#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b5h s GLY 24 N 0.00 0.64 -0.09 0.00 0.00 -1.26 -4.78 107.32 101.84 3b5h s GLY 24 Ca 0.00 -0.98 -0.01 0.00 0.00 0.00 0.00 44.72 43.74 3b5h s GLY 24 CO 0.00 -0.78 -0.05 -1.59 0.00 0.00 0.00 173.10 170.68 3b5h s THR 25 N -4.02 3.89 -0.30 0.90 2.01 -0.97 -4.81 115.64 112.33 3b5h s THR 25 Ca 0.23 -0.40 -0.11 0.00 0.31 0.00 0.00 61.69 61.72 3b5h s THR 25 Cb 0.01 -2.62 -0.03 0.00 0.01 0.00 0.00 72.50 69.88 3b5h s THR 25 CO 0.07 0.59 0.19 -0.69 -0.69 0.00 0.00 174.62 174.08 3b5h s VAL 26 N -0.65 5.10 -0.24 3.82 1.01 -1.26 -0.26 120.40 127.91 3b5h s VAL 26 Ca 0.10 -0.09 -0.15 0.00 0.00 0.00 0.00 61.98 61.84 3b5h s VAL 26 Cb -0.12 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 3b5h s VAL 26 CO 0.02 0.14 0.38 -0.36 0.00 0.00 0.00 175.10 175.28 3b5h s PHE 27 N 1.71 3.30 -0.15 5.22 0.40 0.15 -4.88 117.98 123.73 3b5h s PHE 27 Ca 0.06 0.50 -0.08 0.00 -0.60 0.00 0.00 56.93 56.81 3b5h s PHE 27 Cb -0.17 -2.55 -0.04 0.00 0.51 0.00 0.00 43.02 40.77 3b5h s PHE 27 CO 0.09 -0.14 0.15 0.99 0.70 0.00 0.00 175.22 177.01 3b5h s THR 28 N 1.76 5.46 -0.01 0.64 2.01 -1.26 -0.81 115.64 123.43 3b5h s THR 28 Ca 0.17 0.22 0.02 0.00 0.31 0.00 0.00 61.69 62.41 3b5h s THR 28 Cb -0.15 -3.43 0.00 0.00 0.01 0.00 0.00 72.50 68.92 3b5h s THR 28 CO 0.09 0.55 -0.06 0.28 -0.69 0.00 0.00 174.62 174.79 3b5h s THR 29 N -0.54 0.51 -0.09 -0.82 -1.32 0.54 -5.00 115.64 108.92 3b5h s THR 29 Ca 0.13 -0.24 0.01 0.00 -1.21 0.00 0.00 61.69 60.38 3b5h s THR 29 Cb -0.12 -0.46 0.02 0.00 -1.51 0.00 0.00 72.50 70.44 3b5h s THR 29 CO 0.02 0.16 -0.09 0.54 -2.21 0.00 0.00 174.62 173.04 3b5h s VAL 30 N 0.10 1.01 0.06 5.08 0.11 -1.26 -0.66 120.40 124.84 3b5h s VAL 30 Ca -0.01 -0.35 -0.00 0.00 -2.93 0.00 0.00 61.98 58.70 3b5h s VAL 30 Cb -0.05 -0.99 -0.04 0.00 -1.53 0.00 0.00 36.38 33.77 3b5h s VAL 30 CO -0.00 0.35 -0.04 -1.83 -3.33 0.00 0.00 175.10 170.24 3b5h s GLU 31 N 1.19 0.62 0.33 1.54 -1.05 -1.00 -4.99 118.70 115.35 3b5h s GLU 31 Ca -0.05 -1.14 -0.26 0.00 -0.15 0.00 0.00 54.97 53.37 3b5h s GLU 31 Cb -0.14 0.07 -0.09 0.00 -0.44 0.00 0.00 34.13 33.53 3b5h s GLU 31 CO -0.02 -0.07 1.01 -0.51 0.95 0.00 0.00 175.26 176.61 3b5h s ASP 32 N -2.68 7.16 -0.49 0.83 1.01 -1.26 -0.31 116.67 120.94 3b5h s ASP 32 Ca 0.04 2.00 0.08 0.00 0.71 0.00 0.00 52.55 55.38 3b5h s ASP 32 Cb 0.04 -2.59 0.30 0.00 1.01 0.00 0.00 42.92 41.67 3b5h s ASP 32 CO -0.07 -0.20 0.73 0.18 0.21 0.00 0.00 175.17 176.02 3b5h n LEU 33 N 0.56 2.17 0.00 1.23 4.77 0.26 -4.81 117.00 121.18 3b5h n LEU 33 Ca 0.02 -5.18 0.00 0.00 -0.03 0.00 0.00 56.01 50.82 3b5h n LEU 33 Cb 0.49 0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 3b5h n LEU 33 CO 0.47 2.19 0.00 0.61 -1.33 0.00 0.00 177.39 179.33 3b5h n GLY 34 N 0.59 1.02 0.06 -0.72 0.00 -1.26 -2.09 105.19 102.79 3b5h n GLY 34 Ca 0.26 0.36 0.12 0.00 0.00 0.00 0.00 46.02 46.76 3b5h n GLY 34 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3b5h n SER 35 N 8.93 0.68 -4.73 1.61 3.41 -1.26 -4.93 113.62 117.32 3b5h n SER 35 Ca 0.00 0.15 -0.23 0.00 -0.26 0.00 0.00 58.87 58.53 3b5h n SER 35 Cb 0.00 0.05 -0.06 0.00 -0.26 0.00 0.00 64.21 63.94 3b5h n SER 35 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3b5h s LYS 36 N -3.14 2.46 -0.15 4.33 1.02 -0.89 -3.87 119.74 119.50 3b5h s LYS 36 Ca 0.07 -1.42 -0.03 0.00 0.02 0.00 0.00 55.97 54.61 3b5h s LYS 36 Cb 0.14 -2.26 -0.03 0.00 -0.52 0.00 0.00 37.83 35.17 3b5h s LYS 36 CO 0.70 0.22 -0.05 0.42 -0.92 0.00 0.00 175.35 175.72 3b5h s ILE 37 N -2.35 3.81 -0.50 2.17 -1.09 -0.72 0.92 121.20 123.46 3b5h s ILE 37 Ca 0.36 -0.39 -0.16 0.00 -2.23 0.00 0.00 60.65 58.23 3b5h s ILE 37 Cb -0.05 -2.66 0.09 0.00 -1.58 0.00 0.00 42.46 38.26 3b5h s ILE 37 CO 0.23 0.50 0.44 -0.22 -1.23 0.00 0.00 174.94 174.65 3b5h s LEU 38 N 0.33 5.79 0.03 2.97 2.96 0.58 -0.24 118.68 131.11 3b5h s LEU 38 Ca -0.05 -1.47 -0.27 0.00 -0.22 0.00 0.00 54.13 52.13 3b5h s LEU 38 Cb -0.14 -2.20 -0.05 0.00 0.50 0.00 0.00 46.19 44.30 3b5h s LEU 38 CO 0.03 -0.73 0.84 -0.76 -1.32 0.00 0.00 176.35 174.42 3b5h s LEU 39 N 1.67 4.42 -0.05 -0.68 1.43 -0.16 -2.37 118.68 122.95 3b5h s LEU 39 Ca 0.04 1.53 0.02 0.00 -1.03 0.00 0.00 54.13 54.69 3b5h s LEU 39 Cb -0.26 -3.36 0.02 0.00 0.03 0.00 0.00 46.19 42.62 3b5h s LEU 39 CO 0.06 -0.08 -0.07 -0.89 0.23 0.00 0.00 176.35 175.59 3b5h s THR 40 N 0.32 0.75 -0.09 5.49 2.01 0.17 -1.10 115.64 123.19 3b5h s THR 40 Ca 0.43 -0.26 0.04 0.00 0.31 0.00 0.00 61.69 62.20 3b5h s THR 40 Cb -0.21 -0.72 -0.01 0.00 0.01 0.00 0.00 72.50 71.57 3b5h s THR 40 CO 0.25 0.27 -0.21 0.00 -0.69 0.00 0.00 174.62 174.24 3b5h s SER 42 N 0.09 1.18 -0.28 0.00 0.15 0.01 -1.39 113.70 113.47 3b5h s SER 42 Ca -0.09 -0.12 -0.23 0.00 0.70 0.00 0.00 55.95 56.21 3b5h s SER 42 Cb -0.15 -0.45 -0.01 0.00 -1.71 0.00 0.00 66.02 63.70 3b5h s SER 42 CO 0.06 -0.10 0.76 -0.22 1.20 0.00 0.00 173.24 174.93 3b5h s LEU 43 N 1.29 4.08 -0.01 3.45 0.20 0.19 0.31 118.68 128.20 3b5h s LEU 43 Ca -0.05 0.77 0.05 0.00 0.69 0.00 0.00 54.13 55.59 3b5h s LEU 43 Cb -0.14 -3.05 -0.03 0.00 -0.43 0.00 0.00 46.19 42.55 3b5h s LEU 43 CO -0.02 -0.53 -0.16 0.20 -0.29 0.00 0.00 176.35 175.55 3b5h s ASN 44 N 1.51 3.91 -1.08 3.68 -0.87 0.64 -4.76 114.94 117.97 3b5h s ASN 44 Ca 0.31 -0.29 -0.03 0.00 -1.57 0.00 0.00 52.86 51.28 3b5h s ASN 44 Cb -0.15 -0.74 0.00 0.00 -0.02 0.00 0.00 41.25 40.34 3b5h s ASN 44 CO 0.10 0.31 0.92 0.47 -2.57 0.00 0.00 177.10 176.33 3b5h n ASP 45 N 2.02 -3.56 -4.68 -1.22 10.43 -1.26 -2.30 116.55 115.98 3b5h n ASP 45 Ca -0.17 -0.50 -0.35 0.00 2.57 0.00 0.00 54.79 56.34 3b5h n ASP 45 Cb 0.52 -4.43 -0.09 0.00 1.84 0.00 0.00 41.12 38.96 3b5h n ASP 45 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 3b5h s SER 46 N -3.80 5.57 0.34 -2.24 0.15 -1.26 -4.68 113.70 107.78 3b5h s SER 46 Ca 0.21 0.15 0.17 0.00 0.70 0.00 0.00 55.95 57.17 3b5h s SER 46 Cb -0.09 -1.82 0.52 0.00 -1.71 0.00 0.00 66.02 62.92 3b5h s SER 46 CO 0.62 0.27 1.66 0.00 1.20 0.00 