#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wp8 n LEU 4 N 0.00 0.00 -4.04 0.55 4.77 -1.26 -5.11 117.00 111.91 2wp8 n LEU 4 Ca 0.00 -2.95 -0.32 0.00 -0.03 0.00 0.00 56.01 52.71 2wp8 n LEU 4 Cb 0.00 1.66 -0.15 0.00 -2.33 0.00 0.00 43.42 42.60 2wp8 n LEU 4 CO 0.00 -0.51 -0.32 -0.70 -1.33 0.00 0.00 177.39 174.53 2wp8 s GLU 5 N -3.23 1.65 0.25 3.23 2.12 -1.26 -4.99 118.70 116.47 2wp8 s GLU 5 Ca 0.37 -1.80 -0.05 0.00 0.36 0.00 0.00 54.97 53.84 2wp8 s GLU 5 Cb 0.02 -3.22 0.27 0.00 0.26 0.00 0.00 34.13 31.45 2wp8 s GLU 5 CO 0.26 -0.91 1.86 0.82 -0.54 0.00 0.00 175.26 176.75 2wp8 h ILE 6 N 6.59 1.25 -1.58 -3.70 1.08 -1.96 -3.31 117.51 115.88 2wp8 h ILE 6 Ca -0.07 -0.65 -0.25 0.00 -0.39 0.00 0.00 64.86 63.50 2wp8 h ILE 6 Cb 1.03 0.15 -0.26 0.00 -3.07 0.00 0.00 36.82 34.66 2wp8 h ILE 6 CO 0.54 0.29 -0.59 -0.47 -0.69 0.00 0.00 178.15 177.22 2wp8 s TYR 7 N -5.73 -0.85 0.87 1.37 5.04 -1.26 -4.18 117.35 112.61 2wp8 s TYR 7 Ca -0.12 -0.40 -0.14 0.00 -2.44 0.00 0.00 57.07 53.97 2wp8 s TYR 7 Cb 0.17 -0.13 0.01 0.00 0.35 0.00 0.00 41.96 42.37 2wp8 s TYR 7 CO 0.82 -1.05 0.49 -1.13 -1.34 0.00 0.00 175.55 173.34 2wp8 n SER 8 N 4.31 -1.63 0.16 4.32 3.41 -0.92 -4.83 113.62 118.45 2wp8 n SER 8 Ca 0.11 0.43 0.13 0.00 -0.26 0.00 0.00 58.87 59.28 2wp8 n SER 8 Cb 0.50 -1.23 0.55 0.00 -0.26 0.00 0.00 64.21 63.77 2wp8 n SER 8 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2wp8 h PRO 9 N -1.14 0.00 -0.85 4.33 0.11 -2.01 -0.72 132.00 131.72 2wp8 h PRO 9 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2wp8 h PRO 9 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2wp8 h PRO 9 CO 0.37 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.55 2wp8 n GLU 10 N -2.37 2.12 -2.54 1.05 4.71 -1.26 -4.91 120.64 117.43 2wp8 n GLU 10 Ca 0.01 -0.91 -0.11 0.00 -0.01 0.00 0.00 57.16 56.13 2wp8 n GLU 10 Cb 0.21 -1.70 -0.00 0.00 -1.01 0.00 0.00 31.44 28.93 2wp8 n GLU 10 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2wp8 n GLY 11 N 0.21 -0.50 3.57 0.62 0.00 -0.28 -4.97 105.19 103.84 2wp8 n GLY 11 Ca 0.08 0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 2wp8 n GLY 11 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wp8 s LEU 12 N -5.60 3.37 0.77 0.99 1.43 -1.26 -4.51 118.68 113.88 2wp8 s LEU 12 Ca 0.04 -0.03 -0.02 0.00 -1.03 0.00 0.00 54.13 53.09 2wp8 s LEU 12 Cb -0.02 -1.80 0.15 0.00 0.03 0.00 0.00 46.19 44.55 2wp8 s LEU 12 CO 0.05 0.24 1.05 -0.13 0.23 0.00 0.00 176.35 177.79 2wp8 s ARG 13 N -0.08 1.44 0.27 1.70 0.52 -0.75 -2.16 118.95 119.88 2wp8 s ARG 13 Ca 0.03 -1.16 -0.00 0.00 -0.52 0.00 0.00 55.73 54.07 2wp8 s ARG 13 Cb -0.13 -2.28 0.55 0.00 0.52 0.00 0.00 34.95 33.61 2wp8 s ARG 13 CO 0.02 -1.65 1.77 1.37 0.02 0.00 0.00 175.30 176.84 2wp8 h LEU 14 N -0.70 0.58 -1.40 2.53 8.10 -1.72 0.11 115.31 122.80 2wp8 h LEU 14 Ca -0.35 0.09 0.00 0.00 0.11 0.00 0.00 57.88 57.72 2wp8 h LEU 14 Cb 1.26 -0.01 0.00 0.00 -0.44 0.00 0.00 40.66 41.47 2wp8 h LEU 14 CO 0.37 0.25 0.00 -0.90 -4.11 0.00 0.00 178.44 174.05 2wp8 n ASP 15 N -4.84 2.11 0.00 0.17 3.85 -1.26 -4.93 116.55 111.64 2wp8 n ASP 15 Ca 0.18 -1.78 0.00 0.00 -0.71 0.00 0.00 54.79 52.48 2wp8 n ASP 15 Cb 0.43 -0.13 0.00 0.00 -1.35 0.00 0.00 41.12 40.07 2wp8 n ASP 15 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2wp8 n GLY 16 N 1.22 0.70 3.90 6.12 0.00 0.37 -5.06 105.19 112.44 2wp8 n GLY 16 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2wp8 n GLY 16 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wp8 s ARG 17 N -0.37 2.32 0.23 1.61 0.52 -1.26 -4.67 118.95 117.33 2wp8 s ARG 17 Ca 0.00 0.20 0.03 0.00 -0.52 0.00 0.00 55.73 55.45 2wp8 s ARG 17 Cb 0.00 -2.00 0.03 0.00 0.52 0.00 0.00 34.95 33.50 2wp8 s ARG 17 CO 0.00 -1.35 0.27 0.54 0.02 0.00 0.00 175.30 174.79 2wp8 n ARG 18 N -3.16 0.94 0.12 3.54 1.74 -1.26 -1.81 116.66 116.78 2wp8 n ARG 18 Ca 0.07 -1.27 -0.02 0.00 -0.77 0.00 0.00 57.85 55.86 2wp8 n ARG 18 Cb 0.59 -0.02 0.13 0.00 -1.02 0.00 0.00 32.46 32.14 2wp8 n ARG 18 CO 0.00 0.00 0.00 0.11 -1.52 0.00 0.00 177.63 176.22 2wp8 h TRP 19 N 0.20 0.04 -0.45 -1.55 5.08 -1.87 -3.19 115.95 114.21 2wp8 h TRP 19 Ca -0.12 -0.02 -0.12 0.00 1.08 0.00 0.00 58.89 59.71 2wp8 h TRP 19 Cb 0.50 -0.01 -0.07 0.00 -3.00 0.00 0.00 29.16 26.58 2wp8 h TRP 19 CO 0.00 0.69 0.08 0.27 -1.28 0.00 0.00 178.44 178.19 2wp8 n ASN 20 N -3.76 3.82 -4.48 0.11 6.94 -1.26 0.21 115.26 116.84 2wp8 n ASN 20 Ca -0.01 -3.29 -0.35 0.00 -0.02 0.00 0.00 54.58 50.91 2wp8 n ASN 20 Cb 0.66 -0.64 -0.12 0.00 -2.36 0.00 0.00 39.78 37.32 2wp8 n ASN 20 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2wp8 s GLU 21 N -3.00 3.68 0.83 -3.83 2.02 -1.20 -4.94 118.70 112.24 2wp8 s GLU 21 Ca 0.47 -0.49 -0.11 0.00 0.02 0.00 0.00 54.97 54.86 2wp8 s GLU 21 Cb 0.39 -3.09 0.09 0.00 0.10 0.00 0.00 34.13 31.62 2wp8 s GLU 21 CO 0.08 0.07 1.10 -0.51 0.02 0.00 0.00 175.26 176.01 2wp8 s LEU 22 N 0.87 2.81 0.76 1.80 1.43 -1.26 -4.42 118.68 120.66 2wp8 s LEU 22 Ca 0.01 1.81 -0.05 0.00 -1.03 0.00 0.00 54.13 54.88 2wp8 s LEU 22 Cb -0.14 -4.39 0.12 0.00 0.03 0.00 0.00 46.19 41.81 2wp8 s LEU 22 CO 0.02 -2.37 1.05 0.00 0.23 0.00 0.00 176.35 175.28 2wp8 s ARG 23 N -4.86 1.62 0.30 1.70 1.70 -1.26 -5.01 118.95 113.14 2wp8 s ARG 23 Ca 0.63 -0.77 -0.29 0.00 -0.47 0.00 0.00 55.73 54.83 2wp8 s ARG 23 Cb -0.18 -2.21 -0.13 0.00 -0.57 0.00 0.00 34.95 31.86 2wp8 s ARG 23 CO 0.57 -1.56 1.35 -2.13 -1.08 0.00 0.00 175.30 172.45 2wp8 n ARG 24 N -3.01 2.14 -3.60 3.89 0.63 -1.26 -4.64 116.66 110.80 2wp8 n ARG 24 Ca 0.13 0.75 -0.28 0.00 -0.92 0.00 0.00 57.85 57.54 2wp8 n ARG 24 Cb 0.60 -2.37 -0.16 0.00 0.45 0.00 0.00 32.46 30.98 2wp8 n ARG 24 CO 0.00 0.00 0.00 0.12 -2.51 0.00 0.00 177.63 175.24 2wp8 s PHE 25 N -0.67 0.44 0.14 -0.14 5.36 -1.26 -0.51 117.98 121.34 2wp8 s PHE 25 Ca 0.60 -0.70 0.09 0.00 -0.96 0.00 0.00 56.93 55.96 2wp8 s PHE 25 Cb -0.59 -0.88 -0.04 0.00 -0.34 0.00 0.00 43.02 41.17 2wp8 s PHE 25 CO 0.57 -0.68 -0.20 -1.21 -1.46 0.00 0.00 175.22 172.24 2wp8 s GLU 26 N 2.06 1.24 0.10 10.12 2.02 -0.65 -5.03 118.70 128.57 2wp8 s GLU 26 Ca 0.05 -1.32 -0.02 0.00 0.02 0.00 0.00 54.97 53.70 2wp8 s GLU 26 Cb -0.16 -1.43 -0.03 0.00 0.10 0.00 0.00 34.13 32.61 2wp8 s GLU 26 CO -0.21 0.31 0.06 -1.12 0.02 0.00 0.00 175.26 174.31 2wp8 s SER 27 N -2.35 0.33 0.04 -0.19 0.01 -1.26 -1.62 113.70 108.67 2wp8 s SER 27 Ca 0.13 -1.07 -0.11 0.00 1.31 0.00 0.00 55.95 56.21 2wp8 s SER 27 Cb -0.08 0.28 0.01 0.00 0.21 0.00 0.00 66.02 66.44 2wp8 s SER 27 CO 0.06 -0.70 0.23 -0.44 0.41 0.00 0.00 173.24 172.80 2wp8 s SER 28 N -2.98 -0.02 0.10 2.44 0.01 -0.66 -4.98 113.70 107.60 2wp8 s SER 28 Ca 0.16 -0.29 0.05 0.00 1.31 0.00 0.00 55.95 57.18 2wp8 s SER 28 Cb 0.07 0.31 -0.04 0.00 0.21 0.00 0.00 66.02 66.57 2wp8 s SER 28 CO -0.03 -0.57 -0.12 -0.63 0.41 0.00 0.00 173.24 172.30 2wp8 s ILE 29 N -2.49 1.11 -1.07 1.44 -1.09 -1.26 -2.14 121.20 115.70 2wp8 s ILE 29 Ca -0.06 -1.61 -0.04 0.00 -2.23 0.00 0.00 60.65 56.72 2wp8 s ILE 29 Cb -0.01 -1.37 -0.05 0.00 -1.58 0.00 0.00 42.46 39.45 2wp8 s ILE 29 CO -0.03 -0.45 0.92 -3.20 -1.23 0.00 0.00 174.94 170.95 2wp8 n ASN 30 N 0.67 -5.02 0.06 3.58 5.15 0.39 -4.89 115.26 115.21 2wp8 n ASN 30 Ca -0.17 -0.66 0.12 0.00 -0.60 0.00 0.00 54.58 53.27 2wp8 n ASN 30 Cb 0.57 -5.07 0.10 0.00 -0.53 0.00 0.00 39.78 34.84 2wp8 n ASN 30 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 2wp8 n THR 31 N -3.48 0.35 -3.15 -0.44 -1.04 -1.24 -4.50 114.28 100.79 2wp8 n THR 31 Ca -0.14 -0.32 -0.21 0.00 -2.04 0.00 0.00 64.05 61.34 2wp8 n THR 31 Cb 0.63 -0.08 -0.05 0.00 -1.82 0.00 0.00 70.33 69.02 2wp8 n THR 31 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2wp8 n HIS 32 N -2.18 -0.49 -0.06 -1.42 8.25 -1.26 -5.00 115.22 113.07 2wp8 n HIS 32 Ca 0.02 -3.47 0.24 0.00 -0.26 0.00 0.00 57.72 54.25 2wp8 n HIS 32 Cb 0.46 -0.19 0.71 0.00 1.12 0.00 0.00 29.99 32.09 2wp8 n HIS 32 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2wp8 h PRO 33 N 3.73 0.00 0.00 -0.41 0.13 -1.82 -2.22 132.00 131.41 2wp8 h PRO 33 Ca 0.06 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.85 2wp8 h PRO 33 Cb 0.92 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.98 2wp8 h PRO 33 CO 0.45 0.00 -2.29 0.72 -0.23 0.00 0.00 178.00 176.65 2wp8 n HIS 34 N -4.22 0.00 0.28 1.56 8.25 -1.26 -4.41 115.22 115.41 2wp8 n HIS 34 Ca 0.13 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.75 2wp8 n HIS 34 Cb 0.75 -0.91 0.60 0.00 1.12 0.00 0.00 29.99 31.55 2wp8 n HIS 34 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2wp8 h ALA 35 N 0.64 1.00 -2.79 -1.41 0.00 -1.89 -3.47 119.26 111.34 2wp8 h ALA 35 Ca -0.51 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.35 2wp8 h ALA 35 Cb 2.04 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 19.71 2wp8 h ALA 35 CO -0.01 0.00 -0.06 0.00 0.00 0.00 0.00 179.25 179.19 2wp8 s ALA 36 N -3.59 -0.87 0.01 0.00 0.00 -0.87 -4.88 121.76 111.56 2wp8 s ALA 36 Ca 0.02 -0.16 -0.12 0.00 0.00 0.00 0.00 51.96 51.71 2wp8 s ALA 36 Cb 0.08 0.76 -0.33 0.00 0.00 0.00 0.00 23.12 23.64 2wp8 s ALA 36 CO 0.56 -0.70 0.90 -0.44 0.00 0.00 0.00 175.76 176.08 2wp8 h ASP 37 N 2.32 0.68 -3.87 0.00 3.32 -1.70 -3.42 116.42 113.74 2wp8 h ASP 37 Ca -0.32 -0.82 -0.35 0.00 0.02 0.00 0.00 57.03 55.55 2wp8 h ASP 37 Cb 1.26 -0.22 -0.15 0.00 0.22 0.00 0.00 39.33 40.44 2wp8 h ASP 37 CO 0.44 1.67 -0.72 -0.83 -1.72 0.00 0.00 179.24 178.07 2wp8 s GLY 38 N -4.81 1.11 -0.18 2.75 0.00 -0.94 -4.17 107.32 101.09 2wp8 s GLY 38 Ca -0.11 -1.49 -0.29 0.00 0.00 0.00 0.00 44.72 42.84 2wp8 s GLY 38 CO 0.90 -1.58 0.99 -1.35 0.00 0.00 0.00 173.10 172.06 2wp8 s SER 39 N -3.10 -0.40 0.01 1.64 1.04 -1.26 -1.53 113.70 110.11 2wp8 s SER 39 Ca 0.16 0.52 -0.02 0.00 0.48 0.00 0.00 55.95 57.09 2wp8 s SER 39 Cb 0.01 0.44 -0.01 0.00 0.10 0.00 0.00 66.02 66.56 2wp8 s SER 39 CO 0.02 -0.31 0.02 -0.94 0.98 0.00 0.00 173.24 173.01 2wp8 s SER 40 N -0.82 0.13 -0.05 7.02 1.04 -0.27 -0.46 113.70 120.29 2wp8 s SER 40 Ca -0.01 -0.30 0.04 0.00 0.48 0.00 0.00 55.95 56.16 2wp8 s SER 40 Cb -0.01 0.12 -0.00 0.00 0.10 0.00 0.00 66.02 66.22 2wp8 s SER 40 CO 0.00 -0.25 -0.17 -0.47 0.98 0.00 0.00 173.24 173.33 2wp8 s TYR 41 N -1.11 1.76 -0.10 5.02 5.04 -0.91 -1.81 117.35 125.25 2wp8 s TYR 41 Ca -0.12 -0.52 -0.05 0.00 -2.44 0.00 0.00 57.07 53.94 2wp8 s TYR 41 Cb -0.07 -1.19 0.05 0.00 0.35 0.00 0.00 41.96 41.09 2wp8 s TYR 41 CO -0.00 -0.18 0.22 0.00 -1.34 0.00 0.00 175.55 174.25 2wp8 s MET 42 N 0.07 0.17 -0.17 4.97 0.23 -0.70 -1.65 119.30 122.22 2wp8 s MET 42 Ca -0.05 0.51 -0.02 0.00 -1.03 0.00 0.00 55.69 55.10 2wp8 s MET 42 Cb -0.12 -0.13 -0.01 0.00 -1.53 0.00 0.00 34.83 33.04 2wp8 s MET 42 CO 0.03 -0.17 -0.10 -1.21 -2.03 0.00 0.00 175.02 171.53 2wp8 s GLU 43 N 1.32 3.34 -0.32 3.16 2.02 -0.64 -1.86 118.70 125.72 2wp8 s GLU 43 Ca -0.09 -0.67 -0.02 0.00 0.02 0.00 0.00 54.97 54.21 2wp8 s GLU 43 Cb -0.11 -2.79 0.11 0.00 0.10 0.00 0.00 34.13 31.45 2wp8 s GLU 43 CO -0.08 -0.01 0.14 -1.14 0.02 0.00 0.00 175.26 174.19 2wp8 s GLN 44 N 0.94 0.51 7.35 1.61 0.74 -0.93 -1.63 119.66 128.24 2wp8 s GLN 44 Ca -0.02 -0.97 0.00 0.00 0.05 0.00 0.00 55.36 54.42 2wp8 s GLN 44 Cb -0.15 -1.54 0.00 0.00 1.10 0.00 0.00 33.01 32.42 2wp8 s GLN 44 CO -0.00 -1.06 0.00 0.41 -0.55 0.00 0.00 175.29 174.09 2wp8 n GLY 45 N 4.76 2.49 0.32 2.59 0.00 0.33 -2.06 105.19 113.62 2wp8 n GLY 45 Ca -0.00 -0.30 0.14 0.00 0.00 0.00 0.00 46.02 45.86 2wp8 n GLY 45 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wp8 n ASN 46 N 6.68 1.10 -4.74 1.61 3.02 -1.26 -4.85 115.26 116.81 2wp8 n ASN 46 Ca 0.00 -1.13 -0.35 0.00 -0.03 0.00 0.00 54.58 53.07 2wp8 n ASN 46 Cb 0.00 0.04 0.06 0.00 -0.61 0.00 0.00 39.78 39.26 2wp8 n ASN 46 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2wp8 s ASN 47 N -2.24 4.84 -0.28 6.41 0.02 -0.87 -4.46 114.94 118.37 2wp8 s ASN 47 Ca 0.33 2.35 0.00 0.00 -1.02 0.00 0.00 52.86 54.53 2wp8 s ASN 47 Cb 0.20 -2.59 0.16 0.00 0.02 0.00 0.00 41.25 39.04 2wp8 s ASN 47 CO 0.42 -1.83 0.47 -0.54 0.02 0.00 0.00 177.10 175.64 2wp8 s LYS 48 N -3.59 0.45 -0.05 -0.60 1.02 -0.54 -2.19 119.74 114.25 2wp8 s LYS 48 Ca 0.76 0.51 0.02 0.00 0.02 0.00 0.00 55.97 57.28 2wp8 s LYS 48 Cb -0.29 -0.10 0.01 0.00 -0.52 0.00 0.00 37.83 36.93 2wp8 s LYS 48 CO 0.38 -0.82 -0.09 0.42 -0.92 0.00 0.00 175.35 174.32 2wp8 s ILE 49 N 2.65 0.90 -0.15 2.17 1.01 -0.78 -0.29 121.20 126.71 2wp8 s ILE 49 Ca 0.13 -0.35 -0.14 0.00 0.00 0.00 0.00 60.65 60.29 2wp8 s ILE 49 Cb -0.14 -0.84 -0.05 0.00 0.01 0.00 0.00 42.46 41.45 2wp8 s ILE 49 CO -0.23 0.30 0.31 -0.63 0.00 0.00 0.00 174.94 174.69 2wp8 s ILE 50 N 0.66 5.29 -0.06 2.92 1.01 -0.55 -1.72 121.20 128.75 2wp8 s ILE 50 Ca -0.12 0.58 0.05 0.00 0.00 0.00 0.00 60.65 61.15 2wp8 s ILE 50 Cb -0.14 -3.64 -0.00 0.00 0.01 0.00 0.00 42.46 38.68 2wp8 s ILE 50 CO 0.02 0.39 -0.20 -0.89 0.00 0.00 0.00 174.94 174.27 2wp8 s THR 51 N 0.41 1.68 -0.06 2.92 2.01 -0.75 -0.43 115.64 121.42 2wp8 s THR 51 Ca 0.17 -0.84 -0.01 0.00 0.31 0.00 0.00 61.69 61.33 2wp8 s THR 51 Cb -0.13 -1.44 0.03 0.00 0.01 0.00 0.00 72.50 70.96 2wp8 s THR 51 CO 0.05 0.47 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.69 2wp8 s LEU 52 N 0.11 0.81 -0.26 4.42 1.43 -0.63 -1.12 118.68 123.44 2wp8 s LEU 52 Ca -0.08 -0.07 -0.06 0.00 -1.03 0.00 0.00 54.13 52.89 2wp8 s LEU 52 Cb -0.14 -0.39 -0.01 0.00 0.03 0.00 0.00 46.19 45.69 2wp8 s LEU 52 CO 0.04 -0.15 0.05 0.68 0.23 0.00 0.00 176.35 177.19 2wp8 s VAL 53 N 1.61 3.90 -0.67 -1.59 -7.23 -0.58 -0.50 120.40 115.35 2wp8 s VAL 53 Ca -0.01 -0.50 -0.20 0.00 -1.81 0.00 0.00 61.98 59.46 2wp8 s VAL 53 Cb -0.13 -2.90 0.10 0.00 0.56 0.00 0.00 36.38 34.01 2wp8 s VAL 53 CO -0.03 0.24 0.84 -0.54 -0.31 0.00 0.00 175.10 175.29 2wp8 s LYS 54 N 1.52 3.16 0.00 4.82 -0.14 0.28 -2.05 119.74 127.33 2wp8 s LYS 54 Ca 0.04 -1.28 0.00 0.00 -1.36 0.00 0.00 55.97 53.37 2wp8 s LYS 54 Cb -0.16 -4.34 0.00 0.00 -1.68 0.00 0.00 37.83 31.65 2wp8 s LYS 54 CO 0.01 -1.64 0.00 0.41 -0.76 0.00 0.00 175.35 173.37 2wp8 n GLY 55 N 5.26 -2.15 3.64 -3.33 0.00 -1.26 -2.96 105.19 104.40 2wp8 n GLY 55 Ca -0.03 -0.72 -0.42 0.00 0.00 0.00 0.00 46.02 44.84 2wp8 n GLY 55 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2wp8 s PRO 56 N -0.45 3.84 0.22 1.61 0.02 -1.26 -4.42 135.00 134.58 2wp8 s PRO 56 Ca 0.00 2.12 -0.00 0.00 0.02 0.00 0.00 61.00 63.14 2wp8 s PRO 56 Cb 0.00 -4.13 -0.04 0.00 0.02 0.00 0.00 34.50 30.35 2wp8 s PRO 56 CO 0.00 -1.27 0.12 -1.59 -0.33 0.00 0.00 177.00 173.93 2wp8 s LYS 57 N 4.82 1.28 0.08 5.54 -2.85 -0.66 -4.92 119.74 123.03 2wp8 s LYS 57 Ca 0.83 -1.68 -0.28 0.00 -1.00 0.00 0.00 55.97 53.83 2wp8 s LYS 57 Cb -0.33 0.10 -0.05 0.00 -2.06 0.00 0.00 37.83 35.48 2wp8 s LYS 57 CO 0.34 -0.37 0.89 -1.21 0.10 0.00 0.00 175.35 175.10 2wp8 s GLU 58 N -4.10 4.61 0.00 1.78 0.41 -1.26 -0.21 118.70 119.92 2wp8 s GLU 58 Ca 0.39 1.30 0.00 0.00 -0.41 0.00 0.00 54.97 56.25 2wp8 s GLU 58 Cb 0.07 -3.38 0.00 0.00 -1.78 0.00 0.00 34.13 29.04 2wp8 s GLU 58 CO 0.13 0.21 0.00 0.00 -0.49 0.00 0.00 