#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wp8 s ARG 37 N 0.00 4.48 0.82 7.34 3.52 -1.26 -5.03 118.95 128.82 2wp8 s ARG 37 Ca 0.00 1.60 -0.12 0.00 -0.13 0.00 0.00 55.73 57.08 2wp8 s ARG 37 Cb 0.00 -2.91 0.08 0.00 -1.56 0.00 0.00 34.95 30.56 2wp8 s ARG 37 CO 0.00 0.13 1.11 -1.21 -0.81 0.00 0.00 175.30 174.52 2wp8 s GLU 38 N -1.88 1.90 -0.27 5.12 2.02 -1.26 -5.07 118.70 119.26 2wp8 s GLU 38 Ca 0.50 0.48 -0.02 0.00 0.02 0.00 0.00 54.97 55.95 2wp8 s GLU 38 Cb -0.26 -1.91 0.16 0.00 0.10 0.00 0.00 34.13 32.22 2wp8 s GLU 38 CO 0.33 -1.71 0.49 -1.58 0.02 0.00 0.00 175.26 172.81 2wp8 s HIS 39 N -3.25 -1.22 0.03 1.61 2.46 -1.26 -5.15 115.29 108.52 2wp8 s HIS 39 Ca 0.61 1.31 0.05 0.00 0.47 0.00 0.00 55.06 57.50 2wp8 s HIS 39 Cb -0.14 0.31 -0.03 0.00 -0.13 0.00 0.00 32.58 32.59 2wp8 s HIS 39 CO 0.53 -0.79 -0.11 0.71 -2.47 0.00 0.00 174.74 172.61 2wp8 s TYR 40 N 2.71 2.75 0.06 3.88 1.51 -1.26 -5.12 117.35 121.88 2wp8 s TYR 40 Ca 0.16 -0.14 0.06 0.00 -1.01 0.00 0.00 57.07 56.15 2wp8 s TYR 40 Cb -0.15 -1.53 -0.04 0.00 -0.11 0.00 0.00 41.96 40.14 2wp8 s TYR 40 CO -0.18 0.34 -0.13 -0.51 -1.11 0.00 0.00 175.55 173.96 2wp8 s LEU 41 N -1.56 2.90 0.30 -1.29 1.43 -1.26 -4.76 118.68 114.44 2wp8 s LEU 41 Ca 0.17 -0.36 0.04 0.00 -1.03 0.00 0.00 54.13 52.95 2wp8 s LEU 41 Cb -0.11 -1.70 -0.06 0.00 0.03 0.00 0.00 46.19 44.35 2wp8 s LEU 41 CO 0.08 0.23 0.03 -0.13 0.23 0.00 0.00 176.35 176.78 2wp8 s ARG 42 N -1.78 1.58 0.00 1.70 0.52 0.74 -4.80 118.95 116.91 2wp8 s ARG 42 Ca 0.18 -1.85 0.00 0.00 -0.52 0.00 0.00 55.73 53.54 2wp8 s ARG 42 Cb -0.11 -0.89 0.00 0.00 0.52 0.00 0.00 34.95 34.47 2wp8 s ARG 42 CO 0.09 -0.13 0.76 -1.13 0.02 0.00 0.00 175.30 174.92 2wp8 n SER 43 N -0.63 1.33 0.14 0.23 3.41 -1.26 -1.78 113.62 115.06 2wp8 n SER 43 Ca -0.03 -1.58 0.12 0.00 -0.26 0.00 0.00 58.87 57.12 2wp8 n SER 43 Cb 0.66 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.81 2wp8 n SER 43 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2wp8 h ASP 44 N 0.00 0.00 -3.54 4.04 3.32 -1.96 -3.45 116.42 114.84 2wp8 h ASP 44 Ca 0.00 -0.04 -0.62 0.00 0.02 0.00 0.00 57.03 56.39 2wp8 h ASP 44 Cb 0.52 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 39.94 2wp8 h ASP 44 CO 0.00 0.02 0.22 -0.63 -1.72 0.00 0.00 179.24 177.13 2wp8 s ILE 45 N -3.20 4.86 0.18 0.35 1.01 -1.26 -4.42 121.20 118.71 2wp8 s ILE 45 Ca 0.07 0.77 -0.28 0.00 0.00 0.00 0.00 60.65 61.21 2wp8 s ILE 45 Cb 0.09 -4.10 -0.08 0.00 0.01 0.00 0.00 42.46 38.39 2wp8 s ILE 45 CO 0.68 -0.30 0.86 -2.84 0.00 0.00 0.00 174.94 173.34 2wp8 s PRO 46 N 2.80 4.70 0.00 2.79 0.02 -1.26 -4.97 135.00 139.07 2wp8 s PRO 46 Ca 0.27 1.32 -0.00 0.00 0.02 0.00 0.00 61.00 62.60 2wp8 s PRO 46 Cb -0.14 -3.29 -0.00 0.00 0.02 0.00 0.00 34.50 31.09 2wp8 s PRO 46 CO 0.14 0.49 0.01 0.00 -0.33 0.00 0.00 177.00 177.31 2wp8 n LEU 48 N -3.52 0.00 -4.72 0.00 4.77 -1.26 -5.00 117.00 107.27 2wp8 n LEU 48 Ca 0.00 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.57 2wp8 n LEU 48 Cb 0.00 -0.21 -0.04 0.00 -2.33 0.00 0.00 43.42 40.84 2wp8 n LEU 48 CO -0.00 0.00 0.71 -0.44 -1.33 0.00 0.00 177.39 176.33 2wp8 s SER 49 N -2.43 7.39 0.23 -1.43 0.01 -1.26 -1.12 113.70 115.10 2wp8 s SER 49 Ca 0.00 1.82 0.16 0.00 1.31 0.00 0.00 55.95 59.24 2wp8 s SER 49 Cb 0.00 -2.58 0.85 0.00 0.21 0.00 0.00 66.02 64.50 2wp8 s SER 49 CO 0.00 -0.18 1.49 0.54 0.41 0.00 0.00 173.24 175.50 2wp8 n ARG 50 N 3.16 0.10 -0.49 12.44 5.12 0.93 -1.19 116.66 136.73 2wp8 n ARG 50 Ca 0.04 0.59 0.08 0.00 -1.93 0.00 0.00 57.85 56.63 2wp8 n ARG 50 Cb 0.49 -1.83 0.29 0.00 -1.16 0.00 0.00 32.46 30.25 2wp8 n ARG 50 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2wp8 n SER 51 N -2.05 4.16 -4.74 0.55 3.41 -1.26 -4.92 113.62 108.77 2wp8 n SER 51 Ca -0.01 -2.56 -0.41 0.00 -0.26 0.00 0.00 58.87 55.63 2wp8 n SER 51 Cb 0.04 -0.50 -0.03 0.00 -0.26 0.00 0.00 64.21 63.46 2wp8 n SER 51 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wp8 n THR 53 N 2.63 0.00 -0.10 0.00 5.66 -1.26 -4.69 114.28 116.52 2wp8 n THR 53 Ca 0.06 -0.41 -0.21 0.00 -3.05 0.00 0.00 64.05 60.44 2wp8 n THR 53 Cb 0.42 1.04 -0.12 0.00 -1.55 0.00 0.00 70.33 70.12 2wp8 n THR 53 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2wp8 n LYS 54 N -0.66 0.65 -0.18 1.09 5.02 -1.26 -4.58 118.16 118.24 2wp8 n LYS 54 Ca 0.00 0.23 0.10 0.00 -2.02 0.00 0.00 58.31 56.62 2wp8 n LYS 54 Cb 0.01 -1.57 0.40 0.00 -0.02 0.00 0.00 35.03 33.85 2wp8 n LYS 54 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wp8 n PRO 56 N -4.50 0.08 0.00 0.00 -0.02 -1.26 -0.32 135.00 128.98 2wp8 n PRO 56 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 2wp8 n PRO 56 Cb 0.35 -1.39 0.00 0.00 -0.02 0.00 0.00 33.50 32.44 2wp8 n PRO 56 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2wp8 n GLN 57 N -0.89 4.10 0.14 -0.52 6.02 -0.90 -4.48 117.38 120.85 2wp8 n GLN 57 Ca 0.01 -0.13 -0.00 0.00 -0.01 0.00 0.00 57.00 56.88 2wp8 n GLN 57 Cb 0.01 -0.58 0.19 0.00 1.02 0.00 0.00 30.24 30.87 2wp8 n GLN 57 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 2wp8 h ILE 58 N 0.04 1.35 -3.78 5.09 2.04 -0.70 -3.49 117.51 118.05 2wp8 h ILE 58 Ca 0.00 -2.05 -0.48 0.00 1.00 0.00 0.00 64.86 63.32 2wp8 h ILE 58 Cb 0.02 2.13 -0.02 0.00 -0.74 0.00 0.00 36.82 38.20 2wp8 h ILE 58 CO 0.00 0.57 0.32 -0.69 0.00 0.00 0.00 178.15 178.36 2wp8 s VAL 59 N -3.58 4.18 0.01 1.67 1.01 -1.08 -4.47 120.40 118.14 2wp8 s VAL 59 Ca -0.01 1.91 0.06 0.00 0.00 0.00 0.00 61.98 63.94 2wp8 s VAL 59 Cb 0.12 -4.16 -0.03 0.00 0.00 0.00 0.00 36.38 32.32 2wp8 s VAL 59 CO 0.75 0.33 -0.18 0.68 0.00 0.00 0.00 175.10 176.69 2wp8 s VAL 60 N -1.38 2.81 0.75 2.92 -7.23 -1.26 -5.07 120.40 111.93 2wp8 s VAL 60 Ca 0.45 -1.06 -0.15 0.00 -1.81 0.00 0.00 61.98 59.40 2wp8 s VAL 60 Cb -0.22 -2.15 0.04 0.00 0.56 0.00 0.00 36.38 34.61 2wp8 s VAL 60 CO 0.27 0.42 1.13 -2.65 -0.31 0.00 0.00 175.10 173.96 2wp8 n PRO 61 N 1.80 0.48 -0.38 4.82 -0.01 -1.26 -4.59 135.00 135.86 2wp8 n PRO 61 Ca -0.16 0.23 -0.05 0.00 -0.01 0.00 0.00 63.50 63.51 2wp8 n PRO 61 Cb 0.52 -2.37 0.03 0.00 -0.01 0.00 0.00 33.50 31.67 2wp8 n PRO 61 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 175.50 175.09 2wp8 n ASP 62 N -2.40 0.04 -0.35 2.55 5.68 -0.77 -4.83 116.55 116.47 2wp8 n ASP 62 Ca 0.14 -1.09 0.12 0.00 -0.50 0.00 0.00 54.79 53.45 2wp8 n ASP 62 Cb 0.50 -0.16 0.31 0.00 -1.14 0.00 0.00 41.12 40.63 2wp8 n ASP 62 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2wp8 h ALA 63 N -1.79 1.66 -0.33 2.12 0.00 -1.95 -1.13 119.26 117.83 2wp8 h ALA 63 Ca -0.07 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2wp8 h ALA 63 Cb 0.19 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2wp8 h ALA 63 CO 0.05 0.01 0.00 1.04 0.00 0.00 0.00 179.25 180.35 2wp8 n GLN 64 N -4.71 2.39 -2.91 0.00 6.02 -1.26 -4.88 117.38 112.02 2wp8 n GLN 64 Ca 0.22 -1.46 -0.16 0.00 -0.01 0.00 0.00 57.00 55.59 2wp8 n GLN 64 Cb 0.52 -1.57 0.03 0.00 1.02 0.00 0.00 30.24 30.24 2wp8 n GLN 64 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2wp8 n ASN 65 N 0.46 -4.87 -4.23 1.08 5.15 -0.43 -5.00 115.26 107.43 2wp8 n ASN 65 Ca 0.13 -0.25 -0.34 0.00 -0.60 0.00 0.00 54.58 53.53 2wp8 n ASN 65 Cb 0.51 -3.66 -0.15 0.00 -0.53 0.00 0.00 39.78 35.95 2wp8 n ASN 65 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 2wp8 s GLU 66 N -5.49 3.19 0.38 1.20 2.56 -1.26 -4.81 118.70 114.46 2wp8 s GLU 66 Ca 0.26 -0.74 -0.28 0.00 0.00 0.00 0.00 54.97 54.21 2wp8 s GLU 66 Cb -0.12 -2.71 -0.11 0.00 2.00 0.00 0.00 34.13 33.20 2wp8 s GLU 66 CO 0.33 -0.11 1.47 -0.51 -0.56 0.00 0.00 175.26 175.87 2wp8 s LEU 67 N 1.15 4.32 0.18 2.70 1.43 -1.26 -1.85 118.68 125.34 2wp8 s LEU 67 Ca 0.01 3.02 -0.32 0.00 -1.03 0.00 0.00 54.13 55.80 2wp8 s LEU 67 Cb -0.14 -3.68 -0.12 0.00 0.03 0.00 0.00 46.19 42.27 2wp8 s LEU 67 CO -0.05 -0.86 1.72 -0.81 0.23 0.00 0.00 176.35 176.58 2wp8 n PRO 68 N 0.45 2.66 -2.41 1.29 -0.04 -1.26 -4.94 135.00 130.75 2wp8 n PRO 68 Ca 0.01 0.96 -0.42 0.00 -0.04 0.00 0.00 63.50 64.01 2wp8 n PRO 68 Cb 0.40 -2.81 -0.03 0.00 -0.04 0.00 0.00 33.50 31.02 2wp8 n PRO 68 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 2wp8 s LYS 69 N 1.45 4.42 0.21 0.54 0.00 -1.26 -5.02 119.74 120.07 2wp8 s LYS 69 Ca 0.77 1.78 -0.30 0.00 0.00 0.00 0.00 55.97 58.22 2wp8 s LYS 69 Cb -0.53 -3.37 -0.08 0.00 0.00 0.00 0.00 37.83 33.85 2wp8 s LYS 69 CO 0.34 -0.28 0.97 -0.06 0.00 0.00 0.00 175.35 176.32 2wp8 s PHE 70 N 1.18 3.88 -0.10 1.78 2.99 -1.26 -5.00 117.98 121.44 2wp8 s PHE 70 Ca 0.59 1.84 -0.12 0.00 0.00 0.00 0.00 56.93 59.24 2wp8 s PHE 70 Cb -0.29 -3.05 -0.05 0.00 0.00 0.00 0.00 43.02 39.63 2wp8 s PHE 70 CO 0.29 0.21 -0.24 -0.89 -0.00 0.00 0.00 175.22 174.59 2wp8 n ILE 71 N 1.84 1.38 -1.91 0.64 2.08 -0.27 -4.73 119.36 118.39 2wp8 n ILE 71 Ca -0.01 0.18 -0.36 0.00 0.56 0.00 0.00 62.75 63.12 2wp8 n ILE 71 Cb 0.47 -2.08 0.05 0.00 -0.75 0.00 0.00 39.64 37.33 2wp8 n ILE 71 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 2wp8 s LEU 72 N -7.57 3.63 0.60 1.39 1.43 -0.63 -4.65 118.68 112.89 2wp8 s LEU 72 Ca -0.21 2.48 -0.14 0.00 -1.03 0.00 0.00 54.13 55.23 2wp8 s LEU 72 Cb 0.03 -4.60 -0.04 0.00 0.03 0.00 0.00 46.19 41.61 2wp8 s LEU 72 CO 0.30 -1.75 1.04 -0.55 0.23 0.00 0.00 176.35 175.62 2wp8 s SER 73 N -1.51 5.95 0.12 2.29 0.15 -1.26 -0.05 113.70 119.40 2wp8 s SER 73 Ca 0.79 1.66 -0.19 0.00 0.70 0.00 0.00 55.95 58.91 2wp8 s SER 73 Cb -0.33 -2.51 -0.05 0.00 -1.71 0.00 0.00 66.02 61.42 2wp8 s SER 73 CO 0.36 -1.05 1.73 0.44 1.20 0.00 0.00 173.24 175.92 2wp8 h ASP 74 N 0.18 0.33 -4.20 5.45 3.32 -1.91 -3.40 116.42 116.19 2wp8 h ASP 74 Ca -0.46 -0.07 -0.66 0.00 0.02 0.00 0.00 57.03 55.86 2wp8 h ASP 74 Cb 1.20 -0.08 -0.39 0.00 0.22 0.00 0.00 39.33 40.28 2wp8 h ASP 74 CO 0.59 0.31 -0.55 -0.44 -1.72 0.00 0.00 179.24 177.43 2wp8 s SER 75 N -5.54 4.69 0.80 6.45 0.01 -1.26 -4.99 113.70 113.86 2wp8 s SER 75 Ca -0.13 -2.85 -0.08 0.00 1.31 0.00 0.00 55.95 54.20 2wp8 s SER 75 Cb 0.09 -1.72 0.13 0.00 0.21 0.00 0.00 66.02 64.73 2wp8 s SER 75 CO 0.71 -0.30 1.11 -2.84 0.41 0.00 0.00 173.24 172.33 2wp8 s PRO 76 N -0.06 1.50 -0.04 12.44 0.02 -1.26 -4.95 135.00 142.65 2wp8 s PRO 76 Ca 0.16 -0.59 -0.35 0.00 0.02 0.00 0.00 61.00 60.24 2wp8 s PRO 76 Cb -0.23 -2.11 -0.13 0.00 0.02 0.00 0.00 34.50 32.04 2wp8 s PRO 76 CO -0.02 -1.70 1.74 -0.11 -0.33 0.00 0.00 177.00 176.57 2wp8 n LEU 77 N -3.18 3.05 -4.52 -5.54 7.94 -1.26 -4.62 117.00 108.88 2wp8 n LEU 77 Ca 0.13 1.03 -0.41 0.00 -1.11 0.00 0.00 56.01 55.64 2wp8 n LEU 77 Cb 0.60 -1.34 -0.10 0.00 0.53 0.00 0.00 43.42 43.12 2wp8 n LEU 77 CO 0.47 -0.25 -0.01 -0.70 -1.11 0.00 0.00 177.39 175.79 2wp8 s GLU 78 N 2.88 3.36 0.67 1.96 2.12 -1.25 -2.95 118.70 125.49 2wp8 s GLU 78 Ca 0.89 -0.63 0.01 0.00 0.36 0.00 0.00 54.97 55.60 2wp8 s GLU 78 Cb -0.77 -3.86 0.10 0.00 0.26 0.00 0.00 34.13 29.86 2wp8 s GLU 78 CO 0.50 -0.60 0.92 -0.51 -0.54 0.00 0.00 175.26 175.03 2wp8 s LEU 79 N 1.91 3.06 0.66 2.70 1.43 0.99 -4.87 118.68 124.56 2wp8 s LEU 79 Ca 0.09 -0.33 -0.17 0.00 -1.03 0.00 0.00 54.13 52.70 2wp8 s LEU 79 Cb -0.17 -2.16 0.00 0.00 0.03 0.00 0.00 46.19 43.89 2wp8 s LEU 79 CO 0.11 -1.65 1.19 -0.44 0.23 0.00 0.00 176.35 175.80 2wp8 s SER 80 N -4.66 4.76 0.69 2.29 0.01 -1.26 -2.42 113.70 113.11 2wp8 s SER 80 Ca 0.64 2.31 -0.13 0.00 1.31 0.00 0.00 55.95 60.08 2wp8 s SER 80 Cb -0.07 -2.59 0.01 0.00 0.21 0.00 0.00 66.02 63.59 2wp8 s SER 80 CO 0.42 -1.88 1.08 0.00 0.41 0.00 0.00 173.24 173.27 2wp8 s ALA 81 N -1.88 2.52 -1.63 1.44 0.00 -1.26 -3.10 121.76 117.85 2wp8 s ALA 81 Ca 0.74 0.30 0.06 0.00 0.00 0.00 0.00 51.96 53.06 2wp8 s ALA 81 Cb -0.28 -3.25 0.30 0.00 0.00 0.00 0.00 23.12 19.89 2wp8 s ALA 81 CO 0.40 -1.31 0.94 -2.30 0.00 0.00 0.00 175.76 173.49 2wp8 n PRO 82 N -2.88 0.11 0.13 0.00 -0.02 -1.26 -4.90 135.00 126.18 2wp8 n PRO 82 Ca 0.09 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 2wp8 n PRO 82 Cb 0.53 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.51 2wp8 n PRO 82 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2wp8 n ILE 83 N -1.18 0.00 0.00 4.25 5.41 -1.23 -4.91 119.36 121.70 2wp8 n ILE 83 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.78 2wp8 n ILE 83 Cb 0.04 -0.16 0.00 0.00 -0.71 0.00 0.00 39.64 38.80 2wp8 n ILE 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2wp8 n GLY 84 N 0.05 3.71 3.70 7.39 0.00 -1.02 -4.23 105.19 114.81 2wp8 n GLY 84 Ca 0.00 0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2wp8 n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wp8 s LYS 85 N 0.00 4.40 -0.00 1.61 1.02 -1.26 -0.01 119.74 125.49 2wp8 s LYS 85 Ca 0.00 1.77 -0.10 0.00 0.02 0.00 0.00 55.97 57.66 2wp8 s LYS 85 Cb 0.00 -3.41 0.01 0.00 -0.52 0.00 0.00 37.83 33.91 2wp8 s LYS 85 CO 0.00 -0.33 0.21 -3.38 -0.92 0.00 0.00 175.35 170.92 2wp8 s HIS 86 N 1.45 -0.05 0.20 3.18 -3.43 -1.15 -1.02 115.29 114.48 2wp8 s HIS 86 Ca 0.59 0.02 0.05 0.00 -0.80 0.00 0.00 55.06 54.92 2wp8 s HIS 86 Cb -0.29 0.01 -0.03 0.00 -1.43 0.00 0.00 32.58 30.84 2wp8 s HIS 86 CO 0.27 -0.33 0.26 0.71 -2.00 0.00 0.00 174.74 173.65 2wp8 s TYR 87 N -1.38 3.34 -0.04 0.38 2.02 0.68 -4.45 117.35 117.90 2wp8 s TYR 87 Ca -0.14 0.00 0.01 0.00 -0.37 0.00 0.00 57.07 56.57 2wp8 s TYR 87 Cb -0.07 -1.55 -0.03 0.00 -0.40 0.00 0.00 41.96 39.91 2wp8 s TYR 87 CO 0.03 0.49 -0.04 0.08 -1.57 0.00 0.00 175.55 174.53 2wp8 s VAL 88 N -1.90 3.86 -0.23 0.71 1.01 -0.53 -0.27 120.40 123.05 2wp8 s VAL 88 Ca 0.33 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.77 2wp8 s VAL 88 Cb -0.10 -2.64 0.06 0.00 0.00 0.00 0.00 36.38 33.70 2wp8 s VAL 88 CO 0.27 0.50 -0.08 -0.69 0.00 0.00 0.00 175.10 175.10 2wp8 s VAL 89 N -0.93 1.68 -0.06 2.92 1.01 0.99 0.15 120.40 126.16 2wp8 s VAL 89 Ca 0.15 -1.25 -0.23 0.00 0.00 0.00 0.00 61.98 60.66 2wp8 s VAL 89 Cb -0.11 -1.87 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 2wp8 s VAL 89 CO 0.05 -0.02 0.67 -0.76 0.00 0.00 0.00 175.10 175.04 2wp8 s LEU 90 N 1.34 4.33 0.68 3.92 1.43 -1.08 -3.10 118.68 126.19 2wp8 s LEU 90 Ca -0.05 1.16 -0.12 0.00 -1.03 0.00 0.00 54.13 54.08 2wp8 s LEU 90 Cb -0.18 -3.03 0.00 0.00 0.03 0.00 0.00 46.19 43.01 2wp8 s LEU 90 CO -0.06 -0.08 1.07 -0.62 0.23 0.00 0.00 176.35 176.88 2wp8 s ASP 91 N 0.65 5.36 0.09 2.29 2.15 -1.15 -4.62 116.67 121.45 2wp8 s ASP 91 Ca 0.36 1.72 -0.20 0.00 0.43 0.00 0.00 52.55 54.86 2wp8 s ASP 91 Cb -0.18 -2.51 -0.08 0.00 -0.30 0.00 0.00 42.92 39.85 2wp8 s ASP 91 CO 0.17 -1.45 1.61 0.00 -0.17 0.00 0.00 175.17 175.33 2wp8 h THR 92 N -0.42 1.18 0.00 1.71 1.03 -1.93 -2.08 112.91 112.40 2wp8 h THR 92 Ca -0.45 -0.57 0.00 0.00 -0.01 0.00 0.00 66.41 65.38 2wp8 h THR 92 Cb 1.22 1.16 0.00 0.00 -1.07 0.00 0.00 68.15 69.46 2wp8 h THR 92 CO 0.56 0.18 0.00 0.78 -0.01 0.00 0.00 175.52 177.03 2wp8 h ASN 93 N 0.18 0.00 -0.17 0.00 4.21 -1.95 -1.78 115.58 116.06 2wp8 h ASN 93 Ca 0.07 0.00 -0.12 0.00 1.21 0.00 0.00 56.30 57.46 2wp8 h ASN 93 Cb 0.22 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.42 2wp8 h ASN 93 CO -0.00 0.00 -0.38 0.58 -1.29 0.00 0.00 177.43 176.34 2wp8 h VAL 94 N 0.00 1.34 0.19 2.81 2.07 -1.73 -3.08 116.25 117.86 2wp8 h VAL 94 Ca 0.00 -1.63 -0.01 0.00 0.82 0.00 0.00 66.70 65.88 2wp8 h VAL 94 Cb 0.28 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.00 2wp8 h VAL 94 CO 0.00 0.50 -0.09 0.58 0.02 0.00 0.00 177.57 178.58 2wp8 h VAL 95 N 0.21 0.89 -0.83 2.57 2.07 -1.05 -0.93 116.25 119.19 2wp8 h VAL 95 Ca 0.00 -0.44 0.17 0.00 0.82 0.00 0.00 66.70 67.25 2wp8 h VAL 95 Cb 0.98 1.16 -0.10 0.00 -1.52 0.00 0.00 31.29 31.80 2wp8 h VAL 95 CO 0.08 0.10 