#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bv4 n GLN 2 N 0.00 1.69 -4.20 0.00 7.27 -1.26 -5.02 117.38 115.85 2bv4 n GLN 2 Ca 0.00 0.61 -0.15 0.00 0.07 0.00 0.00 57.00 57.52 2bv4 n GLN 2 Cb 0.00 -2.32 -0.11 0.00 2.41 0.00 0.00 30.24 30.22 2bv4 n GLN 2 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 2bv4 s GLN 3 N -2.30 0.93 0.00 3.69 -1.52 -1.26 -4.82 119.66 114.37 2bv4 s GLN 3 Ca 0.64 -1.23 0.00 0.00 -1.95 0.00 0.00 55.36 52.82 2bv4 s GLN 3 Cb -0.50 -0.63 0.00 0.00 -0.22 0.00 0.00 33.01 31.66 2bv4 s GLN 3 CO 0.56 0.10 0.00 0.41 -0.25 0.00 0.00 175.29 176.11 2bv4 n GLY 4 N 0.41 0.54 3.39 3.09 0.00 -1.26 -4.91 105.19 106.46 2bv4 n GLY 4 Ca -0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 2bv4 n GLY 4 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bv4 s VAL 5 N -2.12 3.27 0.02 1.61 1.01 -1.26 -0.58 120.40 122.34 2bv4 s VAL 5 Ca 0.00 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.42 2bv4 s VAL 5 Cb 0.00 -2.40 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 2bv4 s VAL 5 CO 0.00 0.51 -0.07 -0.36 0.00 0.00 0.00 175.10 175.18 2bv4 s PHE 6 N 0.46 0.60 -0.37 5.22 0.08 -0.08 -5.03 117.98 118.87 2bv4 s PHE 6 Ca -0.08 -0.27 -0.15 0.00 0.12 0.00 0.00 56.93 56.56 2bv4 s PHE 6 Cb -0.15 -0.37 -0.00 0.00 -0.57 0.00 0.00 43.02 41.92 2bv4 s PHE 6 CO 0.04 -0.04 0.32 0.99 -0.10 0.00 0.00 175.22 176.43 2bv4 s THR 7 N -0.66 5.22 0.40 0.64 2.01 -1.26 -1.64 115.64 120.35 2bv4 s THR 7 Ca -0.03 -0.27 0.02 0.00 0.31 0.00 0.00 61.69 61.72 2bv4 s THR 7 Cb -0.06 -3.85 -0.01 0.00 0.01 0.00 0.00 72.50 68.60 2bv4 s THR 7 CO 0.00 -0.17 0.59 -0.76 -0.69 0.00 0.00 174.62 173.59 2bv4 s LEU 8 N 1.86 3.82 0.50 4.42 1.02 -0.01 -5.03 118.68 125.25 2bv4 s LEU 8 Ca 0.08 0.20 -0.22 0.00 0.02 0.00 0.00 54.13 54.22 2bv4 s LEU 8 Cb -0.17 -3.08 -0.08 0.00 0.02 0.00 0.00 46.19 42.87 2bv4 s LEU 8 CO 0.11 -0.54 0.93 -2.65 0.02 0.00 0.00 176.35 174.22 2bv4 n PRO 9 N -1.90 1.09 -2.20 1.29 -0.02 -1.26 -4.40 135.00 127.60 2bv4 n PRO 9 Ca -0.01 0.40 -0.39 0.00 -2.02 0.00 0.00 63.50 61.48 2bv4 n PRO 9 Cb 0.57 -2.04 -0.02 0.00 -0.02 0.00 0.00 33.50 32.00 2bv4 n PRO 9 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bv4 s ALA 10 N -1.41 3.31 -1.61 3.55 0.00 -1.26 -3.65 121.76 120.69 2bv4 s ALA 10 Ca 0.68 1.11 -0.01 0.00 0.00 0.00 0.00 51.96 53.74 2bv4 s ALA 10 Cb -0.50 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.20 2bv4 s ALA 10 CO 0.53 -0.59 0.17 0.54 0.00 0.00 0.00 175.76 176.41 2bv4 n ARG 11 N 0.42 -2.47 -4.05 0.00 1.74 0.11 -4.93 116.66 107.48 2bv4 n ARG 11 Ca 0.02 0.92 -0.34 0.00 -0.77 0.00 0.00 57.85 57.69 2bv4 n ARG 11 Cb 0.44 -5.55 -0.07 0.00 -1.02 0.00 0.00 32.46 26.26 2bv4 n ARG 11 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 2bv4 s ILE 12 N -3.02 4.95 0.14 0.55 2.07 -1.24 -4.77 121.20 119.88 2bv4 s ILE 12 Ca 0.08 -0.27 -0.30 0.00 -1.41 0.00 0.00 60.65 58.76 2bv4 s ILE 12 Cb -0.04 -3.25 -0.07 0.00 0.13 0.00 0.00 42.46 39.24 2bv4 s ILE 12 CO 0.11 0.40 0.97 0.20 -1.91 0.00 0.00 174.94 174.70 2bv4 s ASN 13 N -1.63 7.51 0.03 4.50 0.01 -1.26 -0.61 114.94 123.50 2bv4 s ASN 13 Ca 0.22 1.85 -0.01 0.00 -0.71 0.00 0.00 52.86 54.22 2bv4 s ASN 13 Cb -0.12 -2.59 -0.03 0.00 0.41 0.00 0.00 41.25 38.92 2bv4 s ASN 13 CO 0.13 -0.03 -0.02 0.72 -1.51 0.00 0.00 177.10 176.38 2bv4 s PHE 14 N -0.25 0.37 0.04 2.20 -0.12 -0.11 -4.38 117.98 115.73 2bv4 s PHE 14 Ca 0.46 -0.76 -0.05 0.00 -0.05 0.00 0.00 56.93 56.52 2bv4 s PHE 14 Cb -0.24 -0.28 -0.05 0.00 -0.63 0.00 0.00 43.02 41.82 2bv4 s PHE 14 CO 0.31 -0.28 0.28 0.20 -0.05 0.00 0.00 175.22 175.68 2bv4 s GLY 15 N -2.12 2.24 -0.12 1.99 0.00 -0.60 -1.61 107.32 107.09 2bv4 s GLY 15 Ca -0.06 -0.61 0.01 0.00 0.00 0.00 0.00 44.72 44.07 2bv4 s GLY 15 CO -0.05 -0.46 -0.15 0.14 0.00 0.00 0.00 173.10 