175.26 175.11 2wp8 n MET 65 N 2.90 0.00 -1.70 1.61 3.85 -1.26 -4.66 117.12 117.86 2wp8 n MET 65 Ca 0.01 0.00 -0.44 0.00 -1.00 0.00 0.00 57.70 56.27 2wp8 n MET 65 Cb 0.50 0.00 -0.03 0.00 -1.05 0.00 0.00 33.22 32.64 2wp8 n MET 65 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 2wp8 n ASP 66 N 0.00 3.45 0.15 3.17 2.03 -1.26 -4.85 116.55 119.24 2wp8 n ASP 66 Ca 0.00 1.11 0.08 0.00 0.52 0.00 0.00 54.79 56.50 2wp8 n ASP 66 Cb 0.00 -1.51 0.07 0.00 -0.72 0.00 0.00 41.12 38.96 2wp8 n ASP 66 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 2wp8 h THR 67 N 3.48 0.27 0.02 5.18 1.35 -1.98 -2.83 112.91 118.40 2wp8 h THR 67 Ca -0.45 -1.42 -0.21 0.00 -0.55 0.00 0.00 66.41 63.78 2wp8 h THR 67 Cb 1.24 2.00 -0.02 0.00 -1.73 0.00 0.00 68.15 69.64 2wp8 h THR 67 CO 0.86 0.16 -0.99 0.77 -0.25 0.00 0.00 175.52 176.06 2wp8 h SER 68 N 0.00 0.07 -3.97 5.36 4.64 -1.97 -3.37 113.55 114.31 2wp8 h SER 68 Ca -0.02 -0.07 -0.53 0.00 -0.47 0.00 0.00 61.79 60.70 2wp8 h SER 68 Cb 1.16 -0.02 -0.13 0.00 -0.31 0.00 0.00 62.40 63.10 2wp8 h SER 68 CO 0.02 1.02 -0.51 -0.54 -0.87 0.00 0.00 176.83 175.95 2wp8 s LYS 69 N -2.80 1.87 0.26 4.77 1.02 -1.24 -4.67 119.74 118.95 2wp8 s LYS 69 Ca -0.00 -2.13 0.01 0.00 0.02 0.00 0.00 55.97 53.88 2wp8 s LYS 69 Cb 0.10 -0.32 -0.04 0.00 -0.52 0.00 0.00 37.83 37.05 2wp8 s LYS 69 CO 0.82 -0.53 0.43 0.00 -0.92 0.00 0.00 175.35 175.16 2wp8 s ALA 70 N -3.30 3.82 -0.11 5.17 0.00 0.06 -2.21 121.76 125.19 2wp8 s ALA 70 Ca 0.29 -0.97 -0.03 0.00 0.00 0.00 0.00 51.96 51.24 2wp8 s ALA 70 Cb 0.02 -1.95 -0.03 0.00 0.00 0.00 0.00 23.12 21.16 2wp8 s ALA 70 CO 0.18 0.23 0.02 -0.51 0.00 0.00 0.00 175.76 175.69 2wp8 s LEU 71 N -3.84 3.69 0.11 0.00 1.43 0.58 -4.92 118.68 115.73 2wp8 s LEU 71 Ca 0.38 0.16 0.07 0.00 -1.03 0.00 0.00 54.13 53.71 2wp8 s LEU 71 Cb -0.10 -1.87 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 2wp8 s LEU 71 CO 0.31 0.34 -0.11 -0.22 0.23 0.00 0.00 176.35 176.90 2wp8 s LEU 72 N -0.65 2.99 -0.15 1.79 2.96 -1.26 0.14 118.68 124.51 2wp8 s LEU 72 Ca 0.11 -0.42 -0.06 0.00 -0.22 0.00 0.00 54.13 53.54 2wp8 s LEU 72 Cb -0.12 -1.79 0.07 0.00 0.50 0.00 0.00 46.19 44.86 2wp8 s LEU 72 CO 0.02 0.17 0.32 0.20 -1.32 0.00 0.00 176.35 175.74 2wp8 s ASN 73 N -2.24 0.10 -0.17 3.68 0.02 -0.84 -4.95 114.94 110.54 2wp8 s ASN 73 Ca 0.21 0.73 -0.06 0.00 -1.02 0.00 0.00 52.86 52.72 2wp8 s ASN 73 Cb -0.11 0.89 -0.04 0.00 0.02 0.00 0.00 41.25 42.02 2wp8 s ASN 73 CO 0.13 -0.23 0.03 0.68 0.02 0.00 0.00 177.10 177.73 2wp8 s VAL 74 N 2.39 4.53 -0.19 1.60 -7.23 -1.26 -0.38 120.40 119.85 2wp8 s VAL 74 Ca -0.01 -0.13 0.01 0.00 -1.81 0.00 0.00 61.98 60.04 2wp8 s VAL 74 Cb -0.12 -3.02 0.04 0.00 0.56 0.00 0.00 36.38 33.84 2wp8 s VAL 74 CO -0.10 0.48 -0.12 -0.55 -0.31 0.00 0.00 175.10 174.50 2wp8 s SER 75 N 0.29 3.32 -0.21 4.85 0.15 0.15 -4.93 113.70 117.32 2wp8 s SER 75 Ca 0.02 -0.83 -0.03 0.00 0.70 0.00 0.00 55.95 55.80 2wp8 s SER 75 Cb -0.13 -1.26 -0.00 0.00 -1.71 0.00 0.00 66.02 62.92 2wp8 s SER 75 CO 0.01 -0.12 -0.07 0.54 1.20 0.00 0.00 173.24 174.79 2wp8 s VAL 76 N 1.39 3.14 -0.17 4.45 0.11 -1.26 0.21 120.40 128.27 2wp8 s VAL 76 Ca -0.00 -0.57 -0.06 0.00 -2.93 0.00 0.00 61.98 58.42 2wp8 s VAL 76 Cb -0.16 -2.41 -0.04 0.00 -1.53 0.00 0.00 36.38 32.25 2wp8 s VAL 76 CO -0.09 0.45 0.03 0.21 -3.33 0.00 0.00 175.10 172.37 2wp8 s ASN 77 N 1.40 5.36 0.21 3.54 2.47 -0.77 -5.01 114.94 122.15 2wp8 s ASN 77 Ca 0.05 0.03 -0.03 0.00 0.42 0.00 0.00 52.86 53.33 2wp8 s ASN 77 Cb -0.14 -1.88 -0.05 0.00 -1.45 0.00 0.00 41.25 37.73 2wp8 s ASN 77 CO -0.05 0.19 0.44 -0.63 -3.72 0.00 0.00 177.10 173.33 2wp8 s ILE 78 N 0.25 5.14 -0.46 -5.21 1.09 -1.26 -0.21 121.20 120.53 2wp8 s ILE 78 Ca 0.02 -0.13 0.03 0.00 -1.10 0.00 0.00 60.65 59.46 2wp8 s ILE 78 Cb -0.13 -3.70 0.22 0.00 -1.06 0.00 0.00 42.46 37.79 2wp8 s ILE 78 CO 0.01 -0.16 1.06 0.59 -0.10 0.00 0.00 174.94 176.34 2wp8 n ASN 79 N -0.55 2.80 0.13 3.58 4.13 -1.22 -4.95 115.26 119.18 2wp8 n ASN 79 Ca -0.03 -2.37 0.00 0.00 1.68 0.00 0.00 54.58 53.86 2wp8 n ASN 79 Cb 0.53 -0.58 0.00 0.00 -1.54 0.00 0.00 39.78 38.20 2wp8 n ASN 79 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2wp8 n GLU 94 N 0.10 0.00 0.21 3.52 -0.58 -1.26 -5.14 120.64 117.49 2wp8 n GLU 94 Ca 0.13 0.00 -0.09 0.00 -0.42 0.00 0.00 57.16 56.78 2wp8 n GLU 94 Cb 0.69 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 31.51 2wp8 n GLU 94 CO 0.00 0.00 0.00 0.07 -0.48 0.00 0.00 177.13 176.72 2wp8 h ARG 95 N 0.00 -0.56 -1.04 3.49 -0.00 -2.05 -3.06 114.38 111.15 2wp8 h ARG 95 Ca 0.00 0.04 0.27 0.00 -0.00 0.00 0.00 59.98 60.29 2wp8 h ARG 95 Cb 0.00 0.13 -0.10 0.00 -0.00 0.00 0.00 29.97 30.00 2wp8 h ARG 95 CO 0.00 -0.38 0.66 0.07 -0.00 0.00 0.00 179.97 180.33 2wp8 h ARG 96 N -1.07 0.41 0.33 0.08 -0.00 -2.05 -1.05 114.38 111.03 2wp8 h ARG 96 Ca -0.06 -0.02 -0.02 0.00 -0.00 0.00 0.00 59.98 59.88 2wp8 h ARG 96 Cb 0.45 -0.09 0.00 0.00 -0.00 0.00 0.00 29.97 30.33 2wp8 h ARG 96 CO 0.10 0.27 -0.16 -0.24 -0.00 0.00 0.00 179.97 179.94 2wp8 h VAL 97 N 0.42 0.58 -0.54 0.08 3.04 -1.98 -1.40 116.25 116.46 2wp8 h VAL 97 Ca 0.61 -0.68 0.07 0.00 -1.01 0.00 0.00 66.70 65.69 2wp8 h VAL 97 Cb 1.49 0.88 -0.03 0.00 -2.01 0.00 0.00 31.29 31.62 2wp8 h VAL 97 CO -0.34 0.11 0.36 -0.07 -1.01 0.00 0.00 177.57 176.63 2wp8 h LEU 98 N -0.87 0.41 0.77 3.16 -0.00 -1.23 0.17 115.31 117.71 2wp8 h LEU 98 Ca -0.05 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.80 2wp8 h LEU 98 Cb 0.53 -0.09 0.01 0.00 -0.00 0.00 0.00 40.66 41.11 2wp8 h LEU 98 CO 0.07 0.26 -0.37 -0.33 -0.00 0.00 0.00 178.44 178.08 2wp8 h GLU 99 N 0.46 -1.00 -0.65 1.13 5.08 -1.17 0.12 114.58 118.55 2wp8 h GLU 99 Ca 0.23 0.07 0.12 0.00 -1.00 0.00 0.00 59.36 58.78 2wp8 h GLU 99 Cb 0.34 0.23 -0.12 0.00 0.50 0.00 0.00 28.75 29.69 2wp8 h GLU 99 CO -0.06 -0.67 -0.32 0.82 -1.00 0.00 0.00 179.01 177.78 2wp8 h ILE 100 N -1.09 0.16 0.03 3.13 1.08 -0.38 -1.30 117.51 119.14 2wp8 h ILE 100 Ca -0.11 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.37 2wp8 h ILE 100 Cb 0.79 0.16 -0.03 0.00 -3.07 0.00 0.00 36.82 34.67 2wp8 h ILE 100 CO 0.17 0.00 -0.33 1.56 -0.69 0.00 0.00 178.15 178.86 2wp8 h GLN 101 N -0.13 -0.43 0.00 2.37 4.20 -0.53 -2.24 115.11 118.35 2wp8 h GLN 101 Ca 0.26 0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.97 2wp8 h GLN 101 Cb 0.56 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.43 2wp8 h GLN 101 CO -0.73 -0.28 -0.14 1.79 -0.67 0.00 0.00 178.83 178.81 2wp8 h THR 102 N -0.44 0.53 -0.67 -0.54 1.35 -0.26 0.17 112.91 113.04 2wp8 h THR 102 Ca 0.00 -0.65 -0.06 0.00 -0.55 0.00 0.00 66.41 65.16 2wp8 h THR 102 Cb 0.46 1.43 -0.03 0.00 -1.73 0.00 0.00 68.15 68.28 2wp8 h THR 102 CO -0.21 0.13 0.20 0.28 -0.25 0.00 0.00 175.52 175.68 2wp8 h SER 103 N 0.00 0.98 0.18 5.36 0.02 -1.07 -2.22 113.55 116.80 2wp8 h SER 103 Ca -0.00 -0.21 -0.24 0.00 -0.84 0.00 0.00 61.79 60.50 2wp8 h SER 103 Cb 0.42 -0.26 0.01 0.00 0.14 0.00 0.00 62.40 62.71 2wp8 h SER 103 CO 0.02 0.94 -0.95 -0.07 -1.14 0.00 0.00 176.83 175.63 2wp8 h LEU 104 N 0.98 0.69 -0.75 5.07 3.38 -0.11 -2.10 115.31 122.47 2wp8 h LEU 104 Ca 0.22 -0.54 0.03 0.00 0.09 0.00 0.00 57.88 57.68 2wp8 h LEU 104 Cb 0.31 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 2wp8 h LEU 104 CO -0.01 1.33 0.48 0.58 0.09 0.00 0.00 178.44 180.91 2wp8 h VAL 105 N 0.32 1.11 0.56 1.22 2.07 -1.24 -1.97 116.25 118.32 2wp8 h VAL 105 Ca -0.09 -0.32 -0.03 0.00 0.82 0.00 0.00 66.70 67.08 2wp8 h VAL 105 Cb 1.58 