0.37 -0.07 0.02 0.00 0.00 177.57 178.07 2wp8 h LEU 96 N -0.47 0.36 0.00 2.57 3.38 -1.48 -1.16 115.31 118.52 2wp8 h LEU 96 Ca -0.03 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2wp8 h LEU 96 Cb 0.36 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2wp8 h LEU 96 CO 0.04 0.11 -0.87 1.56 0.09 0.00 0.00 178.44 179.37 2wp8 h GLN 97 N 0.48 0.00 0.00 1.13 4.20 -1.43 -3.40 115.11 116.09 2wp8 h GLN 97 Ca 0.47 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 59.11 2wp8 h GLN 97 Cb 0.76 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.39 2wp8 h GLN 97 CO -0.43 0.00 -0.66 0.00 -0.67 0.00 0.00 178.83 177.07 2wp8 n ALA 98 N -2.09 2.33 0.08 3.87 0.00 -0.36 -4.56 120.51 119.78 2wp8 n ALA 98 Ca 0.01 -1.92 0.19 0.00 0.00 0.00 0.00 53.44 51.72 2wp8 n ALA 98 Cb 0.52 -0.57 0.74 0.00 0.00 0.00 0.00 19.45 20.14 2wp8 n ALA 98 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 2wp8 h ILE 99 N 5.67 0.57 -0.41 0.00 6.09 -1.40 -2.10 117.51 125.93 2wp8 h ILE 99 Ca -0.09 0.00 -0.10 0.00 -1.37 0.00 0.00 64.86 63.30 2wp8 h ILE 99 Cb 1.51 0.74 -0.01 0.00 0.47 0.00 0.00 36.82 39.53 2wp8 h ILE 99 CO 0.04 0.00 -0.15 0.44 -3.07 0.00 0.00 178.15 175.41 2wp8 h ASP 100 N 0.00 0.85 0.73 2.19 3.32 -1.88 -2.47 116.42 119.16 2wp8 h ASP 100 Ca 0.20 -0.38 -0.16 0.00 0.02 0.00 0.00 57.03 56.70 2wp8 h ASP 100 Cb 0.90 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.20 2wp8 h ASP 100 CO -0.00 1.04 -0.76 0.25 -1.72 0.00 0.00 179.24 178.05 2wp8 h LEU 101 N 0.65 0.03 -1.02 1.55 5.85 -1.72 -2.78 115.31 117.86 2wp8 h LEU 101 Ca 0.10 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 2wp8 h LEU 101 Cb 0.70 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 2wp8 h LEU 101 CO 0.05 0.77 0.30 -0.07 -0.34 0.00 0.00 178.44 179.15 2wp8 h LEU 102 N 0.01 0.91 0.00 2.25 3.38 -1.33 -1.98 115.31 118.55 2wp8 h LEU 102 Ca -0.01 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2wp8 h LEU 102 Cb 1.34 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2wp8 h LEU 102 CO 0.10 0.79 0.00 -0.62 0.09 0.00 0.00 178.44 178.80 2wp8 n GLU 103 N -4.31 0.18 -2.42 1.13 1.02 -0.94 -4.69 120.64 110.62 2wp8 n GLU 103 Ca 0.06 0.12 -0.41 0.00 -0.02 0.00 0.00 57.16 56.91 2wp8 n GLU 103 Cb 0.16 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.04 2wp8 n GLU 103 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2wp8 s ASN 104 N -2.72 7.15 0.00 1.62 3.84 -0.75 -4.92 114.94 119.16 2wp8 s ASN 104 Ca 0.16 2.21 0.31 0.00 0.21 0.00 0.00 52.86 55.75 2wp8 s ASN 104 Cb 0.13 -2.61 1.78 0.00 -0.55 0.00 0.00 41.25 40.01 2wp8 s ASN 104 CO 0.32 -0.31 2.17 -0.81 -2.79 0.00 0.00 177.10 175.68 2wp8 n PRO 105 N 2.29 0.82 -0.41 0.43 -0.04 -1.26 -3.55 135.00 133.28 2wp8 n PRO 105 Ca 0.03 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.55 2wp8 n PRO 105 Cb 0.45 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.60 2wp8 n PRO 105 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2wp8 n ASN 106 N -1.09 2.39 0.00 3.54 3.02 -1.26 -4.90 115.26 116.96 2wp8 n ASN 106 Ca 0.21 -3.45 0.00 0.00 -0.03 0.00 0.00 54.58 51.31 2wp8 n ASN 106 Cb 0.15 -0.51 0.00 0.00 -0.61 0.00 0.00 39.78 38.81 2wp8 n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wp8 s PHE 108 N -1.96 3.26 -0.19 0.00 0.08 -1.26 -4.94 117.98 112.97 2wp8 s PHE 108 Ca 0.00 -1.14 0.02 0.00 0.12 0.00 0.00 56.93 55.93 2wp8 s PHE 108 Cb 0.00 -2.54 -0.13 0.00 -0.57 0.00 0.00 43.02 39.78 2wp8 s PHE 108 CO 0.00 -0.71 -0.17 1.19 -0.10 0.00 0.00 175.22 175.44 2wp8 n PHE 109 N 4.96 0.00 -3.90 0.36 3.72 -1.26 -4.56 117.46 116.78 2wp8 n PHE 109 Ca -0.12 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 56.98 2wp8 n PHE 109 Cb 0.45 -0.74 -0.15 0.00 -0.94 0.00 0.00 39.48 38.09 2wp8 n PHE 109 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2wp8 s ASP 110 N -5.86 3.99 -0.03 4.37 1.01 -1.25 -0.70 116.67 118.20 2wp8 s ASP 110 Ca -0.26 -1.42 0.05 0.00 0.71 0.00 0.00 52.55 51.63 2wp8 s ASP 110 Cb 0.07 -1.16 -0.01 0.00 1.01 0.00 0.00 42.92 42.83 2wp8 s ASP 110 CO 0.45 -0.30 -0.18 -0.69 0.21 0.00 0.00 175.17 174.66 2wp8 s VAL 111 N 1.38 1.44 -0.18 -1.27 1.01 -0.51 -1.45 120.40 120.82 2wp8 s VAL 111 Ca 0.01 -0.74 -0.06 0.00 0.00 0.00 0.00 61.98 61.18 2wp8 s VAL 111 Cb -0.18 -1.22 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 2wp8 s VAL 111 CO -0.11 0.41 0.02 -0.63 0.00 0.00 0.00 175.10 174.80 2wp8 s ILE 112 N -0.15 4.34 -0.41 2.22 1.01 0.12 -0.59 121.20 127.75 2wp8 s ILE 112 Ca 0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 60.65 60.42 2wp8 s ILE 112 Cb -0.10 -2.95 0.10 0.00 0.01 0.00 0.00 42.46 39.53 2wp8 s ILE 112 CO 0.01 0.46 0.21 -0.69 0.00 0.00 0.00 174.94 174.93 2wp8 s VAL 113 N 0.54 3.48 0.24 2.92 1.01 0.26 -2.63 120.40 126.22 2wp8 s VAL 113 Ca 0.01 -1.90 -0.30 0.00 0.00 0.00 0.00 61.98 59.78 2wp8 s VAL 113 Cb -0.13 -3.31 -0.14 0.00 0.00 0.00 0.00 36.38 32.79 2wp8 s VAL 113 CO 0.02 -0.63 1.15 -2.65 0.00 0.00 0.00 175.10 172.98 2wp8 n PRO 114 N 4.67 1.43 -0.35 2.72 -0.02 -1.26 -1.58 135.00 140.61 2wp8 n PRO 114 Ca -0.05 0.50 0.07 0.00 -2.02 0.00 0.00 63.50 62.01 2wp8 n PRO 114 Cb 0.42 -1.98 0.25 0.00 -0.02 0.00 0.00 33.50 32.16 2wp8 n PRO 114 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2wp8 h GLN 115 N 2.96 0.95 0.00 -0.52 4.15 -0.76 0.13 115.11 122.02 2wp8 h GLN 115 Ca -0.42 -0.06 -0.04 0.00 0.77 0.00 0.00 58.65 58.91 2wp8 h GLN 115 Cb 1.33 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 28.80 2wp8 h GLN 115 CO 0.67 0.63 -0.17 0.97 -1.93 0.00 0.00 178.83 179.00 2wp8 h ILE 116 N 0.98 0.74 0.19 2.39 2.10 -1.88 0.37 117.51 122.40 2wp8 h ILE 116 Ca 0.48 -0.70 -0.30 0.00 1.08 0.00 0.00 64.86 65.42 2wp8 h ILE 116 Cb 0.47 1.43 0.03 0.00 -1.09 0.00 0.00 36.82 37.67 2wp8 h ILE 116 CO -0.25 0.17 -1.28 0.58 -1.08 0.00 0.00 178.15 176.29 2wp8 h VAL 117 N 0.00 1.32 -0.99 2.19 2.07 -1.14 -1.93 116.25 117.77 2wp8 h VAL 117 Ca -0.00 -2.58 0.12 0.00 0.82 0.00 0.00 66.70 65.06 2wp8 h VAL 117 Cb 0.41 2.95 -0.09 0.00 -1.52 0.00 0.00 31.29 33.05 2wp8 h VAL 117 CO 0.02 0.77 0.62 0.25 0.02 0.00 0.00 177.57 179.25 2wp8 h LEU 118 N 0.10 0.91 0.04 2.57 5.85 -0.56 -1.28 115.31 122.93 2wp8 h LEU 118 Ca -0.22 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.55 2wp8 h LEU 118 Cb 1.99 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.89 2wp8 h LEU 118 CO 0.24 0.48 -0.02 0.44 -0.34 0.00 0.00 178.44 179.24 2wp8 h ASP 119 N 0.97 -0.05 -0.40 1.25 3.32 -0.90 -1.28 116.42 119.33 2wp8 h ASP 119 Ca 0.50 -0.53 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 2wp8 h ASP 119 Cb 0.50 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.04 2wp8 h ASP 119 CO -0.27 0.53 0.23 -0.33 -1.72 0.00 0.00 179.24 177.68 2wp8 h GLU 120 N -0.65 0.59 -0.12 3.56 3.07 -1.20 -1.40 114.58 118.42 2wp8 h GLU 120 Ca -0.01 -0.06 -0.02 0.00 -0.50 0.00 0.00 59.36 58.78 2wp8 h GLU 120 Cb 0.58 -0.12 -0.00 0.00 -0.84 0.00 0.00 28.75 28.36 2wp8 h GLU 120 CO 0.01 0.44 0.00 0.28 -1.40 0.00 0.00 179.01 178.34 2wp8 h VAL 121 N 0.59 1.24 0.00 3.13 2.07 -1.20 -2.06 116.25 120.04 2wp8 h VAL 121 Ca 0.15 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 2wp8 h VAL 121 Cb 0.03 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 31.33 2wp8 h VAL 121 CO -0.02 0.23 -0.04 -0.09 0.02 0.00 0.00 177.57 177.66 2wp8 h ARG 122 N -0.05 0.00 0.07 1.57 2.43 -0.58 0.77 114.38 118.59 2wp8 h ARG 122 Ca 0.03 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 58.92 2wp8 h ARG 122 Cb 0.35 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.88 2wp8 h ARG 122 CO 0.01 0.04 -1.44 -0.91 -1.51 0.00 0.00 179.97 176.16 2wp8 h ASN 123 N 0.00 0.24 0.19 -3.80 2.35 -1.10 -3.26 115.58 110.21 2wp8 h ASN 123 Ca -0.00 -0.33 -0.20 0.00 -0.55 0.00 0.00 56.30 55.22 2wp8 h ASN 123 Cb 0.09 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.38 2wp8 h ASN 123 CO 0.01 1.28 -0.78 0.11 -1.65 0.00 0.00 177.43 176.39 2wp8 h LYS 124 N 0.04 0.48 -1.01 0.81 1.79 -1.10 -3.45 116.57 114.13 2wp8 h LYS 124 Ca -0.20 -0.41 0.10 0.00 -2.18 0.00 0.00 60.65 57.96 2wp8 h LYS 124 Cb 1.96 0.09 -0.21 0.00 -1.58 0.00 0.00 32.23 32.49 2wp8 h LYS 124 CO 0.14 1.05 -0.25 0.45 -1.08 0.00 0.00 179.45 179.76 2wp8 s SER 125 N -7.02 -1.34 0.29 0.86 0.15 0.24 -4.77 113.70 102.11 2wp8 s SER 125 Ca -0.07 0.88 0.00 0.00 0.70 0.00 0.00 55.95 57.47 2wp8 s SER 125 Cb 0.10 2.14 0.44 0.00 -1.71 0.00 0.00 66.02 66.99 2wp8 s SER 125 CO 0.86 -0.25 1.82 0.22 1.20 0.00 0.00 173.24 177.08 2wp8 h TYR 126 N 8.00 0.76 -0.27 3.44 3.20 -1.77 -2.49 116.97 127.84 2wp8 h TYR 126 Ca -0.22 -0.08 0.02 0.00 3.14 0.00 0.00 58.73 61.58 2wp8 h TYR 126 Cb 1.16 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 39.19 2wp8 h TYR 126 CO 0.10 0.68 0.12 -1.35 -1.64 0.00 0.00 178.16 176.07 2wp8 h PRO 127 N 0.69 0.25 -0.53 1.82 0.11 -1.83 0.93 132.00 133.44 2wp8 h PRO 127 Ca 0.15 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.22 2wp8 h PRO 127 Cb 0.35 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.38 2wp8 h PRO 127 CO 0.01 0.17 0.26 0.28 -0.21 0.00 0.00 178.00 178.50 2wp8 h VAL 128 N 0.26 1.20 -0.41 3.15 2.07 -1.85 -1.75 116.25 118.93 2wp8 h VAL 128 Ca 0.11 -0.56 0.07 0.00 0.82 0.00 0.00 66.70 67.14 2wp8 h VAL 128 Cb 0.05 0.59 -0.06 0.00 -1.52 0.00 0.00 31.29 30.34 2wp8 h VAL 128 CO -0.09 0.22 0.02 0.22 0.02 0.00 0.00 177.57 177.97 2wp8 h TYR 129 N 0.72 0.02 -0.74 1.57 3.20 -1.19 0.17 116.97 120.70 2wp8 h TYR 129 Ca 0.18 0.03 0.17 0.00 3.14 0.00 0.00 58.73 62.25 2wp8 h TYR 129 Cb 0.12 0.05 -0.11 0.00 1.54 0.00 0.00 36.73 38.33 2wp8 h TYR 129 CO -0.00 -0.06 0.16 1.15 -1.64 0.00 0.00 178.16 177.77 2wp8 h THR 130 N 0.13 0.49 -0.08 1.81 2.02 -0.20 -0.60 112.91 116.47 2wp8 h THR 130 Ca 0.20 -0.09 -0.15 0.00 0.77 0.00 0.00 66.41 67.14 2wp8 h THR 130 Cb 0.28 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.89 2wp8 h THR 130 CO -0.31 0.05 -0.62 0.03 0.37 0.00 0.00 175.52 175.03 2wp8 h ARG 131 N 0.25 0.29 0.00 6.66 3.08 -0.23 -1.72 114.38 122.70 2wp8 h ARG 131 Ca 0.42 -0.20 -0.10 0.00 0.07 0.00 0.00 59.98 60.17 2wp8 h ARG 131 Cb 0.73 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.80 2wp8 h ARG 131 CO -0.53 0.82 -0.48 1.25 -1.07 0.00 0.00 179.97 179.96 2wp8 h LEU 132 N 0.21 0.00 -0.07 3.04 5.85 0.30 -2.70 115.31 121.95 2wp8 h LEU 132 Ca -0.01 0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.46 2wp8 h LEU 132 Cb 1.14 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.18 2wp8 h LEU 132 CO 0.10 0.48 -1.05 0.03 -0.34 0.00 0.00 178.44 177.65 2wp8 h ARG 133 N 0.00 0.42 -0.45 1.25 2.47 -0.74 -3.10 114.38 114.23 2wp8 h ARG 133 Ca -0.00 -0.51 0.05 0.00 -1.26 0.00 0.00 59.98 58.25 2wp8 h ARG 133 Cb 0.96 0.16 -0.05 0.00 -1.65 0.00 0.00 29.97 29.40 2wp8 h ARG 133 CO 0.06 1.18 0.18 1.15 0.56 0.00 0.00 179.97 183.10 2wp8 h THR 134 N 0.21 0.89 0.16 2.04 2.02 -1.21 -0.00 112.91 117.03 2wp8 h THR 134 Ca -0.11 -0.13 0.01 0.00 0.77 0.00 0.00 66.41 66.95 2wp8 h THR 134 Cb 1.71 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 68.59 2wp8 h THR 134 CO 0.18 0.07 -0.21 -0.07 0.37 0.00 0.00 175.52 175.87 2wp8 h LEU 135 N 0.37 -0.56 -0.40 2.58 3.38 -1.48 0.33 115.31 119.53 2wp8 h LEU 135 Ca 0.21 0.06 0.06 0.00 0.09 0.00 0.00 57.88 58.30 2wp8 h LEU 135 Cb 0.17 0.20 -0.09 0.00 0.09 0.00 0.00 40.66 41.04 2wp8 h LEU 135 CO -0.19 -0.30 -0.47 0.00 0.09 0.00 0.00 178.44 177.57 2wp8 h ARG 137 N -0.36 0.83 -0.90 0.00 2.43 -0.14 -1.57 114.38 114.67 2wp8 h ARG 137 Ca 0.12 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 59.12 2wp8 h ARG 137 Cb 0.59 -0.19 -0.07 0.00 -0.42 0.00 0.00 29.97 29.89 2wp8 h ARG 137 CO -0.58 0.55 0.15 -0.25 -1.51 0.00 0.00 179.97 178.33 2wp8 n ASP 138 N -4.70 3.26 -4.75 -3.80 9.92 0.11 -4.95 116.55 111.65 2wp8 n ASP 138 Ca 0.14 -2.58 -0.41 0.00 -0.53 0.00 0.00 54.79 51.41 2wp8 n ASP 138 Cb 0.26 -0.62 -0.02 0.00 -0.64 0.00 0.00 41.12 40.10 2wp8 n ASP 138 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 2wp8 s SER 139 N -0.21 6.53 0.00 -2.24 0.01 -0.59 -4.93 113.70 112.27 2wp8 s SER 139 Ca 0.26 2.79 0.00 0.00 1.31 0.00 0.00 55.95 60.31 2wp8 s SER 139 Cb 0.21 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.81 2wp8 s SER 139 CO 0.06 -0.80 0.00 -0.90 0.41 0.00 0.00 173.24 172.02 2wp8 n ASP 140 N 2.28 0.00 0.27 2.44 5.68 -0.58 -5.01 116.55 121.63 2wp8 n ASP 140 Ca 0.07 -0.91 0.12 0.00 -0.50 0.00 0.00 54.79 53.57 2wp8 n ASP 140 Cb 0.39 0.00 0.77 0.00 -1.14 0.00 0.00 41.12 41.14 2wp8 n ASP 140 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2wp8 h ASP 141 N 0.00 0.00 0.01 -1.12 3.32 -2.01 -3.20 116.42 113.43 2wp8 h ASP 141 Ca 0.00 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.90 2wp8 h ASP 141 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 2wp8 h ASP 141 CO 0.00 0.00 -0.81 0.45 -1.72 0.00 0.00 179.24 177.16 2wp8 h HIS 142 N 0.00 0.05 -3.45 4.55 3.86 -1.96 -3.49 115.15 114.71 2wp8 h HIS 142 Ca 0.01 -0.04 -0.17 0.00 -1.16 0.00 0.00 60.37 59.01 2wp8 h HIS 142 Cb 0.04 -0.00 -0.24 0.00 1.06 0.00 0.00 27.41 28.27 2wp8 h HIS 142 CO 0.00 1.32 -0.53 0.21 0.86 0.00 0.00 177.93 179.79 2wp8 s LYS 143 N -2.32 0.30 -0.13 2.45 2.20 -1.21 -4.82 119.74 116.21 2wp8 s LYS 143 Ca -0.24 -0.07 -0.05 0.00 -0.36 0.00 0.00 55.97 55.25 2wp8 s LYS 143 Cb 0.02 0.13 0.06 0.00 -1.51 0.00 0.00 37.83 36.54 2wp8 s LYS 143 CO 0.65 -0.06 0.28 1.03 -0.36 0.00 0.00 175.35 176.89 2wp8 s ARG 144 N -0.57 0.20 -0.00 4.03 0.52 0.12 -1.52 118.95 121.73 2wp8 s ARG 144 Ca -0.07 0.70 0.06 0.00 -0.52 0.00 0.00 55.73 55.91 2wp8 s ARG 144 Cb -0.04 -0.03 -0.02 0.00 0.52 0.00 0.00 34.95 35.38 2wp8 s ARG 144 CO 0.01 -0.23 -0.19 -0.06 0.02 0.00 0.00 175.30 174.84 2wp8 s PHE 145 N 1.99 1.69 0.16 -0.53 0.08 -1.26 -1.43 117.98 118.68 2wp8 s PHE 145 Ca -0.03 -0.33 0.07 0.00 0.12 0.00 0.00 56.93 56.76 2wp8 s PHE 145 Cb -0.11 -1.07 -0.04 0.00 -0.57 0.00 0.00 43.02 41.23 2wp8 s PHE 145 CO -0.09 -0.00 -0.14 0.96 -0.10 0.00 0.00 175.22 175.84 2wp8 s ILE 146 N -0.52 1.53 -0.21 0.64 -4.36 0.25 -4.16 121.20 114.36 2wp8 s ILE 146 Ca 0.07 -1.97 -0.10 0.00 -0.26 0.00 0.00 60.65 58.40 2wp8 s ILE 146 Cb -0.08 -1.81 -0.05 0.00 1.25 0.00 0.00 42.46 41.78 2wp8 s ILE 146 CO -0.00 -0.51 0.12 -0.69 0.24 0.00 0.00 174.94 174.10 2wp8 s VAL 147 N -2.58 5.23 -0.22 8.37 1.01 -1.26 0.90 120.40 131.85 2wp8 s VAL 147 Ca 0.16 0.13 -0.04 0.00 0.00 0.00 0.00 61.98 62.22 2wp8 s VAL 147 Cb -0.03 -3.40 -0.01 0.00 0.00 0.00 0.00 36.38 32.94 2wp8 s VAL 147 CO 0.05 0.42 -0.02 0.12 0.00 0.00 0.00 175.10 175.66 2wp8 s PHE 148 N 0.59 2.98 -1.35 5.22 5.36 -0.61 -4.88 117.98 125.28 2wp8 s PHE 148 Ca 0.07 -0.78 -0.13 0.00 -0.96 0.00 0.00 56.93 55.13 2wp8 s PHE 148 Cb -0.12 -2.11 -0.04 0.00 -0.34 0.00 0.00 43.02 40.41 2wp8 s PHE 148 CO 0.00 -0.46 2.40 0.72 -1.46 0.00 0.00 175.22 176.43 2wp8 n HIS 149 N 4.68 2.72 0.00 10.12 8.25 -1.26 0.01 115.22 139.73 2wp8 n HIS 149 Ca -0.18 -2.74 0.21 0.00 -0.26 0.00 0.00 57.72 54.76 2wp8 n HIS 149 Cb 0.51 -2.32 0.71 0.00 1.12 0.00 0.00 29.99 30.01 2wp8 n HIS 149 CO 0.00 0.00 0.00 -2.95 0.64 0.00 0.00 176.34 174.03 2wp8 h ASN 150 N 6.00 0.00 1.45 0.41 -1.07 -1.92 -1.24 115.58 119.20 2wp8 h ASN 150 Ca 0.64 0.00 0.00 0.00 0.07 0.00 0.00 56.30 57.01 2wp8 h ASN 150 Cb 0.48 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.73 2wp8 h ASN 150 CO 1.82 0.00 -0.04 -0.62 0.07 0.00 0.00 177.43 178.66 2wp8 n GLU 151 N -4.20 0.27 -0.01 4.14 -0.58 -1.26 -2.84 120.64 116.16 2wp8 n GLU 151 Ca 0.10 0.21 0.10 0.00 -0.42 0.00 0.00 57.16 57.15 2wp8 n GLU 151 Cb 0.64 -1.80 -0.15 0.00 -0.57 0.00 0.00 31.44 