#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bm4 s TRP 4 N 0.00 3.35 -0.12 1.08 0.51 -0.82 -4.99 118.94 117.95 2bm4 s TRP 4 Ca 0.00 -1.58 -0.04 0.00 -2.12 0.00 0.00 56.10 52.35 2bm4 s TRP 4 Cb 0.00 -2.94 -0.04 0.00 -0.81 0.00 0.00 33.47 29.68 2bm4 s TRP 4 CO 0.00 -0.85 0.04 0.08 -0.51 0.00 0.00 176.95 175.71 2bm4 s VAL 5 N 1.40 4.63 -0.74 4.03 1.01 -1.26 -0.64 120.40 128.83 2bm4 s VAL 5 Ca 0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 61.98 61.87 2bm4 s VAL 5 Cb -0.23 -3.01 0.03 0.00 0.00 0.00 0.00 36.38 33.17 2bm4 s VAL 5 CO 0.02 0.56 0.12 0.47 0.00 0.00 0.00 175.10 176.27 2bm4 n ASP 6 N 2.60 -2.68 -4.96 3.32 10.43 0.37 -4.90 116.55 120.73 2bm4 n ASP 6 Ca -0.18 0.13 -0.22 0.00 2.57 0.00 0.00 54.79 57.09 2bm4 n ASP 6 Cb 0.53 -2.32 -0.02 0.00 1.84 0.00 0.00 41.12 41.16 2bm4 n ASP 6 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2bm4 s GLU 8 N -4.01 -0.06 0.19 0.00 2.12 -1.26 -0.71 118.70 114.97 2bm4 s GLU 8 Ca 0.36 0.41 0.11 0.00 0.36 0.00 0.00 54.97 56.21 2bm4 s GLU 8 Cb -0.09 -0.48 -0.04 0.00 0.26 0.00 0.00 34.13 33.78 2bm4 s GLU 8 CO 0.31 -0.33 -0.24 -0.06 -0.54 0.00 0.00 175.26 174.40 2bm4 s PHE 9 N 2.19 2.28 -0.10 5.30 0.08 0.20 -4.97 117.98 122.96 2bm4 s PHE 9 Ca 0.05 -0.37 -0.09 0.00 0.12 0.00 0.00 56.93 56.64 2bm4 s PHE 9 Cb -0.12 -1.14 0.03 0.00 -0.57 0.00 0.00 43.02 41.22 2bm4 s PHE 9 CO -0.04 0.48 0.26 0.99 -0.10 0.00 0.00 175.22 176.81 2bm4 s THR 10 N -1.63 -0.00 -1.27 0.64 2.01 -1.26 -0.78 115.64 113.35 2bm4 s THR 10 Ca 0.20 0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.21 2bm4 s THR 10 Cb -0.08 -0.36 0.00 0.00 0.01 0.00 0.00 72.50 72.07 2bm4 s THR 10 CO 0.09 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.64 2bm4 n GLY 11 N 3.01 1.13 3.78 4.40 0.00 0.10 -4.91 105.19 112.70 2bm4 n GLY 11 Ca -0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 2bm4 n GLY 11 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bm4 s ARG 12 N -3.02 4.52 -0.38 1.61 1.81 -1.25 -4.85 118.95 117.39 2bm4 s ARG 12 Ca 0.00 1.15 -0.15 0.00 -1.72 0.00 0.00 55.73 55.01 2bm4 s ARG 12 Cb 0.00 -3.08 0.00 0.00 -0.45 0.00 0.00 34.95 31.42 2bm4 s ARG 12 CO 0.00 0.47 0.31 0.34 -0.68 0.00 0.00 175.30 175.74 2bm4 s ASP 13 N -1.36 6.12 -0.10 0.23 -1.08 -1.26 -1.35 116.67 117.86 2bm4 s ASP 13 Ca 0.41 -0.64 0.14 0.00 -0.52 0.00 0.00 52.55 51.94 2bm4 s ASP 13 Cb -0.21 -2.17 0.48 0.00 -1.46 0.00 0.00 42.92 39.56 2bm4 s ASP 13 CO 0.25 -0.39 1.39 0.49 0.52 0.00 0.00 175.17 177.44 2bm4 n PHE 14 N 5.23 0.86 -1.65 -5.34 3.72 -0.44 -4.97 117.46 114.88 2bm4 n PHE 14 Ca -0.11 -0.69 -0.54 0.00 -0.05 0.00 0.00 57.45 56.06 2bm4 n PHE 14 Cb 0.48 -0.20 -0.06 0.00 -0.94 0.00 0.00 39.48 38.76 2bm4 n PHE 14 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2bm4 n ARG 15 N 0.14 1.23 -0.85 -1.08 1.74 -1.13 -1.95 116.66 114.77 2bm4 n ARG 15 Ca 0.18 0.45 0.00 0.00 -0.77 0.00 0.00 57.85 57.71 2bm4 n ARG 15 Cb 0.72 -2.12 0.00 0.00 -1.02 0.00 0.00 32.46 30.04 2bm4 n ARG 15 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2bm4 n ASP 16 N 3.90 -0.88 -4.79 0.55 8.00 -1.09 -4.95 116.55 117.29 2bm4 n ASP 16 Ca 0.22 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.38 2bm4 n ASP 16 Cb 0.17 -1.13 -0.03 0.00 -0.02 0.00 0.00 41.12 40.12 2bm4 n ASP 16 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2bm4 s GLU 17 N -0.47 3.78 -0.38 -1.24 2.02 -0.82 -4.81 118.70 116.77 2bm4 s GLU 17 Ca 0.00 1.40 -0.17 0.00 0.02 0.00 0.00 54.97 56.22 2bm4 s GLU 17 Cb 0.00 -2.11 0.01 0.00 0.10 0.00 0.00 34.13 32.13 2bm4 s GLU 17 CO 0.00 -0.46 0.43 0.34 0.02 0.00 0.00 175.26 175.60 2bm4 s ASP 18 N -1.93 6.21 -0.18 -0.19 2.15 -1.26 -1.30 116.67 120.17 2bm4 s ASP 18 Ca 0.67 -0.41 0.13 0.00 0.43 0.00 0.00 52.55 53.37 2bm4 s ASP 18 Cb -0.17 -2.23 0.42 0.00 -0.30 0.00 0.00 42.92 40.64 2bm4 s ASP 18 CO 0.21 -0.49 1.21 0.18 -0.17 0.00 0.00 175.17 176.11 2bm4 n LEU 19 N 5.58 2.47 -4.77 -1.34 4.77 0.20 -4.93 117.00 118.98 2bm4 n LEU 19 Ca -0.07 -3.63 -0.41 0.00 -0.03 0.00 0.00 56.01 51.87 2bm4 n LEU 19 Cb 0.48 -0.45 -0.01 0.00 -2.33 0.00 0.00 43.42 41.10 2bm4 n LEU 19 CO 0.44 1.28 1.05 -0.94 -1.33 0.00 0.00 177.39 177.89 2bm4 s SER 20 N -3.06 6.60 -0.59 -1.43 1.04 0.08 -2.14 113.70 114.21 2bm4 s SER 20 Ca 0.37 2.82 0.00 0.00 0.48 0.00 0.00 55.95 59.63 2bm4 s SER 20 Cb 0.37 -2.65 0.00 0.00 0.10 0.00 0.00 66.02 63.84 2bm4 s SER 20 CO -0.08 -0.67 0.00 0.54 0.98 0.00 0.00 173.24 174.00 2bm4 n ARG 21 N 0.79 -0.67 -2.12 4.02 1.74 -0.07 -4.94 116.66 115.41 2bm4 n ARG 21 Ca 0.01 0.59 -0.38 0.00 -0.77 0.00 0.00 57.85 57.29 2bm4 n ARG 21 Cb 0.41 -4.36 -0.00 0.00 -1.02 0.00 0.00 32.46 27.48 2bm4 n ARG 21 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2bm4 s LEU 22 N -1.26 4.12 -0.22 0.55 2.96 -0.91 -4.70 118.68 119.22 2bm4 s LEU 22 Ca 0.00 2.52 0.01 0.00 -0.22 0.00 0.00 54.13 56.44 2bm4 s LEU 22 Cb 0.00 -4.05 0.05 0.00 0.50 0.00 0.00 46.19 42.69 2bm4 s LEU 22 CO 0.00 -0.91 -0.08 -1.00 -1.32 0.00 0.00 176.35 173.04 2bm4 s HIS 23 N -1.36 2.43 0.20 5.38 3.76 -1.25 0.15 115.29 124.59 2bm4 s HIS 23 Ca 0.60 -1.70 0.07 0.00 -0.15 0.00 0.00 55.06 53.88 2bm4 s HIS 23 Cb -0.35 -1.61 -0.04 0.00 1.11 0.00 0.00 32.58 31.70 2bm4 s HIS 23 CO 0.43 -0.76 0.08 0.95 -0.85 0.00 0.00 174.74 174.59 2bm4 s THR 24 N 1.39 4.08 -0.23 1.30 -4.23 0.77 -1.94 115.64 116.78 2bm4 s THR 24 Ca -0.04 -1.38 -0.04 0.00 -1.18 0.00 0.00 61.69 59.05 2bm4 s THR 24 Cb -0.18 -3.11 0.12 0.00 1.34 0.00 0.00 72.50 70.67 2bm4 s THR 24 CO -0.07 -0.19 0.40 -0.70 -0.54 0.00 0.00 174.62 173.52 2bm4 s GLU 25 N -3.28 0.35 -1.60 3.99 2.12 0.19 -1.80 118.70 118.67 2bm4 s GLU 25 Ca 0.30 0.73 0.00 0.00 0.36 0.00 0.00 54.97 56.36 2bm4 s GLU 25 Cb -0.09 -0.14 0.00 0.00 0.26 0.00 0.00 34.13 34.16 2bm4 s GLU 25 CO 0.22 -0.51 0.00 0.54 -0.54 0.00 0.00 175.26 174.97 2bm4 n