172.58 2bv4 s VAL 16 N -1.40 1.54 -0.03 1.40 1.01 0.15 -1.31 120.40 121.76 2bv4 s VAL 16 Ca 0.31 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.71 2bv4 s VAL 16 Cb -0.13 -1.42 -0.01 0.00 0.00 0.00 0.00 36.38 34.82 2bv4 s VAL 16 CO 0.19 0.45 -0.22 -0.89 0.00 0.00 0.00 175.10 174.64 2bv4 s THR 17 N 1.18 1.74 -0.05 3.92 2.01 -0.18 -1.06 115.64 123.20 2bv4 s THR 17 Ca -0.02 -0.93 0.04 0.00 0.31 0.00 0.00 61.69 61.09 2bv4 s THR 17 Cb -0.14 -1.46 0.00 0.00 0.01 0.00 0.00 72.50 70.92 2bv4 s THR 17 CO -0.05 0.49 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.53 2bv4 s VAL 18 N -0.39 1.32 0.03 3.82 1.01 -1.15 -0.88 120.40 124.16 2bv4 s VAL 18 Ca 0.05 -0.63 0.07 0.00 0.00 0.00 0.00 61.98 61.47 2bv4 s VAL 18 Cb -0.10 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 2bv4 s VAL 18 CO 0.00 0.39 -0.18 -0.76 0.00 0.00 0.00 175.10 174.55 2bv4 s LEU 19 N 0.25 2.58 0.11 3.92 1.43 -0.20 -0.63 118.68 126.14 2bv4 s LEU 19 Ca -0.08 -0.40 0.11 0.00 -1.03 0.00 0.00 54.13 52.73 2bv4 s LEU 19 Cb -0.13 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.55 2bv4 s LEU 19 CO 0.03 0.27 -0.27 0.68 0.23 0.00 0.00 176.35 177.29 2bv4 s VAL 20 N -0.88 2.26 -0.42 -1.59 -7.23 -0.05 -0.46 120.40 112.03 2bv4 s VAL 20 Ca 0.14 -1.68 0.07 0.00 -1.81 0.00 0.00 61.98 58.71 2bv4 s VAL 20 Cb -0.10 -1.98 0.24 0.00 0.56 0.00 0.00 36.38 35.10 2bv4 s VAL 20 CO 0.04 0.15 0.61 0.59 -0.31 0.00 0.00 175.10 176.18 2bv4 n ASN 21 N 1.08 -0.73 -3.59 4.85 3.02 -0.37 -1.36 115.26 118.16 2bv4 n ASN 21 Ca -0.18 -2.85 -0.16 0.00 -0.03 0.00 0.00 54.58 51.36 2bv4 n ASN 21 Cb 0.53 0.06 -0.07 0.00 -0.61 0.00 0.00 39.78 39.69 2bv4 n ASN 21 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2bv4 s SER 22 N -1.24 -0.52 0.28 6.41 1.04 0.61 -4.09 113.70 116.20 2bv4 s SER 22 Ca 0.34 0.51 0.25 0.00 0.48 0.00 0.00 55.95 57.53 2bv4 s SER 22 Cb 0.18 0.47 0.60 0.00 0.10 0.00 0.00 66.02 67.37 2bv4 s SER 22 CO -0.15 -0.57 1.67 0.00 0.98 0.00 0.00 173.24 175.17 2bv4 h ALA 23 N 3.22 0.96 -2.69 5.32 0.00 -1.96 -2.14 119.26 121.97 2bv4 h ALA 23 Ca -0.28 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.02 2bv4 h ALA 23 Cb 1.16 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.89 2bv4 h ALA 23 CO 0.39 0.00 -0.21 0.00 0.00 0.00 0.00 179.25 179.44 2bv4 s ALA 24 N -3.15 3.70 0.24 0.00 0.00 -1.26 -4.89 121.76 116.41 2bv4 s ALA 24 Ca 0.09 -0.23 -0.30 0.00 0.00 0.00 0.00 51.96 51.52 2bv4 s ALA 24 Cb 0.10 -2.38 -0.10 0.00 0.00 0.00 0.00 23.12 20.73 2bv4 s ALA 24 CO 0.63 0.47 1.50 0.99 0.00 0.00 0.00 175.76 179.35 2bv4 s THR 25 N -1.02 2.51 -0.09 0.00 2.01 -1.26 -4.75 115.64 113.04 2bv4 s THR 25 Ca 0.23 0.42 -0.04 0.00 0.31 0.00 0.00 61.69 62.61 2bv4 s THR 25 Cb -0.16 -3.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.04 2bv4 s THR 25 CO 0.13 0.06 0.10 -1.10 -0.69 0.00 0.00 174.62 173.12 2bv4 s GLN 26 N -0.14 3.27 -0.16 4.92 -1.52 0.13 -4.33 119.66 121.83 2bv4 s GLN 26 Ca 0.62 -0.27 -0.01 0.00 -1.95 0.00 0.00 55.36 53.76 2bv4 s GLN 26 Cb -0.44 -3.03 0.04 0.00 -0.22 0.00 0.00 33.01 29.36 2bv4 s GLN 26 CO 0.42 0.73 -0.05 -1.01 -0.25 0.00 0.00 175.29 175.14 2bv4 s HIS 27 N -1.04 1.59 -0.13 0.91 3.76 0.02 -2.00 115.29 118.40 2bv4 s HIS 27 Ca 0.17 -0.98 -0.01 0.00 -0.15 0.00 0.00 55.06 54.08 2bv4 s HIS 27 Cb -0.12 -1.26 -0.02 0.00 1.11 0.00 0.00 32.58 32.29 2bv4 s HIS 27 CO 0.06 -0.59 -0.10 0.08 -0.85 0.00 0.00 174.74 173.35 2bv4 s VAL 28 N 1.67 3.38 -0.06 -0.90 1.01 -0.05 -0.41 120.40 125.04 2bv4 s VAL 28 Ca 0.01 -0.55 0.04 0.00 0.00 0.00 0.00 61.98 61.49 2bv4 s VAL 28 Cb -0.15 -2.44 -0.00 0.00 0.00 0.00 0.00 36.38 33.79 2bv4 s VAL 28 CO -0.08 0.52 -0.20 -0.70 0.00 0.00 0.00 175.10 174.65 2bv4 s GLU 29 N 0.27 2.16 -0.23 2.72 2.56 0.04 -1.01 118.70 125.22 2bv4 s GLU 29 Ca -0.07 -0.70 -0.07 0.00 0.00 0.00 0.00 54.97 54.13 2bv4 s GLU 29 Cb -0.15 -1.80 -0.03 0.00 2.00 0.00 0.00 34.13 34.15 2bv4 s GLU 29 CO 0.04 0.24 0.06 0.42 -0.56 0.00 0.00 175.26 175.46 2bv4 s ILE 30 N 0.11 4.35 -0.10 -3.70 -1.09 0.09 -1.05 121.20 119.80 2bv4 s ILE 30 Ca -0.07 -0.17 -0.06 0.00 -2.23 0.00 0.00 60.65 58.12 2bv4 s ILE 30 Cb -0.14 -3.01 -0.04 0.00 -1.58 0.00 0.00 42.46 37.70 2bv4 s ILE 30 CO 0.04 0.38 0.12 -0.36 -1.23 0.00 0.00 174.94 173.89 2bv4 s PHE 31 N 1.26 3.53 -0.12 3.97 0.08 0.26 -0.59 117.98 126.36 2bv4 s PHE 31 Ca 0.05 0.46 0.01 0.00 0.12 0.00 0.00 56.93 57.56 2bv4 s PHE 31 Cb -0.15 -1.90 0.02 0.00 -0.57 0.00 0.00 43.02 40.42 2bv4 s PHE 31 CO 0.03 0.69 -0.13 0.08 -0.10 0.00 0.00 175.22 175.79 2bv4 s VAL 32 N -1.04 1.43 -1.54 -0.44 1.01 -0.29 -1.07 120.40 118.47 2bv4 s VAL 32 Ca 0.16 -0.57 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 2bv4 s VAL 32 Cb -0.12 -1.34 0.09 0.00 0.00 0.00 0.00 36.38 35.00 2bv4 s VAL 32 CO 0.05 0.43 0.87 0.47 0.00 0.00 0.00 175.10 176.93 2bv4 n ASP 33 N 4.56 -3.78 -0.78 3.32 8.00 0.17 -1.36 116.55 126.69 2bv4 n ASP 33 Ca -0.17 -0.85 -0.10 0.00 0.71 0.00 0.00 54.79 54.38 2bv4 n ASP 33 Cb 0.50 -3.60 -0.04 0.00 -0.02 0.00 0.00 41.12 37.96 2bv4 n ASP 33 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2bv4 n ASN 34 N -2.83 -4.60 -4.28 -2.24 3.02 -1.26 -5.00 115.26 98.06 2bv4 n ASN 34 Ca -0.01 0.25 -0.31 0.00 -0.03 0.00 0.00 54.58 54.48 2bv4 n ASN 34 Cb 0.55 -3.00 -0.16 0.00 -0.61 0.00 0.00 39.78 36.55 2bv4 n ASN 34 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2bv4 s GLU 35 N -2.70 2.17 0.15 3.52 0.41 -0.46 -5.07 118.70 116.71 2bv4 s GLU 35 Ca 0.00 -0.89 -0.31 0.00 -0.41 0.00 0.00 54.97 53.36 2bv4 s GLU 35 Cb 0.00 -2.01 -0.08 0.00 -1.78 0.00 0.00 34.13 30.26 2bv4 s GLU 35 CO 0.00 0.49 1.38 -1.25 -0.49 0.00 0.00 175.26 175.39 2bv4 s PRO 36 N -0.45 4.33 0.00 0.39 0.04 -1.26 -1.13 135.00 136.91 2bv4 s PRO 36 Ca 0.06 2.09 0.00 0.00 0.04 0.00 0.00 61.00 63.19 2bv4 s PRO 36 Cb -0.11 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.21 2bv4 s PRO 36 CO 0.00 -0.40 0.00 0.54 0.04 0.00 0.00 177.00 177.19 2bv4 n ARG 37 N 3.52 3.11 -3.67 4.56 5.12 0.24 -4.92 116.66 124.62 2bv4 n ARG 37 Ca 0.10 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.89 2bv4 n ARG 37 Cb 0.42 -0.39 -0.08 0.00 -1.16 0.00 0.00 32.46 31.25 2bv4 n ARG 37 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2bv4 s ALA 38 N -0.55 -1.49 0.05 7.54 0.00 -1.12 -4.98 121.76 121.20 2bv4 s ALA 38 Ca 0.00 1.74 0.07 0.00 0.00 0.00 0.00 51.96 53.76 2bv4 s ALA 38 Cb 0.00 -1.01 -0.02 0.00 0.00 0.00 0.00 23.12 22.08 2bv4 s ALA 38 CO 0.00 -0.29 -0.19 0.00 0.00 0.00 0.00 175.76 175.28 2bv4 s ALA 39 N 0.45 1.61 0.01 0.00 0.00 -1.26 -0.74 121.76 121.84 2bv4 s ALA 39 Ca -0.01 -1.01 -0.02 0.00 0.00 0.00 0.00 51.96 50.92 2bv4 s ALA 39 Cb -0.04 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.77 2bv4 s ALA 39 CO -0.01 0.35 0.03 -0.06 0.00 0.00 0.00 175.76 176.07 2bv4 s PHE 40 N -0.83 0.15 0.02 0.00 0.08 -0.18 -5.00 117.98 112.22 2bv4 s PHE 40 Ca 0.06 -0.31 -0.11 0.00 0.12 0.00 0.00 56.93 56.69 2bv4 s PHE 40 Cb -0.09 -0.12 0.01 0.00 -0.57 0.00 0.00 43.02 42.26 2bv4 s PHE 40 CO 0.02 -0.19 0.24 -1.12 -0.10 0.00 0.00 175.22 174.07 2bv4 s SER 41 N -1.19 -0.06 0.00 1.36 0.01 -1.26 -0.87 113.70 111.68 2bv4 s SER 41 Ca -0.13 -0.19 0.00 0.00 1.31 0.00 0.00 55.95 56.94 2bv4 s SER 41 Cb -0.08 0.30 0.00 0.00 0.21 0.00 0.00 66.02 66.45 2bv4 s SER 41 CO -0.00 -0.52 0.00 0.61 0.41 0.00 0.00 173.24 173.74 2bv4 n GLY 42 N 0.92 -0.82 3.32 3.44 0.00 -0.84 -4.99 105.19 106.22 2bv4 n GLY 42 Ca -0.20 -1.14 -0.14 0.00 0.00 0.00 0.00 46.02 44.53 2bv4 n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bv4 s VAL 43 N -2.00 0.03 0.00 1.61 0.11 -1.26 -0.69 