0.00 173.24 177.00 3b5h h ALA 47 N 5.95 0.91 -2.37 5.45 0.00 -1.96 -3.46 119.26 123.79 3b5h h ALA 47 Ca -0.44 -0.40 -0.53 0.00 0.00 0.00 0.00 54.91 53.54 3b5h h ALA 47 Cb 1.19 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.85 3b5h h ALA 47 CO 0.63 0.55 -0.54 -0.08 0.00 0.00 0.00 179.25 179.81 3b5h s THR 48 N -3.47 4.43 -0.05 0.00 -1.32 -1.26 -5.12 115.64 108.85 3b5h s THR 48 Ca 0.01 -1.31 -0.03 0.00 -1.21 0.00 0.00 61.69 59.15 3b5h s THR 48 Cb 0.11 -3.35 -0.04 0.00 -1.51 0.00 0.00 72.50 67.71 3b5h s THR 48 CO 0.71 -0.27 0.10 -1.61 -2.21 0.00 0.00 174.62 171.34 3b5h s GLU 49 N -3.58 3.23 0.48 7.08 2.02 -1.26 -5.09 118.70 121.57 3b5h s GLU 49 Ca 0.32 -0.34 -0.19 0.00 0.02 0.00 0.00 54.97 54.78 3b5h s GLU 49 Cb -0.09 -2.99 -0.09 0.00 0.10 0.00 0.00 34.13 31.07 3b5h s GLU 49 CO 0.24 0.70 0.98 0.14 0.02 0.00 0.00 175.26 177.35 3b5h s VAL 50 N -1.11 4.30 0.00 2.63 -7.23 -1.26 -4.78 120.40 112.95 3b5h s VAL 50 Ca 0.20 1.30 0.00 0.00 -1.81 0.00 0.00 61.98 61.66 3b5h s VAL 50 Cb -0.12 -3.60 0.00 0.00 0.56 0.00 0.00 36.38 33.22 3b5h s VAL 50 CO 0.10 -0.44 0.49 0.41 -0.31 0.00 0.00 175.10 175.35 3b5h n THR 51 N -1.09 0.24 0.00 5.32 -1.04 0.53 -4.40 114.28 113.83 3b5h n THR 51 Ca 0.07 -0.37 0.00 0.00 -2.04 0.00 0.00 64.05 61.71 3b5h n THR 51 Cb 0.54 1.14 0.00 0.00 -1.82 0.00 0.00 70.33 70.19 3b5h n THR 51 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3b5h n GLY 52 N -0.12 0.88 3.09 3.41 0.00 -1.13 -2.74 105.19 108.58 3b5h n GLY 52 Ca 0.00 -1.25 -0.11 0.00 0.00 0.00 0.00 46.02 44.66 3b5h n GLY 52 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3b5h s HIS 53 N -1.96 0.06 -0.01 1.61 3.76 -1.25 -1.89 115.29 115.61 3b5h s HIS 53 Ca 0.00 -0.16 0.00 0.00 -0.15 0.00 0.00 55.06 54.75 3b5h s HIS 53 Cb 0.00 -0.06 0.02 0.00 1.11 0.00 0.00 32.58 33.65 3b5h s HIS 53 CO 0.00 -0.27 0.02 0.50 -0.85 0.00 0.00 174.74 174.14 3b5h s ARG 54 N -1.33 -0.02 -0.11 1.40 3.52 0.56 -1.81 118.95 121.15 3b5h s ARG 54 Ca -0.14 0.12 0.01 0.00 -0.13 0.00 0.00 55.73 55.59 3b5h s ARG 54 Cb -0.08 -0.17 -0.02 0.00 -1.56 0.00 0.00 34.95 33.13 3b5h s ARG 54 CO 0.01 -0.11 -0.14 -1.58 -0.81 0.00 0.00 175.30 172.67 3b5h s TRP 55 N 0.71 2.77 0.29 5.12 0.52 0.49 0.58 118.94 129.43 3b5h s TRP 55 Ca -0.06 -0.56 0.05 0.00 0.02 0.00 0.00 56.10 55.55 3b5h s TRP 55 Cb -0.09 -1.79 -0.06 0.00 -1.15 0.00 0.00 33.47 30.38 3b5h s TRP 55 CO -0.02 -0.14 0.00 -0.51 0.02 0.00 0.00 176.95 176.30 3b5h s LEU 56 N 0.12 2.33 0.00 2.99 1.02 -0.44 -1.01 118.68 123.69 3b5h s LEU 56 Ca -0.07 -1.28 0.00 0.00 0.02 0.00 0.00 54.13 52.81 3b5h s LEU 56 Cb -0.15 -0.48 0.00 0.00 0.02 0.00 0.00 46.19 45.58 3b5h s LEU 56 CO 0.05 -0.48 0.90 0.29 0.02 0.00 0.00 176.35 177.13 3b5h n LYS 57 N -0.61 0.00 0.00 1.70 5.02 -1.26 -2.19 118.16 120.81 3b5h n LYS 57 Ca -0.04 -0.89 0.00 0.00 -2.02 0.00 0.00 58.31 55.36 3b5h n LYS 57 Cb 0.65 -0.49 0.00 0.00 -0.02 0.00 0.00 35.03 35.17 3b5h n LYS 57 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3b5h n GLY 58 N 0.00 3.24 3.82 0.72 0.00 -1.26 -4.96 105.19 106.75 3b5h n GLY 58 Ca 0.00 -0.90 -0.25 0.00 0.00 0.00 0.00 46.02 44.87 3b5h n GLY 58 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3b5h s GLY 59 N 0.00 2.38 -0.25 -0.02 0.00 -1.26 -5.11 107.32 103.06 3b5h s GLY 59 Ca 0.00 -1.65 -0.24 0.00 0.00 0.00 0.00 44.72 42.83 3b5h s GLY 59 CO 0.00 -1.91 0.83 0.14 0.00 0.00 0.00 173.10 172.16 3b5h s VAL 60 N -2.66 4.83 -0.04 1.40 1.01 -1.26 -4.43 120.40 119.24 3b5h s VAL 60 Ca 0.37 1.53 0.11 0.00 0.00 0.00 0.00 61.98 64.00 3b5h s VAL 60 Cb 0.01 -4.12 -0.23 0.00 0.00 0.00 0.00 36.38 32.03 3b5h s VAL 60 CO 0.21 -0.09 0.66 1.33 0.00 0.00 0.00 175.10 177.21 3b5h n VAL 61 N 5.29 1.63 -3.59 2.92 0.24 -0.18 -4.96 118.33 119.67 3b5h n VAL 61 Ca 0.05 -0.79 -0.14 0.00 -2.04 0.00 0.00 64.34 61.43 3b5h n VAL 61 Cb 0.48 -1.09 -0.06 0.00 -1.47 0.00 0.00 33.84 31.69 3b5h n VAL 61 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 3b5h s LEU 62 N -6.16 -0.62 -0.21 1.34 2.96 -1.19 -5.02 118.68 109.79 3b5h s LEU 62 Ca -0.06 0.98 -0.28 0.00 -0.22 0.00 0.00 54.13 54.56 3b5h s LEU 62 Cb 0.08 2.31 0.11 0.00 0.50 0.00 0.00 46.19 49.19 3b5h s LEU 62 CO 0.82 -0.36 0.93 -0.75 -1.32 0.00 0.00 176.35 175.68 3b5h s LYS 63 N -0.34 0.65 -0.45 1.98 2.20 -1.26 -0.38 119.74 122.15 3b5h s LYS 63 Ca -0.03 0.44 0.05 0.00 -0.36 0.00 0.00 55.97 56.08 3b5h s LYS 63 Cb -0.03 0.31 0.29 0.00 -1.51 0.00 0.00 37.83 36.90 3b5h s LYS 63 CO 0.03 -0.15 1.08 -0.85 -0.36 0.00 0.00 175.35 175.11 3b5h n GLU 64 N 1.58 0.80 -0.27 4.03 0.00 -0.75 -5.00 120.64 121.02 3b5h n GLU 64 Ca -0.13 -1.67 -0.04 0.00 0.00 0.00 0.00 57.16 55.32 3b5h n GLU 64 Cb 0.57 -1.03 -0.04 0.00 0.00 0.00 0.00 31.44 30.94 3b5h n GLU 64 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3b5h n ASP 65 N 0.84 1.50 0.00 -1.84 8.00 -1.26 -1.21 116.55 122.58 3b5h n ASP 65 Ca 0.05 -1.81 0.00 0.00 0.71 0.00 0.00 54.79 53.74 3b5h n ASP 65 Cb 0.68 -0.43 0.00 0.00 -0.02 0.00 0.00 41.12 41.36 3b5h n ASP 65 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3b5h n ALA 66 N 3.12 0.02 -2.99 2.24 0.00 -1.11 -4.31 120.51 117.49 3b5h n ALA 66 Ca 0.13 -0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.22 3b5h n ALA 66 Cb 0.22 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.55 3b5h n ALA 66 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3b5h s LEU 67 N -0.02 3.40 0.00 0.00 1.02 -0.35 -4.91 118.68 117.83 3b5h s LEU 67 Ca 0.00 -0.12 -0.02 0.00 0.02 0.00 0.00 54.13 54.01 3b5h s LEU 67 Cb 0.00 -1.86 0.03 0.00 0.02 0.00 0.00 46.19 44.38 3b5h s LEU 67 CO 0.00 0.11 0.15 -0.81 0.02 0.00 0.00 176.35 175.82 3b5h n PRO 68 N 3.97 -0.14 0.00 1.29 -0.04 -1.26 -2.84 135.00 135.98 3b5h n PRO 68 Ca -0.17 -0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.06 3b5h n PRO 68 Cb 0.52 -0.15 0.00 0.00 -0.04 0.00 0.00 33.50 33.83 3b5h n PRO 68 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3b5h n GLY 69 N 4.01 3.56 0.00 0.55 0.00 -1.26 -4.90 105.19 