ARG 26 N 5.38 -1.11 -2.89 4.30 1.74 -0.69 0.14 116.66 123.53 2bm4 n ARG 26 Ca -0.05 1.03 -0.38 0.00 -0.77 0.00 0.00 57.85 57.68 2bm4 n ARG 26 Cb 0.50 -5.19 -0.06 0.00 -1.02 0.00 0.00 32.46 26.69 2bm4 n ARG 26 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2bm4 s ALA 27 N -2.53 3.33 -0.04 7.54 0.00 -1.25 -3.80 121.76 125.00 2bm4 s ALA 27 Ca 0.00 0.43 -0.00 0.00 0.00 0.00 0.00 51.96 52.39 2bm4 s ALA 27 Cb 0.00 -3.06 0.03 0.00 0.00 0.00 0.00 23.12 20.09 2bm4 s ALA 27 CO 0.00 0.24 0.00 -1.64 0.00 0.00 0.00 175.76 174.36 2bm4 s MET 28 N -1.70 0.41 -0.15 0.00 -1.94 0.11 -1.31 119.30 114.73 2bm4 s MET 28 Ca 0.44 0.10 -0.03 0.00 -1.71 0.00 0.00 55.69 54.49 2bm4 s MET 28 Cb -0.20 -0.67 -0.02 0.00 2.01 0.00 0.00 34.83 35.94 2bm4 s MET 28 CO 0.25 -0.20 -0.06 -0.06 -0.01 0.00 0.00 175.02 174.94 2bm4 s PHE 29 N 1.41 2.97 -0.09 -0.03 0.08 0.54 -0.63 117.98 122.22 2bm4 s PHE 29 Ca -0.04 -0.38 0.03 0.00 0.12 0.00 0.00 56.93 56.65 2bm4 s PHE 29 Cb -0.13 -1.92 0.01 0.00 -0.57 0.00 0.00 43.02 40.41 2bm4 s PHE 29 CO -0.03 -0.07 -0.16 -1.12 -0.10 0.00 0.00 175.22 173.74 2bm4 s SER 30 N 0.33 2.36 -1.27 1.36 0.01 0.04 -0.25 113.70 116.28 2bm4 s SER 30 Ca -0.06 -0.41 -0.22 0.00 1.31 0.00 0.00 55.95 56.57 2bm4 s SER 30 Cb -0.15 -1.07 0.02 0.00 0.21 0.00 0.00 66.02 65.03 2bm4 s SER 30 CO 0.04 0.06 0.57 -0.62 0.41 0.00 0.00 173.24 173.70 2bm4 n GLU 31 N 3.86 -0.91 -4.23 12.44 4.71 -0.27 0.01 120.64 136.25 2bm4 n GLU 31 Ca -0.21 0.20 -0.23 0.00 -0.01 0.00 0.00 57.16 56.91 2bm4 n GLU 31 Cb 0.52 -3.28 -0.06 0.00 -1.01 0.00 0.00 31.44 27.61 2bm4 n GLU 31 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2bm4 s ASP 33 N -3.66 4.59 -0.18 0.00 -1.08 -0.45 -0.32 116.67 115.56 2bm4 s ASP 33 Ca 0.32 -0.98 0.16 0.00 -0.52 0.00 0.00 52.55 51.52 2bm4 s ASP 33 Cb -0.07 -1.70 0.59 0.00 -1.46 0.00 0.00 42.92 40.28 2bm4 s ASP 33 CO 0.21 -0.18 1.49 0.49 0.52 0.00 0.00 175.17 177.71 2bm4 n PHE 34 N 4.68 1.19 -1.72 -5.34 3.72 0.11 -1.33 117.46 118.75 2bm4 n PHE 34 Ca -0.15 -0.83 -0.42 0.00 -0.05 0.00 0.00 57.45 56.00 2bm4 n PHE 34 Cb 0.46 -0.35 -0.02 0.00 -0.94 0.00 0.00 39.48 38.63 2bm4 n PHE 34 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2bm4 n SER 35 N -0.19 3.78 0.00 4.37 7.64 -1.12 -0.67 113.62 127.43 2bm4 n SER 35 Ca 0.22 1.11 0.00 0.00 1.01 0.00 0.00 58.87 61.21 2bm4 n SER 35 Cb 0.94 -1.56 0.00 0.00 -1.01 0.00 0.00 64.21 62.58 2bm4 n SER 35 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bm4 n GLY 36 N 2.94 0.61 3.79 0.23 0.00 -0.22 -2.65 105.19 109.89 2bm4 n GLY 36 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2bm4 n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bm4 s VAL 37 N -2.65 3.50 -0.42 1.61 1.01 0.16 -4.10 120.40 119.51 2bm4 s VAL 37 Ca 0.00 0.73 -0.08 0.00 0.00 0.00 0.00 61.98 62.63 2bm4 s VAL 37 Cb 0.00 -3.25 0.09 0.00 0.00 0.00 0.00 36.38 33.22 2bm4 s VAL 37 CO 0.00 -0.40 0.26 0.21 0.00 0.00 0.00 175.10 175.17 2bm4 s ASN 38 N -2.59 5.57 -0.23 3.32 2.47 -0.42 -1.40 114.94 121.66 2bm4 s ASN 38 Ca 0.66 -1.65 0.13 0.00 0.42 0.00 0.00 52.86 52.42 2bm4 s ASN 38 Cb -0.19 -1.96 0.50 0.00 -1.45 0.00 0.00 41.25 38.15 2bm4 s ASN 38 CO 0.38 -0.56 1.42 0.18 -3.72 0.00 0.00 177.10 174.80 2bm4 n LEU 39 N 4.86 3.87 -4.54 3.21 4.77 -0.25 0.61 117.00 129.52 2bm4 n LEU 39 Ca -0.09 -3.41 -0.45 0.00 -0.03 0.00 0.00 56.01 52.03 2bm4 n LEU 39 Cb 0.42 -0.58 -0.02 0.00 -2.33 0.00 0.00 43.42 40.91 2bm4 n LEU 39 CO 0.38 0.97 0.41 0.00 -1.33 0.00 0.00 177.39 177.82 2bm4 n ALA 40 N -0.91 -0.94 -4.22 -1.18 0.00 -1.21 -1.33 120.51 110.73 2bm4 n ALA 40 Ca 0.27 0.40 -0.36 0.00 0.00 0.00 0.00 53.44 53.74 2bm4 n ALA 40 Cb 0.94 -1.91 -0.05 0.00 0.00 0.00 0.00 19.45 18.43 2bm4 n ALA 40 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2bm4 n GLU 41 N 0.78 -1.82 -2.42 0.00 1.02 -0.70 -0.89 120.64 116.62 2bm4 n GLU 41 Ca 0.12 0.22 -0.26 0.00 -0.02 0.00 0.00 57.16 57.22 2bm4 n GLU 41 Cb 0.30 -4.86 0.03 0.00 -0.02 0.00 0.00 31.44 26.90 2bm4 n GLU 41 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2bm4 s SER 42 N -3.13 5.62 0.04 1.62 1.04 -0.44 -3.10 113.70 115.34 2bm4 s SER 42 Ca 0.72 0.70 0.04 0.00 0.48 0.00 0.00 55.95 57.90 2bm4 s SER 42 Cb -0.41 -1.71 -0.02 0.00 0.10 0.00 0.00 66.02 63.98 2bm4 s SER 42 CO 0.88 -1.04 -0.12 -1.10 0.98 0.00 0.00 173.24 172.84 2bm4 s GLN 43 N -4.97 0.83 -0.21 4.02 -0.21 0.39 -0.19 119.66 119.32 2bm4 s GLN 43 Ca 0.54 -0.72 -0.17 0.00 0.02 0.00 0.00 55.36 55.02 2bm4 s GLN 43 Cb -0.10 -0.80 0.06 0.00 1.00 0.00 0.00 33.01 33.16 2bm4 s GLN 43 CO 0.45 0.19 0.54 -1.01 -2.12 0.00 0.00 175.29 173.34 2bm4 s HIS 44 N -0.89 -0.67 -0.03 0.91 3.76 -1.01 -0.16 115.29 117.20 2bm4 s HIS 44 Ca -0.00 1.53 -0.01 0.00 -0.15 0.00 0.00 55.06 56.42 2bm4 s HIS 44 Cb -0.08 0.28 0.03 0.00 1.11 0.00 0.00 32.58 33.92 2bm4 s HIS 44 CO 0.01 -0.33 0.04 0.50 -0.85 0.00 0.00 174.74 174.11 2bm4 s ARG 45 N 0.70 -0.05 -0.29 1.40 3.52 -0.75 -1.19 118.95 122.29 2bm4 s ARG 45 Ca -0.03 0.28 0.00 0.00 -0.13 0.00 0.00 55.73 55.85 2bm4 s ARG 45 Cb -0.05 -0.39 0.00 0.00 -1.56 0.00 0.00 34.95 32.95 2bm4 s ARG 45 CO -0.05 -0.25 0.00 0.41 -0.81 0.00 0.00 175.30 174.60 2bm4 n GLY 46 N 4.75 0.48 3.92 8.12 0.00 0.19 -1.70 105.19 120.96 2bm4 n GLY 46 Ca -0.15 -0.13 -0.27 0.00 0.00 0.00 0.00 46.02 45.47 2bm4 n GLY 46 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bm4 s SER 47 N -2.22 6.37 0.01 1.61 0.01 -1.25 -3.89 113.70 114.34 2bm4 s SER 47 Ca 0.00 0.59 0.08 0.00 1.31 0.00 0.00 55.95 57.93 2bm4 s SER 47 Cb 0.00 -2.09 -0.02 0.00 0.21 0.00 0.00 66.02 64.11 2bm4 s SER 47 CO 0.00 -0.24 -0.25 0.00 0.41 0.00 0.00 173.24 173.16 2bm4 s ALA 48 N -2.19 2.07 -0.45 1.44 0.00 -0.43 -1.26 121.76 120.94 2bm4 s ALA 48 Ca 0.42 -1.13 0.03 0.00 0.00 0.00 0.00 51.96 51.27 2bm4 s ALA 48 Cb -0.10 -0.48 0.13 0.00 0.00 0.00 0.00 