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 2wp8 h VAL 105 CO 0.17 0.17 -0.28 0.03 0.02 0.00 0.00 177.57 177.69 2wp8 h ARG 106 N 0.93 -0.74 -0.08 1.57 3.08 -1.30 0.14 114.38 117.98 2wp8 h ARG 106 Ca 0.30 0.05 0.02 0.00 0.07 0.00 0.00 59.98 60.42 2wp8 h ARG 106 Cb 0.01 0.17 -0.04 0.00 0.08 0.00 0.00 29.97 30.19 2wp8 h ARG 106 CO -0.11 -0.49 -0.39 0.52 -1.07 0.00 0.00 179.97 178.43 2wp8 h MET 107 N -0.77 -0.41 0.00 0.04 2.86 -1.34 -2.81 114.93 112.51 2wp8 h MET 107 Ca -0.08 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2wp8 h MET 107 Cb 0.59 0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.35 2wp8 h MET 107 CO 0.12 -0.27 0.00 1.19 1.06 0.00 0.00 176.91 179.01 2wp8 n PHE 108 N -4.60 0.00 0.01 -0.22 3.01 -0.75 -1.62 117.46 113.30 2wp8 n PHE 108 Ca -0.04 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.29 2wp8 n PHE 108 Cb 0.27 -0.40 -0.09 0.00 -0.01 0.00 0.00 39.48 39.25 2wp8 n PHE 108 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 2wp8 h GLU 109 N 0.00 -0.05 -0.81 -1.08 5.08 -0.47 -1.26 114.58 115.99 2wp8 h GLU 109 Ca 0.00 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.43 2wp8 h GLU 109 Cb 0.34 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.55 2wp8 h GLU 109 CO 0.00 0.36 0.49 0.87 -1.00 0.00 0.00 179.01 179.73 2wp8 h LYS 110 N -0.48 0.86 0.20 2.33 1.57 -1.07 -3.34 116.57 116.64 2wp8 h LYS 110 Ca -0.01 -0.05 -0.29 0.00 -1.87 0.00 0.00 60.65 58.44 2wp8 h LYS 110 Cb 0.44 -0.19 0.03 0.00 0.08 0.00 0.00 32.23 32.58 2wp8 h LYS 110 CO 0.01 0.57 -1.30 -0.97 -0.57 0.00 0.00 179.45 177.19 2wp8 h ASN 111 N 0.89 0.66 -3.97 0.86 -0.00 -1.34 -3.44 115.58 109.23 2wp8 h ASN 111 Ca 0.36 -0.93 -0.49 0.00 -0.00 0.00 0.00 56.30 55.24 2wp8 h ASN 111 Cb 0.18 -0.21 0.04 0.00 -0.00 0.00 0.00 38.32 38.33 2wp8 h ASN 111 CO -0.18 1.62 0.45 -0.69 -0.00 0.00 0.00 177.43 178.62 2wp8 s VAL 112 N -2.53 3.45 -1.35 2.57 1.01 -0.48 -0.85 120.40 122.21 2wp8 s VAL 112 Ca -0.12 1.11 -0.13 0.00 0.00 0.00 0.00 61.98 62.83 2wp8 s VAL 112 Cb 0.03 -3.57 0.10 0.00 0.00 0.00 0.00 36.38 32.94 2wp8 s VAL 112 CO 0.88 0.01 1.94 0.23 0.00 0.00 0.00 175.10 178.16 2wp8 n MET 113 N -0.20 3.21 0.24 2.72 2.81 -0.69 -4.75 117.12 120.46 2wp8 n MET 113 Ca 0.06 -3.15 0.17 0.00 -1.81 0.00 0.00 57.70 52.96 2wp8 n MET 113 Cb 0.49 -3.18 0.81 0.00 -0.71 0.00 0.00 33.22 30.62 2wp8 n MET 113 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 2wp8 h LEU 114 N 9.76 0.00 0.00 4.03 3.38 -1.87 0.26 115.31 130.87 2wp8 h LEU 114 Ca 0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.44 2wp8 h LEU 114 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2wp8 h LEU 114 CO 1.66 0.00 0.00 0.59 0.09 0.00 0.00 178.44 180.78 2wp8 n ASN 115 N -2.73 0.00 0.11 -0.43 4.13 -1.26 -0.76 115.26 114.32 2wp8 n ASN 115 Ca -0.01 0.17 0.04 0.00 1.68 0.00 0.00 54.58 56.46 2wp8 n ASN 115 Cb 0.15 -0.39 -0.00 0.00 -1.54 0.00 0.00 39.78 38.00 2wp8 n ASN 115 CO 0.00 0.00 0.00 0.40 0.28 0.00 0.00 177.26 177.94 2wp8 h ILE 116 N 0.00 0.55 -2.70 2.41 2.04 -1.29 -3.41 117.51 115.11 2wp8 h ILE 116 Ca 0.00 -1.87 -0.61 0.00 1.00 0.00 0.00 64.86 63.38 2wp8 h ILE 116 Cb 0.39 2.13 -0.42 0.00 -0.74 0.00 0.00 36.82 38.18 2wp8 h ILE 116 CO 0.00 0.31 -0.58 -1.22 0.00 0.00 0.00 178.15 176.66 2wp8 n TYR 117 N -3.03 3.44 -1.43 1.37 4.01 -1.20 -5.09 117.16 115.24 2wp8 n TYR 117 Ca -0.02 -4.25 -0.30 0.00 -0.16 0.00 0.00 57.90 53.17 2wp8 n TYR 117 Cb 0.73 -0.60 0.11 0.00 -0.31 0.00 0.00 39.34 39.27 2wp8 n TYR 117 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2wp8 s PRO 118 N -1.92 1.69 -1.44 -0.72 0.04 -1.26 -2.02 135.00 129.37 2wp8 s PRO 118 Ca 0.31 0.67 -0.08 0.00 0.04 0.00 0.00 61.00 61.95 2wp8 s PRO 118 Cb 0.04 -1.87 0.05 0.00 0.04 0.00 0.00 34.50 32.76 2wp8 s PRO 118 CO -0.10 -1.90 0.83 2.89 0.04 0.00 0.00 177.00 178.76 2wp8 n ARG 119 N -3.63 -5.10 -3.74 4.56 -4.01 -0.94 -4.83 116.66 98.98 2wp8 n ARG 119 Ca 0.07 0.59 -0.11 0.00 -1.04 0.00 0.00 57.85 57.36 2wp8 n ARG 119 Cb 0.56 -5.30 -0.06 0.00 -3.04 0.00 0.00 32.46 24.62 2wp8 n ARG 119 CO 0.00 0.00 0.00 -0.08 -3.04 0.00 0.00 177.63 174.51 2wp8 s THR 120 N -3.49 0.09 -0.02 8.89 -1.32 -1.26 -4.70 115.64 113.84 2wp8 s THR 120 Ca 0.37 -0.76 0.07 0.00 -1.21 0.00 0.00 61.69 60.16 2wp8 s THR 120 Cb -0.18 -1.11 -0.02 0.00 -1.51 0.00 0.00 72.50 69.67 2wp8 s THR 120 CO 0.83 -0.42 -0.24 -0.69 -2.21 0.00 0.00 174.62 171.89 2wp8 s VAL 121 N -3.27 1.88 -0.25 5.08 1.01 0.71 -0.31 120.40 125.25 2wp8 s VAL 121 Ca 0.00 -1.02 -0.02 0.00 0.00 0.00 0.00 61.98 60.94 2wp8 s VAL 121 Cb 0.01 -1.56 0.02 0.00 0.00 0.00 0.00 36.38 34.86 2wp8 s VAL 121 CO -0.08 0.53 -0.06 -0.63 0.00 0.00 0.00 175.10 174.87 2wp8 s ILE 122 N -0.55 2.96 -0.29 2.22 1.01 0.12 -1.65 121.20 125.03 2wp8 s ILE 122 Ca 0.09 -0.95 -0.09 0.00 0.00 0.00 0.00 60.65 59.70 2wp8 s ILE 122 Cb -0.09 -2.48 -0.01 0.00 0.01 0.00 0.00 42.46 39.88 2wp8 s ILE 122 CO -0.01 0.22 0.12 -1.81 0.00 0.00 0.00 174.94 173.46 2wp8 s ASP 123 N 1.35 5.38 -0.36 3.58 1.01 -1.16 -1.98 116.67 124.49 2wp8 s ASP 123 Ca 0.01 -0.41 -0.12 0.00 0.71 0.00 0.00 52.55 52.74 2wp8 s ASP 123 Cb -0.16 -1.97 0.01 0.00 1.01 0.00 0.00 42.92 41.81 2wp8 s ASP 123 CO -0.04 -0.13 0.23 -0.63 0.21 0.00 0.00 175.17 174.80 2wp8 s ILE 124 N 1.61 4.91 -0.30 0.77 1.01 0.49 -0.55 121.20 129.13 2wp8 s ILE 124 Ca 0.05 -0.58 -0.04 0.00 0.00 0.00 0.00 60.65 60.08 2wp8 s ILE 124 Cb -0.16 -3.65 0.04 0.00 0.01 0.00 0.00 42.46 38.69 2wp8 s ILE 124 CO 0.05 -0.15 0.03 -1.61 0.00 0.00 0.00 174.94 173.26 2wp8 s GLU 125 N 1.64 2.64 -0.01 2.79 2.02 0.35 -0.67 118.70 127.46 2wp8 s GLU 125 Ca 0.04 -1.14 -0.02 0.00 0.02 0.00 0.00 54.97 53.87 2wp8 s GLU 125 Cb -0.18 -3.26 -0.04 0.00 0.10 0.00 0.00 34.13 30.75 2wp8 s GLU 125 CO 0.08 -0.57 0.17 0.42 0.02 0.00 0.00 175.26 175.38 2wp8 s ILE 126 N 1.34 5.34 -0.21 -1.63 1.01 0.13 -1.61 121.20 125.58 2wp8 s ILE 126 Ca -0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 60.65 60.42 2wp8 s ILE 126 Cb -0.19 -3.50 0.06 0.00 0.01 0.00 0.00 42.46 38.84 2wp8 s ILE 126 CO 0.00 0.32 -0.03 -1.00 0.00 0.00 0.00 174.94 174.24 2wp8 s HIS 127 N -1.32 1.80 -0.57 3.97 3.76 0.43 -1.84 115.29 121.53 2wp8 s HIS 127 Ca 0.27 -1.32 -0.23 0.00 -0.15 0.00 0.00 55.06 53.64 2wp8 s HIS 127 Cb -0.13 -1.34 0.05 0.00 1.11 0.00 0.00 32.58 32.27 2wp8 s HIS 127 CO 0.18 -0.69 0.87 0.08 -0.85 0.00 0.00 174.74 174.34 2wp8 s VAL 128 N 1.60 4.48 0.16 -0.90 1.01 0.70 -1.49 120.40 125.96 2wp8 s VAL 128 Ca -0.03 -0.06 -0.03 0.00 0.00 0.00 0.00 61.98 61.86 2wp8 s VAL 128 Cb -0.17 -4.52 -0.13 0.00 0.00 0.00 0.00 36.38 31.56 2wp8 s VAL 128 CO -0.07 -1.13 1.39 -0.07 0.00 0.00 0.00 175.10 175.22 2wp8 h LEU 129 N 10.77 0.54 -7.24 3.92 3.38 -0.95 -3.23 115.31 122.50 2wp8 h LEU 129 Ca -0.27 -0.38 -0.09 0.00 0.09 0.00 0.00 57.88 57.23 2wp8 h LEU 129 Cb 1.08 -0.16 -0.21 0.00 0.09 0.00 0.00 40.66 41.45 2wp8 h LEU 129 CO 1.08 1.14 -0.08 -0.70 0.09 0.00 0.00 178.44 179.97 2wp8 s GLU 130 N -3.55 0.74 -0.01 1.13 2.12 -1.06 -4.88 118.70 113.20 2wp8 s GLU 130 Ca -0.06 0.34 0.01 0.00 0.36 0.00 0.00 54.97 55.62 2wp8 s GLU 130 Cb 0.10 0.35 -0.00 0.00 0.26 0.00 0.00 34.13 34.84 2wp8 s GLU 130 CO 0.85 -0.17 -0.04 1.14 -0.54 0.00 0.00 175.26 176.50 2wp8 s GLN 131 N -0.58 0.37 -0.41 4.30 -2.07 -1.26 -1.46 119.66 118.55 2wp8 s GLN 131 Ca -0.07 -0.15 0.09 0.00 -1.82 0.00 0.00 55.36 53.42 2wp8 s GLN 131 Cb -0.03 -0.36 0.36 0.00 -1.09 0.00 0.00 33.01 31.89 2wp8 s GLN 131 CO 0.04 0.08 1.08 -3.47 -1.32 0.00 0.00 175.29 