cb 0.24 0.14 0.05 0.00 -1.04 0.00 0.00 41.96 41.35 2r92 s TYR 95 CO 0.02 -0.15 -0.01 0.08 -1.54 0.00 0.00 175.55 173.94 2r92 s VAL 96 N 2.55 0.87 0.00 3.14 1.01 -1.26 -0.88 120.40 125.83 2r92 s VAL 96 Ca -0.03 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.31 2r92 s VAL 96 Cb -0.06 -1.20 0.00 0.00 0.00 0.00 0.00 36.38 35.12 2r92 s VAL 96 CO -0.13 -0.05 0.00 0.23 0.00 0.00 0.00 175.10 175.15 2r92 n MET 97 N 4.94 1.62 -3.23 2.72 2.81 -1.03 -4.92 117.12 120.03 2r92 n MET 97 Ca -0.10 0.00 0.04 0.00 -1.81 0.00 0.00 57.70 55.83 2r92 n MET 97 Cb 0.47 0.00 -0.02 0.00 -0.71 0.00 0.00 33.22 32.96 2r92 n MET 97 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 2r92 s TYR 98 N 0.44 -0.70 0.00 2.03 5.04 -1.26 -2.41 117.35 120.49 2r92 s TYR 98 Ca 0.00 0.89 0.00 0.00 -2.44 0.00 0.00 57.07 55.52 2r92 s TYR 98 Cb 0.00 0.30 0.00 0.00 0.35 0.00 0.00 41.96 42.61 2r92 s TYR 98 CO 0.00 -0.37 0.00 0.41 -1.34 0.00 0.00 175.55 174.25 2r92 n GLY 99 N 5.29 5.60 3.29 8.97 0.00 -1.24 -4.41 105.19 122.68 2r92 n GLY 99 Ca -0.07 -1.02 -0.09 0.00 0.00 0.00 0.00 46.02 44.84 2r92 n GLY 99 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r92 s THR 100 N 1.83 0.08 -0.16 2.61 2.01 0.24 -4.42 115.64 117.83 2r92 s THR 100 Ca 0.00 -1.50 -0.05 0.00 0.31 0.00 0.00 61.69 60.45 2r92 s THR 100 Cb 0.00 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.62 2r92 s THR 100 CO 0.00 -0.36 -0.01 0.00 -0.69 0.00 0.00 174.62 173.57 2r92 s ALA 101 N -3.98 3.14 -0.13 7.40 0.00 -1.26 0.13 121.76 127.06 2r92 s ALA 101 Ca 0.18 -0.79 -0.13 0.00 0.00 0.00 0.00 51.96 51.22 2r92 s ALA 101 Cb 0.04 -1.66 -0.04 0.00 0.00 0.00 0.00 23.12 21.46 2r92 s ALA 101 CO -0.00 0.22 -0.25 2.48 0.00 0.00 0.00 175.76 178.21 2r92 n TYR 102 N 3.47 0.02 -4.16 0.00 -0.00 -0.95 -4.87 117.16 110.67 2r92 n TYR 102 Ca -0.17 0.01 -0.30 0.00 -0.00 0.00 0.00 57.90 57.44 2r92 n TYR 102 Cb 0.52 -0.37 -0.09 0.00 -0.00 0.00 0.00 39.34 39.41 2r92 n TYR 102 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.86 177.07 2r92 s LYS 103 N -2.37 2.39 -0.66 -3.48 2.20 -1.26 -4.99 119.74 111.57 2r92 s LYS 103 Ca -0.21 -0.92 0.04 0.00 -0.36 0.00 0.00 55.97 54.53 2r92 s LYS 103 Cb 0.03 -2.45 0.31 0.00 -1.51 0.00 0.00 37.83 34.21 2r92 s LYS 103 CO 0.31 0.52 0.99 1.19 -0.36 0.00 0.00 175.35 178.00 2r92 n PHE 104 N 0.57 3.76 -0.63 4.03 3.01 -1.26 -1.73 117.46 125.21 2r92 n PHE 104 Ca -0.12 -3.86 -0.31 0.00 1.01 0.00 0.00 57.45 54.17 2r92 n PHE 104 Cb 0.52 -0.61 0.19 0.00 -0.01 0.00 0.00 39.48 39.58 2r92 n PHE 104 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 2r92 n GLU 105 N 0.17 -1.67 -3.54 -1.08 2.13 -0.87 -4.83 120.64 110.94 2r92 n GLU 105 Ca 0.32 -0.46 -0.27 0.00 0.66 0.00 0.00 57.16 57.41 2r92 n GLU 105 Cb 0.38 -1.90 -0.11 0.00 0.27 0.00 0.00 31.44 