23.12 22.67 2bm4 s ALA 48 CO 0.33 0.50 0.23 -0.06 0.00 0.00 0.00 175.76 176.76 2bm4 s PHE 49 N -0.69 2.36 -0.19 0.00 0.08 0.13 -0.34 117.98 119.32 2bm4 s PHE 49 Ca 0.10 -2.62 -0.17 0.00 0.12 0.00 0.00 56.93 54.36 2bm4 s PHE 49 Cb -0.10 -2.17 -0.04 0.00 -0.57 0.00 0.00 43.02 40.14 2bm4 s PHE 49 CO 0.01 -0.78 0.43 0.50 -0.10 0.00 0.00 175.22 175.28 2bm4 s ARG 50 N 0.24 4.21 -1.15 0.44 3.52 0.65 -3.46 118.95 123.41 2bm4 s ARG 50 Ca 0.17 0.28 -0.10 0.00 -0.13 0.00 0.00 55.73 55.95 2bm4 s ARG 50 Cb -0.25 -3.52 0.08 0.00 -1.56 0.00 0.00 34.95 29.71 2bm4 s ARG 50 CO -0.01 -0.02 0.39 0.09 -0.81 0.00 0.00 175.30 174.95 2bm4 n ASN 51 N 4.37 -2.94 -4.92 -2.12 4.13 0.12 -1.11 115.26 112.79 2bm4 n ASN 51 Ca -0.08 -0.34 -0.26 0.00 1.68 0.00 0.00 54.58 55.58 2bm4 n ASN 51 Cb 0.51 -2.49 0.01 0.00 -1.54 0.00 0.00 39.78 36.28 2bm4 n ASN 51 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2bm4 s THR 53 N -2.78 4.20 -0.59 0.00 2.01 0.57 -1.68 115.64 117.36 2bm4 s THR 53 Ca 0.49 -0.23 0.04 0.00 0.31 0.00 0.00 61.69 62.31 2bm4 s THR 53 Cb -0.10 -2.91 0.16 0.00 0.01 0.00 0.00 72.50 69.65 2bm4 s THR 53 CO 0.43 0.41 0.40 -0.36 -0.69 0.00 0.00 174.62 174.82 2bm4 s PHE 54 N 1.05 2.85 -0.24 4.92 0.08 -0.22 0.04 117.98 126.45 2bm4 s PHE 54 Ca 0.03 -3.01 -0.06 0.00 0.12 0.00 0.00 56.93 54.01 2bm4 s PHE 54 Cb -0.14 -2.27 -0.02 0.00 -0.57 0.00 0.00 43.02 40.01 2bm4 s PHE 54 CO 0.02 -0.65 0.04 -1.21 -0.10 0.00 0.00 175.22 173.32 2bm4 s GLU 55 N -0.79 3.56 -1.38 0.44 2.02 -1.26 -0.75 118.70 120.53 2bm4 s GLU 55 Ca 0.24 -0.53 -0.09 0.00 0.02 0.00 0.00 54.97 54.61 2bm4 s GLU 55 Cb -0.08 -3.23 0.02 0.00 0.10 0.00 0.00 34.13 30.94 2bm4 s GLU 55 CO -0.13 -0.20 1.16 0.54 0.02 0.00 0.00 175.26 176.65 2bm4 n ARG 56 N 4.89 -7.68 -3.38 1.61 1.74 0.16 -1.05 116.66 112.95 2bm4 n ARG 56 Ca -0.17 0.80 -0.34 0.00 -0.77 0.00 0.00 57.85 57.37 2bm4 n ARG 56 Cb 0.51 -5.84 -0.06 0.00 -1.02 0.00 0.00 32.46 26.05 2bm4 n ARG 56 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2bm4 s THR 57 N -3.32 4.88 -0.30 0.55 2.01 -1.26 -2.55 115.64 115.66 2bm4 s THR 57 Ca 0.59 0.71 -0.11 0.00 0.31 0.00 0.00 61.69 63.19 2bm4 s THR 57 Cb -0.26 -3.69 -0.03 0.00 0.01 0.00 0.00 72.50 68.52 2bm4 s THR 57 CO 0.74 0.14 0.19 -0.89 -0.69 0.00 0.00 174.62 174.11 2bm4 s THR 58 N -1.58 5.08 0.00 -0.82 2.01 -0.49 -1.14 115.64 118.71 2bm4 s THR 58 Ca 0.41 -0.07 0.00 0.00 0.31 0.00 0.00 61.69 62.34 2bm4 s THR 58 Cb -0.14 -3.50 0.00 0.00 0.01 0.00 0.00 72.50 68.88 2bm4 s THR 58 CO 0.20 0.16 0.53 0.18 -0.69 0.00 0.00 174.62 174.99 2bm4 n LEU 59 N 5.05 0.97 -4.71 4.42 4.77 0.94 -1.09 117.00 127.34 2bm4 n LEU 59 Ca -0.14 -0.97 -0.40 0.00 -0.03 0.00 0.00 56.01 54.47 2bm4 n LEU 59 Cb 0.51 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.62 2bm4 n LEU 59 CO 0.34 0.24 0.90 -2.67 -1.33 0.00 0.00 177.39 174.87 2bm4 n TRP 60 N -0.12 2.13 -0.97 -1.77 2.14 -0.94 -2.11 117.44 115.80 2bm4 n TRP 60 Ca 0.00 0.48 0.00 0.00 2.07 0.00 0.00 57.50 60.05 2bm4 n TRP 60 Cb 0.14 -2.37 0.00 0.00 -0.81 0.00 0.00 31.31 28.28 2bm4 n TRP 60 CO 0.00 0.00 0.00 0.72 2.07 0.00 0.00 177.69 180.48 2bm4 n HIS 61 N -0.44 0.00 -2.28 -2.67 8.25 0.95 -1.72 115.22 117.32 2bm4 n HIS 61 Ca 0.07 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.28 2bm4 n HIS 61 Cb 0.41 -1.12 0.09 0.00 1.12 0.00 0.00 29.99 30.49 2bm4 n HIS 61 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2bm4 s SER 62 N -2.04 4.57 -0.04 0.41 1.04 -0.90 -3.69 113.70 113.05 2bm4 s SER 62 Ca 0.00 0.24 0.04 0.00 0.48 0.00 0.00 55.95 56.71 2bm4 s SER 62 Cb 0.00 -0.79 -0.00 0.00 0.10 0.00 0.00 66.02 65.33 2bm4 s SER 62 CO 0.00 -1.74 -0.17 -0.89 0.98 0.00 0.00 173.24 171.42 2bm4 s THR 63 N -3.26 1.39 -0.15 2.02 2.01 0.73 -2.12 115.64 116.26 2bm4 s THR 63 Ca 0.63 -0.70 -0.00 0.00 0.31 0.00 0.00 61.69 61.92 2bm4 s THR 63 Cb -0.09 -1.19 0.04 0.00 0.01 0.00 0.00 72.50 71.27 2bm4 s THR 63 CO 0.45 0.40 -0.06 -0.36 -0.69 0.00 0.00 174.62 174.36 2bm4 s PHE 64 N -0.02 1.69 -0.08 4.92 0.08 0.12 -2.40 117.98 122.30 2bm4 s PHE 64 Ca -0.02 -1.02 0.05 0.00 0.12 0.00 0.00 56.93 56.05 2bm4 s PHE 64 Cb -0.11 -1.32 -0.00 0.00 -0.57 0.00 0.00 43.02 41.02 2bm4 s PHE 64 CO 0.02 -0.60 -0.24 0.00 -0.10 0.00 0.00 175.22 174.30 2bm4 s ALA 65 N 1.64 2.14 -0.54 5.36 0.00 -0.33 -0.95 121.76 129.08 2bm4 s ALA 65 Ca 0.02 -0.98 -0.29 0.00 0.00 0.00 0.00 51.96 50.70 2bm4 s ALA 65 Cb -0.14 -0.75 0.04 0.00 0.00 0.00 0.00 23.12 22.26 2bm4 s ALA 65 CO -0.08 0.33 0.65 0.94 0.00 0.00 0.00 175.76 177.60 2bm4 n GLN 66 N 3.32 -1.85 -3.98 0.00 7.27 0.57 -2.09 117.38 120.63 2bm4 n GLN 66 Ca -0.19 1.29 -0.08 0.00 0.07 0.00 0.00 57.00 58.09 2bm4 n GLN 66 Cb 0.53 -2.24 -0.09 0.00 2.41 0.00 0.00 30.24 30.85 2bm4 n GLN 66 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2bm4 s SER 68 N -2.58 4.01 -0.12 0.00 0.15 -0.39 -0.94 113.70 113.83 2bm4 s SER 68 Ca 0.01 -0.21 0.16 0.00 0.70 0.00 0.00 55.95 56.62 2bm4 s SER 68 Cb 0.03 -0.83 0.28 0.00 -1.71 0.00 0.00 66.02 63.79 2bm4 s SER 68 CO -0.08 0.34 1.14 0.23 1.20 0.00 0.00 173.24 176.07 2bm4 n MET 69 N 2.25 1.17 -1.49 5.44 2.81 0.70 0.18 117.12 128.19 2bm4 n MET 69 Ca -0.17 -2.49 -0.58 0.00 -1.81 0.00 0.00 57.70 52.65 2bm4 n MET 69 Cb 0.52 -1.40 -0.08 0.00 -0.71 0.00 0.00 33.22 31.55 2bm4 n MET 69 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 2bm4 n LEU 70 N -1.25 0.84 -0.13 4.03 0.00 -1.22 -1.31 117.00 117.96 2bm4 n LEU 70 Ca 0.15 1.04 -0.02 0.00 0.00 0.00 0.00 56.01 57.17 2bm4 n LEU 70 Cb 0.66 -0.78 -0.01 0.00 0.00 0.00 0.00 43.42 43.29 2bm4 n LEU 70 CO 0.00 -0.93 -0.02 0.61 0.00 0.00 0.00 177.39 177.06 2bm4 n GLY 71 N 3.04 0.18 3.81 -3.96 0.00 -0.71 -0.70 105.19 106.84 2bm4 n GLY 71 Ca 0.25 -0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.92 2bm4 n GLY 71 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bm4 