#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bm5 s GLN 2 N 0.00 2.63 -0.07 2.12 -0.21 -1.26 -5.03 119.66 117.84 2bm5 s GLN 2 Ca 0.00 -0.96 0.01 0.00 0.02 0.00 0.00 55.36 54.42 2bm5 s GLN 2 Cb 0.00 -2.51 0.02 0.00 1.00 0.00 0.00 33.01 31.52 2bm5 s GLN 2 CO 0.00 0.48 -0.07 -0.65 -2.12 0.00 0.00 175.29 172.93 2bm5 s GLN 3 N -2.89 1.27 -0.31 2.91 -0.21 -1.26 -0.99 119.66 118.18 2bm5 s GLN 3 Ca 0.29 -0.22 0.03 0.00 0.02 0.00 0.00 55.36 55.48 2bm5 s GLN 3 Cb -0.10 -1.24 0.09 0.00 1.00 0.00 0.00 33.01 32.75 2bm5 s GLN 3 CO 0.20 -0.12 -0.01 -1.58 -2.12 0.00 0.00 175.29 171.66 2bm5 s TRP 4 N 1.18 3.49 -0.12 0.91 0.51 0.41 -4.97 118.94 120.35 2bm5 s TRP 4 Ca -0.06 -2.70 0.02 0.00 -2.12 0.00 0.00 56.10 51.24 2bm5 s TRP 4 Cb -0.14 -2.51 -0.01 0.00 -0.81 0.00 0.00 33.47 30.01 2bm5 s TRP 4 CO -0.02 -0.92 -0.19 0.08 -0.51 0.00 0.00 176.95 175.40 2bm5 s VAL 5 N 1.01 2.50 -1.50 4.03 1.01 -1.26 -1.06 120.40 125.13 2bm5 s VAL 5 Ca 0.04 -0.86 -0.06 0.00 0.00 0.00 0.00 61.98 61.10 2bm5 s VAL 5 Cb -0.19 -2.01 0.01 0.00 0.00 0.00 0.00 36.38 34.19 2bm5 s VAL 5 CO -0.07 0.54 0.77 0.47 0.00 0.00 0.00 175.10 176.81 2bm5 n ASP 6 N 3.60 -6.08 -4.85 3.32 8.00 -0.46 -4.97 116.55 115.11 2bm5 n ASP 6 Ca -0.19 -0.38 -0.30 0.00 0.71 0.00 0.00 54.79 54.63 2bm5 n ASP 6 Cb 0.53 -4.87 -0.05 0.00 -0.02 0.00 0.00 41.12 36.70 2bm5 n ASP 6 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2bm5 s GLU 8 N -2.52 2.10 -0.11 0.00 2.12 -1.26 -1.03 118.70 118.00 2bm5 s GLU 8 Ca 0.32 -0.55 0.00 0.00 0.36 0.00 0.00 54.97 55.11 2bm5 s GLU 8 Cb -0.12 -1.68 0.02 0.00 0.26 0.00 0.00 34.13 32.61 2bm5 s GLU 8 CO 0.25 0.06 -0.10 -0.06 -0.54 0.00 0.00 175.26 174.87 2bm5 s PHE 9 N 0.61 1.58 -0.06 5.30 0.08 -0.19 -4.99 117.98 120.32 2bm5 s PHE 9 Ca -0.15 -0.77 0.05 0.00 0.12 0.00 0.00 56.93 56.18 2bm5 s PHE 9 Cb -0.16 -1.26 -0.00 0.00 -0.57 0.00 0.00 43.02 41.03 2bm5 s PHE 9 CO 0.05 -0.49 -0.21 0.99 -0.10 0.00 0.00 175.22 175.46 2bm5 s THR 10 N 1.46 1.76 -1.78 0.64 2.01 -1.26 -1.08 115.64 117.40 2bm5 s THR 10 Ca 0.01 -0.89 0.00 0.00 0.31 0.00 0.00 61.69 61.12 2bm5 s THR 10 Cb -0.13 -1.51 0.00 0.00 0.01 0.00 0.00 72.50 70.87 2bm5 s THR 10 CO -0.06 0.50 0.00 0.61 -0.69 0.00 0.00 174.62 174.97 2bm5 n GLY 11 N 3.19 0.90 3.74 4.40 0.00 0.42 -4.95 105.19 112.89 2bm5 n GLY 11 Ca -0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.43 2bm5 n GLY 11 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bm5 s ARG 12 N -4.09 4.66 -0.65 1.61 1.81 -1.26 -4.87 118.95 116.17 2bm5 s ARG 12 Ca 0.00 1.32 -0.22 0.00 -1.72 0.00 0.00 55.73 55.11 2bm5 s ARG 12 Cb 0.00 -3.33 0.07 0.00 -0.45 0.00 0.00 34.95 31.24 2bm5 s ARG 12 CO 0.00 0.35 0.94 0.34 -0.68 0.00 0.00 175.30 176.25 2bm5 s ASP 13 N -0.44 6.18 0.00 0.23 -1.08 -1.26 -0.85 116.67 119.45 2bm5 s ASP 13 Ca 0.42 -0.98 0.18 0.00 -0.52 0.00 0.00 52.55 51.66 2bm5 s ASP 13 Cb -0.23 -2.41 0.44 0.00 -1.46 0.00 0.00 42.92 39.26 2bm5 s ASP 13 CO 0.28 -1.40 1.36 0.49 0.52 0.00 0.00 175.17 176.42 2bm5 n PHE 14 N 7.58 0.62 -1.55 -5.34 3.72 -0.07 -4.96 117.46 117.46 2bm5 n PHE 14 Ca -0.04 -0.39 -0.52 0.00 -0.05 0.00 0.00 57.45 56.45 2bm5 n PHE 14 Cb 0.45 -0.01 -0.06 0.00 -0.94 0.00 0.00 39.48 38.93 2bm5 n PHE 14 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2bm5 n ARG 15 N 1.19 0.79 -0.81 -1.08 1.74 -1.03 -1.82 116.66 115.65 2bm5 n ARG 15 Ca 0.18 0.28 0.00 0.00 -0.77 0.00 0.00 57.85 57.54 2bm5 n ARG 15 Cb 0.53 -1.79 0.00 0.00 -1.02 0.00 0.00 32.46 30.18 2bm5 n ARG 15 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2bm5 n ASP 16 N 2.05 -0.79 -4.79 0.55 8.00 -0.06 -4.92 116.55 116.59 2bm5 n ASP 16 Ca 0.17 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.35 2bm5 n ASP 16 Cb 0.19 -1.29 0.03 0.00 -0.02 0.00 0.00 41.12 40.03 2bm5 n ASP 16 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2bm5 s GLU 17 N -0.55 3.09 -0.51 -1.24 2.02 -0.75 -4.78 118.70 115.98 2bm5 s GLU 17 Ca 0.00 1.22 -0.20 0.00 0.02 0.00 0.00 54.97 56.01 2bm5 s GLU 17 Cb 0.00 -2.00 0.05 0.00 0.10 0.00 0.00 34.13 32.28 2bm5 s GLU 17 CO 0.00 -0.99 0.68 0.34 0.02 0.00 0.00 175.26 175.30 2bm5 s ASP 18 N -2.88 6.25 -0.24 -0.19 -1.08 -1.26 -1.33 116.67 115.95 2bm5 s ASP 18 Ca 0.64 -0.77 0.11 0.00 -0.52 0.00 0.00 52.55 52.01 2bm5 s ASP 18 Cb -0.17 -2.32 0.45 0.00 -1.46 0.00 0.00 42.92 39.43 2bm5 s ASP 18 CO 0.41 -0.94 1.33 0.18 0.52 0.00 0.00 175.17 176.68 2bm5 n LEU 19 N 6.39 3.36 -4.77 -1.34 4.77 0.14 -4.95 117.00 120.60 2bm5 n LEU 19 Ca -0.05 -3.75 -0.41 0.00 -0.03 0.00 0.00 56.01 51.77 2bm5 n LEU 19 Cb 0.46 -0.57 -0.01 0.00 -2.33 0.00 0.00 43.42 40.97 2bm5 n LEU 19 CO 0.55 1.26 1.15 -0.94 -1.33 0.00 0.00 177.39 178.09 2bm5 s SER 20 N -2.84 6.40 -0.22 -1.43 1.04 -0.88 -1.66 113.70 114.10 2bm5 s SER 20 Ca 0.41 2.98 0.00 0.00 0.48 0.00 0.00 55.95 59.82 2bm5 s SER 20 Cb 0.38 -2.66 0.00 0.00 0.10 0.00 0.00 66.02 63.84 2bm5 s SER 20 CO -0.03 -0.85 0.00 0.54 0.98 0.00 0.00 173.24 173.88 2bm5 n ARG 21 N 1.03 -1.39 -1.72 4.02 1.74 -0.30 -4.81 116.66 115.24 2bm5 n ARG 21 Ca 0.03 0.45 -0.43 0.00 -0.77 0.00 0.00 57.85 57.14 2bm5 n ARG 21 Cb 0.39 -4.55 -0.01 0.00 -1.02 0.00 0.00 32.46 27.27 2bm5 n ARG 21 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2bm5 n LEU 22 N -0.24 3.86 -4.40 0.55 7.94 -0.66 -4.49 117.00 119.57 2bm5 n LEU 22 Ca -0.02 1.18 -0.33 0.00 -1.11 0.00 0.00 56.01 55.73 2bm5 n LEU 22 Cb 0.38 -1.52 -0.14 0.00 0.53 0.00 0.00 43.42 42.67 2bm5 n LEU 22 CO 0.03 -0.22 -0.47 -1.00 -1.11 0.00 0.00 177.39 174.63 2bm5 s HIS 23 N -0.59 2.72 0.08 1.96 3.76 -0.17 -0.73 115.29 122.33 2bm5 s HIS 23 Ca 0.60 -0.48 0.05 0.00 -0.15 0.00 0.00 55.06 55.08 2bm5 s HIS 23 Cb -0.55 -1.73 -0.03 0.00 1.11 0.00 0.00 32.58 31.37 2bm5 s HIS 23 CO 0.56 -0.07 -0.13 0.95 -0.85 0.00 0.00 174.74 175.21 2bm5 s THR 24 N -0.12 1.04 -0.18 1.30 -4.23 -0.33 -0.44 115.64 112.68 2bm5 s THR 24 Ca -0.02 -1.39 -0.08 0.00 -1.18 0.00 0.00 61.69 59.01 