107.15 3b5h n GLY 69 Ca 0.02 -1.35 0.07 0.00 0.00 0.00 0.00 46.02 44.76 3b5h n GLY 69 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3b5h n GLN 70 N 0.48 0.91 -3.86 1.61 3.00 -1.26 -4.80 117.38 113.45 3b5h n GLN 70 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.84 3b5h n GLN 70 Cb 0.00 -1.23 -0.15 0.00 0.00 0.00 0.00 30.24 28.85 3b5h n GLN 70 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.06 177.27 3b5h s LYS 71 N -2.00 0.09 0.04 -1.09 2.20 -1.26 0.54 119.74 118.25 3b5h s LYS 71 Ca 0.20 0.09 0.01 0.00 -0.36 0.00 0.00 55.97 55.92 3b5h s LYS 71 Cb 0.09 -0.26 -0.02 0.00 -1.51 0.00 0.00 37.83 36.13 3b5h s LYS 71 CO 0.15 -0.10 -0.06 -0.08 -0.36 0.00 0.00 175.35 174.90 3b5h s THR 72 N 0.73 0.41 0.08 3.43 -1.32 -0.48 -5.03 115.64 113.47 3b5h s THR 72 Ca -0.07 -1.06 0.03 0.00 -1.21 0.00 0.00 61.69 59.39 3b5h s THR 72 Cb -0.09 -0.54 -0.03 0.00 -1.51 0.00 0.00 72.50 70.32 3b5h s THR 72 CO -0.02 -0.44 -0.09 -1.61 -2.21 0.00 0.00 174.62 170.25 3b5h s GLU 73 N -1.63 0.76 -0.09 7.08 2.02 -1.26 -1.53 118.70 124.05 3b5h s GLU 73 Ca -0.11 -1.06 -0.04 0.00 0.02 0.00 0.00 54.97 53.78 3b5h s GLU 73 Cb -0.09 -0.46 0.04 0.00 0.10 0.00 0.00 34.13 33.72 3b5h s GLU 73 CO -0.00 0.07 0.21 0.12 0.02 0.00 0.00 175.26 175.68 3b5h s PHE 74 N -2.20 -0.27 -0.28 1.61 5.36 -0.26 -5.01 117.98 116.93 3b5h s PHE 74 Ca 0.02 0.68 -0.15 0.00 -0.96 0.00 0.00 56.93 56.51 3b5h s PHE 74 Cb -0.04 -0.01 -0.03 0.00 -0.34 0.00 0.00 43.02 42.60 3b5h s PHE 74 CO -0.00 -0.21 0.39 0.15 -1.46 0.00 0.00 175.22 174.09 3b5h s LYS 75 N 1.26 3.95 -0.15 10.12 1.02 -1.26 -0.98 119.74 133.69 3b5h s LYS 75 Ca -0.09 -0.00 -0.16 0.00 0.02 0.00 0.00 55.97 55.73 3b5h s LYS 75 Cb -0.11 -3.68 -0.04 0.00 -0.52 0.00 0.00 37.83 33.48 3b5h s LYS 75 CO -0.08 -0.33 0.40 0.08 -0.92 0.00 0.00 175.35 174.51 3b5h s VAL 76 N 2.10 5.23 0.81 3.17 1.01 0.67 -4.94 120.40 128.44 3b5h s VAL 76 Ca 0.15 0.78 -0.11 0.00 0.00 0.00 0.00 61.98 62.79 3b5h s VAL 76 Cb -0.16 -3.74 0.08 0.00 0.00 0.00 0.00 36.38 32.56 3b5h s VAL 76 CO 0.10 0.33 1.09 -1.81 0.00 0.00 0.00 175.10 174.82 3b5h s ASP 77 N 0.66 4.37 0.20 3.32 -0.00 -1.26 -1.75 116.67 122.21 3b5h s ASP 77 Ca 0.22 1.37 -0.11 0.00 -0.00 0.00 0.00 52.55 54.03 3b5h s ASP 77 Cb -0.14 -2.10 0.18 0.00 -0.00 0.00 0.00 42.92 40.86 3b5h s ASP 77 CO 0.08 -2.05 1.83 0.77 -0.00 0.00 0.00 175.17 175.79 3b5h h SER 78 N -1.14 0.61 0.32 0.27 4.64 -1.98 -2.71 113.55 113.55 3b5h h SER 78 Ca -0.47 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3b5h h SER 78 Cb 1.27 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3b5h h SER 78 CO 0.58 0.41 0.00 0.47 -0.87 0.00 0.00 176.83 177.42 3b5h n ASP 79 N -4.74 0.00 -1.22 4.97 10.43 -1.26 -3.16 116.55 121.58 3b5h n ASP 79 Ca 0.07 -0.18 0.02 0.00 2.57 0.00 0.00 54.79 57.27 3b5h n ASP 79 Cb 0.11 -0.22 0.11 0.00 1.84 0.00 0.00 41.12 42.96 3b5h n ASP 79 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 3b5h n ASP 80 N -1.22 1.71 -3.53 -2.24 5.68 -1.03 -4.92 116.55 110.99 3b5h n ASP 80 Ca 0.12 -3.04 -0.41 0.00 -0.50 0.00 0.00 54.79 50.96 3b5h n ASP 80 Cb 0.15 -0.42 -0.01 0.00 -1.14 0.00 0.00 41.12 39.70 3b5h n ASP 80 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3b5h n GLN 81 N -0.44 3.53 -3.45 0.11 6.02 -1.19 -4.80 117.38 117.16 3b5h n GLN 81 Ca 0.15 -2.64 -0.11 0.00 -0.01 0.00 0.00 57.00 54.39 3b5h n GLN 81 Cb 0.90 -2.96 -0.02 0.00 1.02 0.00 0.00 30.24 29.18 3b5h n GLN 81 CO 0.00 0.00 0.00 1.67 -1.01 0.00 0.00 177.06 177.72 3b5h s TRP 82 N 1.89 -0.48 0.00 1.08 1.48 -1.26 -4.65 118.94 117.00 3b5h s TRP 82 Ca 0.57 0.31 0.00 0.00 -1.06 0.00 0.00 56.10 55.92 3b5h s TRP 82 Cb 0.16 0.55 0.00 0.00 -1.16 0.00 0.00 33.47 33.02 3b5h s TRP 82 CO -0.07 -0.75 0.00 0.41 -4.06 0.00 0.00 176.95 172.48 3b5h n GLY 83 N -0.31 -2.82 3.42 3.67 0.00 -1.26 -4.83 105.19 103.07 3b5h n GLY 83 Ca -0.14 -1.84 -0.38 0.00 0.00 0.00 0.00 46.02 43.65 3b5h n GLY 83 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3b5h s GLU 84 N -0.58 3.35 0.15 1.61 2.12 -1.26 -1.18 118.70 122.91 3b5h s GLU 84 Ca 0.00 -0.70 -0.06 0.00 0.36 0.00 0.00 54.97 54.58 3b5h s GLU 84 Cb 0.00 -3.49 -0.06 0.00 0.26 0.00 0.00 34.13 30.84 3b5h s GLU 84 CO 0.00 -0.38 0.40 0.71 -0.54 0.00 0.00 175.26 175.45 3b5h s TYR 85 N 1.59 3.47 -0.06 5.30 1.51 0.37 -4.61 117.35 124.94 3b5h s TYR 85 Ca 0.05 0.61 0.03 0.00 -1.01 0.00 0.00 57.07 56.74 3b5h s TYR 85 Cb -0.17 -2.05 0.01 0.00 -0.11 0.00 0.00 41.96 39.64 3b5h s TYR 85 CO 0.05 0.41 -0.14 -1.12 -1.11 0.00 0.00 175.55 173.65 3b5h s SER 86 N -2.40 1.89 -0.15 2.29 0.01 -0.93 0.11 113.70 114.52 3b5h s SER 86 Ca 0.42 -0.31 -0.11 0.00 1.31 0.00 0.00 55.95 57.26 3b5h s SER 86 Cb -0.12 -0.73 -0.05 0.00 0.21 0.00 0.00 66.02 65.33 3b5h s SER 86 CO 0.24 0.08 0.20 0.00 0.41 0.00 0.00 173.24 174.17 3b5h s VAL 88 N -0.17 1.95 0.17 0.00 1.01 0.20 -2.02 120.40 121.53 3b5h s VAL 88 Ca 0.14 -1.00 -0.27 0.00 0.00 0.00 0.00 61.98 60.85 3b5h s VAL 88 Cb -0.12 -1.84 -0.08 0.00 0.00 0.00 0.00 36.38 34.33 3b5h s VAL 88 CO 0.03 0.40 0.85 -0.36 0.00 0.00 0.00 175.10 176.02 3b5h s PHE 89 N 1.31 3.90 0.03 5.22 0.40 -0.19 -0.32 117.98 128.32 3b5h s PHE 89 Ca 0.02 1.72 0.05 0.00 -0.60 0.00 0.00 56.93 58.13 3b5h s PHE 89 Cb -0.14 -2.88 -0.03 0.00 0.51 0.00 0.00 43.02 40.48 3b5h s PHE 89 CO -0.11 0.43 -0.10 -0.51 0.70 0.00 0.00 175.22 175.62 3b5h s LEU 90 N -0.87 2.98 0.41 -0.37 1.43 -0.79 -3.88 118.68 117.60 3b5h s LEU 90 Ca 0.39 -0.26 -0.22 0.00 -1.03 0.00 0.00 54.13 53.01 3b5h s LEU 90 Cb -0.24 -1.73 -0.10 0.00 0.03 0.00 0.00 46.19 44.15 3b5h s LEU 90 CO 0.28 0.26 0.98 -2.16 0.23 0.00 0.00 176.35 175.94 3b5h s PRO 91 N -1.52 4.22 0.48 1.29 0.04 -1.26 -0.35 135.00 137.89 3b5h s PRO 91 Ca 0.17 1.27 -0.22 0.00 0.04 0.00 0.00 61.00 62.26 3b5h s PRO 91 Cb -0.11 -2.35 -0.07 0.00 0.04 0.00 0.00 34.50 32.01 3b5h s PRO 91 CO 0.08 -0.06 1.11 -1.21 0.04 0.00 0.00 177.00 176.96 3b5h s GLU 92 N -2.85 3.73 -0.99 4.56 2.02 -1.25 -1.90 118.70 122.02 3b5h s GLU 92 Ca 