s SER 72 N -2.06 7.07 -0.28 1.61 0.01 -0.43 -3.91 113.70 115.70 2bm4 s SER 72 Ca 0.00 1.74 -0.08 0.00 1.31 0.00 0.00 55.95 58.93 2bm4 s SER 72 Cb 0.00 -2.55 -0.01 0.00 0.21 0.00 0.00 66.02 63.67 2bm4 s SER 72 CO 0.00 -0.27 0.09 -0.69 0.41 0.00 0.00 173.24 172.79 2bm4 s VAL 73 N -1.99 4.24 -0.23 3.43 1.01 -0.68 -0.52 120.40 125.67 2bm4 s VAL 73 Ca 0.58 -0.42 -0.07 0.00 0.00 0.00 0.00 61.98 62.07 2bm4 s VAL 73 Cb -0.12 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 2bm4 s VAL 73 CO 0.17 0.18 0.05 -0.36 0.00 0.00 0.00 175.10 175.14 2bm4 s PHE 74 N 1.57 3.09 -0.14 5.22 0.08 0.19 -1.05 117.98 126.94 2bm4 s PHE 74 Ca 0.05 -0.38 0.00 0.00 0.12 0.00 0.00 56.93 56.72 2bm4 s PHE 74 Cb -0.16 -2.18 0.02 0.00 -0.57 0.00 0.00 43.02 40.13 2bm4 s PHE 74 CO 0.04 -0.28 -0.13 0.08 -0.10 0.00 0.00 175.22 174.83 2bm4 s VAL 75 N 1.33 1.49 -1.37 -0.44 1.01 0.07 -4.45 120.40 118.05 2bm4 s VAL 75 Ca 0.05 -0.59 -0.15 0.00 0.00 0.00 0.00 61.98 61.29 2bm4 s VAL 75 Cb -0.15 -1.41 0.02 0.00 0.00 0.00 0.00 36.38 34.84 2bm4 s VAL 75 CO 0.03 0.44 0.39 0.00 0.00 0.00 0.00 175.10 175.96 2bm4 n ALA 76 N 4.73 -2.28 -2.47 5.51 0.00 -1.26 0.39 120.51 125.12 2bm4 n ALA 76 Ca -0.17 -0.44 -0.29 0.00 0.00 0.00 0.00 53.44 52.54 2bm4 n ALA 76 Cb 0.50 -1.88 -0.03 0.00 0.00 0.00 0.00 19.45 18.04 2bm4 n ALA 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bm4 s ARG 78 N -3.53 3.11 0.00 0.00 0.52 -0.29 -4.77 118.95 113.99 2bm4 s ARG 78 Ca 0.45 -0.98 0.10 0.00 -0.52 0.00 0.00 55.73 54.77 2bm4 s ARG 78 Cb -0.11 -4.26 0.23 0.00 0.52 0.00 0.00 34.95 31.33 2bm4 s ARG 78 CO 0.29 -1.75 1.13 1.28 0.02 0.00 0.00 175.30 176.27 2bm4 n LEU 79 N 7.34 2.59 -4.04 2.53 4.32 -1.26 -0.04 117.00 128.43 2bm4 n LEU 79 Ca -0.04 -1.76 -0.21 0.00 -0.02 0.00 0.00 56.01 53.98 2bm4 n LEU 79 Cb 0.45 -0.16 -0.15 0.00 -1.62 0.00 0.00 43.42 41.94 2bm4 n LEU 79 CO 0.62 0.62 -0.45 -0.13 -1.22 0.00 0.00 177.39 176.83 2bm4 s ARG 80 N -0.96 1.09 0.76 3.23 0.52 -1.26 -3.87 118.95 118.45 2bm4 s ARG 80 Ca 0.19 -0.38 -0.11 0.00 -0.52 0.00 0.00 55.73 54.91 2bm4 s ARG 80 Cb 0.10 -1.01 0.06 0.00 0.52 0.00 0.00 34.95 34.62 2bm4 s ARG 80 CO 0.14 0.17 1.13 -1.25 0.02 0.00 0.00 175.30 175.50 2bm4 s PRO 81 N 0.05 2.26 -0.16 3.54 0.04 -1.26 -4.66 135.00 134.81 2bm4 s PRO 81 Ca -0.01 0.15 -0.28 0.00 0.04 0.00 0.00 61.00 60.89 2bm4 s PRO 81 Cb -0.08 -2.01 0.09 0.00 0.04 0.00 0.00 34.50 32.54 2bm4 s PRO 81 CO 0.00 -1.37 0.82 -1.17 0.04 0.00 0.00 177.00 175.32 2bm4 s LEU 82 N -5.45 -0.58 -0.30 -3.56 2.96 -1.25 -0.03 118.68 110.46 2bm4 s LEU 82 Ca 0.60 0.85 -0.07 0.00 -0.22 0.00 0.00 54.13 55.29 2bm4 s LEU 82 Cb -0.11 2.27 0.01 0.00 0.50 0.00 0.00 46.19 48.86 2bm4 s LEU 82 CO 0.49 -0.39 0.08 -0.89 -1.32 0.00 0.00 176.35 174.32 2bm4 s THR 83 N -0.57 3.99 -0.38 3.68 2.01 -0.90 -4.76 115.64 118.71 2bm4 s THR 83 Ca -0.04 -0.69 0.03 0.00 0.31 0.00 0.00 61.69 61.30 2bm4 s THR 83 Cb -0.02 -3.06 0.11 0.00 0.01 0.00 0.00 72.50 69.53 2bm4 s THR 83 CO 0.03 0.07 0.11 -0.76 -0.69 0.00 0.00 174.62 173.38 2bm4 s LEU 84 N 1.50 4.31 -0.33 4.42 1.43 -1.26 0.14 118.68 128.88 2bm4 s LEU 84 Ca 0.03 -2.30 -0.11 0.00 -1.03 0.00 0.00 54.13 50.72 2bm4 s LEU 84 Cb -0.17 -1.52 0.00 0.00 0.03 0.00 0.00 46.19 44.53 2bm4 s LEU 84 CO 0.03 -0.35 0.18 -0.62 0.23 0.00 0.00 176.35 175.82 2bm4 s ASP 85 N 0.70 5.69 -0.50 2.29 2.15 -0.13 -4.63 116.67 122.24 2bm4 s ASP 85 Ca 0.12 -0.63 -0.30 0.00 0.43 0.00 0.00 52.55 52.17 2bm4 s ASP 85 Cb -0.21 -2.03 0.05 0.00 -0.30 0.00 0.00 42.92 40.43 2bm4 s ASP 85 CO -0.08 -0.25 0.65 0.47 -0.17 0.00 0.00 175.17 175.79 2bm4 n ASP 86 N 5.01 -5.77 -4.33 -0.34 8.00 -1.26 -0.31 116.55 117.55 2bm4 n ASP 86 Ca -0.13 -0.18 -0.30 0.00 0.71 0.00 0.00 54.79 54.89 2bm4 n ASP 86 Cb 0.48 -2.21 -0.15 0.00 -0.02 0.00 0.00 41.12 39.23 2bm4 n ASP 86 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2bm4 s VAL 87 N -1.85 2.08 -0.35 2.53 1.01 -1.26 -2.59 120.40 119.97 2bm4 s VAL 87 Ca 0.31 -1.27 -0.11 0.00 0.00 0.00 0.00 61.98 60.91 2bm4 s VAL 87 Cb -0.04 -1.76 0.01 0.00 0.00 0.00 0.00 36.38 34.59 2bm4 s VAL 87 CO 0.86 0.44 0.20 -0.62 0.00 0.00 0.00 175.10 175.98 2bm4 s ASP 88 N -0.99 5.73 -0.09 3.32 2.15 -0.12 -1.74 116.67 124.92 2bm4 s ASP 88 Ca 0.11 -0.73 0.17 0.00 0.43 0.00 0.00 52.55 52.52 2bm4 s ASP 88 Cb -0.10 -2.04 0.61 0.00 -0.30 0.00 0.00 42.92 41.09 2bm4 s ASP 88 CO 0.01 -0.30 1.53 0.49 -0.17 0.00 0.00 175.17 176.73 2bm4 n PHE 89 N 5.02 1.19 -1.70 -5.34 3.72 0.27 -0.22 117.46 120.39 2bm4 n PHE 89 Ca -0.13 -0.62 -0.66 0.00 -0.05 0.00 0.00 57.45 55.99 2bm4 n PHE 89 Cb 0.48 -0.20 -0.09 0.00 -0.94 0.00 0.00 39.48 38.72 2bm4 n PHE 89 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 2bm4 n THR 90 N 0.81 0.02 -1.31 4.37 -1.04 -1.22 0.83 114.28 116.73 2bm4 n THR 90 Ca 0.22 -0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 62.13 2bm4 n THR 90 Cb 0.79 -0.45 -0.05 0.00 -1.82 0.00 0.00 70.33 68.80 2bm4 n THR 90 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2bm4 n LEU 91 N 3.60 -0.38 -4.88 -4.42 4.77 0.10 -1.74 117.00 114.05 2bm4 n LEU 91 Ca 0.29 0.26 -0.30 0.00 -0.03 0.00 0.00 56.01 56.23 2bm4 n LEU 91 Cb -0.02 -2.50 0.04 0.00 -2.33 0.00 0.00 43.42 38.60 2bm4 n LEU 91 CO 0.84 -0.96 0.72 0.00 -1.33 0.00 0.00 177.39 176.66 2bm4 s ALA 92 N -2.00 2.99 -0.32 -1.18 0.00 0.24 -3.46 121.76 118.03 2bm4 s ALA 92 Ca 0.00 -0.32 -0.06 0.00 0.00 0.00 0.00 51.96 51.58 2bm4 s ALA 92 Cb 0.00 -2.99 0.03 0.00 0.00 0.00 0.00 23.12 20.16 2bm4 s ALA 92 CO 0.00 -1.00 0.08 0.08 0.00 0.00 0.00 175.76 174.92 2bm4 s VAL 93 N -3.28 3.66 -0.35 0.00 1.01 0.33 -0.69 120.40 121.08 2bm4 s VAL 93 Ca 0.57 -1.08 0.04 0.00 0.00 0.00 0.00 61.98 61.51 2bm4 s VAL 93 Cb -0.11 -3.03 0.09 0.00 0.00 0.00 0.00 36.38 33.33 2bm4 s VAL 93 CO 0.51 -0.10 0.99 0.18 0.00 0.00 0.00 175.10 176.68 