2bm5 s THR 24 Cb -0.14 -1.13 0.07 0.00 1.34 0.00 0.00 72.50 72.64 2bm5 s THR 24 CO 0.04 -0.33 0.40 -0.70 -0.54 0.00 0.00 174.62 173.49 2bm5 s GLU 25 N -2.04 0.35 -1.22 3.99 2.12 -0.22 -1.73 118.70 119.95 2bm5 s GLU 25 Ca -0.00 0.86 -0.01 0.00 0.36 0.00 0.00 54.97 56.18 2bm5 s GLU 25 Cb -0.08 0.09 0.01 0.00 0.26 0.00 0.00 34.13 34.41 2bm5 s GLU 25 CO 0.02 -0.20 0.09 0.54 -0.54 0.00 0.00 175.26 175.17 2bm5 n ARG 26 N 4.69 -2.43 -3.39 4.30 1.74 -0.32 -1.36 116.66 119.90 2bm5 n ARG 26 Ca -0.18 0.67 -0.37 0.00 -0.77 0.00 0.00 57.85 57.20 2bm5 n ARG 26 Cb 0.53 -5.30 -0.06 0.00 -1.02 0.00 0.00 32.46 26.61 2bm5 n ARG 26 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2bm5 s ALA 27 N -2.75 3.62 -0.22 7.54 0.00 -1.26 -3.87 121.76 124.82 2bm5 s ALA 27 Ca 0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 51.96 51.88 2bm5 s ALA 27 Cb -0.03 -2.50 0.02 0.00 0.00 0.00 0.00 23.12 20.61 2bm5 s ALA 27 CO 0.07 0.46 -0.12 1.41 0.00 0.00 0.00 175.76 177.58 2bm5 s MET 28 N -1.58 2.97 -0.29 0.00 1.75 -0.20 -0.46 119.30 121.49 2bm5 s MET 28 Ca 0.32 -0.87 -0.02 0.00 -1.25 0.00 0.00 55.69 53.88 2bm5 s MET 28 Cb -0.16 -2.82 0.05 0.00 2.84 0.00 0.00 34.83 34.74 2bm5 s MET 28 CO 0.18 -0.29 -0.01 -0.06 -0.65 0.00 0.00 175.02 174.18 2bm5 s PHE 29 N 1.33 3.25 -0.20 4.11 0.08 0.16 -1.02 117.98 125.69 2bm5 s PHE 29 Ca 0.03 -1.86 -0.03 0.00 0.12 0.00 0.00 56.93 55.18 2bm5 s PHE 29 Cb -0.15 -2.09 -0.01 0.00 -0.57 0.00 0.00 43.02 40.20 2bm5 s PHE 29 CO -0.08 -0.80 -0.06 0.45 -0.10 0.00 0.00 175.22 174.64 2bm5 s SER 30 N 1.25 4.31 -1.44 1.36 0.15 -0.24 -0.68 113.70 118.42 2bm5 s SER 30 Ca -0.05 -0.35 -0.05 0.00 0.70 0.00 0.00 55.95 56.20 2bm5 s SER 30 Cb -0.19 -1.72 0.04 0.00 -1.71 0.00 0.00 66.02 62.43 2bm5 s SER 30 CO -0.01 0.03 0.65 -0.62 1.20 0.00 0.00 173.24 174.49 2bm5 n GLU 31 N 4.46 -4.18 -3.98 5.44 1.02 0.17 -0.44 120.64 123.14 2bm5 n GLU 31 Ca -0.18 0.50 -0.27 0.00 -0.02 0.00 0.00 57.16 57.19 2bm5 n GLU 31 Cb 0.51 -4.97 -0.04 0.00 -0.02 0.00 0.00 31.44 26.92 2bm5 n GLU 31 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2bm5 s ASP 33 N -3.09 4.85 -0.28 0.00 -1.08 -0.03 -1.78 116.67 115.26 2bm5 s ASP 33 Ca 0.34 -0.58 0.11 0.00 -0.52 0.00 0.00 52.55 51.89 2bm5 s ASP 33 Cb -0.11 -1.83 0.58 0.00 -1.46 0.00 0.00 42.92 40.10 2bm5 s ASP 33 CO 0.27 -0.12 1.57 0.49 0.52 0.00 0.00 175.17 177.90 2bm5 n PHE 34 N 4.84 1.52 -2.00 -5.34 3.72 0.12 -0.89 117.46 119.43 2bm5 n PHE 34 Ca -0.16 -1.32 -0.41 0.00 -0.05 0.00 0.00 57.45 55.51 2bm5 n PHE 34 Cb 0.49 -0.52 -0.01 0.00 -0.94 0.00 0.00 39.48 38.49 2bm5 n PHE 34 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2bm5 s SER 35 N -1.93 6.58 0.00 4.37 0.01 -1.20 -2.10 113.70 119.43 2bm5 s SER 35 Ca 0.47 2.82 0.00 0.00 1.31 0.00 0.00 55.95 60.55 2bm5 s SER 35 Cb 0.40 -2.66 0.00 0.00 0.21 0.00 0.00 66.02 63.98 2bm5 s SER 35 CO 0.06 -0.68 0.00 0.61 0.41 0.00 0.00 173.24 173.64 2bm5 n GLY 36 N 0.66 0.50 3.77 3.44 0.00 0.08 -0.88 105.19 112.77 2bm5 n GLY 36 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 2bm5 n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bm5 s VAL 37 N -2.43 3.44 -0.45 1.61 1.01 -0.89 -3.94 120.40 118.74 2bm5 s VAL 37 Ca 0.00 1.20 -0.18 0.00 0.00 0.00 0.00 61.98 63.00 2bm5 s VAL 37 Cb 0.00 -3.67 0.03 0.00 0.00 0.00 0.00 36.38 32.74 2bm5 s VAL 37 CO 0.00 0.10 0.50 0.21 0.00 0.00 0.00 175.10 175.92 2bm5 s ASN 38 N -1.26 6.21 -0.21 3.32 3.84 -0.44 -1.70 114.94 124.69 2bm5 s ASN 38 Ca 0.55 -0.74 0.13 0.00 0.21 0.00 0.00 52.86 53.01 2bm5 s ASN 38 Cb -0.27 -2.25 0.43 0.00 -0.55 0.00 0.00 41.25 38.61 2bm5 s ASN 38 CO 0.34 -0.68 1.31 0.18 -2.79 0.00 0.00 177.10 175.46 2bm5 n LEU 39 N 5.78 3.23 -4.72 3.21 4.77 0.71 0.25 117.00 130.22 2bm5 n LEU 39 Ca -0.07 -3.57 -0.42 0.00 -0.03 0.00 0.00 56.01 51.92 2bm5 n LEU 39 Cb 0.47 -0.54 -0.01 0.00 -2.33 0.00 0.00 43.42 41.00 2bm5 n LEU 39 CO 0.49 1.11 1.10 0.00 -1.33 0.00 0.00 177.39 178.76 2bm5 n ALA 40 N -1.11 1.92 -1.68 -1.18 0.00 -1.09 -2.40 120.51 114.97 2bm5 n ALA 40 Ca 0.23 0.37 -0.19 0.00 0.00 0.00 0.00 53.44 53.85 2bm5 n ALA 40 Cb 0.81 -2.37 -0.07 0.00 0.00 0.00 0.00 19.45 17.82 2bm5 n ALA 40 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2bm5 n GLU 41 N 1.51 -1.47 -1.73 0.00 1.02 0.06 -1.14 120.64 118.89 2bm5 n GLU 41 Ca 0.07 1.10 -0.32 0.00 -0.02 0.00 0.00 57.16 58.00 2bm5 n GLU 41 Cb 0.36 -5.50 0.04 0.00 -0.02 0.00 0.00 31.44 26.31 2bm5 n GLU 41 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2bm5 s SER 42 N -2.54 5.51 -0.05 1.62 1.04 -1.01 -4.01 113.70 114.26 2bm5 s SER 42 Ca 0.00 1.68 0.02 0.00 0.48 0.00 0.00 55.95 58.13 2bm5 s SER 42 Cb 0.00 -2.51 0.01 0.00 0.10 0.00 0.00 66.02 63.63 2bm5 s SER 42 CO 0.00 -1.35 -0.09 -1.10 0.98 0.00 0.00 173.24 171.68 2bm5 s GLN 43 N -4.72 1.25 -0.02 4.02 -0.21 0.10 -1.00 119.66 119.07 2bm5 s GLN 43 Ca 0.60 -0.29 0.02 0.00 0.02 0.00 0.00 55.36 55.70 2bm5 s GLN 43 Cb -0.15 -1.11 0.01 0.00 1.00 0.00 0.00 33.01 32.77 2bm5 s GLN 43 CO 0.49 0.01 -0.06 -1.01 -2.12 0.00 0.00 175.29 172.61 2bm5 s HIS 44 N 0.64 0.67 -0.05 0.91 3.76 0.17 -1.18 115.29 120.21 2bm5 s HIS 44 Ca -0.11 -0.16 -0.01 0.00 -0.15 0.00 0.00 55.06 54.63 2bm5 s HIS 44 Cb -0.14 -0.53 0.03 0.00 1.11 0.00 0.00 32.58 33.05 2bm5 s HIS 44 CO 0.02 -0.10 0.03 0.50 -0.85 0.00 0.00 174.74 174.33 2bm5 s ARG 45 N 0.40 0.25 -0.80 1.40 3.52 -0.71 -0.83 118.95 122.19 2bm5 s ARG 45 Ca -0.05 0.22 0.00 0.00 -0.13 0.00 0.00 55.73 55.77 2bm5 s ARG 45 Cb -0.09 -0.67 0.00 0.00 -1.56 0.00 0.00 34.95 32.63 2bm5 s ARG 45 CO 0.00 -0.28 0.00 0.41 -0.81 0.00 0.00 175.30 174.62 2bm5 n GLY 46 N 5.00 0.92 3.93 8.12 0.00 -0.42 -1.17 105.19 121.56 2bm5 n GLY 46 Ca -0.09 -0.36 -0.25 0.00 0.00 0.00 0.00 46.02 45.32 2bm5 n GLY 46 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bm5 s SER 47 N -2.60 6.19 -0.05 1.61 0.01 -1.25 -3.56 113.70 114.05 2bm5 s SER 47 Ca 0.00 0.58 0.02 0.00 1.31 0.00 0.00 55.95 