0.60 1.59 -0.01 0.00 0.02 0.00 0.00 54.97 57.17 3b5h s GLU 92 Cb -0.14 -2.25 0.32 0.00 0.10 0.00 0.00 34.13 32.16 3b5h s GLU 92 CO 0.19 -0.53 1.81 -0.35 0.02 0.00 0.00 175.26 176.39 3b5h n PRO 93 N -0.75 5.09 0.11 0.39 -0.04 -1.26 -5.08 135.00 133.46 3b5h n PRO 93 Ca 0.09 -4.57 0.13 0.00 -0.04 0.00 0.00 63.50 59.11 3b5h n PRO 93 Cb 0.50 -2.44 0.39 0.00 -0.04 0.00 0.00 33.50 31.91 3b5h n PRO 93 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3b5h n MET 94 N -0.12 0.27 0.00 0.54 0.00 -0.80 -4.88 117.12 112.14 3b5h n MET 94 Ca 0.47 0.22 0.00 0.00 0.00 0.00 0.00 57.70 58.39 3b5h n MET 94 Cb 0.27 -1.81 0.00 0.00 0.00 0.00 0.00 33.22 31.67 3b5h n MET 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3b5h n GLY 95 N 1.30 2.19 3.17 3.17 0.00 -1.26 -4.13 105.19 109.64 3b5h n GLY 95 Ca 0.05 0.14 -0.12 0.00 0.00 0.00 0.00 46.02 46.09 3b5h n GLY 95 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3b5h s THR 96 N -0.22 0.07 -0.03 2.61 2.01 -1.26 -1.02 115.64 117.80 3b5h s THR 96 Ca 0.00 -0.61 -0.19 0.00 0.31 0.00 0.00 61.69 61.20 3b5h s THR 96 Cb 0.00 -0.55 0.04 0.00 0.01 0.00 0.00 72.50 72.00 3b5h s THR 96 CO 0.00 -0.34 0.41 0.00 -0.69 0.00 0.00 174.62 174.00 3b5h s ALA 97 N -1.45 -1.04 0.01 7.40 0.00 -0.86 -4.80 121.76 121.02 3b5h s ALA 97 Ca -0.14 0.63 0.01 0.00 0.00 0.00 0.00 51.96 52.46 3b5h s ALA 97 Cb -0.06 -0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 3b5h s ALA 97 CO 0.02 -0.28 0.06 -0.80 0.00 0.00 0.00 175.76 174.77 3b5h s ASN 98 N -1.17 5.54 -0.08 0.00 0.01 -1.26 -0.70 114.94 117.28 3b5h s ASN 98 Ca -0.12 0.09 0.04 0.00 -0.71 0.00 0.00 52.86 52.16 3b5h s ASN 98 Cb -0.04 -1.54 0.00 0.00 0.41 0.00 0.00 41.25 40.08 3b5h s ASN 98 CO 0.05 0.25 -0.21 -0.63 -1.51 0.00 0.00 177.10 175.06 3b5h s ILE 99 N -1.21 1.79 -0.21 0.60 1.01 0.31 -4.94 121.20 118.54 3b5h s ILE 99 Ca 0.23 -0.88 -0.05 0.00 0.00 0.00 0.00 60.65 59.96 3b5h s ILE 99 Cb -0.12 -1.55 -0.02 0.00 0.01 0.00 0.00 42.46 40.78 3b5h s ILE 99 CO 0.15 0.50 -0.02 -1.58 0.00 0.00 0.00 174.94 173.99 3b5h s GLN 100 N 0.31 3.49 0.29 2.79 2.00 -1.26 0.14 119.66 127.43 3b5h s GLN 100 Ca -0.14 -0.57 -0.01 0.00 -2.00 0.00 0.00 55.36 52.63 3b5h s GLN 100 Cb -0.16 -3.06 -0.04 0.00 0.80 0.00 0.00 33.01 30.55 3b5h s GLN 100 CO 0.06 -0.11 0.51 -0.51 -0.50 0.00 0.00 175.29 174.74 3b5h s LEU 101 N 1.30 4.09 0.03 3.68 1.43 -0.33 -5.01 118.68 123.86 3b5h s LEU 101 Ca 0.04 0.51 0.07 0.00 -1.03 0.00 0.00 54.13 53.72 3b5h s LEU 101 Cb -0.14 -3.33 -0.02 0.00 0.03 0.00 0.00 46.19 42.72 3b5h s LEU 101 CO -0.00 -0.20 -0.20 -1.00 0.23 0.00 0.00 176.35 175.18 3b5h s HIS 102 N -2.12 1.79 -0.60 0.29 3.76 -1.26 -4.17 115.29 112.97 3b5h s HIS 102 Ca 0.41 -0.36 0.00 0.00 -0.15 0.00 0.00 55.06 54.95 3b5h s HIS 102 Cb -0.10 -1.09 0.00 0.00 1.11 0.00 0.00 32.58 32.50 3b5h s HIS 102 CO 0.32 0.05 0.00 0.41 -0.85 0.00 0.00 174.74 174.68 3b5h n GLY 103 N 2.06 -1.29 3.47 -2.22 0.00 -0.25 -4.93 105.19 102.02 3b5h n GLY 103 Ca -0.17 -1.00 -0.36 0.00 0.00 0.00 0.00 46.02 44.49 3b5h n GLY 103 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3b5h n PRO 104 N -0.09 0.26 -2.22 1.61 -0.04 -1.26 -4.20 135.00 129.05 3b5h n PRO 104 Ca 0.00 0.13 -0.31 0.00 -0.04 0.00 0.00 63.50 63.28 3b5h n PRO 104 Cb 0.00 -1.85 -0.01 0.00 -0.04 0.00 0.00 33.50 31.59 3b5h n PRO 104 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3b5h s PRO 105 N -2.87 3.75 -0.22 0.54 0.05 -1.26 -4.91 135.00 130.08 3b5h s PRO 105 Ca 0.65 0.77 0.00 0.00 0.05 0.00 0.00 61.00 62.47 3b5h s PRO 105 Cb -0.34 -2.15 0.03 0.00 0.05 0.00 0.00 34.50 32.09 3b5h s PRO 105 CO 0.58 -0.38 -0.14 1.03 0.05 0.00 0.00 177.00 178.15 3b5h s ARG 106 N -4.59 2.82 -0.06 4.56 0.52 -1.26 -4.50 118.95 116.44 3b5h s ARG 106 Ca 0.56 -0.96 0.04 0.00 -0.52 0.00 0.00 55.73 54.85 3b5h s ARG 106 Cb -0.10 -2.76 -0.02 0.00 0.52 0.00 0.00 34.95 32.58 3b5h s ARG 106 CO 0.42 -0.33 -0.17 0.14 0.02 0.00 0.00 175.30 175.38 3b5h s VAL 107 N 1.27 2.82 0.03 3.52 -7.23 -1.26 -4.33 120.40 115.22 3b5h s VAL 107 Ca 0.01 -0.81 -0.02 0.00 -1.81 0.00 0.00 61.98 59.36 3b5h s VAL 107 Cb -0.15 -2.09 -0.02 0.00 0.56 0.00 0.00 36.38 34.67 3b5h s VAL 107 CO -0.09 0.58 0.01 -1.59 -0.31 0.00 0.00 175.10 173.70 3b5h s LYS 108 N -0.53 0.42 0.46 4.82 -2.85 -0.85 -4.43 119.74 116.78 3b5h s LYS 108 Ca 0.07 -0.72 -0.22 0.00 -1.00 0.00 0.00 55.97 54.11 3b5h s LYS 108 Cb -0.11 0.15 -0.08 0.00 -2.06 0.00 0.00 37.83 35.73 3b5h s LYS 108 CO 0.01 -0.08 1.07 0.00 0.10 0.00 0.00 175.35 176.45 3b5h s ALA 109 N -2.05 2.94 -0.06 0.59 0.00 -1.26 -1.72 121.76 120.19 3b5h s ALA 109 Ca -0.10 0.70 -0.25 0.00 0.00 0.00 0.00 51.96 52.31 3b5h s ALA 109 Cb -0.05 -3.28 -0.20 0.00 0.00 0.00 0.00 23.12 19.58 3b5h s ALA 109 CO -0.03 -0.36 1.01 0.28 0.00 0.00 0.00 175.76 176.66 3b5h h VAL 110 N 1.77 1.32 -3.18 0.00 2.07 -1.48 -3.42 116.25 113.32 3b5h h VAL 110 Ca -0.49 -1.44 -0.67 0.00 0.82 0.00 0.00 66.70 64.92 3b5h h VAL 110 Cb 1.23 2.24 -0.32 0.00 -1.52 0.00 0.00 31.29 32.91 3b5h h VAL 110 CO 0.60 0.35 -0.82 -0.54 0.02 0.00 0.00 177.57 177.18 3b5h s LYS 111 N -3.47 3.12 0.30 1.57 1.02 -1.26 -5.00 119.74 116.02 3b5h s LYS 111 Ca -0.16 -0.77 0.14 0.00 0.02 0.00 0.00 55.97 55.21 3b5h s LYS 111 Cb 0.00 -2.68 0.41 0.00 -0.52 0.00 0.00 37.83 35.03 3b5h s LYS 111 CO 0.61 -0.17 1.61 0.77 -0.92 0.00 0.00 175.35 177.26 3b5h h SER 112 N 7.87 0.00 -3.47 2.83 0.02 -1.87 -3.45 113.55 115.48 3b5h h SER 112 Ca -0.42 0.00 -0.37 0.00 -0.84 0.00 0.00 61.79 60.16 3b5h h SER 112 Cb 1.15 0.00 -0.34 0.00 0.14 0.00 0.00 62.40 63.35 3b5h h SER 112 CO 0.62 0.54 -0.76 -0.55 -1.14 0.00 0.00 176.83 175.54 3b5h s SER 113 N -6.60 0.65 -0.01 3.07 0.15 -1.26 0.11 113.70 109.80 3b5h s SER 113 Ca 0.00 -0.06 0.01 0.00 0.70 0.00 0.00 55.95 56.60 3b5h s SER 113 Cb 0.11 -0.30 -0.00 0.00 -1.71 0.00 0.00 66.02 64.11 3b5h s SER 113 CO 0.73 -0.09 -0.05 -0.70 1.20 0.00 0.00 173.24 174.34 3b5h s GLU 114 N 1.02 0.40 -0.26 5.44 2.12 -0.70 -4.98 118.70 121.74 3b5h s GLU 