2bm4 n LEU 94 N 4.79 2.10 -4.67 3.92 4.77 0.97 0.54 117.00 129.42 2bm4 n LEU 94 Ca -0.13 -1.79 -0.44 0.00 -0.03 0.00 0.00 56.01 53.62 2bm4 n LEU 94 Cb 0.45 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.46 2bm4 n LEU 94 CO 0.30 0.52 0.95 0.61 -1.33 0.00 0.00 177.39 178.44 2bm4 n GLY 95 N -0.08 0.65 2.50 -0.72 0.00 -0.75 -1.60 105.19 105.18 2bm4 n GLY 95 Ca 0.04 0.44 0.00 0.00 0.00 0.00 0.00 46.02 46.49 2bm4 n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bm4 n GLY 96 N 1.70 2.27 3.89 -0.02 0.00 -0.61 -4.75 105.19 107.67 2bm4 n GLY 96 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 2bm4 n GLY 96 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bm4 s ASN 97 N -3.57 5.66 -0.36 1.61 0.01 -0.63 -4.81 114.94 112.85 2bm4 s ASN 97 Ca 0.00 1.10 -0.10 0.00 -0.71 0.00 0.00 52.86 53.14 2bm4 s ASN 97 Cb 0.00 -2.00 0.03 0.00 0.41 0.00 0.00 41.25 39.68 2bm4 s ASN 97 CO 0.00 -1.16 0.19 -0.62 -1.51 0.00 0.00 177.10 174.00 2bm4 s ASP 98 N -4.30 5.67 -0.08 -1.22 2.15 -1.26 -0.50 116.67 117.12 2bm4 s ASP 98 Ca 0.56 -0.96 0.12 0.00 0.43 0.00 0.00 52.55 52.69 2bm4 s ASP 98 Cb -0.11 -2.00 0.18 0.00 -0.30 0.00 0.00 42.92 40.68 2bm4 s ASP 98 CO 0.51 -0.36 1.07 0.18 -0.17 0.00 0.00 175.17 176.40 2bm4 n LEU 99 N 4.98 1.60 -4.57 -1.34 7.99 0.77 -4.61 117.00 121.82 2bm4 n LEU 99 Ca -0.12 -2.32 -0.49 0.00 -0.01 0.00 0.00 56.01 53.07 2bm4 n LEU 99 Cb 0.46 -0.26 -0.04 0.00 -0.11 0.00 0.00 43.42 43.47 2bm4 n LEU 99 CO 0.36 0.54 0.68 0.54 -1.51 0.00 0.00 177.39 178.00 2bm4 n ARG 100 N -0.92 1.09 -0.46 3.23 1.74 -0.76 -1.74 116.66 118.83 2bm4 n ARG 100 Ca 0.10 0.39 0.00 0.00 -0.77 0.00 0.00 57.85 57.57 2bm4 n ARG 100 Cb 0.62 -1.86 0.00 0.00 -1.02 0.00 0.00 32.46 30.20 2bm4 n ARG 100 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bm4 n GLY 101 N 1.97 0.53 3.74 -0.13 0.00 0.91 -4.90 105.19 107.31 2bm4 n GLY 101 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 2bm4 n GLY 101 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bm4 s LEU 102 N 0.00 3.45 -0.40 0.99 1.43 -0.71 -4.62 118.68 118.82 2bm4 s LEU 102 Ca 0.00 2.34 -0.19 0.00 -1.03 0.00 0.00 54.13 55.25 2bm4 s LEU 102 Cb 0.00 -4.59 0.01 0.00 0.03 0.00 0.00 46.19 41.64 2bm4 s LEU 102 CO 0.00 -1.97 0.58 0.21 0.23 0.00 0.00 176.35 175.40 2bm4 s ASN 103 N -1.93 6.31 -0.16 2.29 3.84 -1.26 -1.23 114.94 122.80 2bm4 s ASN 103 Ca 0.75 -0.24 0.18 0.00 0.21 0.00 0.00 52.86 53.75 2bm4 s ASN 103 Cb -0.29 -2.29 0.41 0.00 -0.55 0.00 0.00 41.25 38.53 2bm4 s ASN 103 CO 0.41 -0.65 1.28 0.18 -2.79 0.00 0.00 177.10 175.54 2bm4 n LEU 104 N 6.00 3.10 -4.55 3.21 4.32 0.19 -4.42 117.00 124.84 2bm4 n LEU 104 Ca -0.03 -3.09 -0.52 0.00 -0.02 0.00 0.00 56.01 52.35 2bm4 n LEU 104 Cb 0.48 -0.49 -0.05 0.00 -1.62 0.00 0.00 43.42 41.74 2bm4 n LEU 104 CO 0.50 0.72 0.69 0.41 -1.22 0.00 0.00 177.39 178.49 2bm4 n THR 105 N -1.01 0.54 -0.87 -5.08 -1.04 -0.95 -1.48 114.28 104.39 2bm4 n THR 105 Ca 0.19 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 2bm4 n THR 105 Cb 0.77 -0.61 0.00 0.00 -1.82 0.00 0.00 70.33 68.66 2bm4 n THR 105 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2bm4 n GLY 106 N 2.06 0.08 3.84 3.41 0.00 -0.36 -4.35 105.19 109.88 2bm4 n GLY 106 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 2bm4 n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm4 s ARG 108 N -5.14 3.73 -0.28 0.00 0.52 -0.71 -1.58 118.95 115.49 2bm4 s ARG 108 Ca 0.57 -0.48 0.14 0.00 -0.52 0.00 0.00 55.73 55.45 2bm4 s ARG 108 Cb -0.13 -3.02 0.48 0.00 0.52 0.00 0.00 34.95 32.80 2bm4 s ARG 108 CO 0.54 0.20 1.15 1.28 0.02 0.00 0.00 175.30 178.49 2bm4 n LEU 109 N 3.69 3.34 -4.66 2.53 4.77 0.16 0.95 117.00 127.77 2bm4 n LEU 109 Ca -0.17 -3.96 -0.42 0.00 -0.03 0.00 0.00 56.01 51.43 2bm4 n LEU 109 Cb 0.52 0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.63 2bm4 n LEU 109 CO 0.33 1.61 1.27 -0.60 -1.33 0.00 0.00 177.39 178.68 2bm4 s ARG 110 N -3.68 4.20 -1.80 3.23 3.52 -1.20 -2.03 118.95 121.19 2bm4 s ARG 110 Ca 0.40 2.04 0.00 0.00 -0.13 0.00 0.00 55.73 58.04 2bm4 s ARG 110 Cb 0.37 -3.88 0.00 0.00 -1.56 0.00 0.00 34.95 29.88 2bm4 s ARG 110 CO -0.00 -0.78 0.00 0.39 -0.81 0.00 0.00 175.30 174.10 2bm4 n GLU 111 N 6.77 -1.60 -2.50 5.12 1.02 -0.58 0.00 120.64 128.88 2bm4 n GLU 111 Ca 0.16 1.01 -0.39 0.00 -0.02 0.00 0.00 57.16 57.92 2bm4 n GLU 111 Cb 0.43 -5.50 -0.04 0.00 -0.02 0.00 0.00 31.44 26.31 2bm4 n GLU 111 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2bm4 s THR 112 N -2.74 3.56 -0.32 2.62 2.01 -0.86 -3.59 115.64 116.32 2bm4 s THR 112 Ca 0.00 1.44 -0.16 0.00 0.31 0.00 0.00 61.69 63.28 2bm4 s THR 112 Cb 0.00 -3.87 -0.02 0.00 0.01 0.00 0.00 72.50 68.62 2bm4 s THR 112 CO 0.00 0.25 0.42 -0.55 -0.69 0.00 0.00 174.62 174.05 2bm4 s SER 113 N -1.10 6.26 -0.21 3.53 0.15 0.13 -1.50 113.70 120.97 2bm4 s SER 113 Ca 0.49 0.03 0.13 0.00 0.70 0.00 0.00 55.95 57.30 2bm4 s SER 113 Cb -0.29 -2.23 0.42 0.00 -1.71 0.00 0.00 66.02 62.22 2bm4 s SER 113 CO 0.37 -0.33 1.29 0.18 1.20 0.00 0.00 173.24 175.94 2bm4 n LEU 114 N 5.48 3.10 -4.65 3.45 4.77 0.20 -0.02 117.00 129.34 2bm4 n LEU 114 Ca -0.07 -3.56 -0.43 0.00 -0.03 0.00 0.00 56.01 51.92 2bm4 n LEU 114 Cb 0.50 -0.53 -0.03 0.00 -2.33 0.00 0.00 43.42 41.02 2bm4 n LEU 114 CO 0.41 1.10 1.66 1.33 -1.33 0.00 0.00 177.39 180.56 2bm4 n VAL 115 N -1.13 0.66 -1.87 4.08 0.24 -1.16 -1.02 118.33 118.12 2bm4 n VAL 115 Ca 0.22 -0.21 -0.18 0.00 -2.04 0.00 0.00 64.34 62.13 2bm4 n VAL 115 Cb 0.79 -2.34 -0.05 0.00 -1.47 0.00 0.00 33.84 30.77 2bm4 n VAL 115 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2bm4 n ASP 116 N 8.44 -5.13 -4.76 -1.34 8.00 -0.21 -1.58 116.55 119.97 2bm4 n ASP 116 Ca 0.23 0.24 -0.39 0.00 0.71 0.00 0.00 54.79 55.57 2bm4 n ASP 116 Cb 0.41 -4.19 -0.05 0.00 -0.02 0.00 0.00 41.12 37.26 2bm4 n ASP 116 