57.86 2bm5 s SER 47 Cb 0.00 -2.01 0.01 0.00 0.21 0.00 0.00 66.02 64.23 2bm5 s SER 47 CO 0.00 -0.46 -0.08 0.00 0.41 0.00 0.00 173.24 173.10 2bm5 s ALA 48 N -2.50 0.91 -0.49 1.44 0.00 0.39 -0.74 121.76 120.77 2bm5 s ALA 48 Ca 0.44 -0.24 0.04 0.00 0.00 0.00 0.00 51.96 52.19 2bm5 s ALA 48 Cb -0.10 -0.43 0.13 0.00 0.00 0.00 0.00 23.12 22.71 2bm5 s ALA 48 CO 0.39 0.08 0.23 -0.06 0.00 0.00 0.00 175.76 176.40 2bm5 s PHE 49 N 0.62 3.12 -0.25 0.00 0.40 0.56 0.40 117.98 122.83 2bm5 s PHE 49 Ca -0.10 -3.08 -0.14 0.00 -0.60 0.00 0.00 56.93 53.01 2bm5 s PHE 49 Cb -0.13 -2.74 -0.04 0.00 0.51 0.00 0.00 43.02 40.62 2bm5 s PHE 49 CO 0.01 -0.77 0.31 0.50 0.70 0.00 0.00 175.22 175.97 2bm5 s ARG 50 N -0.08 4.05 -1.59 0.44 3.52 0.15 -3.63 118.95 121.81 2bm5 s ARG 50 Ca 0.16 -0.05 -0.14 0.00 -0.13 0.00 0.00 55.73 55.57 2bm5 s ARG 50 Cb -0.25 -3.61 0.11 0.00 -1.56 0.00 0.00 34.95 29.64 2bm5 s ARG 50 CO -0.01 -0.15 0.87 0.09 -0.81 0.00 0.00 175.30 175.29 2bm5 n ASN 51 N 4.90 -3.82 -4.93 -2.12 5.03 -0.14 -0.65 115.26 113.52 2bm5 n ASN 51 Ca -0.11 -0.89 -0.25 0.00 0.87 0.00 0.00 54.58 54.21 2bm5 n ASN 51 Cb 0.51 -3.39 0.01 0.00 -1.02 0.00 0.00 39.78 35.89 2bm5 n ASN 51 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2bm5 s THR 53 N -2.66 2.84 -0.48 0.00 2.01 -0.74 -1.11 115.64 115.50 2bm5 s THR 53 Ca 0.48 -0.70 0.03 0.00 0.31 0.00 0.00 61.69 61.82 2bm5 s THR 53 Cb -0.10 -2.23 0.13 0.00 0.01 0.00 0.00 72.50 70.30 2bm5 s THR 53 CO 0.41 0.49 0.23 -0.36 -0.69 0.00 0.00 174.62 174.70 2bm5 s PHE 54 N 1.04 2.93 -0.17 4.92 0.40 0.84 0.13 117.98 128.07 2bm5 s PHE 54 Ca -0.01 -2.95 -0.04 0.00 -0.60 0.00 0.00 56.93 53.33 2bm5 s PHE 54 Cb -0.15 -2.59 -0.02 0.00 0.51 0.00 0.00 43.02 40.77 2bm5 s PHE 54 CO -0.03 -0.78 -0.03 -1.21 0.70 0.00 0.00 175.22 173.87 2bm5 s GLU 55 N 0.03 3.62 -1.47 0.44 2.02 -1.26 -0.77 118.70 121.31 2bm5 s GLU 55 Ca 0.16 -0.54 -0.11 0.00 0.02 0.00 0.00 54.97 54.51 2bm5 s GLU 55 Cb -0.25 -2.94 0.05 0.00 0.10 0.00 0.00 34.13 31.10 2bm5 s GLU 55 CO -0.01 0.16 0.94 0.54 0.02 0.00 0.00 175.26 176.90 2bm5 n ARG 56 N 3.79 -5.91 -3.67 1.61 1.74 -0.06 -0.74 116.66 113.42 2bm5 n ARG 56 Ca -0.17 0.69 -0.35 0.00 -0.77 0.00 0.00 57.85 57.25 2bm5 n ARG 56 Cb 0.52 -5.61 -0.05 0.00 -1.02 0.00 0.00 32.46 26.30 2bm5 n ARG 56 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2bm5 s THR 57 N -3.25 5.21 -0.22 0.55 2.01 -1.26 -3.16 115.64 115.51 2bm5 s THR 57 Ca 0.57 0.35 -0.07 0.00 0.31 0.00 0.00 61.69 62.85 2bm5 s THR 57 Cb -0.28 -3.60 -0.03 0.00 0.01 0.00 0.00 72.50 68.60 2bm5 s THR 57 CO 0.71 0.38 0.05 -0.89 -0.69 0.00 0.00 174.62 174.17 2bm5 s THR 58 N -1.29 4.33 -0.11 -0.82 2.01 -0.69 -0.97 115.64 118.10 2bm5 s THR 58 Ca 0.28 -0.18 0.06 0.00 0.31 0.00 0.00 61.69 62.17 2bm5 s THR 58 Cb -0.14 -2.99 0.12 0.00 0.01 0.00 0.00 72.50 69.50 2bm5 s THR 58 CO 0.16 0.39 1.07 0.18 -0.69 0.00 0.00 174.62 175.73 2bm5 n LEU 59 N 4.39 2.22 -4.63 4.42 4.77 0.53 -0.20 117.00 128.49 2bm5 n LEU 59 Ca -0.16 -2.33 -0.57 0.00 -0.03 0.00 0.00 56.01 52.92 2bm5 n LEU 59 Cb 0.52 -0.15 -0.07 0.00 -2.33 0.00 0.00 43.42 41.39 2bm5 n LEU 59 CO 0.32 0.58 1.01 1.87 -1.33 0.00 0.00 177.39 179.84 2bm5 n TRP 60 N -0.68 1.57 -1.37 -1.77 -0.00 -1.15 -1.76 117.44 112.27 2bm5 n TRP 60 Ca 0.06 0.73 -0.13 0.00 -0.00 0.00 0.00 57.50 58.16 2bm5 n TRP 60 Cb 0.39 -2.32 -0.06 0.00 -0.00 0.00 0.00 31.31 29.32 2bm5 n TRP 60 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 177.69 178.41 2bm5 n HIS 61 N 3.42 0.00 -2.37 5.87 8.25 0.27 -0.76 115.22 129.91 2bm5 n HIS 61 Ca 0.23 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.45 2bm5 n HIS 61 Cb 0.13 -2.45 0.06 0.00 1.12 0.00 0.00 29.99 28.85 2bm5 n HIS 61 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2bm5 s SER 62 N -2.75 4.97 -0.05 0.41 1.04 -0.72 -3.81 113.70 112.79 2bm5 s SER 62 Ca 0.00 0.27 0.01 0.00 0.48 0.00 0.00 55.95 56.71 2bm5 s SER 62 Cb 0.00 -1.00 0.02 0.00 0.10 0.00 0.00 66.02 65.14 2bm5 s SER 62 CO 0.00 -1.44 -0.06 -0.89 0.98 0.00 0.00 173.24 171.84 2bm5 s THR 63 N -3.07 0.66 -0.12 2.02 2.01 -0.17 -0.90 115.64 116.07 2bm5 s THR 63 Ca 0.59 -0.18 0.02 0.00 0.31 0.00 0.00 61.69 62.43 2bm5 s THR 63 Cb -0.10 -0.67 0.01 0.00 0.01 0.00 0.00 72.50 71.75 2bm5 s THR 63 CO 0.42 0.26 -0.18 -0.36 -0.69 0.00 0.00 174.62 174.07 2bm5 s PHE 64 N 0.98 2.22 -0.06 4.92 0.40 0.18 0.42 117.98 127.04 2bm5 s PHE 64 Ca -0.10 -1.07 0.02 0.00 -0.60 0.00 0.00 56.93 55.18 2bm5 s PHE 64 Cb -0.14 -1.56 0.01 0.00 0.51 0.00 0.00 43.02 41.84 2bm5 s PHE 64 CO 0.00 -0.52 -0.10 0.00 0.70 0.00 0.00 175.22 175.30 2bm5 s ALA 65 N 0.91 1.09 -1.38 5.36 0.00 -0.01 -0.77 121.76 126.97 2bm5 s ALA 65 Ca -0.07 -0.33 -0.05 0.00 0.00 0.00 0.00 51.96 51.51 2bm5 s ALA 65 Cb -0.15 -0.51 0.00 0.00 0.00 0.00 0.00 23.12 22.46 2bm5 s ALA 65 CO -0.01 0.10 0.42 1.04 0.00 0.00 0.00 175.76 177.31 2bm5 n GLN 66 N 3.80 -2.47 -4.27 0.00 3.00 0.15 -1.30 117.38 116.28 2bm5 n GLN 66 Ca -0.23 0.34 -0.23 0.00 -0.01 0.00 0.00 57.00 56.87 2bm5 n GLN 66 Cb 0.52 -4.20 -0.07 0.00 0.00 0.00 0.00 30.24 26.48 2bm5 n GLN 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2bm5 s SER 68 N -3.71 3.62 -0.05 0.00 0.15 0.08 -1.50 113.70 112.29 2bm5 s SER 68 Ca 0.34 -0.32 0.07 0.00 0.70 0.00 0.00 55.95 56.74 2bm5 s SER 68 Cb -0.04 -0.63 0.11 0.00 -1.71 0.00 0.00 66.02 63.75 2bm5 s SER 68 CO 0.20 0.33 0.99 0.23 1.20 0.00 0.00 173.24 176.20 2bm5 n MET 69 N 2.32 1.48 -1.43 5.44 2.81 0.11 -0.32 117.12 127.51 2bm5 n MET 69 Ca -0.17 -1.72 -0.56 0.00 -1.81 0.00 0.00 57.70 53.45 2bm5 n MET 69 Cb 0.52 -1.05 -0.08 0.00 -0.71 0.00 0.00 33.22 31.89 2bm5 n MET 69 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 2bm5 n LEU 70 N -0.73 0.72 0.00 4.03 0.00 -1.15 -0.27 117.00 119.60 2bm5 n LEU 70 Ca 0.06 1.01 0.00 0.00 0.00 0.00 0.00 56.01 57.08 2bm5 n LEU 70 Cb 0.50 -0.76 0.00 0.00 0.00 0.00 0.00 43.42 43.16 2bm5 n LEU 70 CO 0.00 -1.00 0.00 0.61 0.00 