120.40 118.20 2bv4 s VAL 43 Ca 0.00 -0.23 0.00 0.00 -2.93 0.00 0.00 61.98 58.82 2bv4 s VAL 43 Cb 0.00 -0.68 0.00 0.00 -1.53 0.00 0.00 36.38 34.17 2bv4 s VAL 43 CO 0.00 -0.12 0.00 0.61 -3.33 0.00 0.00 175.10 172.26 2bv4 n GLY 44 N 1.76 3.79 0.88 6.54 0.00 -0.80 -4.99 105.19 112.36 2bv4 n GLY 44 Ca -0.18 -0.82 0.09 0.00 0.00 0.00 0.00 46.02 45.11 2bv4 n GLY 44 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2bv4 n THR 45 N -1.28 0.50 -1.57 2.61 -2.24 -1.25 -0.28 114.28 110.76 2bv4 n THR 45 Ca 0.00 -0.75 -0.30 0.00 -2.27 0.00 0.00 64.05 60.73 2bv4 n THR 45 Cb 0.00 0.94 0.06 0.00 -2.10 0.00 0.00 70.33 69.23 2bv4 n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bv4 n GLY 46 N 1.07 6.03 3.70 3.38 0.00 -1.26 -4.77 105.19 113.35 2bv4 n GLY 46 Ca 0.15 -2.40 -0.24 0.00 0.00 0.00 0.00 46.02 43.52 2bv4 n GLY 46 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2bv4 n ASP 47 N -0.85 -3.99 -4.72 1.61 2.03 -0.98 -4.87 116.55 104.77 2bv4 n ASP 47 Ca 0.56 -0.70 -0.42 0.00 0.52 0.00 0.00 54.79 54.75 2bv4 n ASP 47 Cb 0.79 -4.44 -0.03 0.00 -0.72 0.00 0.00 41.12 36.72 2bv4 n ASP 47 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 2bv4 s ASN 48 N -3.72 7.04 -0.24 1.67 -0.87 -0.46 -4.63 114.94 113.74 2bv4 s ASN 48 Ca 0.39 2.10 -0.18 0.00 -1.57 0.00 0.00 52.86 53.59 2bv4 s ASN 48 Cb -0.19 -2.58 -0.03 0.00 -0.02 0.00 0.00 41.25 38.43 2bv4 s ASN 48 CO 0.78 -0.48 0.53 0.21 -2.57 0.00 0.00 177.10 175.58 2bv4 s ASN 49 N 0.90 6.49 0.00 -1.22 3.84 -1.26 -0.87 114.94 122.82 2bv4 s ASN 49 Ca 0.59 0.59 0.26 0.00 0.21 0.00 0.00 52.86 54.51 2bv4 s ASN 49 Cb -0.31 -2.29 1.08 0.00 -0.55 0.00 0.00 41.25 39.18 2bv4 s ASN 49 CO 0.31 -0.27 1.75 0.18 -2.79 0.00 0.00 177.10 176.28 2bv4 n LEU 50 N 5.36 1.27 0.00 3.21 4.77 0.20 -5.02 117.00 126.79 2bv4 n LEU 50 Ca -0.04 -0.46 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 2bv4 n LEU 50 Cb 0.50 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2bv4 n LEU 50 CO 0.41 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 2bv4 n GLY 51 N 1.12 -3.48 3.20 -0.72 0.00 -1.26 -4.90 105.19 99.15 2bv4 n GLY 51 Ca 0.19 -1.99 -0.26 0.00 0.00 0.00 0.00 46.02 43.95 2bv4 n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bv4 s THR 52 N -0.77 1.55 0.02 2.61 2.01 -1.26 -2.93 115.64 116.86 2bv4 s THR 52 Ca 0.00 -0.84 0.06 0.00 0.31 0.00 0.00 61.69 61.23 2bv4 s THR 52 Cb 0.00 -1.29 -0.02 0.00 0.01 0.00 0.00 72.50 71.20 2bv4 s THR 52 CO 0.00 0.44 -0.20 -0.54 -0.69 0.00 0.00 174.62 173.63 2bv4 s LYS 53 N -0.45 1.43 -0.19 4.92 1.02 -0.22 -4.95 119.74 121.30 2bv4 s LYS 53 Ca 0.07 -0.81 -0.07 0.00 0.02 0.00 0.00 55.97 55.18 2bv4 s LYS 53 Cb -0.08 -1.46 -0.04 0.00 -0.52 0.00 0.00 37.83 35.73 2bv4 s LYS 53 CO -0.01 0.39 0.05 0.08 -0.92 0.00 0.00 175.35 174.94 2bv4 s VAL 54 N -0.64 4.61 0.24 3.17 1.01 -1.26 -0.68 120.40 126.85 2bv4 s VAL 54 Ca 0.07 -0.10 0.01 0.00 0.00 0.00 0.00 61.98 61.96 2bv4 s VAL 54 Cb -0.08 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 2bv4 s VAL 54 CO 0.01 0.45 0.14 0.27 0.00 0.00 0.00 175.10 175.96 2bv4 s ILE 55 N 0.52 0.17 -0.04 2.22 -4.36 -0.63 -4.96 121.20 114.11 2bv4 s ILE 55 Ca 0.02 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 58.39 2bv4 s ILE 55 Cb -0.13 -2.54 -0.04 0.00 1.25 0.00 0.00 42.46 41.01 2bv4 s ILE 55 CO 0.01 0.00 0.07 0.21 0.24 0.00 0.00 174.94 175.47 2bv4 s ASN 56 N -3.24 5.69 0.00 4.36 3.84 -1.26 -0.93 114.94 123.40 2bv4 s ASN 56 Ca 0.38 0.20 0.30 0.00 0.21 0.00 0.00 52.86 53.96 2bv4 s ASN 56 Cb 0.07 -1.67 1.45 0.00 -0.55 0.00 0.00 41.25 40.54 2bv4 s ASN 56 CO 0.14 0.32 2.01 -1.54 -2.79 0.00 0.00 177.10 175.25 2bv4 n SER 57 N 1.55 0.05 0.00 -4.21 3.41 0.22 -4.93 113.62 109.72 2bv4 n SER 57 Ca -0.16 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.36 2bv4 