171.70 2wp8 n ASP 132 N 3.05 -1.16 0.00 12.60 4.64 -1.26 -4.92 116.55 129.50 2wp8 n ASP 132 Ca -0.14 -3.15 0.00 0.00 -1.38 0.00 0.00 54.79 50.13 2wp8 n ASP 132 Cb 0.58 0.91 0.00 0.00 -1.04 0.00 0.00 41.12 41.57 2wp8 n ASP 132 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2wp8 n GLY 133 N 0.06 0.36 3.59 0.27 0.00 -1.26 -1.96 105.19 106.25 2wp8 n GLY 133 Ca 0.08 -1.38 -0.22 0.00 0.00 0.00 0.00 46.02 44.50 2wp8 n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wp8 n GLY 134 N 1.31 -0.47 0.17 -0.02 0.00 -1.21 -4.75 105.19 100.23 2wp8 n GLY 134 Ca 0.00 0.19 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 2wp8 n GLY 134 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2wp8 h ILE 135 N -2.34 1.16 -0.31 -0.61 -2.65 -1.92 -2.30 117.51 108.54 2wp8 h ILE 135 Ca -0.58 -0.46 0.07 0.00 1.03 0.00 0.00 64.86 64.92 2wp8 h ILE 135 Cb 1.36 0.82 -0.08 0.00 -2.05 0.00 0.00 36.82 36.87 2wp8 h ILE 135 CO 0.55 0.17 -0.35 -0.03 0.03 0.00 0.00 178.15 178.53 2wp8 h MET 136 N 0.43 -0.30 -0.52 0.16 1.85 -1.98 1.48 114.93 116.05 2wp8 h MET 136 Ca 0.12 0.02 0.09 0.00 -0.61 0.00 0.00 59.70 59.32 2wp8 h MET 136 Cb 0.12 0.07 -0.07 0.00 0.43 0.00 0.00 31.60 32.14 2wp8 h MET 136 CO -0.02 -0.20 0.10 0.78 -0.40 0.00 0.00 176.91 177.18 2wp8 h GLY 137 N -0.32 0.64 0.92 1.39 0.00 -1.86 0.55 103.07 104.39 2wp8 h GLY 137 Ca 0.14 -0.02 0.05 0.00 0.00 0.00 0.00 47.33 47.49 2wp8 h GLY 137 CO -0.49 -0.08 0.61 1.76 0.00 0.00 0.00 176.54 178.34 2wp8 h SER 138 N 0.24 0.98 -0.28 0.19 0.02 0.19 -2.59 113.55 112.30 2wp8 h SER 138 Ca 0.26 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.19 2wp8 h SER 138 Cb 0.36 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 2wp8 h SER 138 CO -0.34 0.66 0.12 -0.07 -1.14 0.00 0.00 176.83 176.06 2wp8 h LEU 139 N 1.13 0.38 -0.35 5.07 3.38 0.40 -2.24 115.31 123.07 2wp8 h LEU 139 Ca 0.38 -0.15 0.05 0.00 0.09 0.00 0.00 57.88 58.25 2wp8 h LEU 139 Cb 0.08 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 2wp8 h LEU 139 CO -0.13 0.42 0.07 0.40 0.09 0.00 0.00 178.44 179.30 2wp8 h ILE 140 N 0.31 0.83 -0.37 1.22 2.04 -0.76 -1.17 117.51 119.62 2wp8 h ILE 140 Ca 0.09 -0.07 -0.03 0.00 1.00 0.00 0.00 64.86 65.86 2wp8 h ILE 140 Cb 0.16 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 2wp8 h ILE 140 CO -0.01 0.04 0.12 0.78 0.00 0.00 0.00 178.15 179.08 2wp8 h ASN 141 N 0.20 0.53 -0.35 1.72 2.35 -1.24 -0.35 115.58 118.43 2wp8 h ASN 141 Ca 0.16 -0.20 0.08 0.00 -0.55 0.00 0.00 56.30 55.80 2wp8 h ASN 141 Cb 0.18 -0.14 -0.08 0.00 0.05 0.00 0.00 38.32 38.33 2wp8 h ASN 141 CO -0.21 0.58 -0.26 1.23 -1.65 0.00 0.00 177.43 177.12 2wp8 h GLY 142 N 0.44 -0.10 0.89 2.83 0.00 -1.07 -0.13 103.07 105.93 2wp8 h GLY 142 Ca 0.12 0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.78 2wp8 h GLY 142 CO -0.01 -0.20 -0.08 -2.22 0.00 0.00 0.00 176.54 174.03 2wp8 h ILE 143 N -0.21 0.82 -0.75 2.60 2.04 -0.73 0.43 117.51 121.70 2wp8 h ILE 143 Ca 0.17 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.18 2wp8 h ILE 143 Cb 0.48 0.82 -0.10 0.00 -0.74 0.00 0.00 36.82 37.28 2wp8 h ILE 143 CO -0.47 0.00 0.26 0.74 0.00 0.00 0.00 178.15 178.67 2wp8 h THR 144 N -0.17 0.59 -0.04 -0.27 2.02 -0.77 0.36 112.91 114.63 2wp8 h THR 144 Ca 0.01 -0.13 -0.00 0.00 0.77 0.00 0.00 66.41 67.06 2wp8 h THR 144 Cb 0.17 0.19 -0.00 0.00 -1.74 0.00 0.00 68.15 66.77 2wp8 h THR 144 CO -0.03 0.07 0.01 -0.07 0.37 0.00 0.00 175.52 175.87 2wp8 h LEU 145 N 0.37 0.06 -1.14 2.58 3.38 -0.38 -1.91 115.31 118.28 2wp8 h LEU 145 Ca 0.42 -0.23 0.15 0.00 0.09 0.00 0.00 57.88 58.31 2wp8 h LEU 145 Cb 0.68 -0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.33 2wp8 h LEU 145 CO -0.45 0.27 0.61 0.00 0.09 0.00 0.00 178.44 178.96 2wp8 h ALA 146 N 0.79 1.71 0.02 1.53 0.00 0.14 -1.26 119.26 122.20 2wp8 h ALA 146 Ca 0.01 0.03 -0.21 0.00 0.00 0.00 0.00 54.91 54.74 2wp8 h ALA 146 Cb 0.23 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 17.90 2wp8 h ALA 146 CO 0.00 0.01 -0.85 -0.07 0.00 0.00 0.00 179.25 178.34 2wp8 h LEU 147 N 0.80 0.71 -1.09 0.00 3.38 -0.76 0.15 115.31 118.50 2wp8 h LEU 147 Ca 0.50 -0.77 0.03 0.00 0.09 0.00 0.00 57.88 57.73 2wp8 h LEU 147 Cb 0.71 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.19 2wp8 h LEU 147 CO -0.26 1.39 0.62 0.40 0.09 0.00 0.00 178.44 180.68 2wp8 h ILE 148 N 0.10 1.17 -0.42 1.22 5.03 -1.00 -1.63 117.51 121.99 2wp8 h ILE 148 Ca -0.11 -0.41 -0.06 0.00 -0.12 0.00 0.00 64.86 64.16 2wp8 h ILE 148 Cb 1.54 -0.13 -0.02 0.00 -3.03 0.00 0.00 36.82 35.19 2wp8 h ILE 148 CO 0.17 0.22 0.04 -0.78 -0.68 0.00 0.00 178.15 177.11 2wp8 h ASP 149 N 1.19 0.70 0.00 1.72 3.58 -1.07 -2.25 116.42 120.29 2wp8 h ASP 149 Ca 0.37 -0.28 0.00 0.00 0.42 0.00 0.00 57.03 57.54 2wp8 h ASP 149 Cb -0.00 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 40.86 2wp8 h ASP 149 CO -0.11 0.81 0.32 0.00 -2.88 0.00 0.00 179.24 177.38 2wp8 h ALA 150 N 0.92 1.26 -0.62 -0.78 0.00 0.24 -3.42 119.26 116.86 2wp8 h ALA 150 Ca 0.12 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.77 2wp8 h ALA 150 Cb 0.43 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.11 2wp8 h ALA 150 CO 0.01 -0.26 -0.24 0.41 0.00 0.00 0.00 179.25 179.18 2wp8 n GLY 151 N -1.26 1.36 3.75 0.00 0.00 -0.84 -4.72 105.19 103.47 2wp8 n GLY 151 Ca -0.01 -0.31 -0.40 0.00 0.00 0.00 0.00 46.02 45.29 2wp8 n GLY 151 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wp8 s ILE 152 N -2.41 4.10 0.18 -0.61 1.01 -0.94 -5.01 121.20 117.51 2wp8 s ILE 152 Ca 0.00 2.07 -0.25 0.00 0.00 0.00 0.00 60.65 62.47 2wp8 s ILE 152 Cb 0.00 -4.32 -0.08 0.00 0.01 0.00 0.00 42.46 38.07 2wp8 s ILE 152 CO 0.00 0.48 0.79 -0.44 0.00 0.00 0.00 174.94 175.77 2wp8 s SER 153 N -1.04 7.38 0.11 3.58 0.01 -1.26 -4.59 113.70 117.89 2wp8 s SER 153 Ca 0.42 1.66 -0.09 0.00 1.31 0.00 0.00 55.95 59.25 2wp8 s SER 153 Cb -0.26 -2.51 -0.00 0.00 0.21 0.00 0.00 66.02 63.46 2wp8 s SER 153 CO 0.32 0.18 0.22 0.00 0.41 0.00 0.00 173.24 174.37 2wp8 s MET 154 N -1.27 0.94 0.01 12.44 0.23 -1.26 -1.70 119.30 128.69 2wp8 s MET 154 Ca 0.37 -1.01 -0.13 0.00 -1.03 0.00 0.00 55.69 53.89 2wp8 s MET 154 Cb -0.23 0.36 -0.07 0.00 -1.53 0.00 0.00 34.83 33.36 2wp8 s MET 154 CO 0.26 -0.31 1.03 0.74 -2.03 0.00 0.00 175.02 174.71 2wp8 h PHE 155 N 2.68 -0.44 -3.93 3.16 0.04 -1.33 -3.47 116.94 113.65 2wp8 h PHE 155 Ca -0.33 -0.01 -0.21 0.00 2.80 0.00 0.00 57.97 60.22 2wp8 h PHE 155 Cb 1.21 0.15 -0.04 0.00 2.20 0.00 0.00 35.95 39.46 2wp8 h PHE 155 CO 0.41 -0.27 -0.17 -3.47 -0.60 0.00 0.00 178.31 174.21 2wp8 n ASP 156 N -3.47 1.62 -4.55 2.17 4.64 -1.26 -5.11 116.55 110.59 2wp8 n ASP 156 Ca -0.06 -1.77 -0.40 0.00 -1.38 0.00 0.00 54.79 51.18 2wp8 n ASP 156 Cb 0.19 0.27 -0.09 0.00 -1.04 0.00 0.00 41.12 40.44 2wp8 n ASP 156 CO 0.00 0.00 0.00 -0.31 -0.82 0.00 0.00 177.20 176.07 2wp8 s TYR 157 N -1.90 3.21 -0.12 -0.67 4.12 -1.26 -4.90 117.35 115.83 2wp8 s TYR 157 Ca 0.04 0.03 -0.22 0.00 0.02 0.00 0.00 57.07 56.95 2wp8 s TYR 157 Cb 0.00 -2.64 -0.03 0.00 -1.52 0.00 0.00 41.96 37.77 2wp8 s TYR 157 CO 0.03 -0.39 0.67 0.42 0.02 0.00 0.00 175.55 176.30 2wp8 s ILE 158 N 2.01 5.04 0.13 2.71 1.01 -1.26 -0.26 121.20 130.57 2wp8 s ILE 158 Ca 0.12 1.34 0.08 0.00 0.00 0.00 0.00 60.65 62.18 2wp8 s ILE 158 Cb -0.16 -4.00 -0.04 0.00 0.01 0.00 0.00 42.46 38.27 2wp8 s ILE 158 CO 0.11 0.19 -0.12 -0.94 0.00 0.00 0.00 174.94 174.19 2wp8 s SER 159 N 0.94 4.24 0.16 3.58 1.04 -0.81 -4.68 113.70 118.16 2wp8 s SER 159 Ca 0.34 -0.47 0.09 0.00 0.48 0.00 0.00 