0.00 0.00 177.39 177.01 2bm5 n GLY 71 N 2.77 0.22 3.82 -3.96 0.00 -0.46 -0.97 105.19 106.61 2bm5 n GLY 71 Ca 0.24 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.94 2bm5 n GLY 71 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bm5 s SER 72 N -2.18 5.62 -0.11 1.61 0.01 0.63 -4.18 113.70 115.09 2bm5 s SER 72 Ca 0.00 1.66 0.03 0.00 1.31 0.00 0.00 55.95 58.96 2bm5 s SER 72 Cb 0.00 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.73 2bm5 s SER 72 CO 0.00 -1.28 -0.23 -0.69 0.41 0.00 0.00 173.24 171.45 2bm5 s VAL 73 N -2.86 2.00 -0.19 3.43 1.01 -0.27 -0.49 120.40 123.03 2bm5 s VAL 73 Ca 0.59 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.62 2bm5 s VAL 73 Cb -0.14 -1.74 0.03 0.00 0.00 0.00 0.00 36.38 34.52 2bm5 s VAL 73 CO 0.48 0.54 -0.18 -0.36 0.00 0.00 0.00 175.10 175.59 2bm5 s PHE 74 N 0.50 2.76 -0.15 5.22 0.40 -0.30 -0.11 117.98 126.31 2bm5 s PHE 74 Ca -0.15 -1.69 0.01 0.00 -0.60 0.00 0.00 56.93 54.50 2bm5 s PHE 74 Cb -0.17 -1.88 0.02 0.00 0.51 0.00 0.00 43.02 41.50 2bm5 s PHE 74 CO 0.05 -0.80 -0.18 0.08 0.70 0.00 0.00 175.22 175.08 2bm5 s VAL 75 N 1.29 1.81 -1.32 -0.44 1.01 0.05 -4.56 120.40 118.25 2bm5 s VAL 75 Ca 0.03 -0.80 -0.06 0.00 0.00 0.00 0.00 61.98 61.15 2bm5 s VAL 75 Cb -0.14 -1.65 -0.00 0.00 0.00 0.00 0.00 36.38 34.59 2bm5 s VAL 75 CO -0.12 0.50 0.56 0.00 0.00 0.00 0.00 175.10 176.04 2bm5 n ALA 76 N 4.54 -2.17 -2.90 5.51 0.00 -1.26 -0.88 120.51 123.35 2bm5 n ALA 76 Ca -0.19 -0.26 -0.21 0.00 0.00 0.00 0.00 53.44 52.79 2bm5 n ALA 76 Cb 0.50 -2.25 -0.02 0.00 0.00 0.00 0.00 19.45 17.68 2bm5 n ALA 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bm5 s ARG 78 N -4.01 3.08 -0.17 0.00 3.52 -0.14 -4.75 118.95 116.47 2bm5 s ARG 78 Ca 0.36 -1.07 0.17 0.00 -0.13 0.00 0.00 55.73 55.05 2bm5 s ARG 78 Cb -0.09 -4.14 0.44 0.00 -1.56 0.00 0.00 34.95 29.60 2bm5 s ARG 78 CO 0.29 -1.26 1.33 1.28 -0.81 0.00 0.00 175.30 176.13 2bm5 n LEU 79 N 6.02 3.34 -3.55 -0.88 4.32 -1.26 -0.35 117.00 124.64 2bm5 n LEU 79 Ca -0.08 -3.14 -0.14 0.00 -0.02 0.00 0.00 56.01 52.63 2bm5 n LEU 79 Cb 0.44 -0.51 -0.06 0.00 -1.62 0.00 0.00 43.42 41.68 2bm5 n LEU 79 CO 0.54 0.76 0.63 0.00 -1.22 0.00 0.00 177.39 178.09 2bm5 s ARG 80 N -2.90 0.80 0.54 3.23 1.70 -1.26 -4.52 118.95 116.54 2bm5 s ARG 80 Ca 0.39 0.19 -0.07 0.00 -0.47 0.00 0.00 55.73 55.77 2bm5 s ARG 80 Cb 0.33 0.38 -0.04 0.00 -0.57 0.00 0.00 34.95 35.05 2bm5 s ARG 80 CO 0.06 -0.25 0.88 -1.25 -1.08 0.00 0.00 175.30 173.65 2bm5 s PRO 81 N -1.15 3.54 0.16 3.89 0.04 -1.26 -4.71 135.00 135.51 2bm5 s PRO 81 Ca -0.06 0.39 -0.25 0.00 0.04 0.00 0.00 61.00 61.13 2bm5 s PRO 81 Cb -0.00 -2.26 0.06 0.00 0.04 0.00 0.00 34.50 32.33 2bm5 s PRO 81 CO 0.05 -0.36 0.93 -0.48 0.04 0.00 0.00 177.00 177.19 2bm5 s LEU 82 N -4.91 -0.19 -0.22 -3.56 0.05 -1.26 -0.56 118.68 108.02 2bm5 s LEU 82 Ca 0.50 -0.42 -0.05 0.00 0.05 0.00 0.00 54.13 54.22 2bm5 s LEU 82 Cb -0.11 2.21 -0.02 0.00 -2.05 0.00 0.00 46.19 46.23 2bm5 s LEU 82 CO 0.48 -0.94 0.00 -0.89 -0.55 0.00 0.00 176.35 174.45 2bm5 s THR 83 N -3.35 3.81 -0.03 5.48 2.01 -0.08 -4.71 115.64 118.78 2bm5 s THR 83 Ca 0.12 -0.35 0.03 0.00 0.31 0.00 0.00 61.69 61.80 2bm5 s THR 83 Cb -0.02 -2.75 -0.03 0.00 0.01 0.00 0.00 72.50 69.71 2bm5 s THR 83 CO 0.02 0.40 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.51 2bm5 s LEU 84 N 1.37 3.10 -0.39 4.42 1.43 -1.26 -0.65 118.68 126.71 2bm5 s LEU 84 Ca 0.05 -0.12 0.04 0.00 -1.03 0.00 0.00 54.13 53.07 2bm5 s LEU 84 Cb -0.15 -1.73 0.16 0.00 0.03 0.00 0.00 46.19 44.51 2bm5 s LEU 84 CO 0.00 0.32 0.42 -0.62 0.23 0.00 0.00 176.35 176.71 2bm5 s ASP 85 N -1.13 0.72 -0.23 2.29 -1.08 0.05 -4.81 116.67 112.48 2bm5 s ASP 85 Ca 0.15 -1.65 -0.00 0.00 -0.52 0.00 0.00 52.55 50.53 2bm5 s ASP 85 Cb -0.11 0.72 0.00 0.00 -1.46 0.00 0.00 42.92 42.07 2bm5 s ASP 85 CO 0.04 -0.23 0.00 -0.67 0.52 0.00 0.00 175.17 174.84 2bm5 n ASP 86 N 4.04 -6.46 -3.96 -0.34 2.03 -1.26 0.30 116.55 110.89 2bm5 n ASP 86 Ca 0.13 1.08 -0.20 0.00 0.52 0.00 0.00 54.79 56.32 2bm5 n ASP 86 Cb 0.47 -4.25 -0.16 0.00 -0.72 0.00 0.00 41.12 36.47 2bm5 n ASP 86 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2bm5 s VAL 87 N -1.21 0.70 -0.46 5.18 1.01 -1.26 -1.57 120.40 122.79 2bm5 s VAL 87 Ca -0.00 -0.28 -0.20 0.00 0.00 0.00 0.00 61.98 61.50 2bm5 s VAL 87 Cb 0.00 -0.65 0.03 0.00 0.00 0.00 0.00 36.38 35.76 2bm5 s VAL 87 CO 0.59 0.24 0.63 -0.62 0.00 0.00 0.00 175.10 175.93 2bm5 s ASP 88 N 0.47 6.28 -0.27 3.32 -1.08 -0.56 -3.25 116.67 121.59 2bm5 s ASP 88 Ca -0.07 -0.52 0.13 0.00 -0.52 0.00 0.00 52.55 51.56 2bm5 s ASP 88 Cb -0.11 -2.31 0.76 0.00 -1.46 0.00 0.00 42.92 39.81 2bm5 s ASP 88 CO 0.01 -0.80 1.74 0.49 0.52 0.00 0.00 175.17 177.12 2bm5 n PHE 89 N 6.22 2.10 -1.60 -5.34 3.72 0.31 0.04 117.46 122.90 2bm5 n PHE 89 Ca -0.03 -0.93 -0.49 0.00 -0.05 0.00 0.00 57.45 55.94 2bm5 n PHE 89 Cb 0.47 -0.56 -0.05 0.00 -0.94 0.00 0.00 39.48 38.41 2bm5 n PHE 89 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 2bm5 n THR 90 N 0.19 0.53 -0.84 4.37 -1.04 -1.18 -0.61 114.28 115.70 2bm5 n THR 90 Ca 0.32 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 62.20 2bm5 n THR 90 Cb 1.24 -0.95 0.00 0.00 -1.82 0.00 0.00 70.33 68.80 2bm5 n THR 90 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2bm5 n LEU 91 N 2.31 0.99 -4.80 -4.42 4.77 0.41 -1.36 117.00 114.90 2bm5 n LEU 91 Ca 0.16 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.83 2bm5 n LEU 91 Cb 0.24 -2.16 0.07 0.00 -2.33 0.00 0.00 43.42 39.23 2bm5 n LEU 91 CO 0.62 -0.83 0.71 0.00 -1.33 0.00 0.00 177.39 176.55 2bm5 s ALA 92 N -1.01 2.48 -0.31 -1.18 0.00 0.22 -3.97 121.76 117.99 2bm5 s ALA 92 Ca 0.00 0.08 -0.04 0.00 0.00 0.00 0.00 51.96 51.99 2bm5 s ALA 92 Cb 0.00 -3.19 0.04 0.00 0.00 0.00 0.00 23.12 19.97 2bm5 s ALA 92 CO 0.00 -1.47 0.05 0.08 0.00 0.00 0.00 175.76 174.42 2bm5 s VAL 93 N -3.02 3.43 -0.19 0.00 1.01 0.35 -1.31 120.40 120.67 2bm5 s VAL 93 Ca 0.59 -1.16 0.06 0.00 0.00 0.00 0.00 61.98 61.47 2bm5 s VAL 93 Cb -0.15 -2.91 0.12 0.00 0.00 0.00 0.00 36.38 33.44 2bm5 s VAL 93 CO 0.55 -0.09 1.09 0.18 0.00 0.00 0.00 175.10 176.83 2bm5 n LEU 94 N 4.74 2.30 -4.68 3.92 4.77 -0.00 -1.15 117.00 126.90 2bm5 n LEU 94 Ca -0.13 -2.23 -0.42 0.00 -0.03 0.00 0.00 56.01 53.19 2bm5 n LEU 94 Cb 0.45 -0.14 -0.00 0.00 -2.33 0.00 0.00 43.42 41.40 2bm5 n LEU 94 CO 0.29 0.58 0.82 0.61 -1.33 0.00 0.00 177.39 178.36 2bm5 n GLY 95 N -0.49 0.39 3.32 -0.72 0.00 -0.97 -2.31 105.19 104.41 2bm5 n GLY 95 Ca 0.06 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.34 2bm5 n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bm5 n GLY 96 N 0.88 1.08 3.90 -0.02 0.00 0.21 -4.77 105.19 106.46 2bm5 n GLY 96 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 2bm5 n GLY 96 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bm5 s ASN 97 N -2.91 6.37 -0.46 1.61 0.01 -0.98 -4.83 114.94 113.76 2bm5 s ASN 97 Ca 0.00 0.97 -0.14 0.00 -0.71 0.00 0.00 52.86 52.97 2bm5 s ASN 97 Cb 0.00 -2.26 0.07 0.00 0.41 0.00 0.00 41.25 39.47 2bm5 s ASN 97 CO 0.00 -0.47 0.37 -0.62 -1.51 0.00 0.00 177.10 174.87 2bm5 s ASP 98 N -3.68 6.06 -0.19 -1.22 -1.08 -1.26 -1.05 116.67 114.25 2bm5 s ASP 98 Ca 0.48 -1.32 0.15 0.00 -0.52 0.00 0.00 52.55 51.33 2bm5 s ASP 98 Cb -0.10 -2.15 0.40 0.00 -1.46 0.00 0.00 42.92 39.61 2bm5 s ASP 98 CO 0.38 -0.61 1.27 0.18 0.52 0.00 0.00 175.17 176.91 2bm5 n LEU 99 N 5.15 3.01 -4.64 -1.34 4.32 0.36 -4.42 117.00 119.45 2bm5 n LEU 99 Ca -0.12 -3.41 -0.48 0.00 -0.02 0.00 0.00 56.01 51.99 2bm5 n LEU 99 Cb 0.44 -0.51 -0.04 0.00 -1.62 0.00 0.00 43.42 41.68 2bm5 n LEU 99 CO 0.45 0.98 1.03 0.54 -1.22 0.00 0.00 177.39 179.18 2bm5 n ARG 100 N -1.14 1.76 -0.90 3.23 1.74 -0.99 -2.18 116.66 118.19 2bm5 n ARG 100 Ca 0.21 0.63 0.00 0.00 -0.77 0.00 0.00 57.85 57.92 2bm5 n ARG 100 Cb 0.76 -2.32 0.00 0.00 -1.02 0.00 0.00 32.46 29.88 2bm5 n ARG 100 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bm5 n GLY 101 N 2.80 0.96 3.77 -0.13 0.00 -0.51 -4.92 105.19 107.16 2bm5 n GLY 101 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 2bm5 n GLY 101 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bm5 s LEU 102 N 0.00 3.61 -0.60 0.99 1.43 -0.93 -4.75 118.68 118.44 2bm5 s LEU 102 Ca 0.00 2.11 -0.19 0.00 -1.03 0.00 0.00 54.13 55.02 2bm5 s LEU 102 Cb 0.00 -4.57 0.10 0.00 0.03 0.00 0.00 46.19 41.75 2bm5 s LEU 102 CO 0.00 -1.38 0.72 0.21 0.23 0.00 0.00 176.35 176.12 2bm5 s ASN 103 N -2.09 6.18 -0.19 2.29 2.47 -1.26 -2.01 114.94 120.33 2bm5 s ASN 103 Ca 0.71 -1.42 0.13 0.00 0.42 0.00 0.00 52.86 52.70 2bm5 s ASN 103 Cb -0.23 -2.31 0.72 0.00 -1.45 0.00 0.00 41.25 37.99 2bm5 s ASN 103 CO 0.33 -1.13 1.61 0.18 -3.72 0.00 0.00 177.10 174.36 2bm5 n LEU 104 N 6.40 5.09 -4.59 3.21 4.77 0.88 -4.41 117.00 128.34 2bm5 n LEU 104 Ca -0.09 -2.58 -0.49 0.00 -0.03 0.00 0.00 56.01 52.82 2bm5 n LEU 104 Cb 0.43 -0.65 -0.04 0.00 -2.33 0.00 0.00 43.42 40.83 2bm5 n LEU 104 CO 0.59 0.62 0.80 0.41 -1.33 0.00 0.00 177.39 178.47 2bm5 n THR 105 N 0.64 0.73 -0.62 -5.08 -1.04 -1.11 -1.42 114.28 106.38 2bm5 n THR 105 Ca 0.25 -0.18 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 2bm5 n THR 105 Cb 1.05 -0.93 0.00 0.00 -1.82 0.00 0.00 70.33 68.63 2bm5 n THR 105 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2bm5 n GLY 106 N 2.15 0.54 3.76 3.41 0.00 -0.07 -4.28 105.19 110.70 2bm5 n GLY 106 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 2bm5 n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm5 s ARG 108 N -1.56 4.08 -0.29 0.00 0.52 -1.20 -1.85 118.95 118.65 2bm5 s ARG 108 Ca 0.45 0.56 0.07 0.00 -0.52 0.00 0.00 55.73 56.30 2bm5 s ARG 108 Cb -0.25 -3.67 0.46 0.00 0.52 0.00 0.00 34.95 32.01 2bm5 s ARG 108 CO 0.31 -0.47 1.19 1.28 0.02 0.00 0.00 175.30 177.63 2bm5 n LEU 109 N 5.81 4.83 -4.71 2.53 4.77 0.66 -0.53 117.00 130.35 2bm5 n LEU 109 Ca 0.00 -4.70 -0.42 0.00 -0.03 0.00 0.00 56.01 50.86 2bm5 n LEU 109 Cb 0.49 -0.32 -0.03 0.00 -2.33 0.00 0.00 43.42 41.22 2bm5 n LEU 109 CO 0.44 2.08 1.07 -0.13 -1.33 0.00 0.00 177.39 179.52 2bm5 s ARG 110 N -3.60 4.31 -1.46 3.23 0.52 -1.12 -2.52 118.95 118.31 2bm5 s ARG 110 Ca 0.50 2.08 0.00 0.00 -0.52 0.00 0.00 55.73 57.80 2bm5 s ARG 110 Cb 0.41 -3.25 0.00 0.00 0.52 0.00 0.00 34.95 32.62 2bm5 s ARG 110 CO 0.04 -0.45 0.00 0.39 0.02 0.00 0.00 175.30 175.30 2bm5 n GLU 111 N 3.99 -1.63 -2.70 3.54 1.02 -0.46 -0.45 120.64 123.96 2bm5 n GLU 111 Ca 0.12 0.82 -0.41 0.00 -0.02 0.00 0.00 57.16 57.66 2bm5 n GLU 111 Cb 0.42 -5.24 -0.05 0.00 -0.02 0.00 0.00 31.44 26.56 2bm5 n GLU 111 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2bm5 s THR 112 N -2.46 4.31 -0.28 2.62 2.01 -1.05 -3.91 115.64 116.89 2bm5 s THR 112 Ca 0.00 2.00 -0.23 0.00 0.31 0.00 0.00 61.69 63.76 2bm5 s THR 112 Cb 0.00 -4.27 -0.00 0.00 0.01 0.00 0.00 72.50 68.23 2bm5 s THR 112 CO 0.00 0.34 0.79 -0.55 -0.69 0.00 0.00 174.62 174.51 2bm5 s SER 113 N -0.24 6.72 -0.18 3.53 0.15 -0.43 -1.06 113.70 122.19 2bm5 s SER 113 Ca 0.46 0.81 0.13 0.00 0.70 0.00 0.00 55.95 58.06 2bm5 s SER 113 Cb -0.25 -2.41 0.40 0.00 -1.71 0.00 0.00 66.02 62.05 2bm5 s SER 113 CO 0.31 -0.55 1.20 0.18 1.20 0.00 0.00 173.24 175.59 2bm5 n LEU 114 N 6.07 2.48 -4.65 3.45 4.77 0.66 -0.82 117.00 128.96 2bm5 n LEU 114 Ca 0.04 -3.61 -0.42 0.00 -0.03 0.00 0.00 56.01 51.99 2bm5 n LEU 114 Cb 0.48 -0.47 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 2bm5 n LEU 114 CO 0.48 1.23 1.54 -0.69 -1.33 0.00 0.00 177.39 178.63 2bm5 s VAL 115 N -2.88 3.21 -2.01 4.08 1.01 -1.05 -1.83 120.40 120.93 2bm5 s VAL 115 Ca 0.36 0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.59 2bm5 s VAL 115 Cb 0.36 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.57 2bm5 s VAL 115 CO -0.07 -0.03 0.00 0.47 0.00 0.00 0.00 175.10 175.47 2bm5 n ASP 116 N 7.73 -5.42 -4.74 3.32 8.00 -0.58 -0.62 116.55 124.24 2bm5 n ASP 116 Ca 0.20 0.39 -0.40 0.00 0.71 