30.09 2r92 n GLU 105 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2r92 s GLU 106 N -3.82 1.35 -0.45 5.31 2.02 -1.26 -2.80 118.70 119.03 2r92 s GLU 106 Ca 0.61 -2.45 -0.29 0.00 0.02 0.00 0.00 54.97 52.86 2r92 s GLU 106 Cb -0.18 -1.99 -0.31 0.00 0.10 0.00 0.00 34.13 31.75 2r92 s GLU 106 CO 0.66 -1.36 1.79 0.28 0.02 0.00 0.00 175.26 176.65 2r92 n VAL 107 N 2.62 0.00 -0.44 2.63 0.31 0.10 -4.79 118.33 118.76 2r92 n VAL 107 Ca 0.27 -0.01 0.06 0.00 -0.01 0.00 0.00 64.34 64.64 2r92 n VAL 107 Cb 0.44 -1.95 -0.01 0.00 -0.91 0.00 0.00 33.84 31.41 2r92 n VAL 107 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2r92 n SER 108 N 13.49 -2.57 0.00 4.52 3.41 -1.26 -4.26 113.62 126.95 2r92 n SER 108 Ca 0.43 0.17 0.00 0.00 -0.26 0.00 0.00 58.87 59.22 2r92 n SER 108 Cb 0.44 -1.67 0.00 0.00 -0.26 0.00 0.00 64.21 62.72 2r92 n SER 108 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2r92 n LYS 109 N -1.64 0.00 -2.93 4.33 5.02 -1.26 -1.70 118.16 119.99 2r92 n LYS 109 Ca 0.00 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.03 2r92 n LYS 109 Cb 0.55 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.52 2r92 n LYS 109 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2r92 n ASP 110 N 1.50 4.40 -3.86 4.39 5.75 -1.26 -4.99 116.55 122.48 2r92 n ASP 110 Ca 0.00 -3.67 -0.30 0.00 -0.01 0.00 0.00 54.79 50.81 2r92 n ASP 110 Cb 0.00 -0.56 -0.15 0.00 -1.03 0.00 0.00 41.12 39.38 2r92 n ASP 110 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2r92 s LEU 111 N -3.45 2.84 -0.30 -2.12 1.43 -0.69 -4.66 118.68 111.73 2r92 s LEU 111 Ca 0.49 -1.56 -0.09 0.00 -1.03 0.00 0.00 54.13 51.94 2r92 s LEU 111 Cb 0.29 -1.11 -0.01 0.00 0.03 0.00 0.00 46.19 45.38 2r92 s LEU 111 CO -0.14 -0.35 0.14 -0.63 0.23 0.00 0.00 176.35 175.60 2r92 s ILE 112 N 1.40 4.57 -0.04 -0.59 1.01 -1.20 0.03 121.20 126.38 2r92 s ILE 112 Ca 0.05 -0.35 0.01 0.00 0.00 0.00 0.00 60.65 60.36 2r92 s ILE 112 Cb -0.18 -3.29 -0.03 0.00 0.01 0.00 0.00 42.46 38.97 2r92 s ILE 112 CO -0.14 0.13 -0.05 0.00 0.00 0.00 0.00 174.94 174.88 2r92 s ALA 113 N 1.62 3.09 0.00 9.38 0.00 -1.12 -3.54 121.76 131.18 2r92 s ALA 113 Ca 0.05 -0.92 0.08 0.00 0.00 0.00 0.00 51.96 51.17 2r92 s ALA 113 Cb -0.17 -1.26 -0.02 0.00 0.00 0.00 0.00 23.12 21.67 2r92 s ALA 113 CO 0.06 0.60 -0.24 0.14 0.00 0.00 0.00 175.76 176.32 2r92 s VAL 114 N -0.91 1.90 -0.02 0.00 -7.23 -1.18 -2.06 120.40 110.89 2r92 s VAL 114 Ca 0.15 -1.11 -0.02 0.00 -1.81 0.00 0.00 61.98 59.18 2r92 s VAL 114 Cb -0.11 -1.59 -0.04 0.00 0.56 0.00 0.00 36.38 35.20 2r92 s VAL 114 CO 0.04 0.45 0.14 -0.31 -0.31 0.00 0.00 175.10 175.12 2r92 s TYR 115 N -0.64 3.45 0.03 2.82 1.51 -0.71 -2.41 117.35 121.40 2r92 s TYR 115 Ca 0.09 0.32 0.04 0.00 -1.01 0.00 0.00 57.07 56.51 2r92 s TYR 115 Cb -0.09 -1.81 -0.02 0.00 -0.11 0.00 0.00 41.96 39.93 2r92 s TYR 115 CO 0.00 0.62 -0.11 0.71 -1.11 0.00 0.00 175.55 175.66 2r92 s TYR 116 N -1.24 0.99 -0.07 2.71 1.51 0.94 -2.24 117.35 119.95 2r92 s TYR 116 Ca 0.24 -0.31 -0.01 0.00 -1.01 0.00 0.00 57.07 55.98 2r92 s TYR 116 Cb -0.12 -0.60 0.03 0.00 -0.11 0.00 0.00 41.96 41.15 2r92 s TYR 116 CO 0.15 0.00 -0.03 0.45 -1.11 0.00 0.00 175.55 175.01 2r92 s SER 117 N -0.92 1.56 -0.79 2.29 0.15 0.34 0.53 113.70 116.86 2r92 s SER 117 Ca 0.00 -0.14 -0.09 0.00 0.70 0.00 0.00 55.95 56.42 2r92 s SER 117 Cb -0.07 -0.53 0.20 0.00 -1.71 0.00 0.00 66.02 63.92 2r92 s SER 117 CO 0.01 -0.14 0.69 -0.36 1.20 0.00 0.00 173.24 174.63 2r92 s PHE 118 N 1.65 3.69 -0.94 3.44 0.40 0.45 0.82 117.98 127.49 2r92 s PHE 118 Ca 0.01 -2.40 -0.06 0.00 -0.60 0.00 0.00 56.93 53.88 2r92 s PHE 118 Cb -0.13 -3.56 0.05 0.00 0.51 0.00 0.00 43.02 39.90 2r92 s PHE 118 CO -0.04 -0.91 0.25 0.41 0.70 0.00 0.00 175.22 175.62 2r92 n GLY 119 N 3.54 -0.48 0.00 4.36 0.00 -1.26 -1.58 105.19 109.77 2r92 n GLY 119 Ca 0.13 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2r92 n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r92 n GLY 120 N -0.89 1.79 3.43 -0.02 0.00 -1.26 -5.07 105.19 103.17 2r92 n GLY 120 Ca -0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.55 2r92 n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r92 s LEU 121 N 0.00 5.27 0.95 0.99 1.43 -0.61 -5.06 118.68 121.64 2r92 s LEU 121 Ca 0.00 -1.04 -0.14 0.00 -1.03 0.00 0.00 54.13 51.92 2r92 s LEU 121 Cb 0.00 -2.23 0.17 0.00 0.03 0.00 0.00 46.19 44.16 2r92 s LEU 121 CO 0.00 -0.59 1.19 -0.76 0.23 0.00 0.00 176.35 176.42 2r92 s LEU 122 N 1.82 2.08 -0.28 1.79 1.43 -1.26 -0.41 118.68 123.85 2r92 s LEU 122 Ca 0.07 0.70 -0.25 0.00 -1.03 0.00 0.00 54.13 53.62 2r92 s LEU 122 Cb -0.21 -2.89 0.13 0.00 0.03 0.00 0.00 46.19 43.25 2r92 s LEU 122 CO 0.09 -2.73 1.08 -0.32 0.23 0.00 0.00 176.35 174.70 2r92 s MET 123 N -5.51 0.45 -0.02 1.70 1.75 0.19 -2.34 119.30 115.51 2r92 s MET 123 Ca 0.67 0.54 0.05 0.00 -1.25 0.00 0.00 55.69 55.70 2r92 s MET 123 Cb -0.11 0.22 -0.01 0.00 2.84 0.00 0.00 34.83 37.77 2r92 s MET 123 CO 0.53 -0.05 -0.18 0.50 -0.65 0.00 0.00 175.02 175.17 2r92 s ARG 124 N 0.22 1.52 0.22 4.11 3.52 0.29 -0.04 118.95 128.79 2r92 s ARG 124 Ca 0.04 -0.64 0.05 0.00 -0.13 0.00 0.00 55.73 55.05 2r92 s ARG 124 Cb -0.05 -1.44 -0.05 0.00 -1.56 0.00 0.00 34.95 31.85 2r92 s ARG 124 CO -0.07 0.36 -0.07 -1.17 -0.81 0.00 0.00 175.30 173.54 2r92 s LEU 125 N -0.34 2.41 -0.19 -0.88 2.96 -1.01 -1.09 118.68 120.53 2r92 s LEU 125 Ca 0.05 -1.13 -0.16 0.00 -0.22 0.00 0.00 54.13 52.68 2r92 s LEU 125 Cb -0.08 -0.45 0.05 0.00 0.50 0.00 0.00 46.19 46.21 2r92 s LEU 125 CO -0.00 -0.36 0.50 -0.70 -1.32 0.00 0.00 176.35 174.47 2r92 s GLU 126 N -3.76 