n SER 57 Cb 0.53 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 2bv4 n SER 57 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bv4 n GLY 58 N 1.32 3.53 0.22 5.00 0.00 -1.26 -0.29 105.19 113.70 2bv4 n GLY 58 Ca 0.13 -0.13 0.16 0.00 0.00 0.00 0.00 46.02 46.18 2bv4 n GLY 58 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2bv4 h SER 59 N 1.20 0.00 0.00 1.61 4.64 -1.94 0.31 113.55 119.37 2bv4 h SER 59 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2bv4 h SER 59 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2bv4 h SER 59 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2bv4 n GLY 60 N -0.16 1.54 3.49 -0.77 0.00 0.60 -4.42 105.19 105.46 2bv4 n GLY 60 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2bv4 n GLY 60 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2bv4 s ASN 61 N -1.93 6.24 -0.11 1.61 2.47 -1.25 -0.83 114.94 121.14 2bv4 s ASN 61 Ca 0.00 -0.97 -0.00 0.00 0.42 0.00 0.00 52.86 52.31 2bv4 s ASN 61 Cb 0.00 -2.47 -0.02 0.00 -1.45 0.00 0.00 41.25 37.30 2bv4 s ASN 61 CO 0.00 -1.53 -0.10 -0.69 -3.72 0.00 0.00 177.10 171.06 2bv4 s VAL 62 N 4.52 3.37 -0.04 -5.21 1.01 -0.65 -0.65 120.40 122.75 2bv4 s VAL 62 Ca 0.29 -0.57 0.02 0.00 0.00 0.00 0.00 61.98 61.72 2bv4 s VAL 62 Cb -0.12 -2.41 0.01 0.00 0.00 0.00 0.00 36.38 33.87 2bv4 s VAL 62 CO 0.08 0.54 -0.09 -0.60 0.00 0.00 0.00 175.10 175.04 2bv4 s ARG 63 N -0.05 1.07 -0.20 2.72 3.52 -0.23 -0.90 118.95 124.88 2bv4 s ARG 63 Ca -0.01 -0.28 -0.11 0.00 -0.13 0.00 0.00 55.73 55.20 2bv4 s ARG 63 Cb -0.14 -0.98 -0.05 0.00 -1.56 0.00 0.00 34.95 32.22 2bv4 s ARG 63 CO 0.03 0.05 0.19 0.08 -0.81 0.00 0.00 175.30 174.84 2bv4 s VAL 64 N 0.45 5.36 -0.07 7.11 1.01 0.25 -0.58 120.40 133.94 2bv4 s VAL 64 Ca -0.07 0.30 0.03 0.00 0.00 0.00 0.00 61.98 62.24 2bv4 s VAL 64 Cb -0.11 -3.53 0.01 0.00 0.00 0.00 0.00 36.38 32.75 2bv4 s VAL 64 CO 0.01 0.40 -0.15 -1.58 0.00 0.00 0.00 175.10 173.78 2bv4 s GLN 65 N 0.57 2.06 -0.10 2.72 0.74 -0.22 -4.80 119.66 120.62 2bv4 s GLN 65 Ca 0.11 -0.54 0.01 0.00 0.05 0.00 0.00 55.36 54.98 2bv4 s GLN 65 Cb -0.12 -1.65 0.02 0.00 1.10 0.00 0.00 33.01 32.36 2bv4 s GLN 65 CO 0.01 0.08 -0.11 0.42 -0.55 0.00 0.00 175.29 175.14 2bv4 s ILE 66 N 0.55 1.17 -0.01 -2.34 1.01 -1.26 -0.78 121.20 119.54 2bv4 s ILE 66 Ca -0.15 -0.43 0.06 0.00 0.00 0.00 0.00 60.65 60.13 2bv4 s ILE 66 Cb -0.16 -1.12 -0.02 0.00 0.01 0.00 0.00 42.46 41.18 2bv4 s ILE 66 CO 0.05 0.38 -0.20 -0.89 0.00 0.00 0.00 174.94 174.28 2bv4 s THR 67 N 1.21 1.62 -0.08 2.92 2.01 0.45 -0.44 115.64 123.33 2bv4 s THR 67 Ca -0.04 -0.89 -0.10 0.00 0.31 0.00 0.00 61.69 60.97 2bv4 s THR 67 Cb -0.14 -1.35 0.02 0.00 0.01 0.00 0.00 72.50 71.05 2bv4 s THR 67 CO -0.03 0.45 0.26 0.00 -0.69 0.00 0.00 174.62 174.60 2bv4 s ALA 68 N -0.49 -0.65 -1.27 7.40 0.00 -0.60 -0.80 121.76 125.35 2bv4 s ALA 68 Ca 0.08 0.60 -0.01 0.00 0.00 0.00 0.00 51.96 52.63 2bv4 s ALA 68 Cb -0.08 -0.31 0.00 0.00 0.00 0.00 0.00 23.12 22.74 2bv4 s ALA 68 CO -0.01 -0.16 0.05 0.09 0.00 0.00 0.00 175.76 175.73 2bv4 n ASN 69 N 2.53 -4.48 0.00 0.00 3.02 -1.26 -1.32 115.26 113.75 2bv4 n ASN 69 Ca -0.15 0.10 0.00 0.00 -0.03 0.00 0.00 54.58 54.50 2bv4 n ASN 69 Cb 0.58 -3.77 0.00 0.00 -0.61 0.00 0.00 39.78 35.97 2bv4 n ASN 69 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bv4 n GLY 70 N -0.90 1.02 3.35 7.41 0.00 -1.26 -5.01 105.19 109.80 2bv4 n GLY 70 Ca -0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 2bv4 n GLY 70 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2bv4 s ARG 71 N -0.04 2.41 0.07 1.61 3.52 -0.43 -5.09 118.95 120.99 2bv4 s ARG 71 Ca 0.00 -0.85 -0.31 0.00 -0.13 0.00 0.00 55.73 54.45 2bv4 s ARG 71 Cb 0.00 -2.20 -0.08 0.00 -1.56 0.00 0.00 34.95 31.11 2bv4 s ARG 71 CO 0.00 0.51 1.56 -0.65 -0.81 0.00 0.00 175.30 