0.00 0.00 54.79 55.68 2bm5 n ASP 116 Cb 0.42 -4.61 -0.05 0.00 -0.02 0.00 0.00 41.12 36.86 2bm5 n ASP 116 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2bm5 s THR 117 N -2.78 4.29 -0.51 -3.53 2.01 -0.76 -3.44 115.64 110.93 2bm5 s THR 117 Ca 0.00 2.04 -0.19 0.00 0.31 0.00 0.00 61.69 63.85 2bm5 s THR 117 Cb 0.00 -4.31 0.06 0.00 0.01 0.00 0.00 72.50 68.26 2bm5 s THR 117 CO 0.00 0.42 0.61 -0.62 -0.69 0.00 0.00 174.62 174.34 2bm5 s ASP 118 N -0.65 6.22 -0.20 3.53 -1.08 -0.22 -1.19 116.67 123.08 2bm5 s ASP 118 Ca 0.43 -0.97 0.16 0.00 -0.52 0.00 0.00 52.55 51.65 2bm5 s ASP 118 Cb -0.25 -2.28 0.53 0.00 -1.46 0.00 0.00 42.92 39.47 2bm5 s ASP 118 CO 0.30 -0.88 1.44 0.18 0.52 0.00 0.00 175.17 176.73 2bm5 n LEU 119 N 6.11 3.98 -4.78 -1.34 4.77 0.29 -0.49 117.00 125.55 2bm5 n LEU 119 Ca -0.07 -3.11 -0.41 0.00 -0.03 0.00 0.00 56.01 52.39 2bm5 n LEU 119 Cb 0.45 -0.56 -0.00 0.00 -2.33 0.00 0.00 43.42 40.97 2bm5 n LEU 119 CO 0.54 0.74 1.12 -0.13 -1.33 0.00 0.00 177.39 178.33 2bm5 s ARG 120 N -2.88 4.14 -0.26 3.23 0.52 -0.87 -1.28 118.95 121.54 2bm5 s ARG 120 Ca 0.43 2.53 0.00 0.00 -0.52 0.00 0.00 55.73 58.17 2bm5 s ARG 120 Cb 0.35 -2.98 0.00 0.00 0.52 0.00 0.00 34.95 32.84 2bm5 s ARG 120 CO 0.08 -0.50 0.00 1.63 0.02 0.00 0.00 175.30 176.53 2bm5 n LYS 121 N 0.55 -1.54 -1.55 3.54 5.02 -0.84 -1.42 118.16 121.92 2bm5 n LYS 121 Ca 0.01 0.50 -0.31 0.00 -2.02 0.00 0.00 58.31 56.49 2bm5 n LYS 121 Cb 0.39 -4.71 0.06 0.00 -0.02 0.00 0.00 35.03 30.76 2bm5 n LYS 121 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2bm5 s VAL 123 N -3.05 4.30 -0.12 0.00 1.01 -0.85 -0.54 120.40 121.16 2bm5 s VAL 123 Ca 0.59 -0.19 0.14 0.00 0.00 0.00 0.00 61.98 62.52 2bm5 s VAL 123 Cb -0.14 -2.97 0.27 0.00 0.00 0.00 0.00 36.38 33.54 2bm5 s VAL 123 CO 0.55 0.40 1.14 0.18 0.00 0.00 0.00 175.10 177.37 2bm5 n LEU 124 N 4.33 1.92 -4.66 3.92 4.32 0.10 -0.09 117.00 126.85 2bm5 n LEU 124 Ca -0.17 -2.82 -0.47 0.00 -0.02 0.00 0.00 56.01 52.53 2bm5 n LEU 124 Cb 0.52 -0.35 -0.04 0.00 -1.62 0.00 0.00 43.42 41.93 2bm5 n LEU 124 CO 0.32 0.76 1.18 0.54 -1.22 0.00 0.00 177.39 178.97 2bm5 n ARG 125 N -1.00 2.01 -0.61 3.23 1.74 -1.24 -1.40 116.66 119.40 2bm5 n ARG 125 Ca 0.13 0.73 0.00 0.00 -0.77 0.00 0.00 57.85 57.94 2bm5 n ARG 125 Cb 0.69 -2.49 0.00 0.00 -1.02 0.00 0.00 32.46 29.65 2bm5 n ARG 125 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bm5 n GLY 126 N 3.40 1.24 3.79 -0.13 0.00 -0.87 -0.89 105.19 111.72 2bm5 n GLY 126 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2bm5 n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm5 s ALA 127 N -3.06 2.88 -0.34 4.61 0.00 -0.49 -4.08 121.76 121.28 2bm5 s ALA 127 Ca 0.00 0.68 -0.06 0.00 0.00 0.00 0.00 51.96 52.58 2bm5 s ALA 127 Cb 0.00 -3.28 0.04 0.00 0.00 0.00 0.00 23.12 19.88 2bm5 s ALA 127 CO 0.00 -0.40 0.11 0.34 0.00 0.00 0.00 175.76 175.81 2bm5 s ASP 128 N -1.83 5.31 -0.14 0.00 2.15 -0.77 -0.16 116.67 121.23 2bm5 s ASP 128 Ca 0.66 -1.19 0.17 0.00 0.43 0.00 0.00 52.55 52.63 2bm5 s ASP 128 Cb -0.19 -1.87 0.74 0.00 -0.30 0.00 0.00 42.92 41.29 2bm5 s ASP 128 CO 0.23 -0.34 1.65 0.18 -0.17 0.00 0.00 175.17 176.72 2bm5 n LEU 129 N 4.80 4.95 -4.64 -1.34 4.32 0.11 -0.25 117.00 124.95 2bm5 n LEU 129 Ca -0.12 -2.58 -0.53 0.00 -0.02 0.00 0.00 56.01 52.77 2bm5 n LEU 129 Cb 0.44 -0.60 -0.06 0.00 -1.62 0.00 0.00 43.42 41.58 2bm5 n LEU 129 CO 0.32 0.77 1.10 -1.20 -1.22 0.00 0.00 177.39 177.16 2bm5 n SER 130 N 0.95 2.15 0.00 -1.43 7.64 -1.25 -0.79 113.62 120.88 2bm5 n SER 130 Ca 0.26 1.09 0.00 0.00 1.01 0.00 0.00 58.87 61.23 2bm5 n SER 130 Cb 0.96 -1.21 0.00 0.00 -1.01 0.00 0.00 64.21 62.95 2bm5 n SER 130 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bm5 n GLY 131 N 3.26 0.43 3.74 0.23 0.00 -1.26 -1.35 105.19 110.25 2bm5 n GLY 131 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 2bm5 n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm5 s ALA 132 N -2.20 2.41 -0.40 4.61 0.00 0.03 -3.82 121.76 122.40 2bm5 s ALA 132 Ca 0.00 0.98 -0.16 0.00 0.00 0.00 0.00 51.96 52.78 2bm5 s ALA 132 Cb 0.00 -3.46 0.01 0.00 0.00 0.00 0.00 23.12 19.67 2bm5 s ALA 132 CO 0.00 -1.40 0.40 0.50 0.00 0.00 0.00 175.76 175.26 2bm5 s ARG 133 N -3.52 3.21 -0.04 0.00 6.06 -0.22 -4.91 118.95 119.53 2bm5 s ARG 133 Ca 0.77 -0.70 0.08 0.00 -2.50 0.00 0.00 55.73 53.38 2bm5 s ARG 133 Cb -0.31 -3.92 0.21 0.00 0.06 0.00 0.00 34.95 30.99 2bm5 s ARG 133 CO 0.37 -0.75 1.16 0.25 -2.50 0.00 0.00 175.30 173.83 2bm5 n THR 134 N 5.35 1.26 -1.65 4.11 -2.24 -1.26 -0.25 114.28 119.59 2bm5 n THR 134 Ca -0.08 -1.25 -0.49 0.00 -2.27 0.00 0.00 64.05 59.95 2bm5 n THR 134 Cb 0.48 0.32 -0.05 0.00 -2.10 0.00 0.00 70.33 68.98 2bm5 n THR 134 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2bm5 n THR 135 N -0.24 0.15 -0.93 4.28 -1.04 -1.26 -0.36 114.28 114.87 2bm5 n THR 135 Ca 0.09 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 2bm5 n THR 135 Cb 0.44 -1.38 0.00 0.00 -1.82 0.00 0.00 70.33 67.57 2bm5 n THR 135 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2bm5 n GLY 136 N 3.45 0.83 3.77 3.41 0.00 -1.26 -1.52 105.19 113.87 2bm5 n GLY 136 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 2bm5 n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm5 s ALA 137 N -3.47 3.26 -0.28 4.61 0.00 0.51 -3.76 121.76 122.64 2bm5 s ALA 137 Ca 0.00 1.25 -0.06 0.00 0.00 0.00 0.00 51.96 53.15 2bm5 s ALA 137 Cb 0.00 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.63 2bm5 s ALA 137 CO 0.00 -0.85 0.06 1.03 0.00 0.00 0.00 175.76 176.00 2bm5 s ARG 138 N -2.25 3.18 -0.04 0.00 0.52 -0.33 -1.73 118.95 118.29 2bm5 s ARG 138 Ca 0.57 -0.79 0.06 0.00 -0.52 0.00 0.00 55.73 55.05 2bm5 s ARG 138 Cb -0.38 -3.31 0.09 0.00 0.52 0.00 0.00 34.95 31.87 2bm5 s ARG 138 CO 0.49 -0.38 1.01 1.28 0.02 0.00 0.00 175.30 177.72 2bm5 n LEU 139 N 4.86 1.87 -4.65 2.53 4.77 0.37 -0.55 117.00 126.21 2bm5 n LEU 139 Ca -0.15 -2.14 -0.46 0.00 -0.03 