29.56 2wp8 n GLU 151 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 2wp8 n PHE 152 N -2.27 0.00 -2.59 -0.32 3.72 -0.48 -4.74 117.46 110.78 2wp8 n PHE 152 Ca 0.05 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.09 2wp8 n PHE 152 Cb 0.43 -0.36 -0.05 0.00 -0.94 0.00 0.00 39.48 38.57 2wp8 n PHE 152 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2wp8 s SER 153 N -4.04 6.82 0.31 4.37 1.04 -1.18 -0.19 113.70 120.83 2wp8 s SER 153 Ca -0.04 1.98 0.00 0.00 0.48 0.00 0.00 55.95 58.38 2wp8 s SER 153 Cb 0.14 -2.58 0.51 0.00 0.10 0.00 0.00 66.02 64.19 2wp8 s SER 153 CO 0.87 -0.45 1.93 -0.33 0.98 0.00 0.00 173.24 176.24 2wp8 h GLU 154 N 2.48 0.86 -0.03 4.02 5.08 -1.66 -2.20 114.58 123.14 2wp8 h GLU 154 Ca -0.48 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 57.76 2wp8 h GLU 154 Cb 1.21 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 30.29 2wp8 h GLU 154 CO 0.62 0.65 -0.04 0.45 -1.00 0.00 0.00 179.01 179.69 2wp8 h HIS 155 N 0.87 0.10 0.00 4.33 3.86 -1.92 -3.36 115.15 119.02 2wp8 h HIS 155 Ca 0.22 -0.03 -0.16 0.00 -1.16 0.00 0.00 60.37 59.23 2wp8 h HIS 155 Cb 0.06 -0.02 -0.03 0.00 1.06 0.00 0.00 27.41 28.48 2wp8 h HIS 155 CO 0.01 0.60 -1.35 1.15 0.86 0.00 0.00 177.93 179.20 2wp8 h THR 156 N -0.44 0.52 -4.02 2.45 2.02 -1.78 -3.48 112.91 108.18 2wp8 h THR 156 Ca 0.00 -2.00 -0.54 0.00 0.77 0.00 0.00 66.41 64.64 2wp8 h THR 156 Cb 0.59 2.05 0.12 0.00 -1.74 0.00 0.00 68.15 69.18 2wp8 h THR 156 CO 0.01 0.29 0.65 0.12 0.37 0.00 0.00 175.52 176.96 2wp8 s PHE 157 N -2.93 2.40 -0.02 3.16 5.36 -0.83 -4.80 117.98 120.32 2wp8 s PHE 157 Ca -0.02 1.33 0.06 0.00 -0.96 0.00 0.00 56.93 57.34 2wp8 s PHE 157 Cb 0.09 -3.84 -0.02 0.00 -0.34 0.00 0.00 43.02 38.91 2wp8 s PHE 157 CO 0.81 -2.86 -0.21 0.08 -1.46 0.00 0.00 175.22 171.58 2wp8 s VAL 158 N -1.26 1.66 -0.38 3.12 1.01 -1.26 -5.02 120.40 118.27 2wp8 s VAL 158 Ca 0.66 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.77 2wp8 s VAL 158 Cb -0.42 -1.38 0.11 0.00 0.00 0.00 0.00 36.38 34.69 2wp8 s VAL 158 CO 0.51 0.47 0.12 -1.61 0.00 0.00 0.00 175.10 174.60 2wp8 s GLU 159 N -0.45 1.40 0.00 2.72 0.41 -1.26 -5.07 118.70 116.45 2wp8 s GLU 159 Ca 0.07 -1.88 0.00 0.00 -0.41 0.00 0.00 54.97 52.75 2wp8 s GLU 159 Cb -0.08 -2.87 0.00 0.00 -1.78 0.00 0.00 34.13 29.39 2wp8 s GLU 159 CO -0.00 -1.01 0.00 -1.71 -0.49 0.00 0.00 175.26 172.05 2wp8 n ASN 167 N 4.06 0.00 -4.10 -0.19 5.15 -1.26 -5.02 115.26 113.90 2wp8 n ASN 167 Ca 0.03 0.00 -0.41 0.00 -0.60 0.00 0.00 54.58 53.60 2wp8 n ASN 167 Cb 0.39 0.00 -0.01 0.00 -0.53 0.00 0.00 39.78 39.63 2wp8 n ASN 167 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2wp8 n ASP 168 N 0.00 5.54 -0.36 1.20 8.00 -1.26 -4.78 116.55 124.89 2wp8 n ASP 168 Ca 0.00 -3.24 0.31 0.00 0.71 0.00 0.00 54.79 52.57 2wp8 n ASP 168 Cb 0.00 -1.23 0.52 0.00 -0.02 0.00 0.00 41.12 40.39 2wp8 n ASP 168 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 2wp8 n ARG 169 N 1.93 -0.03 0.19 -1.24 0.63 -1.26 -2.92 116.66 113.96 2wp8 n ARG 169 Ca 0.25 0.97 0.14 0.00 -0.92 0.00 0.00 57.85 58.29 2wp8 n ARG 169 Cb 0.36 -1.90 0.56 0.00 0.45 0.00 0.00 32.46 31.93 2wp8 n ARG 169 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 2wp8 h ASN 170 N 0.00 0.00 0.03 6.15 2.35 -1.99 0.14 115.58 122.26 2wp8 h ASN 170 Ca 0.68 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 56.37 2wp8 h ASN 170 Cb 2.18 0.00 0.01 0.00 0.05 0.00 0.00 38.32 40.55 2wp8 h ASN 170 CO -0.37 0.00 -0.25 0.44 -1.65 0.00 0.00 177.43 175.61 2wp8 h ASP 171 N 0.00 0.17 -0.04 5.81 3.32 -1.96 -3.02 116.42 120.70 2wp8 h ASP 171 Ca 0.00 -0.90 0.01 0.00 0.02 0.00 0.00 57.03 56.16 2wp8 h ASP 171 Cb 0.47 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.96 2wp8 h ASP 171 CO 0.00 1.05 0.03 -0.09 -1.72 0.00 0.00 179.24 178.51 2wp8 h ARG 172 N -0.69 0.00 0.02 3.56 2.43 -1.63 0.04 114.38 118.12 2wp8 h ARG 172 Ca -0.04 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2wp8 h ARG 172 Cb 1.11 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 2wp8 h ARG 172 CO 0.05 0.00 -0.01 0.00 -1.51 0.00 0.00 179.97 178.50 2wp8 h ALA 173 N 1.98 -0.03 -0.25 2.80 0.00 -0.74 -2.06 119.26 120.96 2wp8 h ALA 173 Ca 0.02 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 2wp8 h ALA 173 Cb 0.07 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2wp8 h ALA 173 CO -0.00 -0.49 -0.27 0.82 0.00 0.00 0.00 179.25 179.31 2wp8 h ILE 174 N -0.09 1.31 -0.16 0.00 2.04 -1.29 -3.03 117.51 116.29 2wp8 h ILE 174 Ca -0.00 -1.44 0.05 0.00 1.00 0.00 0.00 64.86 64.46 2wp8 h ILE 174 Cb 0.08 1.68 -0.07 0.00 -0.74 0.00 0.00 36.82 37.77 2wp8 h ILE 174 CO 0.01 0.45 -0.34 0.03 0.00 0.00 0.00 178.15 178.30 2wp8 h ARG 175 N 0.33 -0.38 -0.32 2.37 3.08 -0.98 -2.11 114.38 116.37 2wp8 h ARG 175 Ca 0.04 0.03 0.09 0.00 0.07 0.00 0.00 59.98 60.21 2wp8 h ARG 175 Cb 0.84 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.96 2wp8 h ARG 175 CO 0.07 -0.25 0.23 -0.22 -1.07 0.00 0.00 179.97 178.72 2wp8 h LYS 176 N -0.40 0.00 -0.78 0.04 1.63 -1.34 0.54 116.57 116.26 2wp8 h LYS 176 Ca 0.10 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.88 2wp8 h LYS 176 Cb 0.56 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.15 2wp8 h LYS 176 CO -0.38 0.00 0.41 1.15 -3.45 0.00 0.00 179.45 177.18 2wp8 h THR 177 N 0.00 1.24 -0.20 1.00 2.02 -1.26 -2.05 112.91 113.65 2wp8 h THR 177 Ca 0.15 -0.62 -0.16 0.00 0.77 0.00 0.00 66.41 66.56 2wp8 h THR 177 Cb 0.61 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.22 2wp8 h THR 177 CO -0.00 0.27 -0.50 0.00 0.37 0.00 0.00 175.52 175.66 2wp8 h GLN 179 N 0.40 0.53 0.14 0.00 4.20 -1.42 0.45 115.11 119.40 2wp8 h GLN 179 Ca -0.01 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 2wp8 h GLN 179 Cb 1.11 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.77 2wp8 h GLN 179 CO 0.11 0.35 -0.07 2.35 -0.67 0.00 0.00 178.83 180.91 2wp8 h TRP 180 N 0.55 -0.17 -0.43 2.96 7.01 -1.22 0.99 115.95 125.64 2wp8 h TRP 180 Ca 0.17 -0.00 -0.03 0.00 2.11 0.00 0.00 58.89 61.14 2wp8 h TRP 180 Cb -0.01 0.06 -0.02 0.00 -2.10 0.00 0.00 29.16 27.08 2wp8 h TRP 180 CO -0.06 -0.03 0.16 1.88 -2.79 0.00 0.00 178.44 177.60 2wp8 h TYR 181 N -0.27 0.61 0.85 2.65 0.05 -1.04 1.06 116.97 120.89 2wp8 h TYR 181 Ca -0.02 -0.03 -0.04 0.00 0.05 0.00 0.00 58.73 58.69 2wp8 h TYR 181 Cb 0.21 -0.19 0.01 0.00 1.01 0.00 0.00 36.73 37.77 2wp8 h TYR 181 CO -0.04 0.49 -0.42 0.77 -1.05 0.00 0.00 178.16 177.91 2wp8 h SER 182 N 0.61 -1.00 0.05 3.88 0.02 0.18 -0.39 113.55 116.90 2wp8 h SER 182 Ca 0.15 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 61.16 2wp8 h SER 182 Cb 0.14 0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.90 2wp8 h SER 182 CO -0.01 -0.70 -0.27 -0.33 -1.14 0.00 0.00 176.83 174.38 2wp8 h GLU 183 N -1.16 -0.42 -0.99 3.45 3.07 -0.65 -0.94 114.58 116.93 2wp8 h GLU 183 Ca -0.12 0.03 0.17 0.00 -0.50 0.00 0.00 59.36 58.94 2wp8 h GLU 183 Cb 0.89 0.10 -0.10 0.00 -0.84 0.00 0.00 28.75 28.80 2wp8 h GLU 183 CO 0.19 -0.28 0.62 1.25 -1.40 0.00 0.00 179.01 179.38 2wp8 h HIS 184 N -0.44 1.04 0.00 4.33 6.17 0.12 -3.23 115.15 123.13 2wp8 h HIS 184 Ca 0.05 0.03 -0.19 0.00 0.71 0.00 0.00 60.37 60.97 2wp8 h HIS 184 Cb 0.50 -0.32 -0.04 0.00 2.52 0.00 0.00 27.41 30.07 2wp8 h HIS 184 CO -0.27 0.30 -2.12 1.28 0.71 0.00 0.00 177.93 177.83 2wp8 n LEU 185 N -4.69 0.09 -0.15 0.26 4.77 -0.16 -4.61 117.00 112.51 2wp8 n LEU 185 Ca 0.21 0.04 -0.01 0.00 -0.03 0.00 0.00 56.01 56.23 2wp8 n LEU 185 Cb 0.51 0.24 0.01 0.00 -2.33 0.00 0.00 43.42 41.85 2wp8 n LEU 185 CO 0.24 0.25 0.22 1.17 -1.33 0.00 0.00 177.39 177.95 2wp8 n LYS 186 N -2.56 -0.10 -0.32 3.23 4.81 -0.38 0.21 118.16 123.04 2wp8 n LYS 186 Ca -0.18 0.60 0.33 0.00 -0.87 0.00 0.00 58.31 58.19 2wp8 n LYS 186 Cb 0.88 -0.89 0.53 0.00 0.02 0.00 0.00 35.03 35.57 2wp8 n LYS 186 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 2wp8 h PRO 187 N 0.00 0.00 -0.28 1.64 0.11 -1.82 0.20 132.00 131.85 2wp8 h PRO 187 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 2wp8 h PRO 187 Cb 0.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.33 2wp8 h PRO 187 CO -0.38 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.07 2wp8 n TYR 188 N -3.41 0.93 -0.97 0.65 4.01 0.13 -4.96 117.16 113.55 2wp8 n TYR 188 Ca 0.28 -0.83 0.00 0.00 -0.16 0.00 0.00 57.90 57.18 2wp8 n TYR 188 Cb 1.62 -0.29 0.00 0.00 -0.31 0.00 0.00 39.34 40.36 2wp8 n TYR 188 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2wp8 n ASP 189 N -0.36 -4.77 -4.82 7.72 8.00 0.70 -4.98 116.55 118.04 2wp8 n ASP 189 Ca 0.20 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.33 2wp8 n ASP 189 Cb 0.85 -2.67 -0.06 0.00 -0.02 0.00 0.00 41.12 39.22 2wp8 n ASP 189 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2wp8 s ILE 190 N -1.29 5.09 0.09 0.53 1.01 -1.26 -4.27 121.20 121.10 2wp8 s ILE 190 Ca 0.00 0.79 0.08 0.00 0.00 0.00 0.00 60.65 61.52 2wp8 s ILE 190 Cb 0.00 -3.70 -0.03 0.00 0.01 0.00 0.00 42.46 38.74 2wp8 s ILE 190 CO 0.00 0.54 -0.20 0.21 0.00 0.00 0.00 174.94 175.49 2wp8 s ASN 191 N -0.77 2.45 -0.06 3.58 3.84 -0.18 -3.95 114.94 119.84 2wp8 s ASN 191 Ca 0.23 -0.66 -0.13 0.00 0.21 0.00 0.00 52.86 52.51 2wp8 s ASN 191 Cb -0.16 -0.14 -0.05 0.00 -0.55 0.00 0.00 41.25 40.35 2wp8 s ASN 191 CO 0.12 0.06 0.33 -0.69 -2.79 0.00 0.00 177.10 174.12 2wp8 s VAL 192 N -1.13 5.20 -0.05 -5.21 1.01 -1.26 -0.23 120.40 118.72 2wp8 s VAL 192 Ca 0.06 0.65 0.06 0.00 0.00 0.00 0.00 61.98 62.75 2wp8 s VAL 192 Cb -0.10 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.63 2wp8 s VAL 192 CO 0.04 0.54 -0.23 -0.69 0.00 0.00 0.00 175.10 174.76 2wp8 s VAL 193 N -0.70 2.23 -0.40 2.92 1.01 0.63 -4.30 120.40 121.80 2wp8 s VAL 193 Ca 0.21 -1.01 -0.06 0.00 0.00 0.00 0.00 61.98 61.11 2wp8 s VAL 193 Cb -0.15 -1.82 0.08 0.00 0.00 0.00 0.00 36.38 34.50 2wp8 s VAL 193 CO 0.09 0.57 0.21 -0.22 0.00 0.00 0.00 175.10 175.76 2wp8 s LEU 194 N -0.30 5.03 0.05 3.92 2.96 -0.52 -0.01 118.68 129.81 2wp8 s LEU 194 Ca 0.01 -1.64 -0.30 0.00 -0.22 0.00 0.00 54.13 51.98 2wp8 s LEU 194 Cb -0.13 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.61 2wp8 s LEU 194 CO 0.02 -0.51 1.01 -0.69 -1.32 0.00 0.00 176.35 174.87 2wp8 s VAL 195 N 1.32 4.59 0.00 1.68 1.01 -1.18 -0.88 120.40 126.94 2wp8 s VAL 195 Ca 0.03 1.95 0.00 0.00 0.00 0.00 0.00 61.98 63.97 2wp8 s VAL 195 Cb -0.23 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 31.90 2wp8 s VAL 195 CO -0.00 0.21 0.00 0.41 0.00 0.00 0.00 175.10 175.71 2wp8 n THR 196 N 3.49 0.00 0.00 3.92 -1.04 0.54 -2.96 114.28 118.24 2wp8 n THR 196 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 2wp8 n THR 196 Cb 0.50 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.01 2wp8 n THR 196 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2wp8 n ASN 197 N -0.04 0.28 -3.44 8.00 3.02 -1.26 -2.80 115.26 119.01 2wp8 n ASN 197 Ca 0.00 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.29 2wp8 n ASN 197 Cb 0.00 0.00 -0.11 0.00 -0.61 0.00 0.00 39.78 39.06 2wp8 n ASN 197 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2wp8 s ASP 198 N -4.39 2.58 0.63 6.41 -0.00 -1.26 -5.00 116.67 115.64 2wp8 s ASP 198 Ca 0.00 -1.97 0.00 0.00 -0.00 0.00 0.00 52.55 50.58 2wp8 s ASP 198 Cb 0.00 -0.16 0.00 0.00 -0.00 0.00 0.00 42.92 42.76 2wp8 s ASP 198 CO 0.00 -0.31 0.00 -1.84 -0.00 0.00 0.00 175.17 173.02 2wp8 n GLU 210 N 4.19 0.00 0.13 8.23 0.28 -1.26 -5.24 120.64 126.97 2wp8 n GLU 210 Ca 0.10 0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.98 2wp8 n GLU 210 Cb 0.39 0.00 -0.08 0.00 1.43 0.00 0.00 31.44 33.18 2wp8 n GLU 210 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 2wp8 h SER 211 N 0.00 -0.30 0.00 -1.84 0.87 -2.06 -3.50 113.55 106.72 2wp8 h SER 211 Ca 0.00 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 2wp8 h SER 211 Cb 0.00 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 2wp8 h SER 211 CO 0.00 0.09 0.00 0.59 -0.53 0.00 0.00 176.83 176.98 2wp8 n ASN 212 N -5.09 -0.54 -4.28 6.23 3.02 -1.26 -4.84 115.26 108.51 2wp8 n ASN 212 Ca -0.09 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.13 2wp8 n ASN 212 Cb 0.26 -1.12 -0.16 0.00 -0.61 0.00 0.00 39.78 38.15 2wp8 n ASN 212 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2wp8 s ILE 213 N -0.38 2.53 -0.01 2.41 1.01 -1.26 -5.05 121.20 120.44 2wp8 s ILE 213 Ca 0.00 -0.84 -0.30 0.00 0.00 0.00 0.00 60.65 59.51 2wp8 s ILE 213 Cb 0.00 -2.03 -0.07 0.00 0.01 0.00 0.00 42.46 40.38 2wp8 s ILE 213 CO 0.00 0.54 1.73 -0.63 0.00 0.00 0.00 174.94 176.57 2wp8 s ILE 214 N 0.49 3.36 -0.09 2.92 1.01 -1.26 -4.95 121.20 122.68 2wp8 s ILE 214 Ca -0.12 0.51 -0.01 0.00 0.00 0.00 0.00 60.65 61.03 2wp8 s ILE 214 Cb -0.16 -3.33 0.03 0.00 0.01 0.00 0.00 42.46 39.01 2wp8 s ILE 214 CO 0.05 -0.04 -0.01 -0.89 0.00 0.00 0.00 174.94 174.05 2wp8 s THR 215 N 3.90 0.53 0.05 2.92 2.01 -1.26 -1.44 115.64 122.35 2wp8 s THR 215 Ca 0.77 -0.05 0.05 0.00 0.31 0.00 0.00 61.69 62.77 2wp8 s THR 215 Cb -0.37 -0.70 -0.02 0.00 0.01 0.00 0.00 72.50 71.42 2wp8 s THR 215 CO 0.33 0.23 -0.13 -0.54 -0.69 0.00 0.00 174.62 173.81 2wp8 s LYS 216 N 1.90 0.82 1.20 4.92 -0.14 -0.06 -4.98 119.74 123.40 2wp8 s LYS 216 Ca 0.04 -0.82 -0.17 0.00 -1.36 0.00 0.00 55.97 53.66 2wp8 s LYS 216 Cb -0.13 -0.80 0.28 0.00 -1.68 0.00 0.00 37.83 35.50 2wp8 s LYS 216 CO -0.06 0.19 1.05 -1.54 -0.76 0.00 0.00 175.35 174.22 2wp8 s SER 217 N -1.41 0.87 0.01 2.83 1.04 -1.26 -0.34 113.70 115.44 2wp8 s SER 217 Ca -0.01 1.00 -0.25 0.00 0.48 0.00 0.00 55.95 57.17 2wp8 s SER 217 Cb -0.09 -1.51 -0.17 0.00 0.10 0.00 0.00 66.02 64.35 2wp8 s SER 217 CO 0.02 -4.20 1.26 0.25 0.98 0.00 0.00 173.24 171.55 2wp8 h LEU 218 N -2.62 -0.26 -0.85 2.42 5.85 -1.89 -0.03 115.31 117.93 2wp8 h LEU 218 Ca -0.51 -0.22 0.17 0.00 0.84 0.00 0.00 57.88 58.15 2wp8 h LEU 218 Cb 1.32 0.07 -0.16 0.00 0.37 0.00 0.00 40.66 42.26 2wp8 h LEU 218 CO 0.43 0.11 -0.21 0.58 -0.34 0.00 0.00 178.44 179.01 2wp8 h VAL 219 N -0.66 0.15 -0.48 1.05 2.07 -1.93 -1.40 116.25 115.05 2wp8 h VAL 219 Ca -0.03 -0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.36 2wp8 h VAL 219 Cb 0.47 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 2wp8 h VAL 219 CO 0.05 0.00 -0.19 1.56 0.02 0.00 0.00 177.57 179.01 2wp8 h GLN 220 N 0.00 0.96 -0.01 1.57 4.20 -1.89 -2.86 115.11 117.08 2wp8 h GLN 220 Ca 0.41 -0.39 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 2wp8 h GLN 220 Cb 0.63 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.37 2wp8 h GLN 220 CO -0.87 1.06 0.01 -0.92 -0.67 0.00 0.00 178.83 177.44 2wp8 h TYR 221 N 0.84 0.02 -0.79 2.96 3.20 -0.01 -3.15 116.97 120.03 2wp8 h TYR 221 Ca 0.11 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.04 2wp8 h TYR 221 Cb 0.76 -0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.96 2wp8 h TYR 221 CO 0.05 0.14 0.47 0.82 -1.64 0.00 0.00 178.16 178.00 2wp8 h ILE 222 N -0.11 1.02 -0.00 1.81 1.08 -1.32 -1.25 117.51 118.73 2wp8 h ILE 222 Ca 0.00 -0.30 0.00 0.00 -0.39 0.00 0.00 64.86 64.18 2wp8 h ILE 222 Cb 0.13 0.07 -0.00 0.00 -3.07 0.00 0.00 36.82 33.95 2wp8 h ILE 222 CO -0.00 0.16 0.06 -0.33 -0.69 0.00 0.00 178.15 177.34 2wp8 h GLU 223 N 0.87 0.00 -0.04 2.37 4.39 -1.47 -1.44 114.58 119.26 2wp8 h GLU 223 Ca 0.35 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.05 2wp8 h GLU 223 Cb 0.