175.91 2bv4 s GLN 72 N -0.47 4.23 0.73 5.12 -0.21 -1.26 -1.56 119.66 126.24 2bv4 s GLN 72 Ca 0.06 2.23 -0.13 0.00 0.02 0.00 0.00 55.36 57.53 2bv4 s GLN 72 Cb -0.11 -3.49 0.04 0.00 1.00 0.00 0.00 33.01 30.44 2bv4 s GLN 72 CO 0.01 -0.65 1.13 -1.12 -2.12 0.00 0.00 175.29 172.54 2bv4 s SER 73 N 1.98 4.51 0.01 5.90 0.01 0.41 -4.96 113.70 121.57 2bv4 s SER 73 Ca 0.70 2.06 -0.30 0.00 1.31 0.00 0.00 55.95 59.72 2bv4 s SER 73 Cb -0.38 -2.56 -0.05 0.00 0.21 0.00 0.00 66.02 63.25 2bv4 s SER 73 CO 0.31 -2.04 1.20 -0.62 0.41 0.00 0.00 173.24 172.50 2bv4 s ASP 74 N -2.64 7.08 0.04 2.44 2.15 -0.66 -4.83 116.67 120.24 2bv4 s ASP 74 Ca 0.67 1.92 0.02 0.00 0.43 0.00 0.00 52.55 55.60 2bv4 s ASP 74 Cb -0.22 -2.57 -0.04 0.00 -0.30 0.00 0.00 42.92 39.79 2bv4 s ASP 74 CO 0.47 -0.51 0.04 -0.76 -0.17 0.00 0.00 175.17 174.25 2bv4 s LEU 75 N 1.54 3.68 0.03 -1.34 1.43 -1.26 -1.20 118.68 121.56 2bv4 s LEU 75 Ca 0.57 0.00 0.04 0.00 -1.03 0.00 0.00 54.13 53.71 2bv4 s LEU 75 Cb -0.27 -2.24 -0.02 0.00 0.03 0.00 0.00 46.19 43.69 2bv4 s LEU 75 CO 0.26 0.23 -0.11 0.68 0.23 0.00 0.00 176.35 177.65 2bv4 s VAL 76 N -1.23 0.83 0.13 -1.59 -7.23 -0.59 -4.81 120.40 105.90 2bv4 s VAL 76 Ca 0.24 -0.85 -0.16 0.00 -1.81 0.00 0.00 61.98 59.40 2bv4 s VAL 76 Cb -0.12 -0.77 0.04 0.00 0.56 0.00 0.00 36.38 36.09 2bv4 s VAL 76 CO 0.16 -0.06 0.41 -0.94 -0.31 0.00 0.00 175.10 174.36 2bv4 s SER 77 N -1.02 -0.25 0.19 4.85 1.04 -1.26 -0.56 113.70 116.69 2bv4 s SER 77 Ca -0.01 -0.30 -0.21 0.00 0.48 0.00 0.00 55.95 55.91 2bv4 s SER 77 Cb -0.07 0.48 0.05 0.00 0.10 0.00 0.00 66.02 66.58 2bv4 s SER 77 CO 0.01 -0.86 0.59 -0.44 0.98 0.00 0.00 173.24 173.51 2bv4 s SER 78 N -2.80 -0.40 -0.05 7.02 0.01 -0.74 -4.93 113.70 111.81 2bv4 s SER 78 Ca 0.03 -0.28 0.06 0.00 1.31 0.00 0.00 55.95 57.07 2bv4 s SER 78 Cb 0.02 0.61 -0.02 0.00 0.21 0.00 0.00 66.02 66.84 2bv4 s SER 78 CO -0.12 -1.06 -0.22 -1.58 0.41 0.00 0.00 173.24 170.67 2bv4 s GLN 79 N -3.82 2.46 0.01 12.44 0.74 -1.26 -0.92 119.66 129.30 2bv4 s GLN 79 Ca 0.05 -0.85 0.08 0.00 0.05 0.00 0.00 55.36 54.70 2bv4 s GLN 79 Cb -0.02 -2.21 -0.02 0.00 1.10 0.00 0.00 33.01 31.86 2bv4 s GLN 79 CO -0.06 0.48 -0.26 -0.51 -0.55 0.00 0.00 175.29 174.39 2bv4 s LEU 80 N -0.40 2.13 -0.11 3.68 1.43 0.42 -5.01 118.68 120.81 2bv4 s LEU 80 Ca 0.04 -0.52 0.02 0.00 -1.03 0.00 0.00 54.13 52.64 2bv4 s LEU 80 Cb -0.12 -1.32 0.01 0.00 0.03 0.00 0.00 46.19 44.79 2bv4 s LEU 80 CO 0.02 0.29 -0.16 -0.69 0.23 0.00 0.00 176.35 176.04 2bv4 s VAL 81 N -0.71 1.58 -0.06 -1.59 1.01 -1.26 -1.16 120.40 118.20 2bv4 s VAL 81 Ca 0.11 -0.69 0.02 0.00 0.00 0.00 0.00 61.98 61.42 2bv4 s VAL 81 Cb -0.10 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 2bv4 s VAL 81 CO 0.01 0.46 -0.09 -0.76 0.00 0.00 0.00 175.10 174.71 2bv4 s LEU 82 N 0.98 3.02 -1.41 3.92 1.02 0.07 -4.59 118.68 121.70 2bv4 s LEU 82 Ca -0.06 -0.08 0.00 0.00 0.02 0.00 0.00 54.13 54.00 2bv4 s LEU 82 Cb -0.15 -1.64 0.00 0.00 0.02 0.00 0.00 46.19 44.42 2bv4 s LEU 82 CO -0.02 0.35 0.00 0.00 0.02 0.00 0.00 176.35 176.71 2bv4 n ALA 83 N 2.27 -0.59 -2.37 4.21 0.00 -1.26 -1.08 120.51 121.68 2bv4 n ALA 83 Ca -0.18 0.16 -0.17 0.00 0.00 0.00 0.00 53.44 53.26 2bv4 n ALA 83 Cb 0.53 -1.71 -0.01 0.00 0.00 0.00 0.00 19.45 18.25 2bv4 n ALA 83 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2bv4 n ASN 84 N -1.58 -4.89 0.12 0.00 5.15 -1.26 -4.67 115.26 108.12 2bv4 n ASN 84 Ca -0.18 0.11 0.00 0.00 -0.60 0.00 0.00 54.58 53.91 2bv4 n ASN 84 Cb 0.60 -4.12 0.00 0.00 -0.53 0.00 0.00 39.78 35.73 2bv4 n ASN 84 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2bv4 n LYS 85 N -2.87 0.00 -2.87 1.20 4.76 -0.47 -5.08 118.16 112.83 2bv4 n LYS 85 Ca -0.20 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 54.82 2bv4 n LYS 85 Cb 0.64 0.00 -0.04 