114 Ca -0.10 -0.16 0.03 0.00 0.36 0.00 0.00 54.97 55.10 3b5h s GLU 114 Cb -0.14 -0.39 0.06 0.00 0.26 0.00 0.00 34.13 33.93 3b5h s GLU 114 CO -0.01 0.09 -0.09 -1.58 -0.54 0.00 0.00 175.26 173.13 3b5h s HIS 115 N -0.05 3.18 0.09 5.30 2.46 -1.26 -1.42 115.29 123.60 3b5h s HIS 115 Ca 0.01 -2.30 0.06 0.00 0.47 0.00 0.00 55.06 53.29 3b5h s HIS 115 Cb -0.03 -1.96 -0.03 0.00 -0.13 0.00 0.00 32.58 30.43 3b5h s HIS 115 CO -0.00 -0.87 -0.14 0.42 -2.47 0.00 0.00 174.74 171.67 3b5h s ILE 116 N 1.13 1.23 0.28 0.89 1.01 -0.59 -5.00 121.20 120.14 3b5h s ILE 116 Ca -0.07 -1.50 -0.24 0.00 0.00 0.00 0.00 60.65 58.84 3b5h s ILE 116 Cb -0.20 -1.30 -0.09 0.00 0.01 0.00 0.00 42.46 40.88 3b5h s ILE 116 CO -0.05 -0.30 0.86 0.20 0.00 0.00 0.00 174.94 175.65 3b5h s ASN 117 N -2.06 7.27 0.45 3.58 0.02 -1.26 -2.38 114.94 120.56 3b5h s ASN 117 Ca 0.03 1.70 -0.25 0.00 -1.02 0.00 0.00 52.86 53.32 3b5h s ASN 117 Cb -0.08 -2.53 -0.09 0.00 0.02 0.00 0.00 41.25 38.58 3b5h s ASN 117 CO 0.03 -0.00 1.31 1.21 0.02 0.00 0.00 177.10 179.66 3b5h n GLU 118 N 0.74 1.95 -0.61 -0.60 2.13 -1.16 -1.93 120.64 121.15 3b5h n GLU 118 Ca -0.00 0.70 0.00 0.00 0.66 0.00 0.00 57.16 58.52 3b5h n GLU 118 Cb 0.50 -2.46 0.00 0.00 0.27 0.00 0.00 31.44 29.75 3b5h n GLU 118 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3b5h n GLY 119 N 0.76 1.28 0.00 8.31 0.00 0.05 -4.86 105.19 110.74 3b5h n GLY 119 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3b5h n GLY 119 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3b5h n GLU 120 N -2.00 2.00 -4.51 1.61 1.02 -0.81 -4.24 120.64 113.70 3b5h n GLU 120 Ca 0.00 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.93 3b5h n GLU 120 Cb 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 31.44 31.27 3b5h n GLU 120 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 3b5h s THR 121 N 1.16 0.95 -0.20 2.62 -1.32 -1.26 -0.94 115.64 116.64 3b5h s THR 121 Ca 0.00 -0.54 -0.07 0.00 -1.21 0.00 0.00 61.69 59.86 3b5h s THR 121 Cb 0.00 -0.80 -0.04 0.00 -1.51 0.00 0.00 72.50 70.16 3b5h s THR 121 CO 0.00 0.24 0.07 0.00 -2.21 0.00 0.00 174.62 172.72 3b5h s ALA 122 N -0.32 3.33 -0.52 11.08 0.00 0.72 -4.94 121.76 131.11 3b5h s ALA 122 Ca 0.04 -0.87 -0.04 0.00 0.00 0.00 0.00 51.96 51.09 3b5h s ALA 122 Cb -0.05 -1.98 0.14 0.00 0.00 0.00 0.00 23.12 21.23 3b5h s ALA 122 CO -0.00 -0.04 0.34 1.41 0.00 0.00 0.00 175.76 177.46 3b5h s MET 123 N 0.78 2.34 0.21 0.00 0.00 -1.26 -0.05 119.30 121.32 3b5h s MET 123 Ca 0.04 -2.14 -0.30 0.00 0.00 0.00 0.00 55.69 53.29 3b5h s MET 123 Cb -0.13 -3.71 -0.08 0.00 0.00 0.00 0.00 34.83 30.90 3b5h s MET 123 CO 0.02 -1.14 0.94 -0.51 0.00 0.00 0.00 175.02 174.34 3b5h s LEU 124 N 0.62 4.62 -0.09 4.11 1.43 -0.57 -4.89 118.68 123.92 3b5h s LEU 124 Ca 0.12 1.91 -0.01 0.00 -1.03 0.00 0.00 54.13 55.12 3b5h s LEU 124 Cb -0.22 -3.60 0.03 0.00 0.03 0.00 0.00 46.19 42.43 3b5h s LEU 124 CO -0.04 0.11 -0.03 -0.69 0.23 0.00 0.00 176.35 175.94 3b5h s VAL 125 N -0.93 0.64 0.09 -1.59 1.01 -1.26 -0.41 120.40 117.96 3b5h s VAL 125 Ca 0.42 -0.05 0.05 0.00 0.00 0.00 0.00 61.98 62.40 3b5h s VAL 125 Cb -0.25 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 3b5h s VAL 125 CO 0.31 0.30 0.01 0.00 0.00 0.00 0.00 175.10 175.73 3b5h s LYS 127 N -2.37 1.09 -0.02 0.00 -2.85 -0.70 -0.29 119.74 114.59 3b5h s LYS 127 Ca 0.26 -1.19 -0.21 0.00 -1.00 0.00 0.00 55.97 53.84 3b5h s LYS 127 Cb -0.12 0.35 0.04 0.00 -2.06 0.00 0.00 37.83 36.05 3b5h s LYS 127 CO 0.19 -0.38 0.44 -1.54 0.10 0.00 0.00 175.35 174.16 3b5h s SER 128 N -2.97 -0.36 -0.13 0.03 1.04 -0.83 -2.01 113.70 108.49 3b5h s SER 128 Ca 0.17 0.30 0.15 0.00 0.48 0.00 0.00 55.95 57.05 3b5h s SER 128 Cb 0.04 0.40 0.37 0.00 0.10 0.00 0.00 66.02 66.92 3b5h s SER 128 CO -0.01 -0.51 1.26 -1.84 0.98 0.00 0.00 173.24 173.12 3b5h n GLU 129 N 1.11 2.29 -1.44 4.02 0.00 -1.26 -4.32 120.64 121.05 3b5h n GLU 129 Ca -0.21 -2.54 -0.31 0.00 0.00 0.00 0.00 57.16 54.11 3b5h n GLU 129 Cb 0.56 -1.58 0.07 0.00 0.00 0.00 0.00 31.44 30.50 3b5h n GLU 129 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 3b5h s SER 130 N -2.12 4.93 -0.05 -1.84 0.01 -1.26 -4.90 113.70 108.47 3b5h s SER 130 Ca 0.32 1.75 -0.02 0.00 1.31 0.00 0.00 55.95 59.31 3b5h s SER 130 Cb 0.26 -2.51 0.03 0.00 0.21 0.00 0.00 66.02 64.02 3b5h s SER 130 CO 0.06 -1.75 0.09 -0.69 0.41 0.00 0.00 173.24 171.36 3b5h s VAL 131 N -2.91 -0.15 0.81 3.43 1.01 -1.26 -3.39 120.40 117.94 3b5h s VAL 131 Ca 0.60 0.39 -0.12 0.00 0.00 0.00 0.00 61.98 62.85 3b5h s VAL 131 Cb -0.16 -0.19 0.09 0.00 0.00 0.00 0.00 36.38 36.12 3b5h s VAL 131 CO 0.54 0.17 1.17 -2.16 0.00 0.00 0.00 175.10 174.82 3b5h s PRO 132 N 2.13 1.66 0.76 2.72 0.04 -1.26 -1.10 135.00 139.95 3b5h s PRO 132 Ca 0.04 1.62 -0.08 0.00 0.04 0.00 0.00 61.00 62.62 3b5h s PRO 132 Cb -0.12 -1.79 0.09 0.00 0.04 0.00 0.00 34.50 32.72 3b5h s PRO 132 CO -0.04 -2.17 1.07 -1.25 0.04 0.00 0.00 177.00 174.66 3b5h s PRO 133 N -4.31 1.86 -0.48 0.56 0.04 -1.22 -4.77 135.00 126.67 3b5h s PRO 133 Ca 0.70 -0.36 -0.29 0.00 0.04 0.00 0.00 61.00 61.09 3b5h s PRO 133 Cb -0.25 -2.12 0.02 0.00 0.04 0.00 0.00 34.50 32.19 3b5h s PRO 133 CO 0.52 -1.49 1.23 0.08 0.04 0.00 0.00 177.00 177.38 3b5h s VAL 134 N -3.36 4.08 -0.02 -0.36 1.01 -1.26 -4.26 120.40 116.22 3b5h s VAL 134 Ca 0.63 1.07 -0.23 0.00 0.00 0.00 0.00 61.98 63.46 3b5h s VAL 134 Cb -0.09 -4.51 -0.16 0.00 0.00 0.00 0.00 36.38 31.62 3b5h s VAL 134 CO 0.46 -1.00 1.07 0.74 0.00 0.00 0.00 175.10 176.37 3b5h h THR 135 N 6.30 0.77 -4.18 3.92 2.02 -0.81 -3.31 112.91 117.63 3b5h h THR 135 Ca -0.25 -0.84 -0.69 0.00 0.77 0.00 0.00 66.41 65.40 3b5h h THR 135 Cb 1.07 1.20 -0.30 0.00 -1.74 0.00 0.00 68.15 68.39 3b5h h THR 135 CO 1.13 0.16 -0.87 -1.81 0.37 0.00 0.00 175.52 174.51 3b5h s ASP 136 N -5.27 3.23 0.06 4.18 1.01 -1.02 -4.84 116.67 114.01 3b5h s ASP 136 Ca -0.13 -0.45 0.09 0.00 0.71 0.00 0.00 52.55 52.77 3b5h s ASP 136 Cb 0.01 -0.71 -0.03 0.00 1.01 0.00 0.00 42.92 43.20 3b5h s ASP 136 CO 0.51 