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2bm4 s THR 117 N -2.75 4.72 -0.58 -3.53 2.01 -0.19 -3.20 115.64 112.11 2bm4 s THR 117 Ca 0.00 1.51 -0.22 0.00 0.31 0.00 0.00 61.69 63.28 2bm4 s THR 117 Cb 0.00 -4.05 0.06 0.00 0.01 0.00 0.00 72.50 68.51 2bm4 s THR 117 CO 0.00 0.42 0.88 -0.62 -0.69 0.00 0.00 174.62 174.61 2bm4 s ASP 118 N -0.35 6.25 -0.25 3.53 -1.08 0.34 -1.32 116.67 123.80 2bm4 s ASP 118 Ca 0.35 -0.72 0.12 0.00 -0.52 0.00 0.00 52.55 51.78 2bm4 s ASP 118 Cb -0.20 -2.40 0.54 0.00 -1.46 0.00 0.00 42.92 39.40 2bm4 s ASP 118 CO 0.22 -1.24 1.49 0.18 0.52 0.00 0.00 175.17 176.34 2bm4 n LEU 119 N 7.28 4.28 -4.76 -1.34 4.32 0.21 -0.16 117.00 126.83 2bm4 n LEU 119 Ca -0.02 -3.38 -0.41 0.00 -0.02 0.00 0.00 56.01 52.18 2bm4 n LEU 119 Cb 0.46 -0.61 -0.01 0.00 -1.62 0.00 0.00 43.42 41.63 2bm4 n LEU 119 CO 0.62 0.95 1.14 -0.13 -1.22 0.00 0.00 177.39 178.74 2bm4 s ARG 120 N -3.04 4.20 -1.25 3.23 0.52 -0.87 -1.88 118.95 119.86 2bm4 s ARG 120 Ca 0.45 2.44 0.00 0.00 -0.52 0.00 0.00 55.73 58.10 2bm4 s ARG 120 Cb 0.38 -3.04 0.00 0.00 0.52 0.00 0.00 34.95 32.81 2bm4 s ARG 120 CO 0.05 -0.48 0.00 1.63 0.02 0.00 0.00 175.30 176.53 2bm4 n LYS 121 N 1.56 -1.44 -2.00 3.54 5.02 -1.00 -0.06 118.16 123.78 2bm4 n LYS 121 Ca 0.05 0.89 -0.34 0.00 -2.02 0.00 0.00 58.31 56.89 2bm4 n LYS 121 Cb 0.39 -5.18 0.02 0.00 -0.02 0.00 0.00 35.03 30.25 2bm4 n LYS 121 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2bm4 s VAL 123 N -2.18 4.54 -0.18 0.00 1.01 -0.37 -0.72 120.40 122.51 2bm4 s VAL 123 Ca 0.68 -0.37 0.13 0.00 0.00 0.00 0.00 61.98 62.43 2bm4 s VAL 123 Cb -0.20 -3.28 0.39 0.00 0.00 0.00 0.00 36.38 33.29 2bm4 s VAL 123 CO 0.35 0.12 1.20 0.18 0.00 0.00 0.00 175.10 176.96 2bm4 n LEU 124 N 4.97 2.51 -4.71 3.92 4.77 0.11 0.52 117.00 129.08 2bm4 n LEU 124 Ca -0.14 -3.61 -0.42 0.00 -0.03 0.00 0.00 56.01 51.81 2bm4 n LEU 124 Cb 0.50 -0.47 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 2bm4 n LEU 124 CO 0.33 1.21 1.42 -0.13 -1.33 0.00 0.00 177.39 178.89 2bm4 s ARG 125 N -2.94 4.13 0.00 3.23 0.52 -1.14 -1.74 118.95 121.02 2bm4 s ARG 125 Ca 0.36 2.61 0.00 0.00 -0.52 0.00 0.00 55.73 58.18 2bm4 s ARG 125 Cb 0.35 -3.32 0.00 0.00 0.52 0.00 0.00 34.95 32.50 2bm4 s ARG 125 CO -0.06 -0.80 0.00 0.41 0.02 0.00 0.00 175.30 174.88 2bm4 n GLY 126 N 4.10 0.66 3.75 -3.53 0.00 -0.87 -1.22 105.19 108.08 2bm4 n GLY 126 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 2bm4 n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm4 s ALA 127 N -2.19 2.30 -0.34 4.61 0.00 -0.71 -4.41 121.76 121.02 2bm4 s ALA 127 Ca 0.00 0.55 -0.09 0.00 0.00 0.00 0.00 51.96 52.42 2bm4 s ALA 127 Cb 0.00 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.79 2bm4 s ALA 127 CO 0.00 -1.58 0.16 0.34 0.00 0.00 0.00 175.76 174.68 2bm4 s ASP 128 N -2.65 5.55 -0.03 0.00 2.15 -0.62 -1.96 116.67 119.12 2bm4 s ASP 128 Ca 0.67 -0.81 0.13 0.00 0.43 0.00 0.00 52.55 52.97 2bm4 s ASP 128 Cb -0.21 -1.98 0.38 0.00 -0.30 0.00 0.00 42.92 40.81 2bm4 s ASP 128 CO 0.46 -0.29 1.32 0.18 -0.17 0.00 0.00 175.17 176.67 2bm4 n LEU 129 N 4.96 3.23 -4.62 -1.34 4.77 0.25 0.36 117.00 124.61 2bm4 n LEU 129 Ca -0.13 -2.15 -0.53 0.00 -0.03 0.00 0.00 56.01 53.17 2bm4 n LEU 129 Cb 0.47 -0.31 -0.06 0.00 -2.33 0.00 0.00 43.42 41.19 2bm4 n LEU 129 CO 0.34 0.75 1.00 -1.20 -1.33 0.00 0.00 177.39 176.96 2bm4 n SER 130 N 0.51 1.82 0.00 -1.43 7.64 -1.16 -1.38 113.62 119.63 2bm4 n SER 130 Ca 0.15 1.11 0.00 0.00 1.01 0.00 0.00 58.87 61.13 2bm4 n SER 130 Cb 0.52 -1.18 0.00 0.00 -1.01 0.00 0.00 64.21 62.55 2bm4 n SER 130 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bm4 n GLY 131 N 2.92 0.64 3.76 0.23 0.00 -1.26 -1.52 105.19 109.95 2bm4 n GLY 131 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 2bm4 n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm4 s ALA 132 N -2.89 2.91 -0.43 4.61 0.00 -0.48 -3.63 121.76 121.86 2bm4 s ALA 132 Ca 0.00 1.22 -0.21 0.00 0.00 0.00 0.00 51.96 52.97 2bm4 s ALA 132 Cb 0.00 -3.51 0.02 0.00 0.00 0.00 0.00 23.12 19.63 2bm4 s ALA 132 CO 0.00 -1.12 0.64 0.50 0.00 0.00 0.00 175.76 175.78 2bm4 s ARG 133 N -2.78 3.33 -0.15 0.00 3.52 -0.56 -4.87 118.95 117.44 2bm4 s ARG 133 Ca 0.68 -0.32 0.17 0.00 -0.13 0.00 0.00 55.73 56.13 2bm4 s ARG 133 Cb -0.37 -3.93 0.45 0.00 -1.56 0.00 0.00 34.95 29.54 2bm4 s ARG 133 CO 0.44 -0.97 1.34 0.25 -0.81 0.00 0.00 175.30 175.55 2bm4 n THR 134 N 5.82 2.11 -1.76 4.11 -2.24 -1.26 -0.63 114.28 120.43 2bm4 n THR 134 Ca -0.02 -1.91 -0.42 0.00 -2.27 0.00 0.00 64.05 59.44 2bm4 n THR 134 Cb 0.48 -0.20 -0.03 0.00 -2.10 0.00 0.00 70.33 68.48 2bm4 n THR 134 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2bm4 s THR 135 N -2.71 2.33 0.00 4.28 2.01 -1.26 -1.17 115.64 119.11 2bm4 s THR 135 Ca 0.38 0.10 0.00 0.00 0.31 0.00 0.00 61.69 62.48 2bm4 s THR 135 Cb 0.31 -3.06 0.00 0.00 0.01 0.00 0.00 72.50 69.76 2bm4 s THR 135 CO 0.08 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.62 2bm4 n GLY 136 N 4.05 1.18 3.73 4.40 0.00 -1.26 -1.05 105.19 116.25 2bm4 n GLY 136 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2bm4 n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm4 s ALA 137 N -2.51 3.64 -0.38 4.61 0.00 -0.32 -3.79 121.76 123.03 2bm4 s ALA 137 Ca 0.00 1.29 -0.14 0.00 0.00 0.00 0.00 51.96 53.11 2bm4 s ALA 137 Cb 0.00 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.56 2bm4 s ALA 137 CO 0.00 -0.71 0.28 1.03 0.00 0.00 0.00 175.76 176.36 2bm4 s ARG 138 N 0.16 3.22 -0.11 0.00 1.81 -0.43 -1.38 118.95 122.21 2bm4 s ARG 138 Ca 0.62 -0.83 0.15 0.00 -1.72 0.00 0.00 55.73 53.95 2bm4 s ARG 138 Cb -0.41 -3.90 0.30 0.00 -0.45 0.00 0.00 34.95 30.49 2bm4 s ARG 138 CO 0.38 -0.61 1.20 1.28 -0.68 0.00 0.00 175.30 176.87 2bm4 n LEU 139 N 5.15 2.71 -4.67 2.53 4.77 0.51 -0.62 117.00 127.39 2bm4 n LEU 139 Ca -0.12 -2.82 -0.46 0.00 -0.03 