0.56 0.00 1.98 2.12 -1.07 -3.12 118.70 115.40 2r92 s GLU 126 Ca 0.25 0.77 0.00 0.00 0.36 0.00 0.00 54.97 56.35 2r92 s GLU 126 Cb 0.03 0.21 0.00 0.00 0.26 0.00 0.00 34.13 34.63 2r92 s GLU 126 CO 0.07 -0.10 0.00 0.41 -0.54 0.00 0.00 175.26 175.10 2r92 n GLY 127 N 3.27 -0.20 0.00 -1.50 0.00 -1.23 -3.35 105.19 102.18 2r92 n GLY 127 Ca -0.16 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.38 2r92 n GLY 127 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2r92 n ASN 128 N 0.00 0.00 -0.06 1.61 2.85 -1.26 -3.23 115.26 115.17 2r92 n ASN 128 Ca 0.00 0.00 0.03 0.00 -0.11 0.00 0.00 54.58 54.50 2r92 n ASN 128 Cb 0.00 0.00 -0.02 0.00 1.24 0.00 0.00 39.78 41.00 2r92 n ASN 128 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2r92 n TYR 129 N 0.00 0.00 -0.99 1.20 0.18 -1.26 -4.62 117.16 111.67 2r92 n TYR 129 Ca 0.00 0.00 -0.16 0.00 1.88 0.00 0.00 57.90 59.62 2r92 n TYR 129 Cb 0.00 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 38.95 2r92 n TYR 129 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2r92 n ARG 130 N -0.75 1.85 -0.35 -3.48 3.00 -1.26 -4.50 116.66 111.17 2r92 n ARG 130 Ca 0.02 -1.47 -0.01 0.00 -0.01 0.00 0.00 57.85 56.38 2r92 n ARG 130 Cb 0.10 -1.69 0.13 0.00 0.00 0.00 0.00 32.46 30.99 2r92 n ARG 130 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.63 176.72 2r92 h ASN 131 N 1.92 1.03 -0.15 0.55 2.35 -1.93 -1.98 115.58 117.38 2r92 h ASN 131 Ca 0.26 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.97 2r92 h ASN 131 Cb 0.94 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 39.06 2r92 h ASN 131 CO 0.63 0.71 -0.06 0.18 -1.65 0.00 0.00 177.43 177.24 2r92 n LEU 132 N -4.48 3.20 0.02 1.61 4.77 -1.26 -4.75 117.00 116.12 2r92 n LEU 132 Ca 0.12 -3.25 -0.01 0.00 -0.03 0.00 0.00 56.01 52.84 2r92 n LEU 132 Cb 0.08 -0.51 -0.00 0.00 -2.33 0.00 0.00 43.42 40.66 2r92 n LEU 132 CO 0.35 0.85 -0.11 0.59 -1.33 0.00 0.00 177.39 177.74 2r92 n ASN 133 N -1.03 1.00 -4.55 -1.43 3.02 -1.00 -4.95 115.26 106.32 2r92 n ASN 133 Ca 0.21 0.14 -0.35 0.00 -0.03 0.00 0.00 54.58 54.55 2r92 n ASN 133 Cb 0.80 -0.35 -0.04 0.00 -0.61 0.00 0.00 39.78 39.58 2r92 n ASN 133 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2r92 s ASN 134 N -5.72 5.40 1.33 6.41 0.01 -0.78 -4.94 114.94 116.65 2r92 s ASN 134 Ca -0.05 -0.23 -0.17 0.00 -0.71 0.00 0.00 52.86 51.70 2r92 s ASN 134 Cb 0.01 -2.55 0.27 0.00 0.41 0.00 0.00 41.25 39.39 2r92 s ASN 134 CO 0.07 -2.40 0.63 0.18 -1.51 0.00 0.00 177.10 174.07 2r92 n LEU 135 N 12.60 0.00 -0.10 0.60 4.77 -1.26 -4.96 117.00 128.64 2r92 n LEU 135 Ca 0.27 -0.64 0.01 0.00 -0.03 0.00 0.00 56.01 55.62 2r92 n LEU 135 Cb 0.50 -0.70 0.02 0.00 -2.33 0.00 0.00 43.42 40.90 2r92 n LEU 135 CO 0.67 -2.41 0.39 0.29 -1.33 0.00 0.00 177.39 175.00 2r92 n LYS 136 N -4.65 