0.00 -1.84 0.00 0.00 35.03 33.79 2bv4 n LYS 85 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2bv4 s LEU 86 N -6.27 4.08 -0.15 -0.35 2.96 -0.24 -4.42 118.68 114.29 2bv4 s LEU 86 Ca 0.00 1.02 -0.05 0.00 -0.22 0.00 0.00 54.13 54.89 2bv4 s LEU 86 Cb 0.00 -3.22 -0.03 0.00 0.50 0.00 0.00 46.19 43.44 2bv4 s LEU 86 CO 0.00 -0.55 0.00 0.20 -1.32 0.00 0.00 176.35 174.68 2bv4 s ASN 87 N 1.37 5.16 -0.08 3.68 0.01 -0.26 -0.75 114.94 124.08 2bv4 s ASN 87 Ca 0.36 -0.00 0.03 0.00 -0.71 0.00 0.00 52.86 52.54 2bv4 s ASN 87 Cb -0.15 -1.78 0.01 0.00 0.41 0.00 0.00 41.25 39.74 2bv4 s ASN 87 CO 0.08 0.22 -0.18 -0.76 -1.51 0.00 0.00 177.10 174.94 2bv4 s LEU 88 N 0.10 1.87 -0.19 0.60 1.02 -0.31 -2.16 118.68 119.61 2bv4 s LEU 88 Ca 0.02 -0.43 -0.01 0.00 0.02 0.00 0.00 54.13 53.72 2bv4 s LEU 88 Cb -0.13 -1.13 -0.00 0.00 0.02 0.00 0.00 46.19 44.95 2bv4 s LEU 88 CO 0.02 0.10 -0.11 0.00 0.02 0.00 0.00 176.35 176.38 2bv4 s ALA 89 N 0.50 2.62 -0.02 4.21 0.00 -0.07 -0.44 121.76 128.57 2bv4 s ALA 89 Ca -0.17 -1.11 0.07 0.00 0.00 0.00 0.00 51.96 50.75 2bv4 s ALA 89 Cb -0.17 -1.43 -0.02 0.00 0.00 0.00 0.00 23.12 21.51 2bv4 s ALA 89 CO 0.06 -0.23 -0.23 0.14 0.00 0.00 0.00 175.76 175.51 2bv4 s VAL 90 N 1.13 1.78 -0.10 0.00 -7.23 -0.10 -0.33 120.40 115.56 2bv4 s VAL 90 Ca 0.01 -0.96 0.01 0.00 -1.81 0.00 0.00 61.98 59.23 2bv4 s VAL 90 Cb -0.14 -1.49 0.02 0.00 0.56 0.00 0.00 36.38 35.33 2bv4 s VAL 90 CO -0.03 0.50 -0.12 -0.69 -0.31 0.00 0.00 175.10 174.45 2bv4 s VAL 91 N -0.48 1.27 0.30 1.32 1.01 0.17 -1.78 120.40 122.21 2bv4 s VAL 91 Ca 0.07 -0.50 0.07 0.00 0.00 0.00 0.00 61.98 61.62 2bv4 s VAL 91 Cb -0.09 -1.19 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 2bv4 s VAL 91 CO -0.00 0.40 0.34 -0.83 0.00 0.00 0.00 175.10 175.01 2bv4 s GLY 92 N 1.12 1.55 -0.01 4.51 0.00 0.27 -0.85 107.32 113.91 2bv4 s GLY 92 Ca -0.05 -1.47 -0.22 0.00 0.00 0.00 0.00 44.72 42.98 2bv4 s GLY 92 CO -0.02 -1.43 0.47 -1.35 0.00 0.00 0.00 173.10 170.77 2bv4 s SER 93 N -4.02 -0.39 -0.12 1.64 1.04 -0.95 -1.55 113.70 109.34 2bv4 s SER 93 Ca 0.39 0.29 0.00 0.00 0.48 0.00 0.00 55.95 57.12 2bv4 s SER 93 Cb -0.08 0.43 0.02 0.00 0.10 0.00 0.00 66.02 66.49 2bv4 s SER 93 CO 0.28 -0.57 -0.11 -0.70 0.98 0.00 0.00 173.24 173.12 2bv4 s GLU 94 N -1.60 1.91 0.00 4.02 2.56 -0.34 -1.83 118.70 123.42 2bv4 s GLU 94 Ca -0.10 -0.42 0.21 0.00 0.00 0.00 0.00 54.97 54.66 2bv4 s GLU 94 Cb -0.02 -1.81 0.21 0.00 2.00 0.00 0.00 34.13 34.51 2bv4 s GLU 94 CO 0.04 -0.21 1.21 -0.40 -0.56 0.00 0.00 175.26 175.34 2bv4 n ASP 95 N 4.71 2.88 0.00 -1.70 5.68 -1.26 -1.65 116.55 125.21 2bv4 n ASP 95 Ca -0.16 -1.91 0.00 0.00 -0.50 0.00 0.00 54.79 52.23 2bv4 n ASP 95 Cb 0.50 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.44 2bv4 n ASP 95 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2bv4 n GLY 96 N 1.23 4.48 0.01 6.12 0.00 -1.26 -5.00 105.19 110.77 2bv4 n GLY 96 Ca 0.13 -0.43 0.02 0.00 0.00 0.00 0.00 46.02 45.74 2bv4 n GLY 96 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2bv4 n THR 97 N 0.00 0.00 1.30 2.61 -2.24 -1.26 -4.69 114.28 110.00 2bv4 n THR 97 Ca 0.00 -0.40 0.13 0.00 -2.27 0.00 0.00 64.05 61.51 2bv4 n THR 97 Cb 0.00 1.01 0.38 0.00 -2.10 0.00 0.00 70.33 69.61 2bv4 n THR 97 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2bv4 n ASP 98 N -1.02 1.54 -3.09 3.42 5.75 -1.26 -4.96 116.55 116.93 2bv4 n ASP 98 Ca 0.01 -1.33 -0.22 0.00 -0.01 0.00 0.00 54.79 53.24 2bv4 n ASP 98 Cb 0.08 0.09 0.02 0.00 -1.03 0.00 0.00 41.12 40.28 2bv4 n ASP 98 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 2bv4 n MET 99 N -0.01 -4.15 0.15 0.11 2.81 -1.26 -4.88 117.12 109.88 2bv4 n MET 99 Ca 0.15 0.75 0.12 0.00 -1.81 0.00 0.00 57.70 56.90 2bv4 n MET 99 Cb 0.39 -5.54 0.07 0.00 -0.71 0.00 0.00 33.22 27.44 2bv4 n MET 