0.00 0.00 56.01 52.58 2bm4 n LEU 139 Cb 0.48 -0.38 -0.04 0.00 -2.33 0.00 0.00 43.42 41.16 2bm4 n LEU 139 CO 0.39 0.67 1.16 0.47 -1.33 0.00 0.00 177.39 178.75 2bm4 n ASP 140 N -0.93 2.98 -0.50 -1.43 8.00 -1.10 -1.56 116.55 122.01 2bm4 n ASP 140 Ca 0.14 1.09 -0.07 0.00 0.71 0.00 0.00 54.79 56.67 2bm4 n ASP 140 Cb 0.63 -1.41 -0.03 0.00 -0.02 0.00 0.00 41.12 40.28 2bm4 n ASP 140 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2bm4 n ASP 141 N 3.22 -5.71 -4.85 -2.24 8.00 -0.23 -2.39 116.55 112.36 2bm4 n ASP 141 Ca 0.16 0.16 -0.32 0.00 0.71 0.00 0.00 54.79 55.51 2bm4 n ASP 141 Cb 0.29 -3.78 -0.02 0.00 -0.02 0.00 0.00 41.12 37.58 2bm4 n ASP 141 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2bm4 s ALA 142 N -1.60 3.08 -0.38 2.24 0.00 -0.60 -3.82 121.76 120.67 2bm4 s ALA 142 Ca 0.00 0.09 -0.13 0.00 0.00 0.00 0.00 51.96 51.91 2bm4 s ALA 142 Cb 0.00 -3.09 0.01 0.00 0.00 0.00 0.00 23.12 20.04 2bm4 s ALA 142 CO 0.00 -0.37 0.26 0.34 0.00 0.00 0.00 175.76 175.99 2bm4 s ASP 143 N -3.41 5.99 0.00 0.00 -1.08 0.10 -1.48 116.67 116.78 2bm4 s ASP 143 Ca 0.57 -0.81 0.18 0.00 -0.52 0.00 0.00 52.55 51.98 2bm4 s ASP 143 Cb -0.10 -2.12 0.06 0.00 -1.46 0.00 0.00 42.92 39.30 2bm4 s ASP 143 CO 0.38 -0.38 0.99 0.18 0.52 0.00 0.00 175.17 176.86 2bm4 n LEU 144 N 5.10 2.09 -4.57 -1.34 4.77 -0.09 0.04 117.00 123.01 2bm4 n LEU 144 Ca -0.12 -0.87 -0.52 0.00 -0.03 0.00 0.00 56.01 54.47 2bm4 n LEU 144 Cb 0.47 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.51 2bm4 n LEU 144 CO 0.39 0.38 0.80 0.54 -1.33 0.00 0.00 177.39 178.17 2bm4 n ARG 145 N 0.40 0.96 -0.65 3.23 1.74 -1.10 -0.35 116.66 120.90 2bm4 n ARG 145 Ca 0.09 0.34 0.00 0.00 -0.77 0.00 0.00 57.85 57.51 2bm4 n ARG 145 Cb 0.41 -1.93 0.00 0.00 -1.02 0.00 0.00 32.46 29.92 2bm4 n ARG 145 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bm4 n GLY 146 N 2.27 1.14 3.82 -0.13 0.00 -1.26 -2.05 105.19 108.98 2bm4 n GLY 146 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 2bm4 n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm4 s ALA 147 N -3.05 2.76 -0.34 4.61 0.00 0.53 -3.83 121.76 122.43 2bm4 s ALA 147 Ca 0.00 0.18 -0.14 0.00 0.00 0.00 0.00 51.96 52.01 2bm4 s ALA 147 Cb 0.00 -3.18 -0.01 0.00 0.00 0.00 0.00 23.12 19.92 2bm4 s ALA 147 CO 0.00 -0.97 0.28 0.99 0.00 0.00 0.00 175.76 176.06 2bm4 s THR 148 N -2.82 5.25 0.02 0.00 2.01 -0.83 -4.93 115.64 114.34 2bm4 s THR 148 Ca 0.60 -0.16 0.02 0.00 0.31 0.00 0.00 61.69 62.46 2bm4 s THR 148 Cb -0.14 -3.76 -0.01 0.00 0.01 0.00 0.00 72.50 68.60 2bm4 s THR 148 CO 0.47 -0.05 -0.07 0.68 -0.69 0.00 0.00 174.62 174.96 2bm4 s VAL 149 N 1.81 0.54 0.58 3.82 -7.23 -1.26 -0.58 120.40 118.08 2bm4 s VAL 149 Ca 0.08 -0.63 -0.11 0.00 -1.81 0.00 0.00 61.98 59.51 2bm4 s VAL 149 Cb -0.17 -0.52 -0.05 0.00 0.56 0.00 0.00 36.38 36.20 2bm4 s VAL 149 CO 0.11 -0.08 0.99 -1.81 -0.31 0.00 0.00 175.10 174.00 2bm4 s ASP 150 N -0.78 6.30 0.31 4.85 1.01 -1.26 -4.94 116.67 122.16 2bm4 s ASP 150 Ca -0.03 1.39 0.06 0.00 0.71 0.00 0.00 52.55 54.68 2bm4 s ASP 150 Cb -0.06 -2.45 0.72 0.00 1.01 0.00 0.00 42.92 42.15 2bm4 s ASP 150 CO 0.00 -0.79 1.80 -0.65 0.21 0.00 0.00 175.17 175.74 2bm4 h PRO 151 N -0.04 0.77 -0.03 8.23 0.11 -1.98 -2.29 132.00 136.78 2bm4 h PRO 151 Ca -0.45 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 2bm4 h PRO 151 Cb 1.19 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 2bm4 h PRO 151 CO 0.62 0.51 -0.07 -0.24 -0.21 0.00 0.00 178.00 178.61 2bm4 h VAL 152 N 0.79 1.07 -0.75 3.15 3.04 -1.94 -1.44 116.25 120.18 2bm4 h VAL 152 Ca 0.55 -0.31 -0.05 0.00 -1.01 0.00 0.00 66.70 65.88 2bm4 h VAL 152 Cb 0.82 1.13 -0.03 0.00 -2.01 0.00 0.00 31.29 31.19 2bm4 h VAL 152 CO -0.33 0.09 0.27 0.25 -1.01 0.00 0.00 177.57 176.84 2bm4 h LEU 153 N 0.04 1.06 -2.20 3.16 6.46 -1.75 -1.10 115.31 121.00 2bm4 h LEU 153 Ca 0.01 -0.19 0.04 0.00 -0.12 0.00 0.00 57.88 57.62 2bm4 h LEU 153 Cb 0.15 -0.28 -0.00 0.00 -0.73 0.00 0.00 40.66 39.80 2bm4 h LEU 153 CO 0.01 0.96 0.11 -0.50 -0.62 0.00 0.00 178.44 178.40 2bm4 h TRP 154 N 1.10 0.00 -0.02 1.25 -0.00 -1.30 -1.50 115.95 115.49 2bm4 h TRP 154 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.14 2bm4 h TRP 154 Cb 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.41 2bm4 h TRP 154 CO 0.02 0.00 -0.49 0.54 -0.00 0.00 0.00 178.44 178.51 2bm4 n ARG 155 N -4.11 1.19 0.00 0.49 1.74 -0.82 -4.69 116.66 110.46 2bm4 n ARG 155 Ca 0.00 -0.98 0.00 0.00 -0.77 0.00 0.00 57.85 56.10 2bm4 n ARG 155 Cb 0.23 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.19 2bm4 n ARG 155 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2bm4 n THR 156 N -0.06 0.00 -2.87 0.55 -2.24 -0.48 -5.06 114.28 104.12 2bm4 n THR 156 Ca 0.09 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.54 2bm4 n THR 156 Cb 0.47 -0.51 -0.07 0.00 -2.10 0.00 0.00 70.33 68.12 2bm4 n THR 156 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bm4 s ALA 157 N -1.70 3.09 0.06 6.98 0.00 -0.64 -4.16 121.76 125.40 2bm4 s ALA 157 Ca 0.00 0.35 -0.22 0.00 0.00 0.00 0.00 51.96 52.09 2bm4 s ALA 157 Cb 0.00 -3.09 -0.06 0.00 0.00 0.00 0.00 23.12 19.97 2bm4 s ALA 157 CO 0.00 0.17 0.65 -1.54 0.00 0.00 0.00 175.76 175.03 2bm4 s SER 158 N -2.17 7.11 -0.06 0.00 1.04 -0.48 -4.93 113.70 114.21 2bm4 s SER 158 Ca 0.60 1.32 0.10 0.00 0.48 0.00 0.00 55.95 58.45 2bm4 s SER 158 Cb -0.10 -2.40 0.15 0.00 0.10 0.00 0.00 66.02 63.77 2bm4 s SER 158 CO 0.14 0.15 1.08 0.18 0.98 0.00 0.00 173.24 175.77 2bm4 n LEU 159 N 2.26 1.15 -4.73 2.42 4.77 -1.26 -0.37 117.00 121.24 2bm4 n LEU 159 Ca -0.07 -2.04 -0.42 0.00 -0.03 0.00 0.00 56.01 53.45 2bm4 n LEU 159 Cb 0.50 -0.21 -0.02 0.00 -2.33 0.00 0.00 43.42 41.36 2bm4 n LEU 159 CO 0.44 0.49 1.28 -0.69 -1.33 0.00 0.00 177.39 177.58 2bm4 s VAL 160 N -1.38 2.19 0.00 4.08 1.01 -1.26 -1.68 120.40 123.36 2bm4 s VAL 