55.95 56.38 2wp8 s SER 159 Cb -0.17 -0.74 -0.04 0.00 0.10 0.00 0.00 66.02 65.18 2wp8 s SER 159 CO 0.14 0.16 -0.19 -0.83 0.98 0.00 0.00 173.24 173.50 2wp8 s GLY 160 N -2.34 1.41 -0.02 7.32 0.00 -1.26 -0.22 107.32 112.21 2wp8 s GLY 160 Ca 0.21 -1.47 -0.29 0.00 0.00 0.00 0.00 44.72 43.17 2wp8 s GLY 160 CO 0.13 -1.51 0.89 -1.50 0.00 0.00 0.00 173.10 171.11 2wp8 s ILE 161 N -1.87 0.00 0.06 0.90 2.07 -0.53 -4.64 121.20 117.19 2wp8 s ILE 161 Ca 0.15 0.00 0.09 0.00 -1.41 0.00 0.00 60.65 59.48 2wp8 s ILE 161 Cb -0.07 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.49 2wp8 s ILE 161 CO 0.07 0.00 -0.22 -0.94 -1.91 0.00 0.00 174.94 171.93 2wp8 s SER 162 N -2.26 3.51 0.08 4.50 1.04 -1.26 -1.07 113.70 118.25 2wp8 s SER 162 Ca 0.03 -0.55 0.08 0.00 0.48 0.00 0.00 55.95 55.99 2wp8 s SER 162 Cb -0.01 -0.43 -0.03 0.00 0.10 0.00 0.00 66.02 65.65 2wp8 s SER 162 CO -0.07 0.24 -0.21 -0.69 0.98 0.00 0.00 173.24 173.49 2wp8 s VAL 163 N -0.93 1.68 0.21 5.02 1.01 0.13 -3.76 120.40 123.76 2wp8 s VAL 163 Ca 0.14 -1.44 0.11 0.00 0.00 0.00 0.00 61.98 60.79 2wp8 s VAL 163 Cb -0.10 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.72 2wp8 s VAL 163 CO 0.05 0.01 -0.22 -0.83 0.00 0.00 0.00 175.10 174.11 2wp8 s GLY 164 N -1.69 1.69 -0.34 4.51 0.00 -0.67 0.16 107.32 110.97 2wp8 s GLY 164 Ca 0.06 -1.66 -0.09 0.00 0.00 0.00 0.00 44.72 43.03 2wp8 s GLY 164 CO 0.03 -1.71 0.15 -2.27 0.00 0.00 0.00 173.10 169.31 2wp8 s LEU 165 N -2.84 4.38 -0.37 0.66 2.96 -0.36 -0.32 118.68 122.80 2wp8 s LEU 165 Ca 0.22 -0.94 -0.15 0.00 -0.22 0.00 0.00 54.13 53.04 2wp8 s LEU 165 Cb -0.07 -1.95 -0.00 0.00 0.50 0.00 0.00 46.19 44.67 2wp8 s LEU 165 CO 0.10 -0.31 0.35 -0.47 -1.32 0.00 0.00 176.35 174.70 2wp8 s TYR 166 N 1.51 3.21 0.00 5.38 5.04 0.14 -4.04 117.35 128.58 2wp8 s TYR 166 Ca 0.01 -0.22 0.00 0.00 -2.44 0.00 0.00 57.07 54.43 2wp8 s TYR 166 Cb -0.19 -2.67 0.00 0.00 0.35 0.00 0.00 41.96 39.45 2wp8 s TYR 166 CO 0.05 -0.50 0.00 -3.47 -1.34 0.00 0.00 175.55 170.29 2wp8 n ASP 167 N 5.35 0.00 -0.63 4.32 -0.08 -1.26 0.29 116.55 124.53 2wp8 n ASP 167 Ca -0.10 0.00 0.11 0.00 -1.51 0.00 0.00 54.79 53.29 2wp8 n ASP 167 Cb 0.49 0.00 0.03 0.00 2.34 0.00 0.00 41.12 43.97 2wp8 n ASP 167 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2wp8 n THR 168 N 0.00 0.00 -4.20 5.18 -1.04 -1.26 -4.93 114.28 108.03 2wp8 n THR 168 Ca 0.00 -0.34 -0.34 0.00 -2.04 0.00 0.00 64.05 61.32 2wp8 n THR 168 Cb 0.00 1.33 -0.14 0.00 -1.82 0.00 0.00 70.33 69.70 2wp8 n THR 168 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2wp8 s THR 169 N -2.26 3.16 0.22 12.58 2.01 0.14 -5.10 115.64 126.39 2wp8 s THR 169 Ca 0.21 -0.58 -0.30 0.00 0.31 0.00 0.00 61.69 61.33 2wp8 s THR 169 Cb 0.18 -2.39 -0.09 0.00 0.01 0.00 0.00 72.50 70.21 2wp8 s THR 169 CO 0.47 0.47 1.23 -2.84 -0.69 0.00 0.00 174.62 173.26 2wp8 s PRO 170 N 1.08 4.46 -0.22 4.92 0.02 -1.26 -0.69 135.00 143.32 2wp8 s PRO 170 Ca 0.01 1.97 -0.04 0.00 0.02 0.00 0.00 61.00 62.95 2wp8 s PRO 170 Cb -0.15 -3.20 -0.01 0.00 0.02 0.00 0.00 34.50 31.17 2wp8 s PRO 170 CO -0.02 -0.11 -0.05 -0.51 -0.33 0.00 0.00 177.00 175.99 2wp8 s LEU 171 N -0.59 2.89 0.00 -5.54 1.43 0.57 -4.70 118.68 112.73 2wp8 s LEU 171 Ca 0.52 -0.39 0.28 0.00 -1.03 0.00 0.00 54.13 53.51 2wp8 s LEU 171 Cb -0.35 -1.73 1.34 0.00 0.03 0.00 0.00 46.19 45.48 2wp8 s LEU 171 CO 0.40 -0.01 1.95 -0.11 0.23 0.00 0.00 176.35 178.80 2wp8 n LEU 172 N 4.76 0.00 -3.23 1.79 7.94 0.13 -1.67 117.00 126.72 2wp8 n LEU 172 Ca -0.18 0.36 -0.03 0.00 -1.11 0.00 0.00 56.01 55.05 2wp8 n LEU 172 Cb 0.51 -0.36 -0.02 0.00 0.53 0.00 0.00 43.42 44.07 2wp8 n LEU 172 CO 0.29 -0.02 0.04 -0.62 -1.11 0.00 0.00 177.39 175.96 2wp8 s ASP 173 N -2.73 -0.94 -0.15 1.96 3.68 -1.25 -4.57 116.67 112.68 2wp8 s ASP 173 Ca 0.22 -1.01 -0.29 0.00 2.13 0.00 0.00 52.55 53.60 2wp8 s ASP 173 Cb 0.19 1.65 -0.01 0.00 -1.45 0.00 0.00 42.92 43.30 2wp8 s ASP 173 CO 0.46 -0.18 1.10 0.42 0.13 0.00 0.00 175.17 177.10 2wp8 s THR 174 N 1.71 4.55 1.15 1.71 -4.23 -1.26 -4.77 115.64 114.50 2wp8 s THR 174 Ca 0.17 1.86 -0.19 0.00 -1.18 0.00 0.00 61.69 62.35 2wp8 s THR 174 Cb -0.06 -4.20 0.27 0.00 1.34 0.00 0.00 72.50 69.85 2wp8 s THR 174 CO -0.06 -0.09 1.16 0.54 -0.54 0.00 0.00 174.62 175.63 2wp8 s ASN 175 N 1.38 1.41 0.21 3.99 2.20 -1.26 -3.33 114.94 119.53 2wp8 s ASN 175 Ca 0.50 0.53 -0.07 0.00 -0.94 0.00 0.00 52.86 52.88 2wp8 s ASN 175 Cb -0.19 -0.72 0.16 0.00 -2.00 0.00 0.00 41.25 38.50 2wp8 s ASN 175 CO 0.14 -3.81 1.68 -1.28 -2.94 0.00 0.00 177.10 170.89 2wp8 h SER 176 N -2.37 0.96 0.12 3.54 0.87 -1.69 -2.21 113.55 112.76 2wp8 h SER 176 Ca -0.45 -0.26 -0.04 0.00 -1.23 0.00 0.00 61.79 59.81 2wp8 h SER 176 Cb 1.28 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.97 2wp8 h SER 176 CO 0.34 1.01 -0.16 -0.07 -0.53 0.00 0.00 176.83 177.43 2wp8 h LEU 177 N 0.91 0.09 -0.30 2.23 3.38 -1.93 -2.73 115.31 116.96 2wp8 h LEU 177 Ca 0.17 -0.02 -0.20 0.00 0.09 0.00 0.00 57.88 57.92 2wp8 h LEU 177 Cb 0.52 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2wp8 h LEU 177 CO 0.03 0.27 -0.67 -0.33 0.09 0.00 0.00 178.44 177.82 2wp8 h GLU 178 N 0.10 0.71 -0.54 1.13 5.08 -1.80 -3.12 114.58 116.13 2wp8 h GLU 178 Ca 0.02 -0.52 -0.02 0.00 -1.00 0.00 0.00 59.36 57.84 2wp8 h GLU 178 Cb 0.35 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 2wp8 h GLU 178 CO 0.02 1.14 0.27 0.93 -1.00 0.00 0.00 179.01 180.37 2wp8 h GLU 179 N 0.51 0.76 -0.78 2.33 5.08 -1.12 -2.68 114.58 118.68 2wp8 h GLU 179 Ca -0.02 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.23 2wp8 h GLU 179 Cb 1.27 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 30.33 2wp8 h GLU 179 CO 0.13 0.58 0.38 -0.91 -1.00 0.00 0.00 179.01 178.20 2wp8 h ASN 180 N 0.76 1.00 -0.43 1.42 -0.26 -1.50 -3.27 115.58 113.31 2wp8 h ASN 180 Ca 0.19 -0.11 0.00 0.00 -0.56 0.00 0.00 56.30 55.82 2wp8 h ASN 180 Cb 0.06 -0.26 0.00 0.00 -1.06 0.00 0.00 38.32 37.06 2wp8 h ASN 180 CO -0.03 0.84 0.00 0.00 -1.06 0.00 0.00 177.43 177.18 2wp8 n ALA 181 N -2.43 2.43 -3.47 -0.83 0.00 -1.03 -4.97 120.51 110.21 2wp8 n ALA 181 Ca 0.08 -0.98 -0.11 0.00 0.00 0.00 0.00 53.44 52.43 2wp8 n ALA 181 Cb 0.13 -0.92 -0.02 0.00 0.00 0.00 0.00 19.45 18.64 2wp8 n ALA 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wp8 s MET 182 N -1.44 1.04 0.33 0.00 0.23 -1.13 -5.01 119.30 113.32 2wp8 s MET 182 Ca 0.39 -0.33 -0.28 0.00 -1.03 0.00 0.00 55.69 54.45 2wp8 s MET 182 Cb 0.22 0.48 -0.09 0.00 -1.53 0.00 0.00 34.83 33.91 2wp8 s MET 182 CO 0.31 -0.44 1.13 -1.12 -2.03 0.00 0.00 175.02 172.87 2wp8 s SER 183 N -2.47 6.99 0.12 -1.18 0.01 -1.26 -4.67 113.70 111.25 2wp8 s SER 183 Ca 0.02 2.31 0.08 0.00 1.31 0.00 0.00 55.95 59.67 2wp8 s SER 183 Cb -0.01 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.56 2wp8 s SER 183 CO -0.09 -0.34 -0.15 -0.89 0.41 0.00 0.00 173.24 172.18 2wp8 s THR 184 N -1.27 3.03 -0.07 1.44 2.01 -1.26 -1.22 115.64 118.29 2wp8 s THR 184 Ca 0.49 -1.44 0.01 0.00 0.31 0.00 0.00 61.69 61.06 2wp8 s THR 184 Cb -0.31 -2.41 0.02 0.00 0.01 0.00 0.00 72.50 69.81 2wp8 s THR 184 CO 0.40 0.09 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.65 2wp8 s VAL 185 N -1.21 0.89 -0.13 3.82 1.01 0.42 -1.72 120.40 123.48 2wp8 s VAL 185 Ca 0.19 -0.29 -0.06 0.00 0.00 0.00 0.00 61.98 61.83 2wp8 s VAL 185 Cb -0.11 -0.88 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 2wp8 s VAL 185 CO 0.12 0.32 0.07 -0.89 0.00 0.00 0.00 175.10 174.72 2wp8 s THR 186 N 1.12 4.92 0.04 3.92 2.01 0.13 0.17 115.64 