0.00 0.00 56.01 53.23 2bm5 n LEU 139 Cb 0.49 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.41 2bm5 n LEU 139 CO 0.31 0.52 0.93 0.47 -1.33 0.00 0.00 177.39 178.29 2bm5 n ASP 140 N -0.73 2.40 0.00 -1.43 8.00 -1.06 -0.86 116.55 122.87 2bm5 n ASP 140 Ca 0.05 1.14 0.00 0.00 0.71 0.00 0.00 54.79 56.69 2bm5 n ASP 140 Cb 0.41 -1.38 0.00 0.00 -0.02 0.00 0.00 41.12 40.13 2bm5 n ASP 140 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2bm5 n ASP 141 N 2.07 -5.62 -4.85 -2.24 8.00 0.02 -1.99 116.55 111.94 2bm5 n ASP 141 Ca 0.12 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.32 2bm5 n ASP 141 Cb 0.30 -3.31 0.05 0.00 -0.02 0.00 0.00 41.12 38.14 2bm5 n ASP 141 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2bm5 s ALA 142 N -1.05 2.76 -0.38 2.24 0.00 -0.04 -3.67 121.76 121.62 2bm5 s ALA 142 Ca 0.00 -0.13 -0.09 0.00 0.00 0.00 0.00 51.96 51.75 2bm5 s ALA 142 Cb 0.00 -3.10 0.05 0.00 0.00 0.00 0.00 23.12 20.07 2bm5 s ALA 142 CO 0.00 -1.16 0.19 0.34 0.00 0.00 0.00 175.76 175.13 2bm5 s ASP 143 N -4.06 5.55 0.00 0.00 -1.08 0.30 -0.78 116.67 116.60 2bm5 s ASP 143 Ca 0.58 -1.23 0.23 0.00 -0.52 0.00 0.00 52.55 51.61 2bm5 s ASP 143 Cb -0.13 -1.96 0.09 0.00 -1.46 0.00 0.00 42.92 39.47 2bm5 s ASP 143 CO 0.54 -0.42 1.16 0.18 0.52 0.00 0.00 175.17 177.15 2bm5 n LEU 144 N 4.90 1.99 -4.62 -1.34 4.77 -0.01 0.01 117.00 122.70 2bm5 n LEU 144 Ca -0.11 -0.72 -0.49 0.00 -0.03 0.00 0.00 56.01 54.65 2bm5 n LEU 144 Cb 0.44 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.47 2bm5 n LEU 144 CO 0.36 0.37 0.98 0.54 -1.33 0.00 0.00 177.39 178.30 2bm5 n ARG 145 N 0.00 1.52 -0.97 3.23 1.74 -1.16 -0.74 116.66 120.29 2bm5 n ARG 145 Ca 0.10 0.55 0.00 0.00 -0.77 0.00 0.00 57.85 57.73 2bm5 n ARG 145 Cb 0.46 -2.22 0.00 0.00 -1.02 0.00 0.00 32.46 29.69 2bm5 n ARG 145 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bm5 n GLY 146 N 2.73 0.63 3.89 -0.13 0.00 -1.26 -3.85 105.19 107.20 2bm5 n GLY 146 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2bm5 n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm5 s ALA 147 N -2.65 3.40 -0.26 4.61 0.00 0.08 -2.06 121.76 124.89 2bm5 s ALA 147 Ca 0.00 -0.35 -0.10 0.00 0.00 0.00 0.00 51.96 51.51 2bm5 s ALA 147 Cb 0.00 -2.62 -0.04 0.00 0.00 0.00 0.00 23.12 20.46 2bm5 s ALA 147 CO 0.00 -0.10 0.14 0.99 0.00 0.00 0.00 175.76 176.80 2bm5 s THR 148 N -2.47 4.97 0.04 0.00 2.01 0.77 -4.91 115.64 116.06 2bm5 s THR 148 Ca 0.49 0.05 0.01 0.00 0.31 0.00 0.00 61.69 62.56 2bm5 s THR 148 Cb -0.10 -3.35 -0.02 0.00 0.01 0.00 0.00 72.50 69.03 2bm5 s THR 148 CO 0.36 0.29 -0.06 0.68 -0.69 0.00 0.00 174.62 175.20 2bm5 s VAL 149 N 1.62 0.39 0.55 3.82 -7.23 -1.26 0.05 120.40 118.34 2bm5 s VAL 149 Ca 0.07 -1.10 -0.17 0.00 -1.81 0.00 0.00 61.98 58.97 2bm5 s VAL 149 Cb -0.15 -0.58 -0.05 0.00 0.56 0.00 0.00 36.38 36.15 2bm5 s VAL 149 CO 0.08 -0.47 1.05 -1.81 -0.31 0.00 0.00 175.10 173.63 2bm5 s ASP 150 N -1.67 6.00 0.32 4.85 1.01 -1.26 -4.95 116.67 120.97 2bm5 s ASP 150 Ca -0.10 1.86 0.08 0.00 0.71 0.00 0.00 52.55 55.09 2bm5 s ASP 150 Cb -0.08 -2.54 0.79 0.00 1.01 0.00 0.00 42.92 42.10 2bm5 s ASP 150 CO -0.01 -1.02 1.78 -0.65 0.21 0.00 0.00 175.17 175.49 2bm5 h PRO 151 N 0.86 0.69 0.00 8.23 0.11 -2.01 -0.48 132.00 139.39 2bm5 h PRO 151 Ca -0.48 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 2bm5 h PRO 151 Cb 1.22 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 2bm5 h PRO 151 CO 0.58 0.46 -0.04 -0.24 -0.21 0.00 0.00 178.00 178.54 2bm5 h VAL 152 N 0.71 0.33 -0.99 3.15 3.04 -1.96 -1.18 116.25 119.35 2bm5 h VAL 152 Ca 0.57 -0.24 0.01 0.00 -1.01 0.00 0.00 66.70 66.03 2bm5 h VAL 152 Cb 0.97 1.18 -0.05 0.00 -2.01 0.00 0.00 31.29 31.37 2bm5 h VAL 152 CO -0.36 0.04 0.65 0.25 -1.01 0.00 0.00 177.57 177.14 2bm5 h LEU 153 N 0.00 1.14 -2.60 3.16 6.46 -1.45 -2.20 115.31 119.82 2bm5 h LEU 153 Ca -0.00 -0.03 0.01 0.00 -0.12 0.00 0.00 57.88 57.73 2bm5 h LEU 153 Cb 0.17 -0.29 -0.00 0.00 -0.73 0.00 0.00 40.66 39.82 2bm5 h LEU 153 CO 0.01 0.83 0.03 -0.50 -0.62 0.00 0.00 178.44 178.19 2bm5 h TRP 154 N 1.35 0.00 -0.00 1.25 -0.00 -1.36 -0.80 115.95 116.39 2bm5 h TRP 154 Ca 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.25 2bm5 h TRP 154 Cb -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.01 2bm5 h TRP 154 CO 0.00 0.00 -0.85 0.54 -0.00 0.00 0.00 178.44 178.13 2bm5 n ARG 155 N -3.55 0.62 -0.05 0.49 1.74 -0.90 -4.72 116.66 110.29 2bm5 n ARG 155 Ca -0.02 -0.17 -0.07 0.00 -0.77 0.00 0.00 57.85 56.82 2bm5 n ARG 155 Cb 0.11 -1.43 -0.04 0.00 -1.02 0.00 0.00 32.46 30.08 2bm5 n ARG 155 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2bm5 n THR 156 N -1.22 0.51 -2.76 0.55 -2.24 -0.67 -5.03 114.28 103.42 2bm5 n THR 156 Ca 0.05 -0.19 -0.35 0.00 -2.27 0.00 0.00 64.05 61.29 2bm5 n THR 156 Cb 0.33 -0.94 -0.06 0.00 -2.10 0.00 0.00 70.33 67.55 2bm5 n THR 156 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bm5 s ALA 157 N -2.18 3.10 0.26 6.98 0.00 -0.40 -4.13 121.76 125.40 2bm5 s ALA 157 Ca -0.12 0.49 -0.29 0.00 0.00 0.00 0.00 51.96 52.03 2bm5 s ALA 157 Cb 0.03 -3.18 -0.09 0.00 0.00 0.00 0.00 23.12 19.88 2bm5 s ALA 157 CO 0.20 0.09 0.94 -1.54 0.00 0.00 0.00 175.76 175.45 2bm5 s SER 158 N -1.90 7.56 -0.00 0.00 1.04 -0.70 -4.90 113.70 114.80 2bm5 s SER 158 Ca 0.57 1.92 0.22 0.00 0.48 0.00 0.00 55.95 59.14 2bm5 s SER 158 Cb -0.14 -2.60 0.37 0.00 0.10 0.00 0.00 66.02 63.75 2bm5 s SER 158 CO 0.19 0.10 1.15 0.18 0.98 0.00 0.00 173.24 175.84 2bm5 n LEU 159 N 1.25 0.89 -4.66 2.42 4.77 -1.26 -0.47 117.00 119.94 2bm5 n LEU 159 Ca -0.01 -1.89 -0.43 0.00 -0.03 0.00 0.00 56.01 53.65 2bm5 n LEU 159 Cb 0.48 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 2bm5 n LEU 159 CO 0.48 0.48 1.28 -0.69 -1.33 0.00 0.00 177.39 177.61 2bm5 s VAL 160 N -0.04 3.82 0.00 4.08 1.01 -1.26 -1.53 120.40 126.47 2bm5 s VAL 160 Ca 0.30 0.98 0.00 0.00 0.00 0.00 0.00 61.98 63.26 2bm5 s VAL 160 Cb 0.34 -3.65 0.00 