160 Ca 0.16 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.29 2bm4 s VAL 160 Cb 0.15 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.43 2bm4 s VAL 160 CO 0.01 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.73 2bm4 n GLY 161 N 3.12 1.82 3.74 4.51 0.00 -1.26 -1.06 105.19 116.06 2bm4 n GLY 161 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2bm4 n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm4 n ALA 162 N 0.49 2.26 -2.69 4.61 0.00 -0.68 -4.02 120.51 120.49 2bm4 n ALA 162 Ca 0.00 0.37 -0.39 0.00 0.00 0.00 0.00 53.44 53.42 2bm4 n ALA 162 Cb 0.00 -2.42 -0.06 0.00 0.00 0.00 0.00 19.45 16.97 2bm4 n ALA 162 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2bm4 s ARG 163 N -0.88 4.27 0.12 0.00 0.52 -0.55 -4.93 118.95 117.50 2bm4 s ARG 163 Ca 0.62 0.53 0.02 0.00 -0.52 0.00 0.00 55.73 56.38 2bm4 s ARG 163 Cb -0.52 -3.52 -0.04 0.00 0.52 0.00 0.00 34.95 31.40 2bm4 s ARG 163 CO 0.52 -0.06 -0.07 0.14 0.02 0.00 0.00 175.30 175.86 2bm4 s VAL 164 N 1.31 0.81 0.57 3.52 -7.23 -1.26 -0.91 120.40 117.21 2bm4 s VAL 164 Ca 0.27 -1.97 0.04 0.00 -1.81 0.00 0.00 61.98 58.52 2bm4 s VAL 164 Cb -0.16 -1.76 0.06 0.00 0.56 0.00 0.00 36.38 35.09 2bm4 s VAL 164 CO 0.11 -0.81 0.78 1.51 -0.31 0.00 0.00 175.10 176.38 2bm4 s ASP 165 N -3.09 5.10 0.19 4.85 1.47 -1.26 -4.90 116.67 119.03 2bm4 s ASP 165 Ca 0.14 -0.40 -0.13 0.00 1.18 0.00 0.00 52.55 53.33 2bm4 s ASP 165 Cb 0.05 -0.32 0.19 0.00 -0.34 0.00 0.00 42.92 42.49 2bm4 s ASP 165 CO -0.03 -1.28 1.70 0.58 0.68 0.00 0.00 175.17 176.82 2bm4 h VAL 166 N 0.08 0.66 -0.64 2.11 2.07 -2.02 -2.06 116.25 116.45 2bm4 h VAL 166 Ca -0.37 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.13 2bm4 h VAL 166 Cb 1.28 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.50 2bm4 h VAL 166 CO 0.45 0.03 0.43 0.44 0.02 0.00 0.00 177.57 178.93 2bm4 h ASP 167 N 0.16 0.65 0.13 0.57 5.19 -1.99 -0.89 116.42 120.24 2bm4 h ASP 167 Ca 0.25 -0.01 -0.18 0.00 -0.62 0.00 0.00 57.03 56.47 2bm4 h ASP 167 Cb 0.36 -0.15 -0.00 0.00 0.18 0.00 0.00 39.33 39.71 2bm4 h ASP 167 CO -0.37 0.45 -0.68 1.56 -3.12 0.00 0.00 179.24 177.08 2bm4 h GLN 168 N 0.76 0.50 -0.08 3.56 4.20 -1.77 -1.75 115.11 120.52 2bm4 h GLN 168 Ca 0.26 -0.38 -0.01 0.00 0.06 0.00 0.00 58.65 58.59 2bm4 h GLN 168 Cb 0.09 0.07 -0.00 0.00 0.30 0.00 0.00 27.48 27.94 2bm4 h GLN 168 CO -0.07 1.00 0.03 0.00 -0.67 0.00 0.00 178.83 179.12 2bm4 h ALA 169 N 0.90 0.10 -0.66 3.87 0.00 -1.01 0.37 119.26 122.83 2bm4 h ALA 169 Ca -0.02 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 54.84 2bm4 h ALA 169 Cb 1.25 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 2bm4 h ALA 169 CO 0.12 -0.30 0.37 0.28 0.00 0.00 0.00 179.25 179.72 2bm4 h VAL 170 N -0.04 0.97 -0.71 0.00 2.07 -1.17 -0.40 116.25 116.96 2bm4 h VAL 170 Ca 0.03 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.25 2bm4 h VAL 170 Cb 0.19 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.16 2bm4 h VAL 170 CO -0.00 0.12 0.18 0.00 0.02 0.00 0.00 177.57 177.89 2bm4 h ALA 171 N 1.34 0.94 -0.47 1.67 0.00 -0.82 -1.17 119.26 120.75 2bm4 h ALA 171 Ca 0.30 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2bm4 h ALA 171 Cb 0.18 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2bm4 h ALA 171 CO -0.18 0.66 0.31 0.35 0.00 0.00 0.00 179.25 180.38 2bm4 h PHE 172 N 1.07 0.60 -0.35 0.00 3.57 0.44 0.14 116.94 122.42 2bm4 h PHE 172 Ca 0.22 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.72 2bm4 h PHE 172 Cb 0.37 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.89 2bm4 h PHE 172 CO 0.03 0.39 0.16 0.00 -2.23 0.00 0.00 178.31 176.66 2bm4 h ALA 173 N 1.16 0.45 -0.22 2.41 0.00 -0.49 -2.16 119.26 120.42 2bm4 h ALA 173 Ca 0.17 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 2bm4 h ALA 173 Cb -0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2bm4 h ALA 173 CO -0.04 0.02 -0.06 0.00 0.00 0.00 0.00 179.25 179.17 2bm4 h ALA 174 N 1.02 1.49 0.00 0.00 0.00 -0.99 -2.12 119.26 118.65 2bm4 h ALA 174 Ca 0.12 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2bm4 h ALA 174 Cb 0.13 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2bm4 h ALA 174 CO -0.01 0.36 -0.02 0.00 0.00 0.00 0.00 179.25 179.58 2bm4 h ALA 175 N 1.61 1.03 -0.27 0.00 0.00 -0.07 -1.02 119.26 120.55 2bm4 h ALA 175 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2bm4 h ALA 175 Cb 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2bm4 h ALA 175 CO 0.01 0.02 0.00 0.72 0.00 0.00 0.00 179.25 180.01 2bm4 n HIS 176 N -3.16 0.34 0.00 0.00 8.25 -0.85 -4.88 115.22 114.93 2bm4 n HIS 176 Ca -0.01 -0.17 0.00 0.00 -0.26 0.00 0.00 57.72 57.28 2bm4 n HIS 176 Cb 0.22 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.33 2bm4 n HIS 176 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bm4 n GLY 177 N 1.38 0.54 3.77 -1.41 0.00 -0.39 -5.08 105.19 104.00 2bm4 n GLY 177 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 2bm4 n GLY 177 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bm4 s LEU 178 N 0.00 4.36 -0.29 0.99 1.02 -0.92 -4.97 118.68 118.87 2bm4 s LEU 178 Ca 0.00 2.40 -0.07 0.00 0.02 0.00 0.00 54.13 56.47 2bm4 s LEU 178 Cb 0.00 -3.82 -0.00 0.00 0.02 0.00 0.00 46.19 42.39 2bm4 s LEU 178 CO 0.00 -0.47 0.09 0.00 0.02 0.00 0.00 176.35 175.99 2bm4 s LEU 180 N 1.54 4.09 0.28 0.00 1.02 -1.26 -4.99 118.68 119.36 2bm4 s LEU 180 Ca 0.04 0.66 0.05 0.00 0.02 0.00 0.00 54.13 54.90 2bm4 s LEU 180 Cb -0.17 -3.07 -0.06 0.00 0.02 0.00 0.00 46.19 42.92 2bm4 s LEU 180 CO 0.03 -0.61 -0.02 0.00 0.02 0.00 0.00 176.35 175.78 2bm4 s ALA 181 N 2.94 2.23 0.00 4.21 0.00 -1.26 -5.22 121.76 124.67 2bm4 s ALA 181 Ca 0.32 -1.91 0.00 0.00 0.00 0.00 0.00 51.96 50.37 2bm4 s ALA 181 Cb -0.14 0.37 0.00 0.00 0.00 0.00 0.00 23.12 23.35 2bm4 s ALA 181 CO 0.12 -0.17 0.00 0.41 0.00 0.00 0.00 175.76 176.12