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 2wp8 h GLU 223 CO -0.18 0.00 0.00 1.28 -1.16 0.00 0.00 179.01 178.95 2wp8 n LEU 224 N -3.08 1.02 -4.85 1.33 4.77 -0.47 -4.86 117.00 110.86 2wp8 n LEU 224 Ca -0.03 -0.37 -0.33 0.00 -0.03 0.00 0.00 56.01 55.25 2wp8 n LEU 224 Cb 0.12 -0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.13 2wp8 n LEU 224 CO 0.19 0.19 0.35 -0.76 -1.33 0.00 0.00 177.39 176.02 2wp8 s LEU 225 N -1.85 4.17 0.07 2.23 1.43 -0.54 -4.72 118.68 119.46 2wp8 s LEU 225 Ca 0.38 1.19 -0.21 0.00 -1.03 0.00 0.00 54.13 54.46 2wp8 s LEU 225 Cb 0.19 -3.80 -0.08 0.00 0.03 0.00 0.00 46.19 42.53 2wp8 s LEU 225 CO 0.31 -0.10 1.34 1.55 0.23 0.00 0.00 176.35 179.68 2wp8 h PRO 226 N 2.67 -0.31 -1.67 1.29 0.13 -1.91 -1.71 132.00 130.49 2wp8 h PRO 226 Ca -0.48 0.02 -0.20 0.00 -0.87 0.00 0.00 66.00 64.47 2wp8 h PRO 226 Cb 1.18 0.07 -0.09 0.00 0.13 0.00 0.00 31.00 32.29 2wp8 h PRO 226 CO 0.66 -0.21 0.26 0.27 -0.23 0.00 0.00 178.00 178.75 2wp8 n ASN 227 N -4.33 5.91 -0.14 1.44 6.94 -1.26 -4.70 115.26 119.13 2wp8 n ASN 227 Ca -0.03 -2.80 -0.10 0.00 -0.02 0.00 0.00 54.58 51.63 2wp8 n ASN 227 Cb 0.22 -1.06 -0.05 0.00 -2.36 0.00 0.00 39.78 36.54 2wp8 n ASN 227 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2wp8 h ALA 228 N 1.32 -0.42 -0.21 -2.53 0.00 -1.52 -2.99 119.26 112.91 2wp8 h ALA 228 Ca 0.18 0.07 -0.46 0.00 0.00 0.00 0.00 54.91 54.70 2wp8 h ALA 228 Cb 0.98 0.91 -0.08 0.00 0.00 0.00 0.00 17.79 19.59 2wp8 h ALA 228 CO 0.47 -0.86 1.24 -0.25 0.00 0.00 0.00 179.25 179.84 2wp8 n ASP 229 N -5.41 6.79 -3.89 0.00 8.00 -1.26 -4.19 116.55 116.59 2wp8 n ASP 229 Ca -0.00 -2.76 -0.30 0.00 0.71 0.00 0.00 54.79 52.44 2wp8 n ASP 229 Cb 0.35 -1.41 -0.14 0.00 -0.02 0.00 0.00 41.12 39.91 2wp8 n ASP 229 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2wp8 s ASP 230 N 1.45 4.20 -0.46 -2.24 1.11 -1.13 -5.10 116.67 114.49 2wp8 s ASP 230 Ca 0.64 -2.72 0.03 0.00 0.18 0.00 0.00 52.55 50.68 2wp8 s ASP 230 Cb 0.28 -1.45 0.13 0.00 1.07 0.00 0.00 42.92 42.95 2wp8 s ASP 230 CO -0.08 -0.27 0.22 0.27 1.18 0.00 0.00 175.17 176.49 2wp8 s ILE 231 N 0.14 2.18 -1.24 0.77 -4.36 -1.26 -4.97 121.20 112.46 2wp8 s ILE 231 Ca 0.16 -2.91 -0.12 0.00 -0.26 0.00 0.00 60.65 57.51 2wp8 s ILE 231 Cb -0.24 -2.53 0.16 0.00 1.25 0.00 0.00 42.46 41.10 2wp8 s ILE 231 CO -0.02 -0.79 1.62 0.54 0.24 0.00 0.00 174.94 176.52 2wp8 n ARG 232 N 3.45 3.44 -3.86 0.37 5.12 -1.26 -5.00 116.66 118.92 2wp8 n ARG 232 Ca 0.05 -3.70 -0.35 0.00 -1.93 0.00 0.00 57.85 51.93 2wp8 n ARG 232 Cb 0.34 -3.02 -0.09 0.00 -1.16 0.00 0.00 32.46 28.53 2wp8 n ARG 232 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2wp8 s ASP 233 N 2.19 5.90 0.80 0.55 -1.08 -1.26 -4.82 116.67 118.95 2wp8 s ASP 233 Ca 0.42 0.15 -0.13 0.00 -0.52 0.00 0.00 52.55 52.47 2wp8 s ASP 233 Cb 0.02 -2.03 -0.03 0.00 -1.46 0.00 0.00 42.92 39.42 2wp8 s ASP 233 CO 0.01 0.17 -0.49 -1.54 0.52 0.00 0.00 175.17 173.84 2wp8 n SER 234 N 3.58 -2.54 0.00 -0.34 3.41 -1.26 -5.12 113.62 111.36 2wp8 n SER 234 Ca -0.16 -0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.37 2wp8 n SER 234 Cb 0.52 -0.57 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 2wp8 n SER 234 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2wp8 n PHE 253 N -3.50 0.00 -3.65 7.33 7.35 -1.26 -5.07 117.46 118.66 2wp8 n PHE 253 Ca 0.00 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.57 2wp8 n PHE 253 Cb 0.36 0.00 -0.08 0.00 0.35 0.00 0.00 39.48 40.12 2wp8 n PHE 253 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 2wp8 s THR 254 N -0.66 -0.00 0.49 -2.13 2.01 -1.26 -4.76 115.64 109.33 2wp8 s THR 254 Ca 0.00 0.00 -0.13 0.00 0.31 0.00 0.00 61.69 61.88 2wp8 s THR 254 Cb 0.00 -0.93 -0.06 0.00 0.01 0.00 0.00 72.50 71.51 2wp8 s THR 254 CO 0.00 0.00 0.90 -0.36 -0.69 0.00 0.00 174.62 174.47 2wp8 s PHE 255 N 0.63 3.49 0.05 4.92 0.40 -0.50 -5.00 117.98 121.97 2wp8 s PHE 255 Ca -0.02 1.24 -0.30 0.00 -0.60 0.00 0.00 56.93 57.25 2wp8 s PHE 255 Cb -0.05 -2.62 -0.05 0.00 0.51 0.00 0.00 43.02 40.81 2wp8 s PHE 255 CO -0.03 -0.31 1.18 -2.14 0.70 0.00 0.00 175.22 174.62 2wp8 s PRO 256 N -4.19 4.44 0.48 0.24 0.02 -1.26 -4.84 135.00 129.88 2wp8 s PRO 256 Ca 0.55 1.74 -0.22 0.00 0.02 0.00 0.00 61.00 63.08 2wp8 s PRO 256 Cb -0.10 -3.37 -0.09 0.00 0.02 0.00 0.00 34.50 30.96 2wp8 s PRO 256 CO 0.35 -0.26 0.97 0.39 -0.33 0.00 0.00 177.00 178.13 2wp8 n GLU 257 N 4.03 1.19 -1.47 5.54 -0.58 -1.26 -4.96 120.64 123.13 2wp8 n GLU 257 Ca 0.09 0.44 -0.32 0.00 -0.42 0.00 0.00 57.16 56.94 2wp8 n GLU 257 Cb 0.47 -2.06 0.07 0.00 -0.57 0.00 0.00 31.44 29.35 2wp8 n GLU 257 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 2wp8 s TYR 258 N -1.37 2.56 0.74 -0.32 1.51 -1.26 -5.00 117.35 114.21 2wp8 s TYR 258 Ca 0.67 1.56 -0.12 0.00 -1.01 0.00 0.00 57.07 58.17 2wp8 s TYR 258 Cb -0.51 -3.12 0.04 0.00 -0.11 0.00 0.00 41.96 38.26 2wp8 s TYR 258 CO 0.54 -1.80 1.10 0.71 -1.11 0.00 0.00 175.55 174.99 2wp8 s TYR 259 N -2.62 2.54 0.81 2.71 1.51 -0.22 -5.01 117.35 117.08 2wp8 s TYR 259 Ca 0.64 1.57 -0.11 0.00 -1.01 0.00 0.00 57.07 58.16 2wp8 s TYR 259 Cb -0.19 -3.10 0.08 0.00 -0.11 0.00 0.00 41.96 38.64 2wp8 s TYR 259 CO 0.49 -1.83 1.10 -1.54 -1.11 0.00 0.00 175.55 172.67 2wp8 s SER 260 N -3.10 4.11 0.08 2.29 1.04 -1.26 -4.86 113.70 112.00 2wp8 s SER 260 Ca 0.63 1.86 -0.17 0.00 0.48 0.00 0.00 55.95 58.75 2wp8 s SER 260 Cb -0.19 -2.50 -0.05 0.00 0.10 0.00 0.00 66.02 63.39 2wp8 s SER 260 CO 0.52 -2.29 1.28 0.74 0.98 0.00 0.00 173.24 174.47 2wp8 h THR 261 N -1.31 0.00 -0.92 2.02 2.02 -1.99 -0.74 112.91 111.99 2wp8 h THR 261 Ca -0.44 0.00 0.11 0.00 0.77 0.00 0.00 66.41 66.85 2wp8 h THR 261 Cb 1.24 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.58 2wp8 h THR 261 CO 0.50 0.00 0.59 0.00 0.37 0.00 0.00 175.52 176.98 2wp8 h ALA 262 N -0.41 1.64 0.19 6.16 0.00 -1.99 -0.33 119.26 124.53 2wp8 h ALA 262 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2wp8 h ALA 262 Cb 0.26 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2wp8 h ALA 262 CO -0.41 0.15 -0.09 -0.09 0.00 0.00 0.00 179.25 178.81 2wp8 h ARG 263 N 0.88 -0.25 -0.31 0.00 2.43 -1.89 -0.58 114.38 114.67 2wp8 h ARG 263 Ca 0.44 0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.69 2wp8 h ARG 263 Cb 0.48 0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 30.03 2wp8 h ARG 263 CO -0.20 -0.01 -0.08 0.28 -1.51 0.00 0.00 179.97 178.45 2wp8 h VAL 264 N -0.46 0.69 -0.79 0.20 2.07 0.21 -0.09 116.25 118.09 2wp8 h VAL 264 Ca -0.03 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 2wp8 h VAL 264 Cb 0.35 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 2wp8 h VAL 264 CO 0.04 0.00 0.49 0.24 0.02 0.00 0.00 177.57 178.36 2wp8 h MET 265 N -0.00 1.06 0.27 1.57 2.86 -1.10 0.29 114.93 119.88 2wp8 h MET 265 Ca 0.15 -0.08 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 2wp8 h MET 265 Cb 0.23 -0.23 -0.04 0.00 0.06 0.00 0.00 31.60 31.62 2wp8 h MET 265 CO -0.32 0.73 -0.52 0.78 1.06 0.00 0.00 176.91 178.64 2wp8 h GLY 266 N 1.07 -1.21 1.21 8.32 0.00 -0.30 -1.07 103.07 111.09 2wp8 h GLY 266 Ca 0.28 0.63 0.09 0.00 0.00 0.00 0.00 47.33 48.33 2wp8 h GLY 266 CO -0.06 -0.31 0.32 -1.33 0.00 0.00 0.00 176.54 175.17 2wp8 h GLY 267 N -0.85 0.34 0.62 4.60 0.00 -0.06 -1.69 103.07 106.03 2wp8 h GLY 267 Ca -0.03 -0.10 -0.03 0.00 0.00 0.00 0.00 47.33 47.17 2wp8 h GLY 267 CO -0.20 0.07 -0.06 1.41 0.00 0.00 0.00 176.54 177.76 2wp8 h LEU 268 N 0.25 0.16 -0.90 3.11 3.38 -0.13 -0.39 115.31 120.80 2wp8 h LEU 268 Ca 0.22 -0.48 0.07 0.00 0.09 0.00 0.00 57.88 57.78 2wp8 h LEU 268 Cb 0.53 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.17 2wp8 h LEU 268 CO -0.04 0.61 0.56 0.50 0.09 0.00 0.00 178.44 180.15 2wp8 h LYS 269 N -0.28 0.98 -0.02 1.13 3.64 -0.28 -1.14 116.57 120.61 2wp8 h LYS 269 Ca 0.01 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2wp8 h LYS 269 Cb 0.56 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2wp8 h LYS 269 CO 0.02 0.65 0.00 0.09 -2.27 0.00 0.00 179.45 177.93 2wp8 n ASN 270 N -4.60 0.16 0.00 4.20 3.02 -0.98 -4.89 115.26 112.17 2wp8 n ASN 270 Ca 0.13 -1.45 0.00 0.00 -0.03 0.00 0.00 54.58 53.23 2wp8 n ASN 270 Cb 0.19 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.35 2wp8 n ASN 270 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wp8 n GLY 271 N 0.82 0.39 0.05 7.41 0.00 -0.43 -4.87 105.19 108.56 2wp8 n GLY 271 Ca 0.14 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.30 2wp8 n GLY 271 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2wp8 n VAL 272 N -2.12 0.00 -4.17 1.61 0.31 -0.32 -4.82 118.33 108.82 2wp8 n VAL 272 Ca 0.00 -0.03 -0.17 0.00 -0.01 0.00 0.00 64.34 64.13 2wp8 n VAL 272 Cb 0.07 -0.28 -0.12 0.00 -0.91 0.00 0.00 33.84 32.61 2wp8 n VAL 272 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2wp8 s LEU 273 N -2.58 2.31 -0.03 7.52 1.43 -0.31 -4.64 118.68 122.38 2wp8 s LEU 273 Ca 0.27 -0.67 0.01 0.00 -1.03 0.00 0.00 54.13 52.71 2wp8 s LEU 273 Cb 0.20 -0.45 0.01 0.00 0.03 0.00 0.00 46.19 45.98 2wp8 s LEU 273 CO 0.48 -0.13 -0.04 -0.31 0.23 0.00 0.00 176.35 176.59 2wp8 s TYR 274 N -1.58 0.61 0.29 0.29 1.51 -0.78 -4.54 117.35 113.14 2wp8 s TYR 274 Ca -0.00 -0.14 -0.27 0.00 -1.01 0.00 0.00 57.07 55.65 2wp8 s TYR 274 Cb -0.08 -0.52 -0.09 0.00 -0.11 0.00 0.00 41.96 41.15 2wp8 s TYR 274 CO 0.02 -0.12 0.93 -0.65 -1.11 0.00 0.00 175.55 174.62 2wp8 s GLN 275 N 0.59 4.66 0.03 -0.62 -0.21 -1.26 -1.24 119.66 121.61 2wp8 s GLN 275 Ca -0.07 1.36 -0.28 0.00 0.02 0.00 0.00 55.36 56.38 2wp8 s GLN 275 Cb -0.11 -2.97 0.09 0.00 1.00 0.00 0.00 33.01 31.02 2wp8 s GLN 275 CO -0.00 0.37 0.95 0.20 -2.12 0.00 0.00 175.29 174.69 2wp8 s GLY 276 N -1.46 -0.38 -0.30 3.09 0.00 -0.42 -4.96 107.32 102.89 2wp8 s GLY 276 Ca 0.46 0.77 -0.07 0.00 0.00 0.00 0.00 44.72 45.88 2wp8 s GLY 276 CO 0.26 0.24 0.09 -1.31 0.00 0.00 0.00 173.10 172.38 2wp8 s ASN 277 N -2.63 5.17 -0.37 1.64 0.01 -1.26 0.13 114.94 117.64 2wp8 s ASN 277 Ca 0.08 -0.73 -0.29 0.00 -0.71 0.00 0.00 52.86 51.21 2wp8 s ASN 277 Cb -0.01 -1.89 0.01 0.00 0.41 0.00 0.00 41.25 39.78 2wp8 s ASN 277 CO -0.05 -0.20 1.23 -0.51 -1.51 0.00 0.00 177.10 176.05 2wp8 s ILE 278 N 1.50 4.20 -0.28 0.60 2.07 -1.06 -4.37 121.20 123.86 2wp8 s ILE 278 Ca 0.02 1.31 -0.15 0.00 -1.41 0.00 0.00 60.65 60.43 2wp8 s ILE 278 Cb -0.17 -4.33 -0.03 0.00 0.13 0.00 0.00 42.46 38.05 2wp8 s ILE 278 CO 0.03 -0.65 0.38 -1.58 -1.91 0.00 0.00 174.94 171.20 2wp8 s GLN 279 N 4.25 3.98 0.22 3.50 2.00 -0.20 -1.40 119.66 132.01 2wp8 s GLN 279 Ca 0.53 0.01 -0.30 0.00 -2.00 0.00 0.00 55.36 53.60 2wp8 s GLN 279 Cb -0.13 -3.67 -0.08 0.00 0.80 0.00 0.00 33.01 29.93 2wp8 s GLN 279 CO 0.25 -0.30 1.07 0.42 -0.50 0.00 0.00 175.29 176.23 2wp8 s ILE 280 N 2.08 3.80 0.67 -2.34 -1.09 -1.26 -0.19 121.20 122.86 2wp8 s ILE 280 Ca 0.15 1.67 -0.17 0.00 -2.23 0.00 0.00 60.65 60.07 2wp8 s ILE 280 Cb -0.16 -4.06 0.00 0.00 -1.58 0.00 0.00 42.46 36.66 2wp8 s ILE 280 CO 0.10 0.34 1.25 -0.94 -1.23 0.00 0.00 174.94 174.47 2wp8 s SER 281 N -0.53 4.55 0.00 3.58 1.04 0.15 -4.90 113.70 117.59 2wp8 s SER 281 Ca 0.46 2.50 0.31 0.00 0.48 0.00 0.00 55.95 59.71 2wp8 s SER 281 Cb -0.29 -2.61 1.71 0.00 0.10 0.00 0.00 66.02 64.93 2wp8 s SER 281 CO 0.36 -2.03 2.12 -1.84 0.98 0.00 0.00 173.24 172.83 2wp8 n GLU 282 N -2.12 1.04 0.00 4.02 0.28 -1.26 -3.64 120.64 118.95 2wp8 n GLU 282 Ca 0.15 -0.16 0.00 0.00 -0.16 0.00 0.00 57.16 56.99 2wp8 n GLU 282 Cb 0.49 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.86 2wp8 n GLU 282 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2wp8 n TYR 283 N -0.84 0.00 -3.66 -1.84 4.02 -1.26 -4.92 117.16 108.65 2wp8 n TYR 283 Ca 0.22 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.83 2wp8 n TYR 283 Cb 0.17 0.00 -0.16 0.00 -0.02 0.00 0.00 39.34 39.33 2wp8 n TYR 283 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 2wp8 s ASN 284 N -0.06 3.14 0.30 7.72 3.84 -1.24 0.16 114.94 128.80 2wp8 s ASN 284 Ca 0.00 -1.04 0.25 0.00 0.21 0.00 0.00 52.86 52.28 2wp8 s ASN 284 Cb 0.00 -0.50 1.01 0.00 -0.55 0.00 0.00 41.25 41.21 2wp8 s ASN 284 CO 0.00 -0.37 1.75 2.19 -2.79 0.00 0.00 177.10 177.88 2wp8 h PHE 285 N 8.30 0.00 -0.60 0.43 -5.15 -1.67 -2.45 116.94 115.81 2wp8 h PHE 285 Ca -0.16 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.61 2wp8 h PHE 285 Cb 1.08 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.25 2wp8 h PHE 285 CO 0.27 0.00 0.00 1.28 -2.00 0.00 0.00 178.31 177.86 2wp8 n LEU 286 N -2.36 3.60 -4.16 2.10 4.77 -1.26 -4.83 117.00 114.85 2wp8 n LEU 286 Ca 0.02 -1.81 -0.29 0.00 -0.03 0.00 0.00 56.01 53.91 2wp8 n LEU 286 Cb 0.26 -0.46 -0.17 0.00 -2.33 0.00 0.00 43.42 40.73 2wp8 n LEU 286 CO 0.22 0.78 -0.52 -0.70 -1.33 0.00 0.00 177.39 175.83 2wp8 s GLU 287 N -1.40 2.29 0.05 3.23 2.12 -0.92 -1.12 118.70 122.95 2wp8 s GLU 287 Ca 0.42 -0.70 -0.01 0.00 0.36 0.00 0.00 54.97 55.04 2wp8 s GLU 287 Cb 0.24 -1.86 -0.04 0.00 0.26 0.00 0.00 34.13 32.73 2wp8 s GLU 287 CO 0.26 0.20 -0.03 0.20 -0.54 0.00 0.00 175.26 175.35 2wp8 s GLY 288 N 0.23 0.50 0.17 -1.50 0.00 -0.23 -0.68 107.32 105.81 2wp8 s GLY 288 Ca -0.11 -1.22 0.05 0.00 0.00 0.00 0.00 44.72 43.44 2wp8 s GLY 288 CO 0.05 -1.33 -0.11 -1.35 0.00 0.00 0.00 173.10 170.36 2wp8 s SER 289 N -2.93 1.99 -0.04 1.64 1.04 0.74 0.57 113.70 116.71 2wp8 s SER 289 Ca 0.08 -1.03 -0.01 0.00 0.48 0.00 0.00 55.95 55.46 2wp8 s SER 289 Cb 0.08 -0.04 0.03 0.00 0.10 0.00 0.00 66.02 66.19 2wp8 s SER 289 CO -0.09 -0.30 0.08 -0.69 0.98 0.00 0.00 173.24 173.21 2wp8 s VAL 290 N -3.24 -0.10 0.15 5.02 1.01 -0.30 -1.03 120.40 121.91 2wp8 s VAL 290 Ca 0.19 0.29 -0.30 0.00 0.00 0.00 0.00 61.98 62.16 2wp8 s VAL 290 Cb 0.02 -0.16 -0.07 0.00 0.00 0.00 0.00 36.38 36.17 2wp8 s VAL 290 CO 0.03 0.12 1.05 -0.55 0.00 0.00 0.00 175.10 175.74 2wp8 s SER 291 N 1.55 7.36 -0.00 3.32 0.15 -1.26 -1.64 113.70 123.17 2wp8 s SER 291 Ca -0.04 1.98 0.00 0.00 0.70 0.00 0.00 55.95 58.59 2wp8 s SER 291 Cb -0.12 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.59 2wp8 s SER 291 CO -0.04 -0.16 0.00 -0.76 1.20 0.00 0.00 173.24 173.48 2wp8 s LEU 292 N -0.21 1.91 0.12 3.45 1.43 -1.26 -4.75 118.68 119.37 2wp8 s LEU 292 Ca 0.49 -0.00 -0.19 0.00 -1.03 0.00 0.00 54.13 53.40 2wp8 s LEU 292 Cb -0.27 -0.02 -0.05 0.00 0.03 0.00 0.00 46.19 45.88 2wp8 s LEU 292 CO 0.33 -0.01 1.75 -0.65 0.23 0.00 0.00 176.35 177.99 2wp8 h PRO 293 N 6.25 0.35 -1.19 1.29 0.11 -1.96 -2.53 132.00 134.32 2wp8 h PRO 293 Ca -0.26 -0.03 0.36 0.00 0.11 0.00 0.00 66.00 66.17 2wp8 h PRO 293 Cb 1.20 -0.07 -0.11 0.00 0.11 0.00 0.00 31.00 32.13 2wp8 h PRO 293 CO 0.51 0.28 0.77 -0.09 -0.21 0.00 0.00 178.00 179.25 2wp8 h ARG 294 N 0.32 0.21 -5.88 1.05 2.43 -2.00 -3.41 114.38 107.10 2wp8 h ARG 294 Ca 0.09 -0.01 -0.67 0.00 -0.81 0.00 0.00 59.98 58.58 2wp8 h ARG 294 Cb 0.02 -0.05 -0.17 0.00 -0.42 0.00 0.00 29.97 29.35 2wp8 h ARG 294 CO -0.02 0.14 -0.65 -0.06 -1.51 0.00 0.00 179.97 177.88 2wp8 s PHE 295 N -5.37 3.08 0.00 2.20 0.40 -0.95 -5.04 117.98 112.30 2wp8 s PHE 295 Ca -0.08 0.06 -0.24 0.00 -0.60 0.00 0.00 56.93 56.06 2wp8 s PHE 295 Cb 0.27 -1.81 -0.18 0.00 0.51 0.00 0.00 43.02 41.81 2wp8 s PHE 295 CO 0.81 0.33 1.33 0.66 0.70 0.00 0.00 175.22 179.05 2wp8 h SER 296 N 5.51 0.08 -2.68 1.36 4.64 -1.82 -3.43 113.55 117.21 2wp8 h SER 296 Ca -0.46 -0.44 -0.47 0.00 -0.47 0.00 0.00 61.79 59.95 2wp8 h SER 296 Cb 1.19 -0.02 0.01 0.00 -0.31 0.00 0.00 62.40 63.26 2wp8 h SER 296 CO 0.56 0.50 -0.21 -0.54 -0.87 0.00 0.00 176.83 176.28 2wp8 s LYS 297 N -4.45 3.39 0.28 4.77 1.02 -1.26 -4.93 119.74 118.57 2wp8 s LYS 297 Ca -0.15 -0.44 -0.30 0.00 0.02 0.00 0.00 55.97 55.10 2wp8 s LYS 297 Cb 0.03 -2.68 -0.11 0.00 -0.52 0.00 0.00 37.83 34.55 2wp8 s LYS 297 CO 0.69 0.10 1.55 -2.14 -0.92 0.00 0.00 175.35 174.63 2wp8 s PRO 298 N -4.32 4.16 -0.14 -1.68 0.02 -1.26 -4.83 135.00 126.96 2wp8 s PRO 298 Ca 0.41 2.50 -0.29 0.00 0.02 0.00 0.00 61.00 63.64 2wp8 s PRO 298 Cb -0.10 -3.05 -0.01 0.00 0.02 0.00 0.00 34.50 31.37 2wp8 s PRO 298 CO 0.35 -0.57 1.00 0.54 -0.33 0.00 0.00 177.00 177.99 2wp8 s VAL 299 N 0.01 4.77 0.46 3.83 0.11 -0.65 -4.80 120.40 124.14 2wp8 s VAL 299 Ca 0.62 2.01 -0.20 0.00 -2.93 0.00 0.00 61.98 61.48 2wp8 s VAL 299 Cb -0.46 -4.30 -0.09 0.00 -1.53 0.00 0.00 36.38 30.00 2wp8 s VAL 299 CO 0.46 -0.04 0.99 -0.76 -3.33 0.00 0.00 175.10 172.42 2wp8 s LEU 300 N 2.32 3.86 -0.17 2.54 1.43 -0.22 -1.15 118.68 127.29 2wp8 s LEU 300 Ca 0.46 1.77 -0.02 0.00 -1.03 0.00 0.00 54.13 55.31 2wp8 s LEU 300 Cb -0.17 -4.54 0.05 0.00 0.03 0.00 0.00 46.19 41.56 2wp8 s LEU 300 CO 0.14 -0.57 0.03 -0.63 0.23 0.00 0.00 176.35 175.55 2wp8 s ILE 301 N -2.15 0.54 -0.13 -0.59 1.01 0.19 -0.16 121.20 119.91 2wp8 s ILE 301 Ca 0.64 -0.47 0.01 0.00 0.00 0.00 0.00 60.65 60.84 2wp8 s ILE 301 Cb -0.12 -0.98 0.02 0.00 0.01 0.00 0.00 42.46 41.39 2wp8 s ILE 301 CO 0.18 -0.12 -0.16 -0.69 0.00 0.00 0.00 174.94 174.14 2wp8 s VAL 302 N 1.86 1.64 0.00 2.92 1.01 -1.26 -1.07 120.40 125.51 2wp8 s VAL 302 Ca -0.00 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.27 2wp8 s VAL 302 Cb -0.16 -1.50 0.00 0.00 0.00 0.00 0.00 36.38 34.72 2wp8 s VAL 302 CO -0.08 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.10 2wp8 n GLY 303 N 4.35 2.24 0.34 4.51 0.00 -0.28 -4.39 105.19 111.96 2wp8 n GLY 303 Ca -0.19 -1.87 -0.01 0.00 0.00 0.00 0.00 46.02 43.95 2wp8 n GLY 303 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2wp8 h GLN 304 N 0.00 -0.06 0.02 1.61 4.20 -1.97 -1.33 115.11 117.57 2wp8 h GLN 304 Ca 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 2wp8 h GLN 304 Cb 0.00 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.79 2wp8 h GLN 304 CO 0.00 -0.04 -0.01 0.87 -0.67 0.00 0.00 178.83 178.98 2wp8 h LYS 305 N -0.07 -0.02 -0.19 1.46 1.79 -1.98 -2.01 116.57 115.55 2wp8 h LYS 305 Ca 0.32 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.67 2wp8 h LYS 305 Cb 0.58 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.22 2wp8 h LYS 305 CO -0.82 0.41 -0.40 -0.91 -1.08 0.00 0.00 179.45 176.65 2wp8 h ASN 306 N -0.46 0.45 0.28 0.86 2.35 -1.75 -0.50 115.58 116.81 2wp8 h ASN 306 Ca -0.00 -0.19 -0.02 0.00 -0.55 0.00 0.00 56.30 55.54 2wp8 h ASN 306 Cb 0.44 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.68 2wp8 h ASN 306 CO 0.00 0.81 -0.07 -0.07 -1.65 0.00 0.00 177.43 176.45 2wp8 h LEU 307 N 0.36 0.00 -3.87 1.61 3.38 -1.18 0.32 115.31 115.92 2wp8 h LEU 307 Ca 0.03 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.48 2wp8 h LEU 307 Cb 0.86 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 2wp8 h LEU 307 CO 0.07 0.07 -0.91 -3.20 0.09 0.00 0.00 178.44 174.56 2wp8 n ASN 308 N -3.59 -3.69 -0.47 -0.43 5.15 -0.20 -1.63 115.26 110.41 2wp8 n ASN 308 Ca -0.02 -1.13 -0.06 0.00 -0.60 0.00 0.00 54.58 52.77 2wp8 n ASN 308 Cb 0.19 -1.39 -0.03 0.00 -0.53 0.00 0.00 39.78 38.02 2wp8 n ASN 308 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2wp8 n ARG 309 N -4.33 -1.65 -1.28 1.20 3.00 -1.26 -4.97 116.66 107.38 2wp8 n ARG 309 Ca -0.12 0.68 -0.33 0.00 -0.01 0.00 0.00 57.85 58.07 2wp8 n ARG 309 Cb 0.51 -5.02 0.10 0.00 0.00 0.00 0.00 32.46 28.06 2wp8 n ARG 309 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2wp8 s ALA 310 N -1.62 2.03 0.04 7.54 0.00 -0.64 -5.05 121.76 124.06 2wp8 s ALA 310 Ca 0.00 0.69 0.07 0.00 0.00 0.00 0.00 51.96 52.72 2wp8 s ALA 310 Cb 0.00 -3.42 -0.03 0.00 0.00 0.00 0.00 23.12 19.67 2wp8 s ALA 310 CO 0.00 -1.99 -0.16 -0.06 0.00 0.00 0.00 175.76 173.55 2wp8 s PHE 311 N -2.31 2.62 0.15 0.00 0.40 -1.26 -4.98 117.98 112.60 2wp8 s PHE 311 Ca 0.70 -0.22 -0.33 0.00 -0.60 0.00 0.00 56.93 56.48 2wp8 s PHE 311 Cb -0.25 -1.48 -0.16 0.00 0.51 0.00 0.00 43.02 41.64 2wp8 s PHE 311 CO 0.49 0.29 1.10 -1.71 0.70 0.00 0.00 175.22 176.09 2wp8 n ASN 312 N 1.46 0.94 0.00 1.36 5.15 -1.26 -0.62 115.26 122.28 2wp8 n ASN 312 Ca -0.16 1.14 0.00 0.00 -0.60 0.00 0.00 54.58 54.96 2wp8 n ASN 312 Cb 0.52 -1.15 0.00 0.00 -0.53 0.00 0.00 39.78 38.62 2wp8 n ASN 312 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2wp8 n GLY 313 N 1.97 2.97 3.74 8.20 0.00 -0.49 -4.83 105.19 116.75 2wp8 n GLY 313 Ca 0.16 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 2wp8 n GLY 313 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wp8 n ASP 314 N 0.23 3.08 -4.73 1.61 8.00 0.21 -4.60 116.55 120.35 2wp8 n ASP 314 Ca 0.00 1.13 -0.42 0.00 0.71 0.00 0.00 54.79 56.21 2wp8 n ASP 314 Cb 0.00 -1.57 -0.03 0.00 -0.02 0.00 0.00 41.12 39.50 2wp8 n ASP 314 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2wp8 s GLN 315 N -2.31 4.46 0.04 -1.24 -0.21 -0.00 -2.56 119.66 117.83 2wp8 s GLN 315 Ca 0.60 1.84 0.02 0.00 0.02 0.00 0.00 55.36 57.84 2wp8 s GLN 315 Cb -0.48 -3.29 -0.02 0.00 1.00 0.00 0.00 33.01 30.22 2wp8 s GLN 315 CO 0.58 -0.18 -0.07 0.08 -2.12 0.00 0.00 175.29 173.59 2wp8 s VAL 316 N 0.51 0.47 -0.16 1.09 1.01 0.12 -1.41 120.40 122.03 2wp8 s VAL 316 Ca 0.56 -1.09 -0.08 0.00 0.00 0.00 0.00 61.98 61.37 2wp8 s VAL 316 Cb -0.31 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.43 2wp8 s VAL 316 CO 0.33 -0.42 0.13 -0.63 0.00 0.00 0.00 175.10 174.50 2wp8 s ILE 317 N -1.49 5.38 0.33 2.22 -1.09 -0.04 -1.30 121.20 125.21 2wp8 s ILE 317 Ca -0.10 0.17 0.10 0.00 -2.23 0.00 0.00 60.65 58.59 2wp8 s ILE 317 Cb -0.09 -3.40 -0.06 0.00 -1.58 0.00 0.00 42.46 37.33 2wp8 s ILE 317 CO -0.00 0.52 -0.12 0.68 -1.23 0.00 0.00 174.94 174.80 2wp8 s VAL 318 N -0.27 2.35 0.01 2.92 -7.23 -0.37 -1.67 120.40 116.14 2wp8 s VAL 318 Ca 0.11 -2.24 0.06 0.00 -1.81 0.00 0.00 61.98 58.09 2wp8 s VAL 318 Cb -0.12 -2.56 -0.02 0.00 0.56 0.00 0.00 36.38 34.24 2wp8 s VAL 318 CO 0.01 -0.26 -0.17 -0.70 -0.31 0.00 0.00 175.10 173.67 2wp8 s GLU 319 N -3.59 1.29 0.32 4.82 2.12 -0.31 -1.87 118.70 121.48 2wp8 s GLU 319 Ca 0.32 -0.72 -0.27 0.00 0.36 0.00 0.00 54.97 54.66 2wp8 s GLU 319 Cb 0.00 -1.30 -0.09 0.00 0.26 0.00 0.00 34.13 33.00 2wp8 s GLU 319 CO 0.16 0.34 1.01 -0.51 -0.54 0.00 0.00 175.26 175.72 2wp8 s LEU 320 N -0.74 4.40 0.48 2.70 1.43 -1.26 -0.59 118.68 125.10 2wp8 s LEU 320 Ca 0.06 2.01 -0.08 0.00 -1.03 0.00 0.00 54.13 55.09 2wp8 s LEU 320 Cb -0.07 -3.89 -0.05 0.00 0.03 0.00 0.00 46.19 42.21 2wp8 s LEU 320 CO 0.00 -0.15 0.82 -0.76 0.23 0.00 0.00 176.35 176.49 2wp8 s LEU 321 N -1.89 3.63 0.69 1.79 1.43 0.03 -4.88 118.68 119.49 2wp8 s LEU 321 Ca 0.49 1.07 -0.16 0.00 -1.03 0.00 0.00 54.13 54.49 2wp8 s LEU 321 Cb -0.24 -4.01 -0.01 0.00 0.03 0.00 0.00 46.19 41.95 2wp8 s LEU 321 CO 0.30 -0.56 0.88 -2.65 0.23 0.00 0.00 176.35 174.55 2wp8 n PRO 322 N -2.02 0.54 0.27 1.29 -0.02 -1.26 -4.77 135.00 129.03 2wp8 n PRO 322 Ca 0.02 0.24 0.11 0.00 -2.02 0.00 0.00 63.50 61.85 2wp8 n PRO 322 Cb 0.55 -2.13 0.76 0.00 -0.02 0.00 0.00 33.50 32.66 2wp8 n PRO 322 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2wp8 h GLN 323 N -0.12 0.00 0.00 -0.52 4.20 -1.97 0.19 115.11 116.89 2wp8 h GLN 323 Ca -0.47 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.24 2wp8 h GLN 323 Cb 1.35 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.13 2wp8 h GLN 323 CO 0.47 0.04 0.40 0.66 -0.67 0.00 0.00 178.83 179.73 2wp8 h SER 324 N 0.00 0.00 -0.00 1.46 4.64 -2.03 -2.12 113.55 115.50 2wp8 h SER 324 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wp8 h SER 324 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 2wp8 h SER 324 CO 0.00 0.00 -0.45 -0.62 -0.87 0.00 0.00 176.83 174.90 2wp8 n GLU 325 N -2.56 3.60 -1.71 4.77 -0.58 0.65 -5.01 120.64 119.81 2wp8 n GLU 325 Ca -0.01 -0.05 -0.37 0.00 -0.42 0.00 0.00 57.16 56.31 2wp8 n GLU 325 Cb 0.43 -0.98 0.07 0.00 -0.57 0.00 0.00 31.44 30.40 2wp8 n GLU 325 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 2wp8 s TRP 326 N -1.89 2.06 0.02 -0.32 0.52 -0.80 -4.87 118.94 113.66 2wp8 s TRP 326 Ca 0.04 1.49 0.01 0.00 0.02 0.00 0.00 56.10 57.66 2wp8 s TRP 326 Cb 0.08 -3.69 -0.02 0.00 -1.15 0.00 0.00 33.47 28.69 2wp8 s TRP 326 CO 0.39 -2.94 -0.04 0.15 0.02 0.00 0.00 176.95 174.54 2wp8 s LYS 327 N -3.42 0.33 0.72 4.98 1.02 -1.20 -4.87 119.74 117.30 2wp8 s LYS 327 Ca 0.82 -0.55 -0.11 0.00 0.02 0.00 0.00 55.97 56.15 2wp8 s LYS 327 Cb -0.37 -0.02 0.02 0.00 -0.52 0.00 0.00 37.83 36.94 2wp8 s LYS 327 CO 0.40 -0.01 1.10 0.00 -0.92 0.00 0.00 175.35 175.91 2wp8 s ALA 328 N -1.20 2.78 0.22 5.17 0.00 -1.26 -1.82 121.76 125.66 2wp8 s ALA 328 Ca -0.12 -0.31 -0.32 0.00 0.00 0.00 0.00 51.96 51.22 2wp8 s ALA 328 Cb -0.08 -3.04 -0.14 0.00 0.00 0.00 0.00 23.12 19.85 2wp8 s ALA 328 CO -0.01 -1.23 1.38 -2.30 0.00 0.00 0.00 175.76 173.61 2wp8 n PRO 329 N -3.08 1.91 -1.51 0.00 -0.02 -1.26 -4.88 135.00 126.16 2wp8 n PRO 329 Ca 0.07 0.68 -0.37 0.00 -2.02 0.00 0.00 63.50 61.86 2wp8 n PRO 329 Cb 0.57 -2.32 0.05 0.00 -0.02 0.00 0.00 33.50 31.78 2wp8 n PRO 329 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2wp8 n SER 330 N 2.23 -0.05 -0.88 2.55 2.88 -1.26 -4.95 113.62 114.14 2wp8 n SER 330 Ca 0.12 0.74 0.07 0.00 -1.33 0.00 0.00 58.87 58.48 2wp8 n SER 330 Cb 0.30 -1.31 0.22 0.00 -0.75 0.00 0.00 64.21 62.68 2wp8 n SER 330 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2wp8 n SER 331 N -0.45 3.55 -4.29 -3.46 7.64 -1.26 -4.98 113.62 110.38 2wp8 n SER 331 Ca 0.13 -2.42 -0.25 0.00 1.01 0.00 0.00 58.87 57.33 2wp8 n SER 331 Cb 0.48 -0.40 -0.13 0.00 -1.01 0.00 0.00 64.21 63.15 2wp8 n SER 331 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2wp8 s ILE 332 N -1.77 1.78 0.17 0.44 -4.36 -1.26 -0.68 121.20 115.52 2wp8 s ILE 332 Ca 0.34 -1.45 -0.04 0.00 -0.26 0.00 0.00 60.65 59.25 2wp8 s ILE 332 Cb 0.23 -1.59 -0.05 0.00 1.25 0.00 0.00 42.46 42.30 2wp8 s ILE 332 CO 0.15 0.07 0.40 0.68 0.24 0.00 0.00 174.94 176.47 2wp8 s VAL 333 N -1.01 5.17 -0.18 8.37 -7.23 -1.26 -4.60 120.40 119.66 2wp8 s VAL 333 Ca 0.08 -0.08 -0.27 0.00 -1.81 0.00 0.00 61.98 59.90 2wp8 s VAL 333 Cb -0.10 -3.66 0.07 0.00 0.56 0.00 0.00 36.38 33.25 2wp8 s VAL 333 CO 0.04 -0.06 0.69 -0.76 -0.31 0.00 0.00 175.10 174.70 2wp8 s LEU 334 N -2.93 -0.66 0.31 1.32 1.43 0.43 -4.93 118.68 113.66 2wp8 s LEU 334 Ca 0.41 1.13 0.04 0.00 -1.03 0.00 0.00 54.13 54.67 2wp8 s LEU 334 Cb -0.12 2.45 -0.04 0.00 0.03 0.00 0.00 46.19 48.52 2wp8 s LEU 334 CO 0.26 -0.39 0.17 1.51 0.23 0.00 0.00 176.35 178.14 2wp8 s ASP 335 N -0.26 1.62 0.41 2.29 1.47 -1.26 -2.27 116.67 118.68 2wp8 s ASP 335 Ca -0.04 -1.59 0.09 0.00 1.18 0.00 0.00 52.55 52.19 2wp8 s ASP 335 Cb -0.03 0.42 0.86 0.00 -0.34 0.00 0.00 42.92 43.84 2wp8 s ASP 335 CO 0.05 -0.92 1.99 0.77 0.68 0.00 0.00 175.17 177.73 2wp8 h SER 336 N 2.18 0.28 0.65 2.11 4.64 -1.83 -2.36 113.55 119.21 2wp8 h SER 336 Ca -0.32 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 60.93 2wp8 h SER 336 Cb 1.25 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2wp8 h SER 336 CO 0.50 0.33 -0.15 -0.08 -0.87 0.00 0.00 176.83 176.56 2wp8 h GLU 337 N 0.30 0.00 0.00 4.77 4.81 -1.96 -3.26 114.58 119.24 2wp8 h GLU 337 Ca 0.07 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2wp8 h GLU 337 Cb 0.20 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.58 2wp8 h GLU 337 CO 0.00 0.15 -0.09 0.72 -0.73 0.00 0.00 179.01 179.06 2wp8 n HIS 338 N -3.45 0.00 -4.87 0.92 8.25 -0.95 -4.76 115.22 110.36 2wp8 n HIS 338 Ca -0.01 -0.80 -0.27 0.00 -0.26 0.00 0.00 57.72 56.39 2wp8 n HIS 338 Cb 0.32 -0.13 -0.16 0.00 1.12 0.00 0.00 29.99 31.14 2wp8 n HIS 338 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 2wp8 s PHE 339 N -2.28 1.81 -1.36 4.41 5.36 -0.93 -4.80 117.98 120.19 2wp8 s PHE 339 Ca 0.25 -0.56 -0.03 0.00 -0.96 0.00 0.00 56.93 55.63 2wp8 s PHE 339 Cb 0.22 -1.22 -0.00 0.00 -0.34 0.00 0.00 43.02 41.67 2wp8 s PHE 339 CO 0.02 -0.21 0.50 -0.25 -1.46 0.00 0.00 175.22 173.83 2wp8 n ASP 340 N 3.25 -1.08 0.05 6.13 8.00 -1.26 -4.81 116.55 126.82 2wp8 n ASP 340 Ca -0.19 -0.99 0.11 0.00 0.71 0.00 0.00 54.79 54.43 2wp8 n ASP 340 Cb 0.53 -3.20 0.44 0.00 -0.02 0.00 0.00 41.12 38.86 2wp8 n ASP 340 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2wp8 n VAL 341 N -4.36 0.69 1.08 2.53 0.24 -1.26 -3.05 118.33 114.20 2wp8 n VAL 341 Ca -0.28 0.12 0.13 0.00 -2.04 0.00 0.00 64.34 62.27 2wp8 n VAL 341 Cb 0.67 -0.88 0.39 0.00 -1.47 0.00 0.00 33.84 32.56 2wp8 n VAL 341 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2wp8 n ASN 342 N -1.79 0.44 -4.76 -1.34 3.02 -1.26 -4.83 115.26 104.75 2wp8 n ASN 342 Ca 0.04 -0.20 -0.38 0.00 -0.03 0.00 0.00 54.58 54.01 2wp8 n ASN 342 Cb 0.26 0.03 0.02 0.00 -0.61 0.00 0.00 39.78 39.47 2wp8 n ASN 342 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2wp8 s ASP 343 N -2.87 5.68 0.12 6.41 1.11 -1.17 -4.60 116.67 121.35 2wp8 s ASP 343 Ca 0.16 2.65 -0.08 0.00 0.18 0.00 0.00 52.55 55.46 2wp8 s ASP 343 Cb 0.18 -2.63 -0.06 0.00 1.07 0.00 0.00 42.92 41.49 2wp8 s ASP 343 CO 0.61 -1.28 0.41 0.20 1.18 0.00 0.00 175.17 176.29 2wp8 s ASN 344 N -0.98 6.57 0.63 0.27 0.01 -1.26 -4.79 114.94 115.39 2wp8 s ASN 344 Ca 0.67 0.72 -0.10 0.00 -0.71 0.00 0.00 52.86 53.43 2wp8 s ASN 344 Cb -0.37 -2.15 -0.02 0.00 0.41 0.00 0.00 41.25 39.12 2wp8 s ASN 344 CO 0.46 0.09 1.02 -2.16 -1.51 0.00 0.00 177.10 175.00 2wp8 s PRO 345 N -2.35 3.33 -0.24 -0.60 0.04 -1.26 -5.07 135.00 128.86 2wp8 s PRO 345 Ca 0.38 0.57 -0.18 0.00 0.04 0.00 0.00 61.00 61.81 2wp8 s PRO 345 Cb -0.13 -2.10 0.07 0.00 0.04 0.00 0.00 34.50 32.38 2wp8 s PRO 345 CO 0.21 -0.69 0.61 -0.51 0.04 0.00 0.00 177.00 176.66 2wp8 s ASP 346 N -4.24 -0.71 0.00 6.66 1.01 -1.26 -4.88 116.67 113.25 2wp8 s ASP 346 Ca 0.55 1.27 0.00 0.00 0.71 0.00 0.00 52.55 55.08 2wp8 s ASP 346 Cb -0.11 1.23 0.00 0.00 1.01 0.00 0.00 42.92 45.05 2wp8 s ASP 346 CO 0.52 -0.22 0.00 -0.38 0.21 0.00 0.00 175.17 175.30 2wp8 n ILE 347 N 3.43 0.00 0.00 0.77 5.41 -1.26 -5.07 119.36 122.64 2wp8 n ILE 347 Ca -0.17 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.58 2wp8 n ILE 347 Cb 0.57 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.50 2wp8 n ILE 347 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 2wp8 n GLU 348 N 0.00 0.00 0.00 0.38 -0.00 -1.26 -5.25 120.64 114.51 2wp8 n GLU 348 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.16 2wp8 n GLU 348 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.44 2wp8 n GLU 348 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2wp8 n ASN 361 N 0.00 0.00 -4.66 -1.84 5.03 -1.26 -5.16 115.26 107.37 2wp8 n ASN 361 Ca 0.00 0.00 -0.43 0.00 0.87 0.00 0.00 54.58 55.02 2wp8 n ASN 361 Cb 0.00 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 38.74 2wp8 n ASN 361 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2wp8 s THR 362 N 0.00 4.04 0.56 3.41 -4.23 -1.26 -5.00 115.64 113.17 2wp8 s THR 362 Ca 0.00 1.26 -0.21 0.00 -1.18 0.00 0.00 61.69 61.56 2wp8 s THR 362 Cb 0.00 -3.82 -0.04 0.00 1.34 0.00 0.00 72.50 69.98 2wp8 s THR 362 CO 0.00 -0.12 1.29 -0.89 -0.54 0.00 0.00 174.62 174.37 2wp8 s THR 363 N 3.70 2.29 -0.27 3.99 2.01 -1.26 -5.03 115.64 121.07 2wp8 s THR 363 Ca 0.61 0.20 -0.03 0.00 0.31 0.00 0.00 61.69 62.78 2wp8 s THR 363 Cb -0.25 -3.10 0.02 0.00 0.01 0.00 0.00 72.50 69.18 2wp8 s THR 363 CO 0.20 -0.02 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.42 2wp8 s VAL 364 N -1.40 3.28 -0.10 3.82 1.01 -1.26 -5.10 120.40 120.65 2wp8 s VAL 364 Ca 0.74 -0.94 -0.19 0.00 0.00 0.00 0.00 61.98 61.59 2wp8 s VAL 364 Cb -0.37 -2.