0.91 -1.38 3.23 5.02 -1.26 -5.06 118.16 114.97 2r92 n LYS 136 Ca 0.10 -1.06 -0.29 0.00 -2.02 0.00 0.00 58.31 55.04 2r92 n LYS 136 Cb 0.42 -1.05 0.19 0.00 -0.02 0.00 0.00 35.03 34.58 2r92 n LYS 136 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2r92 s GLN 137 N -0.54 0.10 -0.04 1.97 -0.21 -1.26 -4.86 119.66 114.82 2r92 s GLN 137 Ca 0.03 0.08 -0.25 0.00 0.02 0.00 0.00 55.36 55.24 2r92 s GLN 137 Cb 0.02 -1.74 -0.20 0.00 1.00 0.00 0.00 33.01 32.09 2r92 s GLN 137 CO 0.03 -2.86 1.11 1.49 -2.12 0.00 0.00 175.29 172.94 2r92 h GLU 138 N -1.97 -0.06 -6.32 2.91 4.81 -1.91 -3.37 114.58 108.67 2r92 h GLU 138 Ca -0.48 0.00 -0.61 0.00 -0.13 0.00 0.00 59.36 58.14 2r92 h GLU 138 Cb 1.30 0.01 0.15 0.00 0.63 0.00 0.00 28.75 30.84 2r92 h GLU 138 CO 0.48 0.48 -0.40 0.09 -0.73 0.00 0.00 179.01 178.93 2r92 n ASN 139 N -4.85 -0.88 0.00 1.04 3.02 -1.26 -4.16 115.26 108.17 2r92 n ASN 139 Ca -0.09 0.91 0.00 0.00 -0.03 0.00 0.00 54.58 55.38 2r92 n ASN 139 Cb 0.29 -1.11 0.00 0.00 -0.61 0.00 0.00 39.78 38.35 2r92 n ASN 139 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2r92 n ALA 140 N -0.84 0.00 -2.06 5.41 0.00 -1.26 -4.91 120.51 116.85 2r92 n ALA 140 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.17 2r92 n ALA 140 Cb 0.39 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.78 2r92 n ALA 140 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2r92 s TYR 141 N 0.00 3.86 0.22 0.00 1.51 -0.98 -3.68 117.35 118.28 2r92 s TYR 141 Ca 0.00 1.53 0.06 0.00 -1.01 0.00 0.00 57.07 57.65 2r92 s TYR 141 Cb 0.00 -2.69 -0.04 0.00 -0.11 0.00 0.00 41.96 39.12 2r92 s TYR 141 CO 0.00 0.52 0.20 -1.17 -1.11 0.00 0.00 175.55 173.99 2r92 s LEU 142 N -1.22 3.89 0.00 -1.29 2.96 -1.01 -4.07 118.68 117.94 2r92 s LEU 142 Ca 0.35 -0.17 -0.06 0.00 -0.22 0.00 0.00 54.13 54.04 2r92 s LEU 142 Cb -0.22 -2.45 -0.00 0.00 0.50 0.00 0.00 46.19 44.02 2r92 s LEU 142 CO 0.24 -0.01 0.10 -0.76 -1.32 0.00 0.00 176.35 174.60 2r92 s LEU 143 N -3.65 1.69 -0.07 -0.68 1.02 -1.21 -2.47 118.68 113.30 2r92 s LEU 143 Ca 0.33 -0.25 -0.10 0.00 0.02 0.00 0.00 54.13 54.12 2r92 s LEU 143 Cb -0.09 0.55 0.02 0.00 0.02 0.00 0.00 46.19 46.70 2r92 s LEU 143 CO 0.25 -0.35 0.26 -0.63 0.02 0.00 0.00 176.35 175.91 2r92 s ILE 144 N -1.35 0.02 -0.01 -0.59 1.01 -0.06 -2.98 121.20 117.24 2r92 s ILE 144 Ca -0.14 -0.18 -0.09 0.00 0.00 0.00 0.00 60.65 60.24 2r92 s ILE 144 Cb -0.08 -0.44 0.01 0.00 0.01 0.00 0.00 42.46 41.96 2r92 s ILE 144 CO 0.01 -0.10 0.18 0.00 0.00 0.00 0.00 174.94 175.03 2r92 s ARG 145 N -0.34 0.51 0.00 2.79 1.70 -1.24 0.10 118.95 122.47 2r92 s ARG 145 Ca -0.05 -0.31 0.00 0.00 -0.47 0.00 0.00 55.73 54.90 2r92 s ARG 145 Cb -0.03 0.22 0.00 0.00 -0.57 0.00 0.00 34.95 34.56 2r92 s ARG 145 CO 0.01 -0.12 0.00 0.54 -1.08 0.00 0.00 175.30 174.65