127.95 2wp8 s THR 186 Ca -0.07 -0.00 0.04 0.00 0.31 0.00 0.00 61.69 61.97 2wp8 s THR 186 Cb -0.14 -3.15 -0.02 0.00 0.01 0.00 0.00 72.50 69.19 2wp8 s THR 186 CO -0.01 0.56 -0.12 -1.48 -0.69 0.00 0.00 174.62 172.87 2wp8 s LEU 187 N -0.47 2.19 -0.18 4.42 2.34 -0.24 -0.24 118.68 126.50 2wp8 s LEU 187 Ca 0.10 -0.47 -0.02 0.00 0.06 0.00 0.00 54.13 53.81 2wp8 s LEU 187 Cb -0.12 -0.49 -0.00 0.00 -0.56 0.00 0.00 46.19 45.01 2wp8 s LEU 187 CO 0.02 -0.02 -0.11 -0.83 -1.06 0.00 0.00 176.35 174.35 2wp8 s GLY 188 N -1.22 1.53 -0.10 -3.48 0.00 0.90 -1.45 107.32 103.50 2wp8 s GLY 188 Ca -0.01 -1.09 -0.00 0.00 0.00 0.00 0.00 44.72 43.62 2wp8 s GLY 188 CO 0.01 0.20 -0.07 0.14 0.00 0.00 0.00 173.10 173.38 2wp8 s VAL 189 N 1.08 3.65 -0.50 1.40 1.01 0.69 -0.82 120.40 126.91 2wp8 s VAL 189 Ca 0.00 -0.48 -0.25 0.00 0.00 0.00 0.00 61.98 61.25 2wp8 s VAL 189 Cb -0.15 -2.52 0.03 0.00 0.00 0.00 0.00 36.38 33.74 2wp8 s VAL 189 CO -0.03 0.56 0.93 -0.69 0.00 0.00 0.00 175.10 175.87 2wp8 s VAL 190 N -0.34 4.44 0.00 2.92 1.01 -0.59 -1.93 120.40 125.92 2wp8 s VAL 190 Ca 0.05 0.52 0.00 0.00 0.00 0.00 0.00 61.98 62.55 2wp8 s VAL 190 Cb -0.12 -4.48 0.00 0.00 0.00 0.00 0.00 36.38 31.78 2wp8 s VAL 190 CO 0.02 -0.96 0.00 0.61 0.00 0.00 0.00 175.10 174.78 2wp8 n GLY 191 N 5.02 0.77 0.00 4.51 0.00 0.64 -2.16 105.19 113.97 2wp8 n GLY 191 Ca 0.04 -0.79 0.02 0.00 0.00 0.00 0.00 46.02 45.28 2wp8 n GLY 191 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2wp8 n LYS 192 N 0.00 0.54 -2.03 1.61 -0.00 -1.26 -4.76 118.16 112.25 2wp8 n LYS 192 Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 58.31 58.11 2wp8 n LYS 192 Cb 0.00 -1.10 0.11 0.00 -0.00 0.00 0.00 35.03 34.04 2wp8 n LYS 192 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2wp8 n SER 193 N -0.60 0.85 -0.57 -5.58 3.41 -0.92 -5.01 113.62 105.21 2wp8 n SER 193 Ca 0.03 -1.79 0.05 0.00 -0.26 0.00 0.00 58.87 56.90 2wp8 n SER 193 Cb 0.01 -0.60 0.12 0.00 -0.26 0.00 0.00 64.21 63.48 2wp8 n SER 193 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2wp8 n GLU 194 N -2.69 2.10 -2.72 4.33 1.02 -1.26 -4.67 120.64 116.74 2wp8 n GLU 194 Ca 0.13 -1.75 -0.41 0.00 -0.02 0.00 0.00 57.16 55.11 2wp8 n GLU 194 Cb 0.48 -1.25 -0.04 0.00 -0.02 0.00 0.00 31.44 30.61 2wp8 n GLU 194 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2wp8 s LYS 195 N -0.97 4.63 -0.25 3.49 -0.14 -1.26 -4.96 119.74 120.29 2wp8 s LYS 195 Ca 0.19 1.44 -0.16 0.00 -1.36 0.00 0.00 55.97 56.09 2wp8 s LYS 195 Cb 0.11 -3.41 -0.04 0.00 -1.68 0.00 0.00 37.83 32.81 2wp8 s LYS 195 CO 0.15 0.09 0.40 -0.51 -0.76 0.00 0.00 175.35 174.72 2wp8 s LEU 196 N 0.46 4.07 0.21 3.17 1.43 -1.26 -1.54 118.68 125.22 2wp8 s LEU 196 Ca 0.49 0.38 -0.07 0.00 -1.03 0.00 0.00 54.13 53.91 2wp8 s LEU 196 Cb -0.22 -2.48 0.15 0.00 0.03 0.00 0.00 46.19 43.67 2wp8 s LEU 196 CO 0.29 -0.17 1.67 0.77 0.23 0.00 0.00 176.35 179.14 2wp8 h SER 197 N 7.92 0.95 -3.48 2.29 4.64 -1.31 -3.45 113.55 121.12 2wp8 h SER 197 Ca -0.32 -0.27 -0.37 0.00 -0.47 0.00 0.00 61.79 60.35 2wp8 h SER 197 Cb 1.16 -0.26 -0.34 0.00 -0.31 0.00 0.00 62.40 62.65 2wp8 h SER 197 CO 0.67 1.02 -0.76 -0.22 -0.87 0.00 0.00 176.83 176.68 2wp8 s LEU 198 N -9.23 1.23 -0.09 5.97 2.96 -0.68 -4.94 118.68 113.90 2wp8 s LEU 198 Ca -0.11 -0.07 -0.01 0.00 -0.22 0.00 0.00 54.13 53.72 2wp8 s LEU 198 Cb 0.14 -0.32 0.03 0.00 0.50 0.00 0.00 46.19 46.53 2wp8 s LEU 198 CO 0.84 -0.08 -0.02 -0.22 -1.32 0.00 0.00 176.35 175.55 2wp8 s LEU 199 N 0.98 0.80 -0.30 -0.68 2.96 -1.26 -0.07 118.68 121.10 2wp8 s LEU 199 Ca -0.10 -0.18 0.01 0.00 -0.22 0.00 0.00 54.13 53.65 2wp8 s LEU 199 Cb -0.14 -0.57 0.09 0.00 0.50 0.00 0.00 46.19 46.07 2wp8 s LEU 199 CO -0.01 -0.17 0.04 -0.76 -1.32 0.00 0.00 176.35 174.13 2wp8 s LEU 200 N 1.88 3.31 -0.24 -0.68 1.43 0.66 -5.02 118.68 120.03 2wp8 s LEU 200 Ca 0.05 -1.73 -0.18 0.00 -1.03 0.00 0.00 54.13 51.24 2wp8 s LEU 200 Cb -0.12 -1.24 -0.03 0.00 0.03 0.00 0.00 46.19 44.83 2wp8 s LEU 200 CO -0.06 -0.36 0.53 -0.69 0.23 0.00 0.00 176.35 176.00 2wp8 s VAL 201 N 1.28 5.07 -0.06 -1.59 1.01 -1.26 -0.69 120.40 124.15 2wp8 s VAL 201 Ca 0.06 0.94 0.10 0.00 0.00 0.00 0.00 61.98 63.09 2wp8 s VAL 201 Cb -0.18 -3.85 -0.15 0.00 0.00 0.00 0.00 36.38 32.20 2wp8 s VAL 201 CO -0.14 0.10 0.13 -0.62 0.00 0.00 0.00 175.10 174.58 2wp8 n GLU 202 N 5.34 1.39 -3.62 2.72 1.02 -0.70 -5.00 120.64 121.79 2wp8 n GLU 202 Ca -0.04 -0.05 -0.16 0.00 -0.02 0.00 0.00 57.16 56.90 2wp8 n GLU 202 Cb 0.50 -1.27 -0.05 0.00 -0.02 0.00 0.00 31.44 30.60 2wp8 n GLU 202 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2wp8 n ASP 203 N -2.16 0.34 -4.77 1.62 8.00 -1.24 -4.91 116.55 113.43 2wp8 n ASP 203 Ca -0.10 -2.52 -0.38 0.00 0.71 0.00 0.00 54.79 52.50 2wp8 n ASP 203 Cb 0.59 0.94 -0.00 0.00 -0.02 0.00 0.00 41.12 42.63 2wp8 n ASP 203 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2wp8 s LYS 204 N -3.02 3.72 -0.11 -1.24 1.02 -1.26 -4.71 119.74 114.14 2wp8 s LYS 204 Ca 0.21 1.93 -0.07 0.00 0.02 0.00 0.00 55.97 58.06 2wp8 s LYS 204 Cb 0.01 -2.47 0.04 0.00 -0.52 0.00 0.00 37.83 34.89 2wp8 s LYS 204 CO 0.15 -0.63 0.28 0.42 -0.92 0.00 0.00 175.35 174.65 2wp8 s ILE 205 N -1.43 -0.02 0.27 2.17 1.01 -1.26 -4.59 121.20 117.35 2wp8 s ILE 205 Ca 0.63 0.08 -0.29 0.00 0.00 0.00 0.00 60.65 61.07 2wp8 s ILE 205 Cb -0.33 -0.42 -0.10 0.00 0.01 0.00 0.00 42.46 41.63 2wp8 s ILE 205 CO 0.40 0.03 1.31 -2.84 0.00 0.00 0.00 174.94 173.84 2wp8 s PRO 206 N 0.87 4.38 0.33 2.79 0.02 -1.26 -4.87 135.00 137.26 2wp8 s PRO 206 Ca -0.06 2.14 0.09 0.00 0.02 0.00 0.00 61.00 63.19 2wp8 s PRO 206 Cb -0.07 -3.13 0.86 0.00 0.02 0.00 0.00 34.50 32.18 2wp8 s PRO 206 CO -0.06 -0.20 1.76 1.25 -0.33 0.00 0.00 177.00 179.42 2wp8 h LEU 207 N 4.29 0.69 -0.54 -5.54 5.85 -2.01 0.30 115.31 118.35 2wp8 h LEU 207 Ca -0.47 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.36 2wp8 h LEU 207 Cb 1.22 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.24 2wp8 h LEU 207 CO 0.71 0.18 0.00 -0.90 -0.34 0.00 0.00 178.44 178.09 2wp8 n ASP 208 N -4.78 0.44 0.00 1.25 5.75 -1.26 -2.66 116.55 115.29 2wp8 n ASP 208 Ca 0.25 -1.62 0.00 0.00 -0.01 0.00 0.00 54.79 53.41 2wp8 n ASP 208 Cb 0.69 -0.22 0.00 0.00 -1.03 0.00 0.00 41.12 40.56 2wp8 n ASP 208 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2wp8 n ARG 209 N -0.18 -0.23 -0.05 0.11 1.74 0.10 -4.90 116.66 113.27 2wp8 n ARG 209 Ca 0.00 -0.13 -0.13 0.00 -0.77 0.00 0.00 57.85 56.82 2wp8 n ARG 209 Cb 0.11 -0.62 -0.07 0.00 -1.02 0.00 0.00 32.46 30.86 2wp8 n ARG 209 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2wp8 h LEU 210 N 0.00 0.28 -0.40 0.55 5.85 -1.27 -2.97 115.31 117.36 2wp8 h LEU 210 Ca 0.00 -0.44 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 2wp8 h LEU 210 Cb 0.39 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 2wp8 h LEU 210 CO 0.00 0.66 0.19 -0.08 -0.34 0.00 0.00 178.44 178.88 2wp8 h GLU 211 N -0.10 0.58 -0.52 1.25 4.81 -1.90 -0.31 114.58 118.38 2wp8 h GLU 211 Ca 0.02 -0.08 0.06 0.00 -0.13 0.00 0.00 59.36 59.23 2wp8 h GLU 211 Cb 0.57 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.79 2wp8 h GLU 211 CO 0.02 0.50 0.23 -0.97 -0.73 0.00 0.00 179.01 178.07 2wp8 h ASN 212 N 0.51 0.29 -0.48 1.04 -0.00 -1.94 -0.32 115.58 114.68 2wp8 h ASN 212 Ca 0.14 0.04 0.05 0.00 -0.00 0.00 0.00 56.30 56.53 2wp8 h ASN 212 Cb 0.12 -0.00 -0.04 0.00 -0.00 0.00 0.00 38.32 38.39 2wp8 h ASN 212 CO -0.02 0.20 0.23 0.58 -0.00 0.00 0.00 177.43 178.42 2wp8 h VAL 213 N 0.44 0.93 -0.21 