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 2wp8 s VAL 364 CO 0.42 0.13 0.53 -0.63 0.00 0.00 0.00 175.10 175.54 2wp8 s ILE 365 N 1.38 5.14 0.65 2.22 -1.09 -1.26 -4.55 121.20 123.69 2wp8 s ILE 365 Ca 0.01 1.07 -0.13 0.00 -2.23 0.00 0.00 60.65 59.36 2wp8 s ILE 365 Cb -0.17 -3.87 -0.01 0.00 -1.58 0.00 0.00 42.46 36.83 2wp8 s ILE 365 CO -0.02 0.32 1.07 -0.94 -1.23 0.00 0.00 174.94 174.14 2wp8 s SER 366 N 0.56 5.47 0.07 3.58 1.04 -1.26 -4.95 113.70 118.22 2wp8 s SER 366 Ca 0.29 1.76 -0.16 0.00 0.48 0.00 0.00 55.95 58.32 2wp8 s SER 366 Cb -0.16 -2.52 -0.16 0.00 0.10 0.00 0.00 66.02 63.29 2wp8 s SER 366 CO 0.12 -1.38 1.29 -0.78 0.98 0.00 0.00 173.24 173.47 2wp8 h ASP 367 N -0.15 0.75 -0.99 7.02 3.58 -1.95 -2.81 116.42 121.87 2wp8 h ASP 367 Ca -0.45 -0.61 0.32 0.00 0.42 0.00 0.00 57.03 56.71 2wp8 h ASP 367 Cb 1.22 -0.22 -0.18 0.00 1.72 0.00 0.00 39.33 41.87 2wp8 h ASP 367 CO 0.56 1.23 0.22 0.50 -2.88 0.00 0.00 179.24 178.88 2wp8 h LYS 368 N 0.31 0.02 0.01 0.28 3.64 -1.96 -1.49 116.57 117.39 2wp8 h LYS 368 Ca -0.03 -0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.17 2wp8 h LYS 368 Cb 1.18 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 33.01 2wp8 h LYS 368 CO 0.12 0.02 -0.70 0.37 -2.27 0.00 0.00 179.45 176.98 2wp8 h GLN 369 N 0.03 0.46 -0.18 1.90 4.15 -1.92 -2.30 115.11 117.24 2wp8 h GLN 369 Ca 0.68 -0.51 0.05 0.00 0.77 0.00 0.00 58.65 59.65 2wp8 h GLN 369 Cb 1.58 0.15 -0.07 0.00 0.21 0.00 0.00 27.48 29.35 2wp8 h GLN 369 CO -0.85 1.16 -0.34 0.00 -1.93 0.00 0.00 178.83 176.87 2wp8 h ARG 370 N -0.03 -0.37 -0.83 1.69 3.08 -1.06 -0.52 114.38 116.34 2wp8 h ARG 370 Ca -0.09 0.03 0.14 0.00 0.07 0.00 0.00 59.98 60.12 2wp8 h ARG 370 Cb 1.41 0.09 -0.09 0.00 0.08 0.00 0.00 29.97 31.46 2wp8 h ARG 370 CO 0.14 -0.25 0.43 0.07 -1.07 0.00 0.00 179.97 179.28 2wp8 h ARG 371 N -0.39 0.61 0.32 0.04 0.11 -1.37 0.27 114.38 113.97 2wp8 h ARG 371 Ca 0.11 -0.04 -0.02 0.00 0.10 0.00 0.00 59.98 60.13 2wp8 h ARG 371 Cb 0.56 -0.14 0.00 0.00 1.11 0.00 0.00 29.97 31.50 2wp8 h ARG 371 CO -0.39 0.40 -0.15 1.25 0.10 0.00 0.00 179.97 181.18 2wp8 h LEU 372 N 0.63 -0.36 -1.60 0.08 5.85 -0.69 -2.26 115.31 116.97 2wp8 h LEU 372 Ca 0.44 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.99 2wp8 h LEU 372 Cb 0.60 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.72 2wp8 h LEU 372 CO -0.35 0.03 0.00 -0.07 -0.34 0.00 0.00 178.44 177.71 2wp8 h LEU 373 N -0.81 0.00 0.10 2.25 3.38 -0.90 -1.28 115.31 118.05 2wp8 h LEU 373 Ca -0.04 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 2wp8 h LEU 373 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2wp8 h LEU 373 CO 0.07 0.00 -0.05 0.00 0.09 0.00 0.00 178.44 178.56 2wp8 h ALA 374 N 2.07 -0.92 -1.05 1.53 0.00 -0.36 -3.01 119.26 117.51 2wp8 h ALA 374 Ca 0.00 -0.03 0.28 0.00 0.00 0.00 0.00 54.91 55.16 2wp8 h ALA 374 Cb 0.23 0.05 -0.11 0.00 0.00 0.00 0.00 17.79 17.96 2wp8 h ALA 374 CO 0.00 -0.91 0.66 0.87 0.00 0.00 0.00 179.25 179.87 2wp8 h LYS 375 N -0.14 0.40 0.00 0.00 1.57 -0.66 0.42 116.57 118.16 2wp8 h LYS 375 Ca -0.01 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.67 2wp8 h LYS 375 Cb 0.10 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 2wp8 h LYS 375 CO 0.02 0.26 -0.33 0.22 -0.57 0.00 0.00 179.45 179.05 2wp8 h ASP 376 N 0.41 0.00 0.39 0.86 3.58 -1.42 -1.30 116.42 118.94 2wp8 h ASP 376 Ca 0.63 0.00 -0.32 0.00 0.42 0.00 0.00 57.03 57.77 2wp8 h ASP 376 Cb 1.54 0.00 0.02 0.00 1.72 0.00 0.00 39.33 42.61 2wp8 h ASP 376 CO -0.37 0.33 -1.42 0.00 -2.88 0.00 0.00 179.24 174.90 2wp8 h ALA 377 N 1.67 -0.05 -0.95 -0.78 0.00 -0.12 -2.37 119.26 116.66 2wp8 h ALA 377 Ca -0.00 -0.89 0.03 0.00 0.00 0.00 0.00 54.91 54.04 2wp8 h ALA 377 Cb 0.95 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.83 2wp8 h ALA 377 CO 0.04 0.82 0.63 1.98 0.00 0.00 0.00 179.25 182.72 2wp8 h MET 378 N 0.12 1.19 -0.28 0.00 1.85 -0.79 -1.14 114.93 115.89 2wp8 h MET 378 Ca -0.22 -0.07 -0.17 0.00 -0.61 0.00 0.00 59.70 58.63 2wp8 h MET 378 Cb 2.10 -0.27 -0.00 0.00 0.43 0.00 0.00 31.60 33.86 2wp8 h MET 378 CO 0.24 0.79 -0.50 0.82 -0.40 0.00 0.00 176.91 177.86 2wp8 h ILE 379 N 1.23 1.29 -0.15 1.77 1.08 -1.30 -3.20 117.51 118.22 2wp8 h ILE 379 Ca 0.37 -1.70 -0.04 0.00 -0.39 0.00 0.00 64.86 63.10 2wp8 h ILE 379 Cb -0.04 1.61 -0.01 0.00 -3.07 0.00 0.00 36.82 35.31 2wp8 h ILE 379 CO -0.10 0.55 -0.09 0.00 -0.69 0.00 0.00 178.15 177.81 2wp8 h ALA 380 N 0.84 1.57 -0.33 1.87 0.00 -0.86 -2.82 119.26 119.52 2wp8 h ALA 380 Ca 0.03 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.81 2wp8 h ALA 380 Cb 1.07 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 2wp8 h ALA 380 CO 0.11 0.31 0.06 0.37 0.00 0.00 0.00 179.25 180.10 2wp8 h GLN 381 N 0.23 0.17 -0.00 0.00 4.15 -1.22 -3.34 115.11 115.10 2wp8 h GLN 381 Ca 0.05 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.46 2wp8 h GLN 381 Cb 0.31 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 27.96 2wp8 h GLN 381 CO 0.02 0.11 -0.87 2.89 -1.93 0.00 0.00 178.83 179.05 2wp8 n ARG 382 N -5.09 0.64 -2.39 1.69 1.85 -1.08 -4.98 116.66 107.30 2wp8 n ARG 382 Ca 0.01 -0.11 -0.41 0.00 -1.00 0.00 0.00 57.85 56.34 2wp8 n ARG 382 Cb 0.15 -1.42 -0.04 0.00 -1.05 0.00 0.00 32.46 30.10 2wp8 n ARG 382 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2wp8 s SER 383 N -2.78 7.13 0.79 2.89 1.04 -1.14 -5.03 113.70 116.60 2wp8 s SER 383 Ca 0.08 2.29 -0.12 0.00 0.48 0.00 0.00 55.95 58.69 2wp8 s SER 383 Cb 0.15 -2.62 0.07 0.00 0.10 0.00 0.00 66.02 63.72 2wp8 s SER 383 CO 0.77 -0.29 1.11 -0.75 0.98 0.00 0.00 173.24 175.06 2wp8 s LYS 384 N -0.88 2.11 -0.94 4.02 2.47 -1.26 -4.58 119.74 120.68 2wp8 s LYS 384 Ca 0.49 0.48 -0.05 0.00 -1.56 0.00 0.00 55.97 55.33 2wp8 s LYS 384 Cb -0.33 -1.93 -0.06 0.00 -1.46 0.00 0.00 37.83 34.05 2wp8 s LYS 384 CO 0.40 -1.56 0.83 1.63 0.16 0.00 0.00 175.35 176.80 2wp8 n LYS 385 N -3.37 -1.98 -2.74 4.03 4.76 -1.26 -4.95 118.16 112.65 2wp8 n LYS 385 Ca 0.07 0.88 -0.32 0.00 -2.87 0.00 0.00 58.31 56.06 2wp8 n LYS 385 Cb 0.57 -5.51 -0.05 0.00 -1.84 0.00 0.00 35.03 28.20 2wp8 n LYS 385 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2wp8 s ILE 386 N -3.32 4.52 0.12 -0.18 1.01 -1.26 -4.45 121.20 117.63 2wp8 s ILE 386 Ca 0.38 1.24 0.05 0.00 0.00 0.00 0.00 60.65 62.31 2wp8 s ILE 386 Cb -0.05 -3.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.73 2wp8 s ILE 386 CO 0.69 -0.44 -0.12 0.00 0.00 0.00 0.00 174.94 175.07 2wp8 s GLN 387 N -3.50 0.97 -0.35 2.79 -2.07 -0.76 -4.86 119.66 111.89 2wp8 s GLN 387 Ca 0.59 -1.24 -0.44 0.00 -1.82 0.00 0.00 55.36 52.45 2wp8 s GLN 387 Cb -0.10 -0.74 -0.18 0.00 -1.09 0.00 0.00 33.01 30.90 2wp8 s GLN 387 CO 0.21 0.13 1.58 -2.30 -1.32 0.00 0.00 175.29 173.59 2wp8 n PRO 388 N 0.44 0.44 -4.70 9.60 -0.02 -1.26 -3.25 135.00 136.25 2wp8 n PRO 388 Ca -0.15 0.16 -0.30 0.00 -2.02 0.00 0.00 63.50 61.19 2wp8 n PRO 388 Cb 0.58 -1.73 -0.14 0.00 -0.02 0.00 0.00 33.50 32.19 2wp8 n PRO 388 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2wp8 s THR 389 N 2.74 2.38 0.13 3.45 2.01 -1.26 -1.05 115.64 124.05 2wp8 s THR 389 Ca 1.00 -1.42 0.02 0.00 0.31 0.00 0.00 61.69 61.60 2wp8 s THR 389 Cb -1.31 -1.99 -0.01 0.00 0.01 0.00 0.00 72.50 69.21 2wp8 s THR 389 CO 0.72 0.28 0.07 0.00 -0.69 0.00 0.00 174.62 175.01 2wp8 n ALA 390 N 1.47 0.22 -3.23 7.40 0.00 0.78 -0.79 120.51 126.36 2wp8 n ALA 390 Ca -0.17 -0.72 -0.13 0.00 0.00 0.00 0.00 53.44 52.43 2wp8 n ALA 390 Cb 0.52 0.52 -0.09 0.00 0.00 0.00 0.00 19.45 20.40 2wp8 n ALA 390 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2wp8 s LYS 391 N -2.52 0.60 -0.21 0.00 -2.85 0.25 -4.40 119.74 110.60 2wp8 s LYS 391 Ca 0.10 -0.03 -0.22 0.00 -1.00 0.00 0.00 55.97 54.81 2wp8 s LYS 391 Cb 0.00 0.27 -0.02 0.00 -2.06 0.00 0.00 37.83 36.02 2wp8 s LYS 391 CO 0.07 -0.15 0.69 0.08 0.10 0.00 0.00 175.35 176.15 2wp8 s VAL 392 N -0.96 4.96 -0.57 1.79 1.01 0.11 -1.16 120.40 125.58 2wp8 s VAL 392 Ca -0.10 1.31 0.09 0.00 0.00 0.00 0.00 61.98 63.28 2wp8 s VAL 392 Cb -0.05 -4.00 -0.06 0.00 0.00 0.00 0.00 36.38 32.27 2wp8 s VAL 392 CO 0.03 0.05 0.46 1.33 0.00 0.00 0.00 175.10 176.97 2wp8 n VAL 393 N 4.89 0.00 -3.62 2.92 0.24 -0.67 -4.65 118.33 117.45 2wp8 n VAL 393 Ca 0.01 -0.33 -0.12 0.00 -2.04 0.00 0.00 64.34 61.86 2wp8 n VAL 393 Cb 0.49 1.04 -0.07 0.00 -1.47 0.00 0.00 33.84 33.83 2wp8 n VAL 393 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 2wp8 s TYR 394 N -1.64 -0.59 -0.36 6.34 5.04 -1.23 -1.05 117.35 123.86 2wp8 s TYR 394 Ca 0.05 1.36 -0.13 0.00 -2.44 0.00 0.00 57.07 55.90 2wp8 s TYR 394 Cb 0.07 0.35 -0.01 0.00 0.35 0.00 0.00 41.96 42.72 2wp8 s TYR 394 CO 0.32 -0.33 0.25 0.42 -1.34 0.00 0.00 175.55 174.86 2wp8 s ILE 395 N -0.03 5.20 0.04 3.14 -1.09 -1.26 -0.86 121.20 126.34 2wp8 s ILE 395 Ca -0.00 -0.37 -0.01 0.00 -2.23 0.00 0.00 60.65 58.04 2wp8 s ILE 395 Cb -0.04 -3.74 -0.27 0.00 -1.58 0.00 0.00 42.46 36.84 2wp8 s ILE 395 CO -0.01 -0.09 1.00 -0.61 -1.23 0.00 0.00 174.94 174.00 2wp8 h GLN 396 N 8.51 0.20 -2.61 2.79 4.15 -1.56 -3.46 115.11 123.13 2wp8 h GLN 396 Ca -0.30 -0.34 -0.11 0.00 0.77 0.00 0.00 58.65 58.67 2wp8 h GLN 396 Cb 1.14 0.13 -0.27 0.00 0.21 0.00 0.00 27.48 28.69 2wp8 h GLN 396 CO 0.66 1.09 -0.31 0.50 -1.93 0.00 0.00 178.83 178.83 2wp8 s ARG 397 N -2.64 0.38 -0.06 1.69 3.52 -1.00 -4.94 118.95 115.90 2wp8 s ARG 397 Ca -0.05 0.85 -0.18 0.00 -0.13 0.00 0.00 55.73 56.22 2wp8 s ARG 397 Cb 0.07 0.05 -0.05 0.00 -1.56 0.00 0.00 34.95 33.47 2wp8 s ARG 397 CO 0.86 -0.18 0.48 0.50 -0.81 0.00 0.00 175.30 176.14 2wp8 s ARG 398 N 1.68 4.21 0.00 5.12 6.06 -1.26 -0.82 118.95 133.94 2wp8 s ARG 398 Ca -0.08 0.49 0.28 0.00 -2.50 0.00 0.00 55.73 53.93 2wp8 s ARG 398 Cb -0.09 -3.35 1.06 0.00 0.06 0.00 0.00 34.95 32.63 2wp8 s ARG 398 CO -0.13 0.37 1.79 -1.13 -2.50 0.00 0.00 175.30 173.70 2wp8 n SER 399 N 2.90 0.19 -4.51 -2.12 3.41 -1.26 -4.91 113.62 107.32 2wp8 n SER 399 Ca -0.09 0.14 -0.51 0.00 -0.26 0.00 0.00 58.87 58.14 2wp8 n SER 399 Cb 0.52 -0.24 -0.05 0.00 -0.26 0.00 0.00 64.21 64.18 2wp8 n SER 399 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2wp8 n TRP 400 N -1.42 0.66 -3.86 7.33 8.01 -1.26 -4.98 117.44 121.91 2wp8 n TRP 400 Ca 0.08 0.86 -0.04 0.00 -1.31 0.00 0.00 57.50 57.09 2wp8 n TRP 400 Cb 0.33 -2.14 -0.01 0.00 -2.01 0.00 0.00 31.31 27.47 2wp8 n TRP 400 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.69 179.57 2wp8 n ARG 401 N 1.47 0.14 -2.41 -0.99 1.85 -1.26 -5.08 116.66 110.38 2wp8 n ARG 401 Ca 0.17 -0.73 -0.42 0.00 -1.00 0.00 0.00 57.85 55.86 2wp8 n ARG 401 Cb 0.20 0.66 -0.03 0.00 -1.05 0.00 0.00 32.46 32.24 2wp8 n ARG 401 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 2wp8 s GLN 402 N -2.25 4.34 -0.00 2.89 -0.21 -1.26 -4.48 119.66 118.69 2wp8 s GLN 402 Ca 0.08 1.74 0.03 0.00 0.02 0.00 0.00 55.36 57.23 2wp8 s GLN 402 Cb 0.00 -3.54 -0.03 0.00 1.00 0.00 0.00 33.01 30.43 2wp8 s GLN 402 CO 0.06 -0.46 -0.08 0.71 -2.12 0.00 0.00 175.29 173.40 2wp8 s TYR 403 N 2.17 2.87 0.16 0.91 1.51 0.10 -4.85 117.35 120.20 2wp8 s TYR 403 Ca 0.58 -0.05 -0.22 0.00 -1.01 0.00 0.00 57.07 56.37 2wp8 s TYR 403 Cb -0.26 -1.61 -0.08 0.00 -0.11 0.00 0.00 41.96 39.90 2wp8 s TYR 403 CO 0.23 0.36 0.70 0.08 -1.11 0.00 0.00 175.55 175.81 2wp8 s VAL 404 N -0.97 4.54 0.29 0.71 1.01 -1.26 -0.14 120.40 124.58 2wp8 s VAL 404 Ca 0.16 1.43 -0.20 0.00 0.00 0.00 0.00 61.98 63.38 2wp8 s VAL 404 Cb -0.11 -3.98 0.05 0.00 0.00 0.00 0.00 36.38 32.34 2wp8 s VAL 404 CO 0.07 0.44 0.85 -0.83 0.00 0.00 0.00 175.10 175.63 2wp8 s GLY 405 N -1.30 0.13 0.01 4.51 0.00 0.48 -0.67 107.32 110.48 2wp8 s GLY 405 Ca 0.36 -0.44 0.03 0.00 0.00 0.00 0.00 44.72 44.67 2wp8 s GLY 405 CO 0.23 0.35 -0.09 -0.86 0.00 0.00 0.00 173.10 172.73 2wp8 s GLN 406 N -2.77 0.66 0.65 2.90 -2.07 0.12 -0.57 119.66 118.59 2wp8 s GLN 406 Ca 0.15 -0.43 -0.17 0.00 -1.82 0.00 0.00 55.36 53.09 2wp8 s GLN 406 Cb -0.04 -0.61 -0.03 0.00 -1.09 0.00 0.00 33.01 31.24 2wp8 s GLN 406 CO 0.08 0.16 0.97 1.28 -1.32 0.00 0.00 175.29 176.46 2wp8 n LEU 407 N 2.51 3.76 -4.58 2.60 4.77 -1.26 -1.80 117.00 123.00 2wp8 n LEU 407 Ca -0.15 0.75 -0.42 0.00 -0.03 0.00 0.00 56.01 56.16 2wp8 n LEU 407 Cb 0.56 -1.40 -0.03 0.00 -2.33 0.00 0.00 43.42 40.23 2wp8 n LEU 407 CO 0.24 -1.91 1.26 0.00 -1.33 0.00 0.00 177.39 175.66 2wp8 s ALA 408 N -1.62 2.83 0.43 -1.18 0.00 0.37 -4.76 121.76 117.83 2wp8 s ALA 408 Ca 0.76 -0.58 0.18 0.00 0.00 0.00 0.00 51.96 52.32 2wp8 s ALA 408 Cb -0.39 -4.08 1.09 0.00 0.00 0.00 0.00 23.12 19.75 2wp8 s ALA 408 CO 0.47 -2.87 1.89 -1.35 0.00 0.00 0.00 175.76 173.91 2wp8 h PRO 409 N 11.13 0.37 0.00 0.00 0.11 -1.91 0.46 132.00 142.17 2wp8 h PRO 409 Ca -0.27 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2wp8 h PRO 409 Cb 1.10 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2wp8 h PRO 409 CO 1.16 0.25 0.00 0.66 -0.21 0.00 0.00 178.00 179.86 2wp8 h SER 410 N 0.38 0.00 -0.00 -2.05 4.64 -1.92 -2.18 113.55 112.42 2wp8 h SER 410 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 2wp8 h SER 410 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2wp8 h SER 410 CO -0.14 0.00 -0.79 -1.54 -0.87 0.00 0.00 176.83 173.49 2wp8 n SER 411 N -2.49 1.20 -4.58 4.97 3.41 0.14 -3.37 113.62 112.91 2wp8 n SER 411 Ca -0.01 -1.10 -0.34 0.00 -0.26 0.00 0.00 58.87 57.16 2wp8 n SER 411 Cb 0.12 0.86 -0.11 0.00 -0.26 0.00 0.00 64.21 64.81 2wp8 n SER 411 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2wp8 s VAL 412 N -2.70 3.84 -0.43 -3.33 1.01 -0.82 -4.70 120.40 113.28 2wp8 s VAL 412 Ca 0.10 -0.42 -0.22 0.00 0.00 0.00 0.00 61.98 61.45 2wp8 s VAL 412 Cb 0.15 -2.60 0.02 0.00 0.00 0.00 0.00 36.38 33.95 2wp8 s VAL 412 CO 0.73 0.58 0.69 -0.62 0.00 0.00 0.00 175.10 176.48 2wp8 s ASP 413 N -0.57 6.37 0.29 3.32 -1.08 -1.26 -4.93 116.67 118.81 2wp8 s ASP 413 Ca 0.09 -0.18 0.26 0.00 -0.52 0.00 0.00 52.55 52.19 2wp8 s ASP 413 Cb -0.12 -2.34 0.86 0.00 -1.46 0.00 0.00 42.92 39.86 2wp8 s ASP 413 CO 0.02 -0.80 1.76 1.55 0.52 0.00 0.00 175.17 178.21 2wp8 h PRO 414 N 8.85 0.00 -0.28 4.34 0.13 -1.95 -3.14 132.00 139.96 2wp8 h PRO 414 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 2wp8 h PRO 414 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2wp8 h PRO 414 CO 0.91 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.72 2wp8 n GLN 415 N -2.46 3.02 -4.48 0.86 3.00 -1.26 -4.80 117.38 111.26 2wp8 n GLN 415 Ca 0.04 -2.84 -0.30 0.00 -0.01 0.00 0.00 57.00 53.89 2wp8 n GLN 415 Cb 0.37 -1.85 -0.17 0.00 0.00 0.00 0.00 30.24 28.59 2wp8 n GLN 415 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2wp8 s SER 416 N -1.86 2.63 0.00 1.08 0.15 -1.19 -5.01 113.70 109.51 2wp8 s SER 416 Ca 0.42 -0.48 0.25 0.00 0.70 0.00 0.00 55.95 56.85 2wp8 s SER 416 Cb 0.34 -1.19 1.19 0.00 -1.71 0.00 0.00 66.02 64.66 2wp8 s SER 416 CO 0.09 0.03 1.81 -0.24 1.20 0.00 0.00 173.24 176.13 2wp8 n SER 417 N 4.21 0.88 -4.63 5.45 2.88 -1.26 -4.55 113.62 116.60 2wp8 n SER 417 Ca -0.19 -1.42 -0.30 0.00 -1.33 0.00 0.00 58.87 55.63 2wp8 n SER 417 Cb 0.51 -0.03 0.18 0.00 -0.75 0.00 0.00 64.21 64.13 2wp8 n SER 417 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2wp8 s SER 418 N -1.81 2.55 0.43 -3.46 0.01 -1.26 -4.87 113.70 105.30 2wp8 s SER 418 Ca 0.37 1.87 -0.22 0.00 1.31 0.00 0.00 55.95 59.28 2wp8 s SER 418 Cb 0.19 -2.44 -0.09 0.00 0.21 0.00 0.00 66.02 63.89 2wp8 s SER 418 CO 0.30 -3.28 1.02 0.42 0.41 0.00 0.00 173.24 172.11 2wp8 s THR 419 N -2.65 3.90 -0.01 1.44 -4.23 -1.26 -4.68 115.64 108.14 2wp8 s THR 419 Ca 0.66 1.30 -0.00 0.00 -1.18 0.00 0.00 61.69 62.47 2wp8 s THR 419 Cb -0.22 -3.60 0.02 0.00 1.34 0.00 0.00 72.50 70.04 2wp8 s THR 419 CO 0.60 -0.14 0.03 -1.10 -0.54 0.00 0.00 174.62 173.46 2wp8 s GLN 420 N -2.88 -0.01 0.01 3.99 -0.21 -0.64 -4.94 119.66 114.98 2wp8 s GLN 420 Ca 0.62 0.12 -0.30 0.00 0.02 0.00 0.00 55.36 55.82 2wp8 s GLN 420 Cb -0.17 -0.14 -0.04 0.00 1.00 0.00 0.00 33.01 33.66 2wp8 s GLN 420 CO 0.22 -0.10 1.07 -0.80 -2.12 0.00 0.00 175.29 173.55 2wp8 s ASN 421 N 0.63 7.25 0.21 5.90 0.01 -1.26 -1.61 114.94 126.06 2wp8 s ASN 421 Ca -0.05 1.78 -0.11 0.00 -0.71 0.00 0.00 52.86 53.77 2wp8 s ASN 421 Cb -0.07 -2.57 -0.00 0.00 0.41 0.00 0.00 41.25 39.01 2wp8 s ASN 421 CO -0.02 -0.36 0.39 0.68 -1.51 0.00 0.00 177.10 176.29 2wp8 s VAL 422 N 1.13 0.03 -0.11 1.60 -7.23 -0.81 -4.80 120.40 110.20 2wp8 s VAL 422 Ca 0.54 -1.33 -0.03 0.00 -1.81 0.00 0.00 61.98 59.35 2wp8 s VAL 422 Cb -0.24 -1.98 -0.03 0.00 0.56 0.00 0.00 36.38 34.68 2wp8 s VAL 422 CO 0.28 -0.13 0.01 -0.36 -0.31 0.00 0.00 175.10 174.59 2wp8 s PHE 423 N -3.98 3.18 -0.19 2.82 0.40 -1.26 -2.39 117.98 116.56 2wp8 s PHE 423 Ca 0.19 0.12 -0.05 0.00 -0.60 0.00 0.00 56.93 56.59 2wp8 s PHE 423 Cb 0.01 -1.87 -0.03 0.00 0.51 0.00 0.00 43.02 41.64 2wp8 s PHE 423 CO 0.04 0.35 0.01 0.08 0.70 0.00 0.00 175.22 176.41 2wp8 s VAL 424 N -0.49 4.14 -0.32 -0.44 1.01 -0.05 -0.48 120.40 123.77 2wp8 s VAL 424 Ca 0.09 -0.25 -0.18 0.00 0.00 0.00 0.00 61.98 61.63 2wp8 s VAL 424 Cb -0.12 -2.87 -0.01 0.00 0.00 0.00 0.00 36.38 33.38 2wp8 s VAL 424 CO 0.02 0.44 0.53 -0.63 0.00 0.00 0.00 175.10 175.46 2wp8 s ILE 425 N 0.82 5.01 0.64 2.22 1.09 -0.74 -1.53 121.20 128.71 2wp8 s ILE 425 Ca 0.01 0.54 -0.16 0.00 -1.10 0.00 0.00 60.65 59.94 2wp8 s ILE 425 Cb -0.14 -3.94 -0.01 0.00 -1.06 0.00 0.00 42.46 37.31 2wp8 s ILE 425 CO 0.02 -0.14 1.12 -0.76 -0.10 0.00 0.00 174.94 175.08 2wp8 s LEU 426 N 2.43 3.46 0.23 2.97 1.43 -1.26 -0.70 118.68 127.23 2wp8 s LEU 426 Ca 0.20 2.06 0.03 0.00 -1.03 0.00 0.00 54.13 55.39 2wp8 s LEU 426 Cb -0.15 -4.56 0.23 0.00 0.03 0.00 0.00 46.19 41.74 2wp8 s LEU 426 CO 0.12 -1.59 1.55 -0.03 0.23 0.00 0.00 176.35 176.64 2wp8 h MET 427 N 0.24 0.31 -6.31 1.70 1.85 -1.26 -3.41 114.93 108.05 2wp8 h MET 427 Ca -0.47 -0.20 -0.57 0.00 -0.61 0.00 0.00 59.70 57.85 2wp8 h MET 427 Cb 1.25 0.03 -0.04 0.00 0.43 0.00 0.00 31.60 33.27 2wp8 h MET 427 CO 0.54 0.80 1.06 0.34 -0.40 0.00 0.00 176.91 179.26 2wp8 s ASP 428 N -6.90 6.51 0.29 1.39 3.68 -1.26 -4.90 116.67 115.46 2wp8 s ASP 428 Ca -0.05 1.44 0.24 0.00 2.13 0.00 0.00 52.55 56.31 2wp8 s ASP 428 Cb 0.12 -2.54 1.05 0.00 -1.45 0.00 0.00 42.92 40.11 2wp8 s ASP 428 CO 0.81 -1.18 1.72 0.29 0.13 0.00 0.00 175.17 176.93 2wp8 n LYS 429 N 7.51 0.19 0.09 4.34 4.76 -1.26 -1.97 118.16 131.82 2wp8 n LYS 429 Ca 0.17 0.48 0.11 0.00 -2.87 0.00 0.00 58.31 56.20 2wp8 n LYS 429 Cb 0.46 -1.91 0.44 0.00 -1.84 0.00 0.00 35.03 32.17 2wp8 n LYS 429 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2wp8 s LEU 431 N -4.02 4.31 0.00 0.00 1.43 -0.83 -4.65 118.68 114.92 2wp8 s LEU 431 Ca 0.06 0.11 -0.15 0.00 -1.03 0.00 0.00 54.13 53.12 2wp8 s LEU 431 Cb 0.10 -2.89 0.20 0.00 0.03 0.00 0.00 46.19 43.63 2wp8 s LEU 431 CO 0.38 -0.06 1.20 -0.81 0.23 0.00 0.00 176.35 177.30 2wp8 n PRO 432 N -1.26 -1.19 -3.40 1.29 -0.04 -1.26 -4.46 135.00 124.68 2wp8 n PRO 432 Ca -0.08 -1.86 -0.22 0.00 -0.04 0.00 0.00 63.50 61.30 2wp8 n PRO 432 Cb 0.56 -1.24 -0.00 0.00 -0.04 0.00 0.00 33.50 32.78 2wp8 n PRO 432 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 2wp8 s LYS 433 N -5.63 3.27 -0.04 0.54 -2.85 -1.26 -4.55 119.74 109.23 2wp8 s LYS 433 Ca 0.68 -0.62 0.05 0.00 -1.00 0.00 0.00 55.97 55.08 2wp8 s LYS 433 Cb -0.02 -2.71 -0.01 0.00 -2.06 0.00 0.00 37.83 33.03 2wp8 s LYS 433 CO 0.48 0.06 -0.18 0.08 0.10 0.00 0.00 175.35 175.88 2wp8 s VAL 434 N -2.29 1.51 0.03 1.79 1.01 -0.58 -4.14 120.40 117.73 2wp8 s VAL 434 Ca 0.42 -0.78 -0.26 0.00 0.00 0.00 0.00 61.98 61.37 2wp8 s VAL 434 Cb -0.10 -1.28 -0.05 0.00 0.00 0.00 0.00 36.38 34.95 2wp8 s VAL 434 CO 0.34 0.43 0.81 -0.13 0.00 0.00 0.00 175.10 176.55 2wp8 s ARG 435 N -0.14 4.52 0.01 2.72 0.52 -0.01 -0.87 118.95 125.70 2wp8 s ARG 435 Ca -0.00 1.13 -0.01 0.00 -0.52 0.00 0.00 55.73 56.32 2wp8 s ARG 435 Cb -0.10 -3.39 -0.01 0.00 0.52 0.00 0.00 34.95 31.97 2wp8 s ARG 435 CO 0.01 0.20 0.01 0.96 0.02 0.00 0.00 175.30 176.50 2wp8 s ILE 436 N 0.21 0.08 -0.16 1.52 -4.36 -1.00 0.69 121.20 118.18 2wp8 s ILE 436 Ca 0.41 -0.69 -0.05 0.00 -0.26 0.00 0.00 60.65 60.06 2wp8 s ILE 436 Cb -0.20 -0.24 -0.03 0.00 1.25 0.00 0.00 42.46 43.23 2wp8 s ILE 436 CO 0.24 -0.38 0.01 -0.60 0.24 0.00 0.00 174.94 174.45 2wp8 s ARG 437 N -1.14 3.70 -0.11 0.37 3.52 -1.26 -1.92 118.95 122.11 2wp8 s ARG 437 Ca -0.12 -0.43 -0.06 0.00 -0.13 0.00 0.00 55.73 54.99 2wp8 s ARG 437 Cb -0.08 -3.02 0.04 0.00 -1.56 0.00 0.00 34.95 30.34 2wp8 s ARG 437 CO -0.00 0.33 0.25 -0.08 -0.81 0.00 0.00 175.30 174.99 2wp8 s THR 438 N 0.16 -0.03 0.60 4.11 -1.32 -0.63 -4.80 115.64 113.73 2wp8 s THR 438 Ca 0.01 0.12 0.39 0.00 -1.21 0.00 0.00 61.69 61.00 2wp8 s THR 438 Cb -0.13 -0.39 0.41 0.00 -1.51 0.00 0.00 72.50 70.89 2wp8 s THR 438 CO 0.02 0.05 2.31 0.03 -2.21 0.00 0.00 174.62 174.81 2wp8 h ARG 439 N 6.94 0.00 -0.16 7.08 3.08 -1.87 -1.69 114.38 127.76 2wp8 h ARG 439 Ca -0.38 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.61 2wp8 h ARG 439 Cb 1.16 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.18 2wp8 h ARG 439 CO 0.37 0.01 -0.17 0.54 -1.07 0.00 0.00 179.97 179.64 2wp8 n ARG 440 N -3.33 1.83 -0.27 0.04 1.74 -1.26 -4.46 116.66 110.95 2wp8 n ARG 440 Ca -0.03 -3.04 -0.04 0.00 -0.77 0.00 0.00 57.85 53.97 2wp8 n ARG 440 Cb 0.09 -1.70 -0.02 0.00 -1.02 0.00 0.00 32.46 29.81 2wp8 n ARG 440 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wp8 n ALA 441 N -1.09 -0.25 -0.01 7.54 0.00 -1.22 -1.29 120.51 124.19 2wp8 n ALA 441 Ca 0.24 0.61 -0.09 0.00 0.00 0.00 0.00 53.44 54.20 2wp8 n ALA 441 Cb 0.83 -0.19 0.07 0.00 0.00 0.00 0.00 19.45 20.16 2wp8 n ALA 441 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wp8 h ALA 442 N 0.62 0.74 -0.21 0.00 0.00 -1.80 -3.04 119.26 115.58 2wp8 h ALA 442 Ca 0.17 -0.48 -0.06 0.00 0.00 0.00 0.00 54.91 54.53 2wp8 h ALA 442 Cb 0.33 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2wp8 h ALA 442 CO -0.64 0.67 -0.10 0.93 0.00 0.00 0.00 179.25 180.11 2wp8 h GLU 443 N 0.46 0.44 0.00 0.00 5.08 -1.63 -3.01 114.58 115.92 2wp8 h GLU 443 Ca 0.02 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 2wp8 h GLU 443 Cb 1.02 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.26 2wp8 h GLU 443 CO 0.09 0.72 0.00 1.28 -1.00 0.00 0.00 179.01 180.11 2wp8 n LEU 444 N -4.55 0.00 0.31 1.33 4.77 -0.41 -4.41 117.00 114.04 2wp8 n LEU 444 Ca -0.05 0.00 0.20 0.00 -0.03 0.00 0.00 56.01 56.13 2wp8 n LEU 444 Cb 0.33 0.00 0.96 0.00 -2.33 0.00 0.00 43.42 42.37 2wp8 n LEU 444 CO 0.39 0.00 1.09 0.25 -1.33 0.00 0.00 177.39 177.79 2wp8 h LEU 445 N 0.00 0.00 -3.02 2.23 5.85 -1.41 -1.04 115.31 117.93 2wp8 h LEU 445 Ca 0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2wp8 h LEU 445 Cb 0.00 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 40.97 2wp8 h LEU 445 CO 0.00 0.01 -0.58 0.47 -0.34 0.00 0.00 178.44 178.01 2wp8 n ASP 446 N -3.15 1.68 -4.80 1.25 8.00 -1.26 -4.77 116.55 113.50 2wp8 n ASP 446 Ca -0.01 -3.66 -0.36 0.00 0.71 0.00 0.00 54.79 51.46 2wp8 n ASP 446 Cb 0.18 -0.50 -0.07 0.00 -0.02 0.00 0.00 41.12 40.71 2wp8 n ASP 446 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2wp8 s LYS 447 N -2.84 3.24 -0.63 -1.24 -0.14 -0.39 -1.87 119.74 115.87 2wp8 s LYS 447 Ca 0.38 -0.26 -0.27 0.00 -1.36 0.00 0.00 55.97 54.45 2wp8 s LYS 447 Cb 0.37 -3.02 0.01 0.00 -1.68 0.00 0.00 37.83 33.52 2wp8 s LYS 447 CO -0.08 0.74 1.42 0.50 -0.76 0.00 0.00 175.35 177.17 2wp8 s ARG 448 N -1.05 3.18 0.37 1.68 3.52 -0.53 -4.51 118.95 121.61 2wp8 s ARG 448 Ca 0.15 0.25 0.07 0.00 -0.13 0.00 0.00 55.73 56.07 2wp8 s ARG 448 Cb -0.12 -4.17 -0.01 0.00 -1.56 0.00 0.00 34.95 29.08 2wp8 s ARG 448 CO 0.04 -2.11 0.41 0.96 -0.81 0.00 0.00 175.30 173.80 2wp8 s ILE 449 N 6.33 3.37 -0.09 4.11 -4.36 0.27 -1.77 121.20 129.06 2wp8 s ILE 449 Ca 0.49 -1.20 0.01 0.00 -0.26 0.00 0.00 60.65 59.68 2wp8 s ILE 449 Cb -0.10 -3.16 -0.02 0.00 1.25 0.00 0.00 42.46 40.42 2wp8 s ILE 449 CO 0.21 -0.10 -0.11 -0.69 0.24 0.00 0.00 174.94 174.49 2wp8 s VAL 450 N -2.32 3.26 0.26 8.37 1.01 0.96 -0.39 120.40 131.55 2wp8 s VAL 450 Ca 0.46 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.83 2wp8 s VAL 450 Cb -0.07 -2.34 -0.05 0.00 0.00 0.00 0.00 36.38 33.93 2wp8 s VAL 450 CO 0.29 0.56 0.12 0.27 0.00 0.00 0.00 175.10 176.33 2wp8 s ILE 451 N -0.24 0.43 -0.01 2.22 -5.25 0.81 -0.73 121.20 118.43 2wp8 s ILE 451 Ca 0.02 -2.00 0.02 0.00 -0.99 0.00 0.00 60.65 57.70 2wp8 s ILE 451 Cb -0.13 -2.59 -0.00 0.00 2.95 0.00 0.00 42.46 42.69 2wp8 s ILE 451 CO 0.03 0.00 -0.08 -0.44 -1.79 0.00 0.00 174.94 172.66 2wp8 s SER 452 N -3.31 0.98 0.21 4.36 0.01 -0.94 -0.72 113.70 114.29 2wp8 s SER 452 Ca 0.37 -0.15 -0.30 0.00 1.31 0.00 0.00 55.95 57.19 2wp8 s SER 452 Cb 0.07 -0.16 -0.08 0.00 0.21 0.00 0.00 66.02 66.06 2wp8 s SER 452 CO 0.14 0.08 0.94 -0.63 0.41 0.00 0.00 173.24 174.19 2wp8 s ILE 453 N -0.05 4.16 -0.17 1.44 -1.09 -1.26 -1.16 121.20 123.08 2wp8 s ILE 453 Ca 0.01 2.08 -0.01 0.00 -2.23 0.00 0.00 60.65 60.50 2wp8 s ILE 453 Cb -0.05 -4.32 -0.10 0.00 -1.58 0.00 0.00 42.46 36.41 2wp8 s ILE 453 CO -0.00 0.46 -0.16 0.47 -1.23 0.00 0.00 174.94 174.48 2wp8 n ASP 454 N 1.75 2.39 -3.69 3.58 8.00 0.57 -4.93 116.55 124.21 2wp8 n ASP 454 Ca -0.01 -0.02 -0.09 0.00 0.71 0.00 0.00 54.79 55.38 2wp8 n ASP 454 Cb 0.47 -0.32 -0.02 0.00 -0.02 0.00 0.00 41.12 41.24 2wp8 n ASP 454 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2wp8 s SER 455 N -5.80 -0.36 -0.45 -2.24 1.04 -1.09 -5.03 113.70 99.75 2wp8 s SER 455 Ca -0.22 -0.36 0.05 0.00 0.48 0.00 0.00 55.95 55.89 2wp8 s SER 455 Cb 0.06 0.66 0.18 0.00 0.10 0.00 0.00 66.02 67.02 2wp8 s SER 455 CO 0.36 -1.16 0.51 1.87 0.98 0.00 0.00 173.24 175.80 2wp8 n TRP 456 N -0.43 -2.11 -1.73 5.02 -0.00 -1.26 -0.80 117.44 116.13 2wp8 n TRP 456 Ca -0.09 -2.52 -0.30 0.00 -0.00 0.00 0.00 57.50 54.59 2wp8 n TRP 456 Cb 0.61 0.75 0.07 0.00 -0.00 0.00 0.00 31.31 32.75 2wp8 n TRP 456 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 2wp8 s PRO 457 N 0.35 2.33 0.37 5.87 0.04 -1.26 -4.95 135.00 137.75 2wp8 s PRO 457 Ca 0.32 0.48 0.13 0.00 0.04 0.00 0.00 61.00 61.96 2wp8 s PRO 457 Cb 0.03 -1.96 0.94 0.00 0.04 0.00 0.00 34.50 33.55 2wp8 s PRO 457 CO -0.14 -1.41 1.83 1.79 0.04 0.00 0.00 177.00 179.11 2wp8 h THR 458 N -0.93 0.70 -0.53 1.26 1.35 -1.96 -2.64 112.91 110.16 2wp8 h THR 458 Ca -0.46 -0.19 -0.11 0.00 -0.55 0.00 0.00 66.41 65.09 2wp8 h THR 458 Cb 1.27 0.09 -0.07 0.00 -1.73 0.00 0.00 68.15 67.72 2wp8 h THR 458 CO 0.62 0.10 0.14 0.35 -0.25 0.00 0.00 175.52 176.49 2wp8 n THR 459 N -4.60 2.27 -4.11 6.82 -2.24 -1.26 -1.41 114.28 109.74 2wp8 n THR 459 Ca 0.21 -1.17 -0.21 0.00 -2.27 0.00 0.00 64.05 60.60 2wp8 n THR 459 Cb 0.64 -0.41 -0.17 0.00 -2.10 0.00 0.00 70.33 68.29 2wp8 n THR 459 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2wp8 s HIS 460 N -2.39 0.82 0.05 4.78 4.02 -1.00 -5.00 115.29 116.58 2wp8 s HIS 460 Ca 0.42 -0.25 0.33 0.00 1.02 0.00 0.00 55.06 56.58 2wp8 s HIS 460 Cb 0.33 -0.74 1.44 0.00 -1.02 0.00 0.00 32.58 32.59 2wp8 s HIS 460 CO 0.11 -0.24 1.97 -0.22 1.02 0.00 0.00 174.74 177.39 2wp8 h LYS 461 N 7.40 0.00 -4.55 1.40 3.64 -1.86 -3.44 116.57 119.16 2wp8 h LYS 461 Ca -0.34 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 58.77 2wp8 h LYS 461 Cb 1.15 0.00 -0.21 0.00 -0.41 0.00 0.00 32.23 32.76 2wp8 h LYS 461 CO 0.43 0.00 -0.73 0.71 -2.27 0.00 0.00 179.45 177.59 2wp8 s TYR 462 N -3.66 0.67 0.78 1.91 1.51 -1.26 -5.08 117.35 112.21 2wp8 s TYR 462 Ca 0.01 -0.53 -0.13 0.00 -1.01 0.00 0.00 57.07 55.41 2wp8 s TYR 462 Cb 0.09 -0.40 0.07 0.00 -0.11 0.00 0.00 41.96 41.61 2wp8 s TYR 462 CO 0.48 -0.09 1.16 -1.25 -1.11 0.00 0.00 175.55 174.74 2wp8 s PRO 463 N -1.72 1.93 -0.11 -1.71 0.04 -1.26 -4.78 135.00 127.39 2wp8 s PRO 463 Ca -0.09 1.58 -0.02 0.00 0.04 0.00 0.00 61.00 62.51 2wp8 s PRO 463 Cb -0.09 -1.83 -0.03 0.00 0.04 0.00 0.00 34.50 32.59 2wp8 s PRO 463 CO -0.00 -1.95 -0.02 -1.17 0.04 0.00 0.00 177.00 173.90 2wp8 s LEU 464 N -5.61 3.42 0.00 -3.56 2.96 0.02 -0.83 118.68 115.08 2wp8 s LEU 464 Ca 0.70 0.03 0.00 0.00 -0.22 0.00 0.00 54.13 54.63 2wp8 s LEU 464 Cb -0.25 -1.80 0.00 0.00 0.50 0.00 0.00 46.19 44.65 2wp8 s LEU 464 CO 0.50 0.30 0.00 0.61 -1.32 0.00 0.00 176.35 176.43 2wp8 n GLY 465 N 2.68 4.48 3.37 7.98 0.00 0.22 -0.32 105.19 123.60 2wp8 n GLY 465 Ca -0.18 -1.64 -0.15 0.00 0.00 0.00 0.00 46.02 44.05 2wp8 n GLY 465 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2wp8 s HIS 466 N -1.56 -0.43 0.26 1.61 -3.43 -0.31 -4.33 115.29 107.10 2wp8 s HIS 466 Ca 0.00 0.83 -0.30 0.00 -0.80 0.00 0.00 55.06 54.80 2wp8 s HIS 466 Cb 0.00 0.22 -0.10 0.00 -1.43 0.00 0.00 32.58 31.27 2wp8 s HIS 466 CO 0.00 -0.42 1.34 0.12 -2.00 0.00 0.00 174.74 173.78 2wp8 s PHE 467 N -0.82 3.13 -0.08 0.38 5.36 -1.26 -2.21 117.98 122.47 2wp8 s PHE 467 Ca -0.09 1.23 -0.08 0.00 -0.96 0.00 0.00 56.93 57.04 2wp8 s PHE 467 Cb -0.03 -3.68 -0.04 0.00 -0.34 0.00 0.00 43.02 38.92 2wp8 s PHE 467 CO 0.05 -2.08 -0.17 0.28 -1.46 0.00 0.00 175.22 171.84 2wp8 n VAL 468 N 1.94 1.09 -3.79 3.12 0.31 0.09 -4.92 118.33 116.17 2wp8 n VAL 468 Ca 0.04 0.08 -0.04 0.00 -0.01 0.00 0.00 64.34 64.41 2wp8 n VAL 468 Cb 0.42 -1.84 -0.01 0.00 -0.91 0.00 0.00 33.84 31.50 2wp8 n VAL 468 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wp8 s ARG 469 N -2.35 1.35 -0.22 5.55 1.70 -1.12 -5.00 118.95 118.86 2wp8 s ARG 469 Ca -0.16 -0.76 -0.03 0.00 -0.47 0.00 0.00 55.73 54.30 2wp8 s ARG 469 Cb 0.04 0.45 -0.00 0.00 -0.57 0.00 0.00 34.95 34.87 2wp8 s ARG 469 CO 0.22 -0.62 -0.06 0.34 -1.08 0.00 0.00 175.30 174.10 2wp8 s ASP 470 N -2.98 4.20 0.00 -2.89 3.68 -1.26 -0.03 116.67 117.40 2wp8 s ASP 470 Ca 0.13 -0.48 0.28 0.00 2.13 0.00 0.00 52.55 54.61 2wp8 s ASP 470 Cb -0.02 -1.71 1.08 0.00 -1.45 0.00 0.00 42.92 40.81 2wp8 s ASP 470 CO 0.04 -0.03 1.79 0.18 0.13 0.00 0.00 175.17 177.27 2wp8 n LEU 471 N 4.77 0.29 0.00 -1.34 4.77 -0.73 -5.00 117.00 119.76 2wp8 n LEU 471 Ca -0.18 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2wp8 n LEU 471 Cb 0.50 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 2wp8 n LEU 471 CO 0.28 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 2wp8 n GLY 472 N 1.41 -0.36 3.73 -0.72 0.00 -1.25 -4.44 105.19 103.57 2wp8 n GLY 472 Ca 0.10 -2.25 -0.30 0.00 0.00 0.00 0.00 46.02 43.56 2wp8 n GLY 472 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wp8 s THR 473 N -0.33 2.82 -0.08 2.61 -4.23 -1.26 -1.45 115.64 113.72 2wp8 s THR 473 Ca 0.00 0.27 0.18 0.00 -1.18 0.00 0.00 61.69 60.95 2wp8 s THR 473 Cb 0.00 -2.77 0.13 0.00 1.34 0.00 0.00 72.50 71.20 2wp8 s THR 473 CO 0.00 -0.35 1.57 0.16 -0.54 0.00 0.00 174.62 175.46 2wp8 h ILE 474 N -1.43 0.74 0.00 2.99 3.07 -1.70 -2.25 117.51 118.93 2wp8 h ILE 474 Ca -0.48 -1.82 0.00 0.00 1.55 0.00 0.00 64.86 64.11 2wp8 h ILE 474 Cb 1.27 2.20 0.00 0.00 -0.27 0.00 0.00 36.82 40.02 2wp8 h ILE 474 CO 0.54 0.39 -0.11 -0.62 -1.05 0.00 0.00 178.15 177.30 2wp8 n GLU 475 N -3.29 0.13 -0.12 0.16 4.71 -1.26 -4.62 120.64 116.36 2wp8 n GLU 475 Ca 0.01 0.09 0.22 0.00 -0.01 0.00 0.00 57.16 57.48 2wp8 n GLU 475 Cb 0.63 -1.64 0.65 0.00 -1.01 0.00 0.00 31.44 30.07 2wp8 n GLU 475 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 2wp8 h SER 476 N 0.00 0.12 0.00 1.62 0.87 -1.76 -3.46 113.55 110.94 2wp8 h SER 476 Ca 0.00 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2wp8 