0.00 0.00 0.00 0.00 36.38 33.07 2bm5 s VAL 160 CO -0.15 -0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.46 2bm5 n GLY 161 N 4.00 1.32 3.77 4.51 0.00 -1.26 -0.80 105.19 116.72 2bm5 n GLY 161 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 2bm5 n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm5 s ALA 162 N -3.58 3.20 -0.15 4.61 0.00 -0.58 -3.93 121.76 121.33 2bm5 s ALA 162 Ca 0.00 1.32 -0.14 0.00 0.00 0.00 0.00 51.96 53.14 2bm5 s ALA 162 Cb 0.00 -3.53 -0.05 0.00 0.00 0.00 0.00 23.12 19.55 2bm5 s ALA 162 CO 0.00 -1.01 0.30 1.03 0.00 0.00 0.00 175.76 176.08 2bm5 s ARG 163 N -2.40 4.22 0.15 0.00 0.52 0.04 -4.92 118.95 116.55 2bm5 s ARG 163 Ca 0.60 0.11 0.02 0.00 -0.52 0.00 0.00 55.73 55.94 2bm5 s ARG 163 Cb -0.40 -3.41 -0.04 0.00 0.52 0.00 0.00 34.95 31.62 2bm5 s ARG 163 CO 0.51 0.27 -0.02 0.14 0.02 0.00 0.00 175.30 176.22 2bm5 s VAL 164 N 0.37 0.70 0.66 3.52 -7.23 -1.26 -0.83 120.40 116.33 2bm5 s VAL 164 Ca 0.17 -1.97 -0.00 0.00 -1.81 0.00 0.00 61.98 58.37 2bm5 s VAL 164 Cb -0.13 -1.97 0.13 0.00 0.56 0.00 0.00 36.38 34.97 2bm5 s VAL 164 CO 0.04 -0.61 0.91 -0.90 -0.31 0.00 0.00 175.10 174.24 2bm5 n ASP 165 N -0.18 1.21 -0.11 4.85 5.68 -1.26 -4.88 116.55 121.86 2bm5 n ASP 165 Ca -0.08 -2.02 -0.09 0.00 -0.50 0.00 0.00 54.79 52.10 2bm5 n ASP 165 Cb 0.62 -0.59 -0.01 0.00 -1.14 0.00 0.00 41.12 40.00 2bm5 n ASP 165 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 2bm5 h VAL 166 N -0.60 1.13 -0.16 2.12 2.07 -2.01 -1.87 116.25 116.92 2bm5 h VAL 166 Ca -0.30 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 66.90 2bm5 h VAL 166 Cb 1.11 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 2bm5 h VAL 166 CO 0.32 0.13 0.02 0.44 0.02 0.00 0.00 177.57 178.50 2bm5 h ASP 167 N 0.46 0.20 -0.04 0.57 3.32 -1.99 -1.28 116.42 117.66 2bm5 h ASP 167 Ca 0.13 -0.02 -0.12 0.00 0.02 0.00 0.00 57.03 57.03 2bm5 h ASP 167 Cb 0.02 -0.05 0.01 0.00 0.22 0.00 0.00 39.33 39.53 2bm5 h ASP 167 CO -0.02 0.23 -0.46 1.56 -1.72 0.00 0.00 179.24 178.83 2bm5 h GLN 168 N 0.23 0.39 -1.00 3.56 4.20 -1.89 -1.88 115.11 118.71 2bm5 h GLN 168 Ca 0.06 -0.36 0.01 0.00 0.06 0.00 0.00 58.65 58.41 2bm5 h GLN 168 Cb 0.12 0.09 -0.05 0.00 0.30 0.00 0.00 27.48 27.94 2bm5 h GLN 168 CO -0.00 1.02 0.65 0.00 -0.67 0.00 0.00 178.83 179.83 2bm5 h ALA 169 N 0.38 1.27 -0.48 3.87 0.00 -1.05 0.24 119.26 123.50 2bm5 h ALA 169 Ca -0.05 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2bm5 h ALA 169 Cb 1.14 -0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 2bm5 h ALA 169 CO 0.09 0.67 0.22 0.28 0.00 0.00 0.00 179.25 180.51 2bm5 h VAL 170 N 1.35 1.20 -0.49 0.00 2.07 -1.22 -1.63 116.25 117.53 2bm5 h VAL 170 Ca 0.36 -0.57 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 2bm5 h VAL 170 Cb -0.14 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 2bm5 h VAL 170 CO -0.08 0.22 0.14 0.00 0.02 0.00 0.00 177.57 177.88 2bm5 h ALA 171 N 1.06 1.34 -0.31 1.67 0.00 -0.56 0.11 119.26 122.58 2bm5 h ALA 171 Ca 0.16 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2bm5 h ALA 171 Cb 0.14 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2bm5 h ALA 171 CO -0.02 0.48 0.15 0.35 0.00 0.00 0.00 179.25 180.22 2bm5 h PHE 172 N 0.71 0.43 -0.60 0.00 3.57 -0.01 0.39 116.94 121.43 2bm5 h PHE 172 Ca 0.16 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 2bm5 h PHE 172 Cb 0.23 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.80 2bm5 h PHE 172 CO 0.01 0.37 0.31 0.00 -2.23 0.00 0.00 178.31 176.77 2bm5 h ALA 173 N 1.02 0.77 -0.32 2.41 0.00 -0.73 -2.18 119.26 120.22 2bm5 h ALA 173 Ca 0.11 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 2bm5 h ALA 173 Cb 0.10 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2bm5 h ALA 173 CO -0.01 0.31 -0.09 0.00 0.00 0.00 0.00 179.25 179.45 2bm5 h ALA 174 N 1.14 1.25 0.00 0.00 0.00 -0.64 -1.53 119.26 119.47 2bm5 h ALA 174 Ca 0.21 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2bm5 h ALA 174 Cb 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2bm5 h ALA 174 CO -0.03 0.49 0.00 0.00 0.00 0.00 0.00 179.25 179.71 2bm5 h ALA 175 N 1.41 1.00 -0.54 0.00 0.00 0.35 -1.52 119.26 119.96 2bm5 h ALA 175 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2bm5 h ALA 175 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2bm5 h ALA 175 CO 0.03 0.00 0.00 0.72 0.00 0.00 0.00 179.25 180.00 2bm5 n HIS 176 N -2.65 1.36 -0.60 0.00 8.25 -0.75 -4.86 115.22 115.98 2bm5 n HIS 176 Ca 0.01 -0.66 0.00 0.00 -0.26 0.00 0.00 57.72 56.81 2bm5 n HIS 176 Cb 0.26 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 31.10 2bm5 n HIS 176 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bm5 n GLY 177 N 0.72 0.76 3.81 -1.41 0.00 -0.57 -5.07 105.19 103.44 2bm5 n GLY 177 Ca 0.24 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.92 2bm5 n GLY 177 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bm5 s LEU 178 N 0.00 4.03 -0.32 0.99 1.02 -0.65 -4.99 118.68 118.75 2bm5 s LEU 178 Ca 0.00 1.74 -0.05 0.00 0.02 0.00 0.00 54.13 55.84 2bm5 s LEU 178 Cb 0.00 -4.42 0.04 0.00 0.02 0.00 0.00 46.19 41.83 2bm5 s LEU 178 CO 0.00 -0.32 0.08 0.00 0.02 0.00 0.00 176.35 176.12 2bm5 s LEU 180 N 1.38 4.38 -0.04 0.00 2.96 -1.26 -4.99 118.68 121.10 2bm5 s LEU 180 Ca -0.02 2.85 0.02 0.00 -0.22 0.00 0.00 54.13 56.76 2bm5 s LEU 180 Cb -0.19 -3.59 0.01 0.00 0.50 0.00 0.00 46.19 42.91 2bm5 s LEU 180 CO 0.02 -0.98 -0.10 0.00 -1.32 0.00 0.00 176.35 173.96 2bm5 s ALA 181 N 1.55 1.00 0.80 5.97 0.00 -1.26 -5.13 121.76 124.68 2bm5 s ALA 181 Ca 0.76 -0.34 -0.11 0.00 0.00 0.00 0.00 51.96 52.28 2bm5 s ALA 181 Cb -0.49 -0.42 0.07 0.00 0.00 0.00 0.00 23.12 22.28 2bm5 s ALA 181 CO 0.33 0.12 1.09 0.20 0.00 0.00 0.00 175.76 177.50 2bm5 s GLY 182 N 0.44 1.65 0.00 0.00 0.00 -1.26 -5.35 107.32 102.80 2bm5 s GLY 182 Ca -0.08 0.12 0.00 0.00 0.00 0.00 0.00 44.72 44.76 2bm5 s GLY 182 CO 0.02 0.51 0.00 0.61 0.00 0.00 0.00 173.10 174.23