99 CO 0.00 0.00 0.00 0.38 1.51 0.00 0.00 175.97 177.86 2bv4 h ASP 100 N -1.13 0.00 -2.68 7.83 2.03 -1.93 -3.48 116.42 117.06 2bv4 h ASP 100 Ca -0.48 -0.01 -0.35 0.00 -0.73 0.00 0.00 57.03 55.46 2bv4 h ASP 100 Cb 1.33 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 39.78 2bv4 h ASP 100 CO 0.55 0.00 -0.41 -1.22 -1.03 0.00 0.00 179.24 177.13 2bv4 n TYR 101 N -2.81 -0.86 -0.02 4.15 4.02 -1.25 -4.82 117.16 115.56 2bv4 n TYR 101 Ca 0.02 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 57.91 2bv4 n TYR 101 Cb 0.54 -3.37 0.02 0.00 -0.02 0.00 0.00 39.34 36.51 2bv4 n TYR 101 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 2bv4 n ASN 102 N -1.65 2.11 -0.13 7.72 0.23 -1.13 -2.25 115.26 120.16 2bv4 n ASN 102 Ca -0.20 -1.99 -0.10 0.00 -0.53 0.00 0.00 54.58 51.76 2bv4 n ASN 102 Cb 0.63 -0.03 -0.01 0.00 -2.08 0.00 0.00 39.78 38.29 2bv4 n ASN 102 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2bv4 h ASP 103 N 0.27 0.64 -4.21 0.53 3.32 -1.51 -3.03 116.42 112.43 2bv4 h ASP 103 Ca 0.00 -0.28 -0.58 0.00 0.02 0.00 0.00 57.03 56.19 2bv4 h ASP 103 Cb 0.52 -0.17 -0.30 0.00 0.22 0.00 0.00 39.33 39.60 2bv4 h ASP 103 CO 0.00 0.76 -0.84 -0.44 -1.72 0.00 0.00 179.24 177.00 2bv4 s SER 104 N -6.11 2.25 -0.17 6.45 0.01 -1.26 -1.24 113.70 113.63 2bv4 s SER 104 Ca -0.13 -0.35 0.00 0.00 1.31 0.00 0.00 55.95 56.78 2bv4 s SER 104 Cb 0.10 -0.39 0.01 0.00 0.21 0.00 0.00 66.02 65.95 2bv4 s SER 104 CO 0.78 0.21 -0.17 -0.63 0.41 0.00 0.00 173.24 173.84 2bv4 s ILE 105 N -0.28 2.44 -0.14 1.44 1.01 0.39 -2.61 121.20 123.45 2bv4 s ILE 105 Ca 0.03 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 59.85 2bv4 s ILE 105 Cb -0.09 -2.03 -0.01 0.00 0.01 0.00 0.00 42.46 40.34 2bv4 s ILE 105 CO 0.00 0.52 -0.15 -0.69 0.00 0.00 0.00 174.94 174.62 2bv4 s VAL 106 N 1.03 2.75 -0.14 2.92 1.01 -0.03 -1.03 120.40 126.91 2bv4 s VAL 106 Ca -0.01 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.23 2bv4 s VAL 106 Cb -0.15 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.09 2bv4 s VAL 106 CO -0.05 0.52 -0.21 -0.63 0.00 0.00 0.00 175.10 174.74 2bv4 s ILE 107 N 0.63 2.19 -0.10 2.22 1.01 -0.06 -0.66 121.20 126.44 2bv4 s ILE 107 Ca -0.08 -0.94 -0.03 0.00 0.00 0.00 0.00 60.65 59.60 2bv4 s ILE 107 Cb -0.16 -1.89 -0.03 0.00 0.01 0.00 0.00 42.46 40.39 2bv4 s ILE 107 CO 0.03 0.54 0.02 -0.76 0.00 0.00 0.00 174.94 174.77 2bv4 s LEU 108 N 0.81 3.66 0.01 2.97 1.02 0.55 -1.01 118.68 126.69 2bv4 s LEU 108 Ca -0.07 0.15 -0.01 0.00 0.02 0.00 0.00 54.13 54.23 2bv4 s LEU 108 Cb -0.15 -1.86 -0.01 0.00 0.02 0.00 0.00 46.19 44.19 2bv4 s LEU 108 CO -0.01 0.35 -0.00 0.54 0.02 0.00 0.00 176.35 177.24 2bv4 s ASN 109 N -0.69 0.14 0.18 2.29 2.20 -0.42 -0.89 114.94 117.74 2bv4 s ASN 109 Ca 0.11 -0.30 -0.23 0.00 -0.94 0.00 0.00 52.86 51.50 2bv4 s ASN 109 Cb -0.12 0.09 0.06 0.00 -2.00 0.00 0.00 41.25 39.28 2bv4 s ASN 109 CO 0.02 -0.21 0.66 -1.66 -2.94 0.00 0.00 177.10 172.98 2bv4 s TRP 110 N -0.96 -0.42 0.69 1.54 -2.14 -0.92 -1.55 118.94 115.18 2bv4 s TRP 110 Ca -0.10 0.15 -0.11 0.00 2.66 0.00 0.00 56.10 58.69 2bv4 s TRP 110 Cb -0.06 0.60 0.01 0.00 -3.10 0.00 0.00 33.47 30.91 2bv4 s TRP 110 CO -0.00 -0.93 1.06 -1.25 -2.66 0.00 0.00 176.95 173.17 2bv4 s PRO 111 N -3.73 2.92 0.41 3.25 0.04 -1.26 -1.10 135.00 135.53 2bv4 s PRO 111 Ca 0.04 1.01 -0.01 0.00 0.04 0.00 0.00 61.00 62.08 2bv4 s PRO 111 Cb -0.02 -1.99 0.08 0.00 0.04 0.00 0.00 34.50 32.61 2bv4 s PRO 111 CO -0.07 -1.11 0.56 1.28 0.04 0.00 0.00 177.00 177.69 2bv4 n LEU 112 N -3.03 0.00 0.00 -3.56 4.77 -1.26 -4.97 117.00 108.94 2bv4 n LEU 112 Ca 0.08 -1.12 0.00 0.00 -0.03 0.00 0.00 56.01 54.94 2bv4 n LEU 112 Cb 0.53 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 2bv4 n LEU 112 CO 0.54 -0.79 0.00 0.61 -1.33 0.00 0.00 177.39 176.43