0.28 -0.25 0.26 0.21 0.00 0.00 175.17 176.18 3b5h s TRP 137 N -0.36 2.36 -0.04 4.23 0.52 -1.26 -0.53 118.94 123.86 3b5h s TRP 137 Ca 0.03 -0.38 -0.02 0.00 0.02 0.00 0.00 56.10 55.74 3b5h s TRP 137 Cb -0.12 -1.38 0.02 0.00 -1.15 0.00 0.00 33.47 30.84 3b5h s TRP 137 CO 0.02 0.18 0.08 0.00 0.02 0.00 0.00 176.95 177.24 3b5h s ALA 138 N -0.86 -0.11 -0.14 0.98 0.00 0.36 -4.98 121.76 117.01 3b5h s ALA 138 Ca 0.13 0.38 -0.06 0.00 0.00 0.00 0.00 51.96 52.41 3b5h s ALA 138 Cb -0.10 -0.27 -0.04 0.00 0.00 0.00 0.00 23.12 22.71 3b5h s ALA 138 CO 0.03 -0.10 0.09 -1.58 0.00 0.00 0.00 175.76 174.20 3b5h s TRP 139 N 0.76 3.39 0.05 0.00 0.52 -1.26 -0.87 118.94 121.52 3b5h s TRP 139 Ca -0.06 0.31 0.05 0.00 0.02 0.00 0.00 56.10 56.42 3b5h s TRP 139 Cb -0.08 -1.96 -0.02 0.00 -1.15 0.00 0.00 33.47 30.25 3b5h s TRP 139 CO -0.03 0.48 -0.15 0.71 0.02 0.00 0.00 176.95 177.98 3b5h s TYR 140 N -0.49 1.28 -0.15 -1.98 1.51 0.39 -0.98 117.35 116.93 3b5h s TYR 140 Ca 0.11 -0.38 -0.16 0.00 -1.01 0.00 0.00 57.07 55.63 3b5h s TYR 140 Cb -0.12 -0.75 -0.04 0.00 -0.11 0.00 0.00 41.96 40.94 3b5h s TYR 140 CO 0.02 0.05 0.38 0.21 -1.11 0.00 0.00 175.55 175.10 3b5h s LYS 141 N -1.30 4.29 -0.27 -0.62 2.20 0.03 -0.31 119.74 123.76 3b5h s LYS 141 Ca 0.01 0.25 -0.29 0.00 -0.36 0.00 0.00 55.97 55.58 3b5h s LYS 141 Cb -0.08 -3.44 0.01 0.00 -1.51 0.00 0.00 37.83 32.80 3b5h s LYS 141 CO 0.02 0.18 1.17 0.42 -0.36 0.00 0.00 175.35 176.77 3b5h s ILE 142 N 0.60 4.39 -1.18 5.43 1.01 -0.35 -1.53 121.20 129.57 3b5h s ILE 142 Ca 0.21 1.63 0.17 0.00 0.00 0.00 0.00 60.65 62.65 3b5h s ILE 142 Cb -0.14 -4.25 0.56 0.00 0.01 0.00 0.00 42.46 38.64 3b5h s ILE 142 CO 0.07 -0.37 1.47 0.35 0.00 0.00 0.00 174.94 176.47 3b5h n THR 143 N 5.78 1.42 -0.87 2.92 -2.24 -1.26 -4.61 114.28 115.43 3b5h n THR 143 Ca 0.13 -1.16 -0.02 0.00 -2.27 0.00 0.00 64.05 60.73 3b5h n THR 143 Cb 0.46 0.29 -0.01 0.00 -2.10 0.00 0.00 70.33 68.98 3b5h n THR 143 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3b5h n ASP 144 N 0.90 -0.66 -2.72 3.42 5.68 -1.26 -4.62 116.55 117.30 3b5h n ASP 144 Ca 0.21 0.05 -0.05 0.00 -0.50 0.00 0.00 54.79 54.50 3b5h n ASP 144 Cb 0.68 -0.98 0.08 0.00 -1.14 0.00 0.00 41.12 39.77 3b5h n ASP 144 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3b5h n SER 145 N 1.11 -0.01 0.00 -1.12 3.41 -1.26 -5.08 113.62 110.67 3b5h n SER 145 Ca -0.02 -2.35 0.00 0.00 -0.26 0.00 0.00 58.87 56.24 3b5h n SER 145 Cb 0.08 0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.16 3b5h n SER 145 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 3b5h n GLU 146 N -0.68 0.00 -2.95 4.33 0.28 -1.26 -5.09 120.64 115.26 3b5h n GLU 146 Ca -0.01 0.00 -0.33 0.00 -0.16 0.00 0.00 57.16 56.67 3b5h n GLU 146 Cb 0.84 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 33.64 3b5h n GLU 146 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 3b5h s ASP 147 N 0.00 6.83 -0.20 -1.84 1.01 -1.26 -3.99 116.67 117.22 3b5h s ASP 147 Ca 0.00 1.47 -0.07 0.00 0.71 0.00 0.00 52.55 54.65 3b5h s ASP 147 Cb 0.00 -2.45 -0.04 0.00 1.01 0.00 0.00 42.92 41.44 3b5h s ASP 147 CO 0.00 -0.30 0.06 -0.75 0.21 0.00 0.00 175.17 174.40 3b5h s LYS 148 N -3.15 3.88 0.35 8.23 2.20 -0.58 -4.94 119.74 125.72 3b5h s LYS 148 Ca 0.58 -0.39 -0.28 0.00 -0.36 0.00 0.00 55.97 55.52 3b5h s LYS 148 Cb -0.10 -3.24 -0.11 0.00 -1.51 0.00 0.00 37.83 32.87 3b5h s LYS 148 CO 0.17 0.14 1.42 0.00 -0.36 0.00 0.00 175.35 176.71 3b5h s ALA 149 N 0.74 3.55 -0.64 3.13 0.00 -1.26 -0.78 121.76 126.49 3b5h s ALA 149 Ca 0.03 1.45 -0.04 0.00 0.00 0.00 0.00 51.96 53.40 3b5h s ALA 149 Cb -0.13 -3.56 0.17 0.00 0.00 0.00 0.00 23.12 19.59 3b5h s ALA 149 CO 0.02 -0.89 0.47 -0.51 0.00 0.00 0.00 175.76 174.85 3b5h s LEU 150 N -1.91 5.42 0.18 0.00 1.43 -0.16 -4.85 118.68 118.80 3b5h s LEU 150 Ca 0.52 -2.79 -0.29 0.00 -1.03 0.00 0.00 54.13 50.53 3b5h s LEU 150 Cb -0.44 -1.90 -0.08 0.00 0.03 0.00 0.00 46.19 43.81 3b5h s LEU 150 CO 0.58 -0.40 0.91 -0.04 0.23 0.00 0.00 176.35 177.63 3b5h s MET 151 N 0.03 4.74 0.18 1.70 -1.94 -1.26 -4.66 119.30 118.09 3b5h s MET 151 Ca 0.17 1.39 -0.33 0.00 -1.71 0.00 0.00 55.69 55.21 3b5h s MET 151 Cb -0.19 -3.31 -0.15 0.00 2.01 0.00 0.00 34.83 33.19 3b5h s MET 151 CO -0.04 0.43 1.31 -1.71 -0.01 0.00 0.00 175.02 175.00 3b5h n ASN 152 N 1.96 2.02 0.00 3.03 2.85 -1.26 -1.96 115.26 121.90 3b5h n ASN 152 Ca -0.01 1.13 0.00 0.00 -0.11 0.00 0.00 54.58 55.59 3b5h n ASN 152 Cb 0.48 -1.30 0.00 0.00 1.24 0.00 0.00 39.78 40.20 3b5h n ASN 152 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3b5h n GLY 153 N 2.28 1.01 3.77 8.20 0.00 0.12 -4.99 105.19 115.58 3b5h n GLY 153 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3b5h n GLY 153 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3b5h s SER 154 N -2.88 6.24 0.00 1.61 0.15 -0.83 -1.93 113.70 116.06 3b5h s SER 154 Ca 0.00 2.97 0.00 0.00 0.70 0.00 0.00 55.95 59.62 3b5h s SER 154 Cb 0.00 -2.66 0.00 0.00 -1.71 0.00 0.00 66.02 61.65 3b5h s SER 154 CO 0.00 -0.93 0.00 -1.84 1.20 0.00 0.00 173.24 171.67 3b5h n GLU 155 N 0.28 -1.83 -2.10 5.44 0.28 -1.26 -0.62 120.64 120.83 3b5h n GLU 155 Ca 0.02 0.00 -0.18 0.00 -0.16 0.00 0.00 57.16 56.84 3b5h n GLU 155 Cb 0.40 -3.36 -0.03 0.00 1.43 0.00 0.00 31.44 29.89 3b5h n GLU 155 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 3b5h n SER 156 N -0.37 -5.28 0.00 -1.84 7.64 -0.81 -4.79 113.62 108.17 3b5h n SER 156 Ca 0.00 0.12 0.00 0.00 1.01 0.00 0.00 58.87 60.00 3b5h n SER 156 Cb 0.23 -4.36 0.00 0.00 -1.01 0.00 0.00 64.21 59.07 3b5h n SER 156 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 3b5h n ARG 157 N -2.67 0.19 -3.61 1.43 1.85 0.21 -5.00 116.66 109.06 3b5h n ARG 157 Ca -0.21 0.00 -0.37 0.00 -1.00 0.00 0.00 57.85 56.28 3b5h n ARG 157 Cb 0.65 -0.02 -0.09 0.00 -1.05 0.00 0.00 32.46 31.95 3b5h n ARG 157 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3b5h s PHE 158 N 0.00 3.34 0.01 2.89 0.40 -0.85 -0.75 117.98 123.01 3b5h s PHE 158 Ca 0.00 0.32 0.01 0.00 -0.60 0.00 0.00 56.93 56.66 3b5h s PHE 158 Cb 0.00 -2.32 -0.01 0.00 0.51 0.00 0.00 43.02 41.21 3b5h s PHE 158 CO 0.00 0.07 -0.04 -0.06 0.70 0.00 0.00 175.22 175.88 3b5h s PHE 159 N 1.05 0.39 -0.08 0.36 0.40 -0.09 0.14 117.98 120.15 3b5h s PHE 159 Ca 0.10 -0.18 0.03 0.00 -0.60 0.00 0.00 56.93 56.29 3b5h s PHE 159 Cb -0.14 -0.25 0.01 0.00 0.51 0.00 0.00 43.02 43.15 3b5h s PHE 159 CO 0.05 -0.03 -0.18 0.54 0.70 0.00 0.00 175.22 176.29 3b5h s VAL 160 N -0.42 1.58 -0.29 -0.44 0.11 -1.26 0.59 120.40 120.27 3b5h s VAL 160 Ca -0.02 -0.74 0.02 0.00 -2.93 0.00 0.00 61.98 58.30 3b5h s VAL 160 Cb -0.04 -1.39 0.08 0.00 -1.53 0.00 0.00 36.38 33.50 3b5h s VAL 160 CO -0.00 0.45 0.01 -0.55 -3.33 0.00 0.00 175.10 171.69 3b5h s SER 161 N 0.48 4.24 -0.08 3.54 0.15 -0.17 -4.96 113.70 116.91 3b5h s SER 161 Ca -0.16 -1.63 0.04 0.00 0.70 0.00 0.00 55.95 54.89 3b5h s SER 161 Cb -0.17 -1.28 -0.02 0.00 -1.71 0.00 0.00 66.02 62.85 3b5h s SER 161 CO 0.06 -0.32 -0.19 -0.44 1.20 0.00 0.00 173.24 173.55 3b5h s SER 162 N 1.26 3.59 0.00 5.45 0.01 -1.26 -1.75 113.70 121.00 3b5h s SER 162 Ca 0.03 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.92 3b5h s SER 162 Cb -0.19 -1.08 0.00 0.00 0.21 0.00 0.00 66.02 64.97 3b5h s SER 162 CO -0.11 0.25 0.00 -1.54 0.41 0.00 0.00 173.24 172.25 3b5h n SER 163 N 2.95 1.66 -4.72 2.44 3.41 0.21 -5.02 113.62 114.55 3b5h n SER 163 Ca -0.18 -0.59 -0.42 0.00 -0.26 0.00 0.00 58.87 57.42 3b5h n SER 163 Cb 0.52 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.44 3b5h n SER 163 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3b5h s GLN 164 N -0.78 4.45 -1.84 4.33 -0.21 -1.26 -3.61 119.66 120.74 3b5h s GLN 164 Ca 0.00 1.81 0.00 0.00 0.02 0.00 0.00 55.36 57.19 3b5h s GLN 164 Cb 0.00 -3.31 0.00 0.00 1.00 0.00 0.00 33.01 30.70 3b5h s GLN 164 CO 0.00 -0.20 0.00 0.41 -2.12 0.00 0.00 175.29 173.38 3b5h n GLY 165 N 2.90 0.71 3.59 3.09 0.00 -1.24 -4.95 105.19 109.28 3b5h n GLY 165 Ca 0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 46.02 46.00 3b5h n GLY 165 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3b5h s ARG 166 N -4.29 0.51 -0.05 1.61 3.52 -1.24 -1.96 118.95 117.05 3b5h s ARG 166 Ca 0.00 1.23 -0.01 0.00 -0.13 0.00 0.00 55.73 56.82 3b5h s ARG 166 Cb 0.00 0.69 0.03 0.00 -1.56 0.00 0.00 34.95 34.11 3b5h s ARG 166 CO 0.00 -0.17 0.01 0.45 -0.81 0.00 0.00 175.30 174.78 3b5h s SER 167 N 2.64 1.19 -0.23 -2.12 0.15 0.60 -0.62 113.70 115.31 3b5h s SER 167 Ca -0.05 -0.04 -0.09 0.00 0.70 0.00 0.00 55.95 56.46 3b5h s SER 167 Cb -0.10 -0.33 -0.05 0.00 -1.71 0.00 0.00 66.02 63.84 3b5h s SER 167 CO -0.19 -0.17 0.13 -1.61 1.20 0.00 0.00 173.24 172.60 3b5h s GLU 168 N 1.72 4.01 -0.39 5.44 2.02 -0.72 -1.47 118.70 129.31 3b5h s GLU 168 Ca 0.01 -0.31 -0.09 0.00 0.02 0.00 0.00 54.97 54.60 3b5h s GLU 168 Cb -0.13 -3.44 0.06 0.00 0.10 0.00 0.00 34.13 30.72 3b5h s GLU 168 CO -0.04 0.09 0.21 -1.17 0.02 0.00 0.00 175.26 174.37 3b5h s LEU 169 N 0.95 4.87 -0.19 1.80 0.20 0.45 -1.00 118.68 125.77 3b5h s LEU 169 Ca 0.06 -1.32 -0.17 0.00 0.69 0.00 0.00 54.13 53.39 3b5h s LEU 169 Cb -0.13 -1.97 -0.04 0.00 -0.43 0.00 0.00 46.19 43.62 3b5h s LEU 169 CO 0.03 -0.46 0.47 -1.00 -0.29 0.00 0.00 176.35 175.10 3b5h s HIS 170 N 1.44 3.38 -0.27 5.38 3.76 0.20 -1.51 115.29 127.68 3b5h s HIS 170 Ca 0.02 0.72 0.02 0.00 -0.15 0.00 0.00 55.06 55.67 3b5h s HIS 170 Cb -0.21 -2.61 0.06 0.00 1.11 0.00 0.00 32.58 30.93 3b5h s HIS 170 CO 0.03 -0.05 -0.08 0.42 -0.85 0.00 0.00 174.74 174.22 3b5h s ILE 171 N 1.43 2.34 0.46 0.60 1.01 0.92 -0.91 121.20 127.06 3b5h s ILE 171 Ca 0.22 -1.62 0.04 0.00 0.00 0.00 0.00 60.65 59.30 3b5h s ILE 171 Cb -0.15 -2.39 0.01 0.00 0.01 0.00 0.00 42.46 39.94 3b5h s ILE 171 CO 0.09 -0.07 0.65 -1.61 0.00 0.00 0.00 174.94 173.99 3b5h s GLU 172 N 1.12 2.80 -1.19 2.79 2.02 0.07 -0.20 118.70 126.12 3b5h s GLU 172 Ca -0.07 -0.93 -0.27 0.00 0.02 0.00 0.00 54.97 53.72 3b5h s GLU 172 Cb -0.20 -2.64 0.02 0.00 0.10 0.00 0.00 34.13 31.41 3b5h s GLU 172 CO -0.04 -0.38 0.73 -1.71 0.02 0.00 0.00 175.26 173.87 3b5h n ASN 173 N -2.03 -4.59 -4.51 -0.19 4.05 -1.17 -4.64 115.26 102.18 3b5h n ASN 173 Ca 0.06 -1.16 -0.46 0.00 0.45 0.00 0.00 54.58 53.47 3b5h n ASN 173 Cb 0.59 -2.55 -0.06 0.00 1.23 0.00 0.00 39.78 39.00 3b5h n ASN 173 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 177.26 174.10 3b5h n LEU 174 N -4.61 2.42 -4.81 1.20 7.94 -0.12 -4.67 117.00 114.35 3b5h n LEU 174 Ca -0.11 0.20 -0.38 0.00 -1.11 0.00 0.00 56.01 54.61 3b5h n LEU 174 Cb 0.58 -1.38 -0.06 0.00 0.53 0.00 0.00 43.42 43.09 3b5h n LEU 174 CO 0.71 -0.84 0.30 0.21 -1.11 0.00 0.00 177.39 176.66 3b5h s ASN 175 N 8.42 7.08 0.00 1.96 3.84 -1.26 -0.77 114.94 134.20 3b5h s ASN 175 Ca 1.07 1.29 0.29 0.00 0.21 0.00 0.00 52.86 55.72 3b5h s ASN 175 Cb -0.62 -2.37 1.24 0.00 -0.55 0.00 0.00 41.25 38.95 3b5h s ASN 175 CO 0.41 0.24 1.87 0.23 -2.79 0.00 0.00 177.10 177.06 3b5h n MET 176 N 1.56 0.73 -0.08 0.43 2.81 -1.26 -3.38 117.12 117.92 3b5h n MET 176 Ca -0.09 -0.25 -0.16 0.00 -1.81 0.00 0.00 57.70 55.39 3b5h n MET 176 Cb 0.51 -1.49 -0.06 0.00 -0.71 0.00 0.00 33.22 31.46 3b5h n MET 176 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3b5h n GLU 177 N -0.91 0.36 -0.05 0.03 1.02 -1.26 -4.72 120.64 115.11 3b5h n GLU 177 Ca 0.15 0.14 -0.07 0.00 -0.02 0.00 0.00 57.16 57.36 3b5h n GLU 177 Cb 0.27 -1.15 -0.14 0.00 -0.02 0.00 0.00 31.44 30.40 3b5h n GLU 177 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3b5h n ALA 178 N -3.54 1.64 0.12 0.62 0.00 -1.26 -4.68 120.51 113.40 3b5h n ALA 178 Ca -0.31 -0.99 -0.21 0.00 0.00 0.00 0.00 53.44 51.92 3b5h n ALA 178 Cb 0.75 -0.54 -0.15 0.00 0.00 0.00 0.00 19.45 19.51 3b5h n ALA 178 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3b5h h ASP 179 N 0.00 0.63 -3.94 0.00 3.32 -1.86 -3.44 116.42 111.13 3b5h h ASP 179 Ca -0.38 -0.72 -0.54 0.00 0.02 0.00 0.00 57.03 55.42 3b5h h ASP 179 Cb 2.01 -0.21 0.10 0.00 0.22 0.00 0.00 39.33 41.45 3b5h h ASP 179 CO 0.05 1.57 0.75 -2.16 -1.72 0.00 0.00 179.24 177.73 3b5h s PRO 180 N -2.62 4.13 0.00 3.56 0.04 -1.26 -4.84 135.00 134.01 3b5h s PRO 180 Ca -0.08 2.50 0.00 0.00 0.04 0.00 0.00 61.00 63.46 3b5h s PRO 180 Cb 0.06 -2.97 0.00 0.00 0.04 0.00 0.00 34.50 31.63 3b5h s PRO 180 CO 0.91 -0.49 0.00 0.41 0.04 0.00 0.00 177.00 177.87 3b5h n GLY 181 N 0.52 -0.07 3.29 0.56 0.00 -0.65 -5.00 105.19 103.85 3b5h n GLY 181 Ca 0.01 -1.32 -0.33 0.00 0.00 0.00 0.00 46.02 44.38 3b5h n GLY 181 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3b5h s GLN 182 N -2.00 3.22 -0.09 1.61 -0.21 -1.26 -0.23 119.66 120.70 3b5h s GLN 182 Ca 0.00 -0.77 0.00 0.00 0.02 0.00 0.00 55.36 54.61 3b5h s GLN 182 Cb 0.00 -2.51 -0.03 0.00 1.00 0.00 0.00 33.01 31.47 3b5h s GLN 182 CO 0.00 0.15 -0.08 0.71 -2.12 0.00 0.00 175.29 173.95 3b5h s TYR 183 N 0.48 2.92 -0.23 0.91 1.51 0.63 -1.21 117.35 122.35 3b5h s TYR 183 Ca -0.12 -0.14 -0.03 0.00 -1.01 0.00 0.00 57.07 55.77 3b5h s TYR 183 Cb -0.16 -1.77 0.00 0.00 -0.11 0.00 0.00 41.96 39.92 3b5h s TYR 183 CO 0.05 0.18 -0.05 0.50 -1.11 0.00 0.00 175.55 175.12 3b5h s ARG 184 N -0.42 3.22 -0.15 -0.62 3.52 0.58 -0.53 118.95 124.56 3b5h s ARG 184 Ca 0.06 -0.73 -0.06 0.00 -0.13 0.00 0.00 55.73 54.87 3b5h s ARG 184 Cb -0.12 -2.99 -0.04 0.00 -1.56 0.00 0.00 34.95 30.24 3b5h s ARG 184 CO 0.02 -0.25 0.06 0.00 -0.81 0.00 0.00 175.30 174.32 3b5h s ASN 186 N -0.20 2.64 -0.07 0.00 3.84 -0.05 -1.70 114.94 119.40 3b5h s ASN 186 Ca 0.08 -0.48 0.05 0.00 0.21 0.00 0.00 52.86 52.72 3b5h s ASN 186 Cb -0.12 -1.21 -0.01 0.00 -0.55 0.00 0.00 41.25 39.37 3b5h s ASN 186 CO 0.01 0.08 -0.24 -0.83 -2.79 0.00 0.00 177.10 173.33 3b5h s GLY 187 N 0.69 1.31 -0.12 1.21 0.00 -0.87 -0.49 107.32 109.06 3b5h s GLY 187 Ca -0.12 -1.02 0.02 0.00 0.00 0.00 0.00 44.72 43.60 3b5h s GLY 187 CO 0.03 -0.55 -0.20 -1.59 0.00 0.00 0.00 173.10 170.79 3b5h s THR 188 N -0.01 2.40 0.51 0.90 2.01 0.31 -2.60 115.64 119.15 3b5h s THR 188 Ca -0.08 -0.89 0.05 0.00 0.31 0.00 0.00 61.69 61.08 3b5h s THR 188 Cb -0.15 -1.96 0.01 0.00 0.01 0.00 0.00 72.50 70.41 3b5h s THR 188 CO 0.05 0.54 0.29 -0.94 -0.69 0.00 0.00 174.62 173.88 3b5h s SER 189 N 0.46 4.52 0.22 3.53 1.04 -0.57 -0.02 113.70 122.89 3b5h s SER 189 Ca -0.14 -1.28 0.22 0.00 0.48 0.00 0.00 55.95 55.23 3b5h s SER 189 Cb -0.17 0.25 0.93 0.00 0.10 0.00 0.00 66.02 67.14 3b5h s SER 189 CO 0.06 -0.95 1.66 -1.54 0.98 0.00 0.00 173.24 173.45 3b5h n SER 190 N -1.58 0.56 -0.91 7.02 3.41 -1.26 -2.43 113.62 118.43 3b5h n SER 190 Ca -0.05 0.65 0.11 0.00 -0.26 0.00 0.00 58.87 59.32 3b5h n SER 190 Cb 0.65 -0.76 0.13 0.00 -0.26 0.00 0.00 64.21 63.96 3b5h n SER 190 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3b5h n LYS 191 N -2.13 2.08 -0.41 4.33 4.76 -1.26 -5.08 118.16 120.44 3b5h n LYS 191 Ca 0.02 -1.90 0.00 0.00 -2.87 0.00 0.00 58.31 53.56 3b5h n LYS 191 Cb 0.20 -1.42 0.00 0.00 -1.84 0.00 0.00 35.03 31.97 3b5h n LYS 191 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3b5h n GLY 192 N 1.23 0.56 3.29 0.72 0.00 -1.02 -4.38 105.19 105.59 3b5h n GLY 192 Ca 0.14 -1.55 -0.13 0.00 0.00 0.00 0.00 46.02 44.48 3b5h n GLY 192 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3b5h s SER 193 N -4.00 -0.22 0.13 1.61 1.04 -1.26 -1.51 113.70 109.48 3b5h s SER 193 Ca 0.00 -0.02 -0.04 0.00 0.48 0.00 0.00 55.95 56.37 3b5h s SER 193 Cb 0.00 0.38 -0.03 0.00 0.10 0.00 0.00 66.02 66.47 3b5h s SER 193 CO 0.00 -0.59 0.12 -0.62 0.98 0.00 0.00 173.24 173.13 3b5h s ASP 194 N -1.83 0.24 0.08 7.02 2.15 -1.07 -4.78 116.67 118.48 3b5h s ASP 194 Ca -0.07 -1.03 0.03 0.00 0.43 0.00 0.00 52.55 51.91 3b5h s ASP 194 Cb -0.02 0.33 -0.03 0.00 -0.30 0.00 0.00 42.92 42.90 3b5h s ASP 194 CO -0.01 -0.76 -0.09 -1.10 -0.17 0.00 0.00 175.17 173.04 3b5h s GLN 195 N -3.99 0.75 0.19 4.34 -0.21 -1.26 -2.04 119.66 117.43 3b5h s GLN 195 Ca 0.18 -1.06 0.07 0.00 0.02 0.00 0.00 55.36 54.57 3b5h s GLN 195 Cb 0.06 -0.41 -0.05 0.00 1.00 0.00 0.00 33.01 33.61 3b5h s GLN 195 CO -0.02 0.06 -0.14 0.00 -2.12 0.00 0.00 175.29 173.07 3b5h s ALA 196 N -2.29 1.91 -0.11 6.09 0.00 -0.69 -4.78 121.76 121.90 3b5h s ALA 196 Ca 0.02 -1.60 0.03 0.00 0.00 0.00 0.00 51.96 50.40 3b5h s ALA 196 Cb -0.04 -0.08 -0.00 0.00 0.00 0.00 0.00 23.12 23.00 3b5h s ALA 196 CO -0.01 0.06 -0.22 0.42 0.00 0.00 0.00 175.76 176.02 3b5h s ILE 197 N -2.90 2.26 -0.10 0.00 1.09 -1.26 -2.02 121.20 118.27 3b5h s ILE 197 Ca 0.20 -0.94 0.03 0.00 -1.10 0.00 0.00 60.65 58.84 3b5h s ILE 197 Cb -0.01 -1.88 -0.01 0.00 -1.06 0.00 0.00 42.46 39.50 3b5h s ILE 197 CO 0.06 0.55 -0.20 -0.63 -0.10 0.00 0.00 174.94 174.62 3b5h s ILE 198 N 0.38 2.48 -0.26 2.92 1.01 0.31 -4.82 121.20 123.22 3b5h s ILE 198 Ca -0.17 -0.88 -0.11 0.00 0.00 0.00 0.00 60.65 59.49 3b5h s ILE 198 Cb -0.17 -1.98 -0.05 0.00 0.01 0.00 0.00 42.46 40.27 3b5h s ILE 198 CO 0.08 0.55 0.21 0.42 0.00 0.00 0.00 174.94 176.20 3b5h s THR 199 N 0.18 5.31 -0.16 2.92 -4.23 0.12 -0.27 115.64 119.51 3b5h s THR 199 Ca -0.11 0.25 -0.05 0.00 -1.18 0.00 0.00 61.69 60.60 3b5h s THR 199 Cb -0.16 -3.55 -0.03 0.00 1.34 0.00 0.00 72.50 70.10 3b5h s THR 199 CO 0.06 0.28 0.00 -0.22 -0.54 0.00 0.00 174.62 174.20 3b5h s LEU 200 N 1.49 3.48 -0.02 4.79 2.96 0.68 -1.72 118.68 130.35 3b5h s LEU 200 Ca 0.09 -0.03 0.03 0.00 -0.22 0.00 0.00 54.13 54.00 3b5h s LEU 200 Cb -0.15 -1.85 -0.00 0.00 0.50 0.00 0.00 46.19 44.69 3b5h s LEU 200 CO 0.08 0.19 -0.11 -0.60 -1.32 0.00 0.00 176.35 174.59 3b5h s ARG 201 N 0.25 0.97 0.03 1.98 3.52 -0.51 -1.63 118.95 123.55 3b5h s ARG 201 Ca -0.00 -0.38 0.07 0.00 -0.13 0.00 0.00 55.73 55.28 3b5h s ARG 201 Cb -0.13 -0.92 -0.02 0.00 -1.56 0.00 0.00 34.95 32.32 3b5h s ARG 201 CO 0.02 0.20 -0.20 0.54 -0.81 0.00 0.00 175.30 175.05 3b5h s VAL 202 N -0.11 1.58 -2.00 7.11 0.11 -1.26 -1.55 120.40 124.28 3b5h s VAL 202 Ca 0.02 -1.07 0.20 0.00 -2.93 0.00 0.00 61.98 58.20 3b5h s VAL 202 Cb -0.06 -1.36 0.58 0.00 -1.53 0.00 0.00 36.38 34.01 3b5h s VAL 202 CO -0.00 0.26 1.60 0.54 -3.33 0.00 0.00 175.10 174.16