2.57 2.07 -1.15 -0.48 116.25 120.43 2wp8 h VAL 213 Ca 0.24 -0.15 0.01 0.00 0.82 0.00 0.00 66.70 67.62 2wp8 h VAL 213 Cb 0.20 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 2wp8 h VAL 213 CO -0.20 0.08 0.14 -0.07 0.02 0.00 0.00 177.57 177.54 2wp8 h LEU 214 N 0.45 0.20 -0.74 2.57 3.38 -0.52 -1.89 115.31 118.76 2wp8 h LEU 214 Ca 0.22 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 2wp8 h LEU 214 Cb 0.15 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 2wp8 h LEU 214 CO -0.17 0.14 0.38 0.00 0.09 0.00 0.00 178.44 178.88 2wp8 h ALA 215 N 1.88 0.95 -0.07 1.53 0.00 0.62 -1.56 119.26 122.60 2wp8 h ALA 215 Ca 0.08 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 2wp8 h ALA 215 Cb 0.04 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.54 2wp8 h ALA 215 CO -0.02 0.49 -0.48 0.82 0.00 0.00 0.00 179.25 180.07 2wp8 h ILE 216 N 1.03 1.39 -0.41 0.00 1.08 -1.08 -2.65 117.51 116.87 2wp8 h ILE 216 Ca 0.26 -1.86 0.08 0.00 -0.39 0.00 0.00 64.86 62.95 2wp8 h ILE 216 Cb 0.08 2.31 -0.09 0.00 -3.07 0.00 0.00 36.82 36.06 2wp8 h ILE 216 CO -0.04 0.55 -0.18 1.23 -0.69 0.00 0.00 178.15 179.03 2wp8 h GLY 217 N 0.01 0.14 1.28 5.37 0.00 -1.25 -0.13 103.07 108.48 2wp8 h GLY 217 Ca -0.04 0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.50 2wp8 h GLY 217 CO 0.10 -0.19 0.34 -2.22 0.00 0.00 0.00 176.54 174.56 2wp8 h ILE 218 N -0.10 1.21 -0.13 2.60 2.04 -1.24 0.36 117.51 122.25 2wp8 h ILE 218 Ca 0.20 -0.58 -0.13 0.00 1.00 0.00 0.00 64.86 65.35 2wp8 h ILE 218 Cb 0.40 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 2wp8 h ILE 218 CO -0.47 0.25 -0.45 0.00 0.00 0.00 0.00 178.15 177.48 2wp8 h ALA 219 N 1.43 0.23 -0.29 1.87 0.00 -1.02 -1.06 119.26 120.41 2wp8 h ALA 219 Ca 0.23 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 2wp8 h ALA 219 Cb 0.08 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2wp8 h ALA 219 CO -0.03 0.37 0.10 0.78 0.00 0.00 0.00 179.25 180.47 2wp8 h GLY 220 N 0.14 0.48 0.44 0.00 0.00 -0.82 -1.02 103.07 102.29 2wp8 h GLY 220 Ca -0.02 -0.28 0.11 0.00 0.00 0.00 0.00 47.33 47.14 2wp8 h GLY 220 CO 0.09 0.26 0.44 0.00 0.00 0.00 0.00 176.54 177.33 2wp8 h ALA 221 N 0.94 1.15 -0.38 3.60 0.00 -0.27 0.16 119.26 124.46 2wp8 h ALA 221 Ca 0.10 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 2wp8 h ALA 221 Cb 0.22 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2wp8 h ALA 221 CO -0.01 0.02 0.05 0.45 0.00 0.00 0.00 179.25 179.77 2wp8 h HIS 222 N 0.71 0.58 -0.42 0.00 3.86 -0.66 -1.83 115.15 117.38 2wp8 h HIS 222 Ca 0.40 -0.05 -0.14 0.00 -1.16 0.00 0.00 60.37 59.43 2wp8 h HIS 222 Cb 0.43 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.72 2wp8 h HIS 222 CO -0.08 0.53 -0.28 -0.09 0.86 0.00 0.00 177.93 178.88 2wp8 h ARG 223 N 0.55 0.90 0.17 2.45 9.65 0.23 -1.26 114.38 127.07 2wp8 h ARG 223 Ca 0.12 -0.41 -0.01 0.00 -1.10 0.00 0.00 59.98 58.59 2wp8 h ARG 223 Cb 0.27 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.84 2wp8 h ARG 223 CO 0.00 1.06 -0.08 0.28 2.80 0.00 0.00 179.97 184.03 2wp8 h VAL 224 N 0.76 0.85 -0.79 0.20 2.07 -0.25 0.11 116.25 119.20 2wp8 h VAL 224 Ca 0.09 -0.08 0.19 0.00 0.82 0.00 0.00 66.70 67.72 2wp8 h VAL 224 Cb 0.84 0.90 -0.13 0.00 -1.52 0.00 0.00 31.29 31.38 2wp8 h VAL 224 CO 0.07 0.02 0.13 -0.09 0.02 0.00 0.00 177.57 177.73 2wp8 h ARG 225 N -0.26 0.19 -0.89 1.57 2.43 -1.32 0.23 114.38 116.33 2wp8 h ARG 225 Ca -0.02 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.12 2wp8 h ARG 225 Cb 0.20 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.67 2wp8 h ARG 225 CO 0.04 0.12 0.50 -0.44 -1.51 0.00 0.00 179.97 178.68 2wp8 h ASP 226 N 0.19 1.09 -0.26 -3.80 3.32 0.13 0.18 116.42 117.28 2wp8 h ASP 226 Ca 0.45 -0.09 -0.08 0.00 0.02 0.00 0.00 57.03 57.34 2wp8 h ASP 226 Cb 0.83 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 2wp8 h ASP 226 CO -0.61 0.86 -0.15 -0.07 -1.72 0.00 0.00 179.24 177.56 2wp8 h LEU 227 N 1.24 0.57 -0.52 1.55 3.38 0.76 -2.64 115.31 119.65 2wp8 h LEU 227 Ca 0.31 -0.42 0.10 0.00 0.09 0.00 0.00 57.88 57.96 2wp8 h LEU 227 Cb -0.00 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 40.51 2wp8 h LEU 227 CO -0.05 0.87 0.04 0.24 0.09 0.00 0.00 178.44 179.63 2wp8 h MET 228 N 0.28 0.16 -0.60 1.13 2.86 -0.10 -2.39 114.93 116.26 2wp8 h MET 228 Ca 0.05 -0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.74 2wp8 h MET 228 Cb 0.67 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 32.24 2wp8 h MET 228 CO 0.04 0.10 0.32 -0.44 1.06 0.00 0.00 176.91 178.00 2wp8 h ASP 229 N 0.16 0.47 0.04 1.22 3.32 -0.59 -2.66 116.42 118.39 2wp8 h ASP 229 Ca 0.27 0.03 0.03 0.00 0.02 0.00 0.00 57.03 57.37 2wp8 h ASP 229 Cb 0.40 -0.06 -0.05 0.00 0.22 0.00 0.00 39.33 39.83 2wp8 h ASP 229 CO -0.40 0.31 -0.42 -0.08 -1.72 0.00 0.00 179.24 176.93 2wp8 h GLU 230 N 0.61 -0.58 -0.45 3.56 4.81 -1.05 0.12 114.58 121.59 2wp8 h GLU 230 Ca 0.27 0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.59 2wp8 h GLU 230 Cb 0.16 0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.63 2wp8 h GLU 230 CO -0.17 -0.39 0.16 0.93 -0.73 0.00 0.00 179.01 178.81 2wp8 h GLU 231 N -0.60 0.32 -0.63 1.92 4.39 -1.39 0.24 114.58 118.83 2wp8 h GLU 231 Ca 0.04 -0.02 0.10 0.00 0.34 0.00 0.00 59.36 59.82 2wp8 h GLU 231 Cb 0.66 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.20 2wp8 h GLU 231 CO -0.29 0.21 0.42 -0.07 -1.16 0.00 0.00 179.01 178.12 2wp8 h LEU 232 N 0.33 0.41 0.64 1.33 3.38 -1.08 0.43 115.31 120.75 2wp8 h LEU 232 Ca 0.21 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 2wp8 h LEU 232 Cb 0.21 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 40.89 2wp8 h LEU 232 CO -0.22 0.25 -0.31 -0.09 0.09 0.00 0.00 178.44 178.16 2wp8 h ARG 233 N 0.45 -0.83 0.00 1.13 2.43 0.80 -2.99 114.38 115.37 2wp8 h ARG 233 Ca 0.29 0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.52 2wp8 h ARG 233 Cb 0.53 0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 2wp8 h ARG 233 CO -0.08 -0.52 0.00 1.63 -1.51 0.00 0.00 179.97 179.49 2wp8 n LYS 234 N -5.41 0.00 -0.39 0.20 5.02 0.12 -2.02 118.16 115.68 2wp8 n LYS 234 Ca -0.13 0.72 0.34 0.00 -2.02 0.00 0.00 58.31 57.22 2wp8 n LYS 234 Cb 0.37 -1.49 0.66 0.00 -0.02 0.00 0.00 35.03 34.55 2wp8 n LYS 234 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2wp8 h HIS 235 N 0.00 0.32 -0.01 2.13 2.76 -0.84 0.20 115.15 119.70 2wp8 h HIS 235 Ca 0.00 0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.13 2wp8 h HIS 235 Cb 0.00 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 28.87 2wp8 h HIS 235 CO -0.30 -0.03 -0.22 0.00 -1.30 0.00 0.00 177.93 176.08 2wp8 h ALA 236 N 1.47 1.62 0.00 5.26 0.00 -1.25 -3.13 119.26 123.23 2wp8 h ALA 236 Ca 0.67 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 55.28 2wp8 h ALA 236 Cb 2.28 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 20.02 2wp8 h ALA 236 CO -0.19 0.29 -0.45 1.96 0.00 0.00 0.00 179.25 180.86 2wp8 h GLN 237 N 0.01 0.00 -6.13 0.00 4.20 -0.34 -3.42 115.11 109.43 2wp8 h GLN 237 Ca 0.00 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.14 2wp8 h GLN 237 Cb 0.40 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.18 2wp8 h GLN 237 CO 0.03 0.45 1.38 0.15 -0.67 0.00 0.00 178.83 180.17 2wp8 s LYS 238 N -3.07 3.47 0.00 1.46 1.02 -1.19 -5.15 119.74 116.28 2wp8 s LYS 238 Ca 0.04 2.12 0.00 0.00 0.02 0.00 0.00 55.97 58.15 2wp8 s LYS 238 Cb 0.08 -4.28 0.00 0.00 -0.52 0.00 0.00 37.83 33.11 2wp8 s LYS 238 CO 0.73 -1.72 0.00 2.89 -0.92 0.00 0.00 175.35 176.33