h SER 476 Cb 0.62 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2wp8 h SER 476 CO 0.00 0.05 0.00 0.00 -0.53 0.00 0.00 176.83 176.35 2wp8 n ALA 477 N -2.63 0.00 -0.03 6.23 0.00 -1.26 -4.13 120.51 118.70 2wp8 n ALA 477 Ca 0.15 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.53 2wp8 n ALA 477 Cb 0.73 0.00 0.13 0.00 0.00 0.00 0.00 19.45 20.31 2wp8 n ALA 477 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 2wp8 h GLN 478 N 0.00 0.60 0.00 0.00 -0.00 -1.95 -1.40 115.11 112.37 2wp8 h GLN 478 Ca 0.00 -0.26 -0.01 0.00 -0.00 0.00 0.00 58.65 58.38 2wp8 h GLN 478 Cb 0.00 -0.02 -0.00 0.00 -0.00 0.00 0.00 27.48 27.46 2wp8 h GLN 478 CO 0.00 0.83 -0.06 0.00 -0.00 0.00 0.00 178.83 179.60 2wp8 h ALA 479 N 1.16 1.05 0.15 0.06 0.00 -1.78 -2.29 119.26 117.61 2wp8 h ALA 479 Ca 0.06 -0.05 -0.21 0.00 0.00 0.00 0.00 54.91 54.71 2wp8 h ALA 479 Cb 0.77 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.57 2wp8 h ALA 479 CO 0.06 0.07 -0.96 1.49 0.00 0.00 0.00 179.25 179.91 2wp8 h GLU 480 N 0.00 0.32 -0.34 0.00 4.22 -1.72 -2.85 114.58 114.21 2wp8 h GLU 480 Ca -0.00 -0.54 0.03 0.00 0.08 0.00 0.00 59.36 58.93 2wp8 h GLU 480 Cb 0.44 0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.86 2wp8 h GLU 480 CO 0.01 1.26 0.14 1.15 -2.18 0.00 0.00 179.01 179.38 2wp8 h THR 481 N -0.31 0.93 -0.71 0.32 2.02 -1.09 -0.99 112.91 113.08 2wp8 h THR 481 Ca -0.18 -0.10 0.07 0.00 0.77 0.00 0.00 66.41 66.97 2wp8 h THR 481 Cb 1.71 0.62 -0.04 0.00 -1.74 0.00 0.00 68.15 68.69 2wp8 h THR 481 CO 0.15 0.05 0.47 -0.08 0.37 0.00 0.00 175.52 176.48 2wp8 h GLU 482 N 0.29 0.70 -0.17 6.66 4.81 -1.49 -2.03 114.58 123.34 2wp8 h GLU 482 Ca 0.15 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.24 2wp8 h GLU 482 Cb 0.10 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 2wp8 h GLU 482 CO -0.13 0.46 -0.26 0.00 -0.73 0.00 0.00 179.01 178.35 2wp8 h ALA 483 N 1.62 0.26 -0.48 2.92 0.00 -1.00 -0.69 119.26 121.89 2wp8 h ALA 483 Ca 0.31 -0.39 0.08 0.00 0.00 0.00 0.00 54.91 54.91 2wp8 h ALA 483 Cb 0.29 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.96 2wp8 h ALA 483 CO -0.10 0.25 0.10 -0.07 0.00 0.00 0.00 179.25 179.43 2wp8 h LEU 484 N 0.12 0.02 0.09 0.00 3.38 -0.77 0.15 115.31 118.29 2wp8 h LEU 484 Ca 0.02 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 2wp8 h LEU 484 Cb 0.83 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.69 2wp8 h LEU 484 CO 0.06 0.04 -0.04 -0.07 0.09 0.00 0.00 178.44 178.52 2wp8 h LEU 485 N 0.24 -0.10 -0.79 1.67 3.38 -1.32 -2.23 115.31 116.16 2wp8 h LEU 485 Ca 0.24 -0.25 0.14 0.00 0.09 0.00 0.00 57.88 58.10 2wp8 h LEU 485 Cb 0.31 0.03 -0.09 0.00 0.09 0.00 0.00 40.66 41.00 2wp8 h LEU 485 CO -0.31 0.20 0.37 -0.07 0.09 0.00 0.00 178.44 178.72 2wp8 h LEU 486 N -0.41 0.42 -1.32 1.67 4.07 -1.00 -1.00 115.31 117.74 2wp8 h LEU 486 Ca -0.01 0.09 -0.06 0.00 0.08 0.00 0.00 57.88 57.98 2wp8 h LEU 486 Cb 0.35 0.04 -0.01 0.00 1.08 0.00 0.00 40.66 42.11 2wp8 h LEU 486 CO 0.02 0.18 -0.23 -0.33 -1.08 0.00 0.00 178.44 177.00 2wp8 h GLU 487 N 0.55 0.17 -0.51 1.13 4.39 -0.50 -2.77 114.58 117.04 2wp8 h GLU 487 Ca 0.43 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 60.08 2wp8 h GLU 487 Cb 0.60 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 2wp8 h GLU 487 CO -0.36 0.40 0.00 0.72 -1.16 0.00 0.00 179.01 178.60 2wp8 n HIS 488 N -4.20 1.43 -1.91 4.33 8.25 -0.86 -4.96 115.22 117.30 2wp8 n HIS 488 Ca -0.01 -0.69 -0.18 0.00 -0.26 0.00 0.00 57.72 56.58 2wp8 n HIS 488 Cb 0.33 -0.31 -0.05 0.00 1.12 0.00 0.00 29.99 31.08 2wp8 n HIS 488 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2wp8 n ASP 489 N 0.56 -4.90 -4.69 0.41 2.03 -0.47 -4.88 116.55 104.61 2wp8 n ASP 489 Ca 0.24 0.27 -0.42 0.00 0.52 0.00 0.00 54.79 55.40 2wp8 n ASP 489 Cb 0.93 -4.26 -0.03 0.00 -0.72 0.00 0.00 41.12 37.04 2wp8 n ASP 489 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2wp8 s VAL 490 N -2.67 4.84 0.14 5.18 1.01 -0.65 -5.01 120.40 123.24 2wp8 s VAL 490 Ca 0.00 1.87 -0.30 0.00 0.00 0.00 0.00 61.98 63.55 2wp8 s VAL 490 Cb 0.00 -4.24 -0.07 0.00 0.00 0.00 0.00 36.38 32.07 2wp8 s VAL 490 CO 0.00 0.05 1.11 -0.70 0.00 0.00 0.00 175.10 175.56 2wp8 s GLU 491 N 1.84 4.55 0.00 2.72 2.56 -1.26 -4.51 118.70 124.60 2wp8 s GLU 491 Ca 0.45 1.71 0.00 0.00 0.00 0.00 0.00 54.97 57.13 2wp8 s GLU 491 Cb -0.18 -3.31 0.00 0.00 2.00 0.00 0.00 34.13 32.64 2wp8 s GLU 491 CO 0.17 -0.01 0.23 2.48 -0.56 0.00 0.00 175.26 177.58 2wp8 n TYR 492 N 2.83 0.00 -0.89 5.30 4.11 -1.26 -4.97 117.16 122.28 2wp8 n TYR 492 Ca 0.04 0.00 -0.30 0.00 -0.00 0.00 0.00 57.90 57.65 2wp8 n TYR 492 Cb 0.47 0.00 0.18 0.00 -0.00 0.00 0.00 39.34 39.98 2wp8 n TYR 492 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.86 177.89 2wp8 s ARG 493 N -0.34 0.56 0.87 -3.48 0.52 -1.26 -4.96 118.95 110.86 2wp8 s ARG 493 Ca 0.00 1.01 -0.10 0.00 -0.52 0.00 0.00 55.73 56.11 2wp8 s ARG 493 Cb 0.00 -1.71 0.12 0.00 0.52 0.00 0.00 34.95 33.88 2wp8 s ARG 493 CO 0.00 -2.77 1.12 -2.14 0.02 0.00 0.00 175.30 171.53 2wp8 s PRO 494 N -4.73 1.39 0.51 3.54 0.02 -1.26 -4.96 135.00 129.51 2wp8 s PRO 494 Ca 0.66 1.35 -0.23 0.00 0.02 0.00 0.00 61.00 62.80 2wp8 s PRO 494 Cb -0.21 -1.78 -0.06 0.00 0.02 0.00 0.00 34.50 32.46 2wp8 s PRO 494 CO 0.59 -2.31 1.34 -0.06 -0.33 0.00 0.00 177.00 176.24 2wp8 s PHE 495 N -2.75 2.43 0.46 6.54 0.40 -1.26 -4.96 117.98 118.84 2wp8 s PHE 495 Ca 0.65 1.38 -0.23 0.00 -0.60 0.00 0.00 56.93 58.12 2wp8 s PHE 495 Cb -0.21 -3.76 -0.09 0.00 0.51 0.00 0.00 43.02 39.48 2wp8 s PHE 495 CO 0.57 -2.67 1.07 0.45 0.70 0.00 0.00 175.22 175.35 2wp8 n SER 496 N -0.73 1.52 0.25 1.36 2.88 -1.26 -4.89 113.62 112.76 2wp8 n SER 496 Ca 0.09 1.01 0.12 0.00 -1.33 0.00 0.00 58.87 58.75 2wp8 n SER 496 Cb 0.45 -1.40 0.66 0.00 -0.75 0.00 0.00 64.21 63.16 2wp8 n SER 496 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2wp8 h LYS 497 N 1.48 0.00 -0.01 -1.46 1.57 -2.03 -1.15 116.57 114.97 2wp8 h LYS 497 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2wp8 h LYS 497 Cb 1.33 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.64 2wp8 h LYS 497 CO 0.56 0.15 0.04 0.87 -0.57 0.00 0.00 179.45 180.50 2wp8 h LYS 498 N 0.00 0.00 -0.06 3.15 1.57 -1.99 -2.88 116.57 116.35 2wp8 h LYS 498 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2wp8 h LYS 498 Cb 0.45 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.75 2wp8 h LYS 498 CO 0.02 0.00 -0.00 0.28 -0.57 0.00 0.00 179.45 179.18 2wp8 h VAL 499 N 0.00 1.26 -0.02 0.50 2.07 -1.54 -3.32 116.25 115.20 2wp8 h VAL 499 Ca 0.01 -0.79 0.00 0.00 0.82 0.00 0.00 66.70 66.73 2wp8 h VAL 499 Cb 0.08 1.67 -0.00 0.00 -1.52 0.00 0.00 31.29 31.52 2wp8 h VAL 499 CO -0.00 0.22 -0.01 0.18 0.02 0.00 0.00 177.57 177.98 2wp8 n LEU 500 N -4.86 -0.02 -0.01 2.57 4.77 -1.09 -0.18 117.00 118.19 2wp8 n LEU 500 Ca -0.07 0.53 0.22 0.00 -0.03 0.00 0.00 56.01 56.66 2wp8 n LEU 500 Cb 0.19 -0.25 0.55 0.00 -2.33 0.00 0.00 43.42 41.58 2wp8 n LEU 500 CO 0.34 -0.27 1.20 -0.08 -1.33 0.00 0.00 177.39 177.25 2wp8 h GLU 501 N 0.00 0.00 0.00 3.23 4.81 -1.72 0.39 114.58 121.28 2wp8 h GLU 501 Ca 0.00 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 2wp8 h GLU 501 Cb 0.01 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 2wp8 h GLU 501 CO -0.01 0.00 -0.83 0.00 -0.73 0.00 0.00 179.01 177.43 2wp8 s LEU 503 N -5.70 2.95 0.18 0.00 1.43 0.14 -4.95 118.68 112.73 2wp8 s LEU 503 Ca 0.01 1.63 -0.32 0.00 -1.03 0.00 0.00 54.13 54.42 2wp8 s LEU 503 Cb 0.08 -4.37 -0.11 0.00 0.03 0.00 0.00 46.19 41.82 2wp8 s LEU 503 CO 0.77 -1.82 1.61 -2.84 0.23 0.00 0.00 176.35 174.30 2wp8 s PRO 504 N -5.00 4.19 0.51 1.29 0.02 -1.26 -4.89 135.00 129.85 2wp8 s PRO 504 Ca 0.60 2.44 0.42 0.00 0.02 0.00 0.00 61.00 64.48 2wp8 s PRO 504 Cb -0.15 -3.12 1.63 0.00 0.02 0.00 0.00 34.50 32.87 2wp8 s PRO 504 CO 0.55 -0.65 1.59 0.00 -0.33 0.00 0.00 177.00 178.17 2wp8 h ALA 505 N 6.69 3.40 -0.35 -1.55 0.00 -1.92 -0.08 119.26 125.46 2wp8 h ALA 505 Ca -0.43 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2wp8 h ALA 505 Cb 1.20 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.18 2wp8 h ALA 505 CO 0.92 -2.01 0.00 -0.85 0.00 0.00 0.00 179.25 177.31 2wp8 n GLU 506 N -4.28 2.33 0.00 0.00 0.00 -1.26 -5.02 120.64 112.41 2wp8 n GLU 506 Ca 0.42 -2.14 0.00 0.00 0.00 0.00 0.00 57.16 55.44 2wp8 n GLU 506 Cb 1.79 -1.45 0.00 0.00 0.00 0.00 0.00 31.44 31.78 2wp8 n GLU 506 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2wp8 n GLY 507 N 1.27 2.86 0.19 -1.84 0.00 -0.04 -0.44 105.19 107.19 2wp8 n GLY 507 Ca 0.17 0.01 0.14 0.00 0.00 0.00 0.00 46.02 46.34 2wp8 n GLY 507 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2wp8 h HIS 508 N 0.00 0.00 -0.00 1.61 3.86 -1.94 -0.96 115.15 117.71 2wp8 h HIS 508 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2wp8 h HIS 508 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 2wp8 h HIS 508 CO 0.00 0.00 -0.11 -0.25 0.86 0.00 0.00 177.93 178.43 2wp8 n ASP 509 N -2.49 0.18 -4.52 2.45 8.00 0.42 -4.89 116.55 115.69 2wp8 n ASP 509 Ca -0.00 0.08 -0.50 0.00 0.71 0.00 0.00 54.79 55.07 2wp8 n ASP 509 Cb 0.15 -0.25 -0.04 0.00 -0.02 0.00 0.00 41.12 40.96 2wp8 n ASP 509 CO 0.00 0.00 0.00 1.87 -0.39 0.00 0.00 177.20 178.68 2wp8 n TRP 510 N -1.37 0.77 -3.82 1.24 -0.00 -0.37 -4.99 117.44 108.91 2wp8 n TRP 510 Ca 0.09 0.82 -0.13 0.00 -0.00 0.00 0.00 57.50 58.28 2wp8 n TRP 510 Cb 0.31 -2.17 -0.15 0.00 -0.00 0.00 0.00 31.31 29.31 2wp8 n TRP 510 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 2wp8 s LYS 511 N -0.55 0.02 0.25 5.87 1.02 -1.26 -5.07 119.74 120.02 2wp8 s LYS 511 Ca 0.73 0.13 -0.31 0.00 0.02 0.00 0.00 55.97 56.55 2wp8 s LYS 511 Cb -0.93 -0.10 -0.11 0.00 -0.52 0.00 0.00 37.83 36.17 2wp8 s LYS 511 CO 0.55 -0.08 1.60 0.00 -0.92 0.00 0.00 175.35 176.50 2wp8 s ALA 512 N 0.52 3.78 0.48 5.17 0.00 -1.26 -4.94 121.76 125.50 2wp8 s ALA 512 Ca -0.04 1.52 -0.23 0.00 0.00 0.00 0.00 51.96 53.21 2wp8 s ALA 512 Cb -0.06 -3.65 -0.09 0.00 0.00 0.00 0.00 23.12 19.33 2wp8 s ALA 512 CO -0.02 -0.92 1.06 -0.35 0.00 0.00 0.00 175.76 175.53 2wp8 n PRO 513 N 2.84 1.35 0.03 0.00 -0.04 -1.26 -4.95 135.00 132.97 2wp8 n PRO 513 Ca 0.11 0.49 -0.11 0.00 -0.04 0.00 0.00 63.50 63.94 2wp8 n PRO 513 Cb 0.37 -2.16 -0.09 0.00 -0.04 0.00 0.00 33.50 31.59 2wp8 n PRO 513 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2wp8 h THR 514 N 1.35 1.04 -3.75 0.52 2.02 -2.03 -3.42 112.91 108.65 2wp8 h THR 514 Ca -0.46 -1.26 -0.66 0.00 0.77 0.00 0.00 66.41 64.79 2wp8 h THR 514 Cb 1.34 1.75 -0.20 0.00 -1.74 0.00 0.00 68.15 69.30 2wp8 h THR 514 CO 0.56 0.27 -0.53 -0.54 0.37 0.00 0.00 175.52 175.65 2wp8 s LYS 515 N -3.42 3.61 0.53 6.66 1.02 -1.26 -4.98 119.74 121.91 2wp8 s LYS 515 Ca -0.14 -0.54 0.18 0.00 0.02 0.00 0.00 55.97 55.49 2wp8 s LYS 515 Cb 0.00 -3.64 1.35 0.00 -0.52 0.00 0.00 37.83 35.02 2wp8 s LYS 515 CO 0.53 -0.32 2.16 -0.07 -0.92 0.00 0.00 175.35 176.72 2wp8 h LEU 516 N 8.39 0.00 -1.09 3.17 4.07 -1.98 -0.79 115.31 127.07 2wp8 h LEU 516 Ca -0.34 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.62 2wp8 h LEU 516 Cb 1.17 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.91 2wp8 h LEU 516 CO 0.60 0.01 0.00 -0.90 -1.08 0.00 0.00 178.44 177.06 2wp8 n ASP 517 N -4.42 1.60 -4.70 -0.43 5.75 -1.26 -4.71 116.55 108.39 2wp8 n ASP 517 Ca -0.03 -1.91 -0.44 0.00 -0.01 0.00 0.00 54.79 52.40 2wp8 n ASP 517 Cb 0.09 -0.18 -0.03 0.00 -1.03 0.00 0.00 41.12 39.98 2wp8 n ASP 517 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 2wp8 n ASP 518 N 0.35 3.32 0.02 -1.12 -0.08 -0.31 -4.91 116.55 113.82 2wp8 n ASP 518 Ca 0.12 1.11 -0.19 0.00 -1.51 0.00 0.00 54.79 54.32 2wp8 n ASP 518 Cb 0.27 -1.49 -0.10 0.00 2.34 0.00 0.00 41.12 42.14 2wp8 n ASP 518 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2wp8 h PRO 519 N 5.24 0.65 -0.24 -0.67 0.14 -1.92 -1.24 132.00 133.96 2wp8 h PRO 519 Ca -0.45 -0.66 0.01 0.00 0.14 0.00 0.00 66.00 65.03 2wp8 h PRO 519 Cb 1.24 0.18 -0.02 0.00 0.14 0.00 0.00 31.00 32.55 2wp8 h PRO 519 CO 0.83 1.26 0.14 1.49 0.14 0.00 0.00 178.00 181.86 2wp8 h GLU 520 N 0.30 0.28 -0.67 0.86 4.81 -1.99 -0.92 114.58 117.25 2wp8 h GLU 520 Ca -0.10 -0.02 0.10 0.00 -0.13 0.00 0.00 59.36 59.22 2wp8 h GLU 520 Cb 1.55 -0.06 -0.08 0.00 0.63 0.00 0.00 28.75 30.79 2wp8 h GLU 520 CO 0.18 0.18 0.27 0.00 -0.73 0.00 0.00 179.01 178.91 2wp8 h ALA 521 N 1.11 0.89 0.00 2.92 0.00 -1.94 -0.82 119.26 121.42 2wp8 h ALA 521 Ca 0.09 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2wp8 h ALA 521 Cb -0.00 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2wp8 h ALA 521 CO -0.05 -0.16 -0.36 0.28 0.00 0.00 0.00 179.25 178.97 2wp8 h VAL 522 N 0.46 1.08 0.03 0.00 2.07 -0.64 -0.07 116.25 119.19 2wp8 h VAL 522 Ca 0.34 -1.29 -0.08 0.00 0.82 0.00 0.00 66.70 66.49 2wp8 h VAL 522 Cb 0.43 1.73 0.01 0.00 -1.52 0.00 0.00 31.29 31.94 2wp8 h VAL 522 CO -0.32 0.35 -0.31 0.28 0.02 0.00 0.00 177.57 177.58 2wp8 h SER 523 N 0.00 0.22 -0.00 0.57 0.02 -0.89 -2.95 113.55 110.52 2wp8 h SER 523 Ca -0.00 -0.88 0.00 0.00 -0.84 0.00 0.00 61.79 60.07 2wp8 h SER 523 Cb 0.70 -0.07 -0.00 0.00 0.14 0.00 0.00 62.40 63.17 2wp8 h SER 523 CO 0.05 1.08 0.01 0.07 -1.14 0.00 0.00 176.83 176.89 2wp8 h LYS 524 N -0.61 0.00 -0.99 3.45 -0.00 -0.96 -3.39 116.57 114.08 2wp8 h LYS 524 Ca -0.05 0.00 0.03 0.00 -0.00 0.00 0.00 60.65 60.63 2wp8 h LYS 524 Cb 1.15 0.00 -0.21 0.00 -0.00 0.00 0.00 32.23 33.17 2wp8 h LYS 524 CO 0.06 0.00 -0.38 0.34 -0.00 0.00 0.00 179.45 179.47 2wp8 s ASP 525 N -5.71 -1.61 0.46 7.07 2.15 -0.06 -5.06 116.67 113.91 2wp8 s ASP 525 Ca -0.05 0.14 0.25 0.00 0.43 0.00 0.00 52.55 53.32 2wp8 s ASP 525 Cb 0.14 2.02 0.64 0.00 -0.30 0.00 0.00 42.92 45.42 2wp8 s ASP 525 CO 0.49 -0.29 1.71 1.55 -0.17 0.00 0.00 175.17 178.46 2wp8 h PRO 526 N 7.94 0.00 0.00 4.34 0.13 -1.72 -3.11 132.00 139.57 2wp8 h PRO 526 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 2wp8 h PRO 526 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2wp8 h PRO 526 CO 0.14 0.05 0.00 1.28 -0.23 0.00 0.00 178.00 179.24 2wp8 n LEU 527 N -3.12 0.00 0.05 1.56 4.77 -1.26 -2.96 117.00 116.03 2wp8 n LEU 527 Ca 0.03 0.40 -0.00 0.00 -0.03 0.00 0.00 56.01 56.40 2wp8 n LEU 527 Cb 0.48 -0.40 0.30 0.00 -2.33 0.00 0.00 43.42 41.47 2wp8 n LEU 527 CO 0.33 -0.31 0.86 0.25 -1.33 0.00 0.00 177.39 177.19 2wp8 h LEU 528 N 0.00 0.38 -0.88 2.23 5.85 -1.90 -2.59 115.31 118.40 2wp8 h LEU 528 Ca 0.00 -0.09 0.14 0.00 0.84 0.00 0.00 57.88 58.77 2wp8 h LEU 528 Cb 0.09 -0.10 -0.09 0.00 0.37 0.00 0.00 40.66 40.93 2wp8 h LEU 528 CO 0.00 0.54 0.48 0.71 -0.34 0.00 0.00 178.44 179.83 2wp8 h THR 529 N 0.37 0.77 0.00 1.05 1.35 -1.81 0.76 112.91 115.40 2wp8 h THR 529 Ca 0.07 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.69 2wp8 h THR 529 Cb 0.44 0.01 0.00 0.00 -1.73 0.00 0.00 68.15 66.87 2wp8 h THR 529 CO 0.03 0.13 0.00 0.29 -0.25 0.00 0.00 175.52 175.71 2wp8 n LYS 530 N -4.82 0.04 -2.68 4.72 5.02 -0.98 -4.84 118.16 114.63 2wp8 n LYS 530 Ca 0.18 0.15 -0.41 0.00 -2.02 0.00 0.00 58.31 56.21 2wp8 n LYS 530 Cb 0.42 -1.56 -0.04 0.00 -0.02 0.00 0.00 35.03 33.84 2wp8 n LYS 530 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2wp8 s ARG 531 N -3.04 4.64 0.42 1.97 3.52 0.26 -4.77 118.95 121.96 2wp8 s ARG 531 Ca 0.10 1.50 -0.10 0.00 -0.13 0.00 0.00 55.73 57.11 2wp8 s ARG 531 Cb 0.14 -3.37 -0.06 0.00 -1.56 0.00 0.00 34.95 30.09 2wp8 s ARG 531 CO 0.42 0.12 0.78 -1.59 -0.81 0.00 0.00 175.30 174.22 2wp8 s LYS 532 N 0.18 3.74 -0.44 5.12 0.00 0.32 -4.91 119.74 123.75 2wp8 s LYS 532 Ca 0.49 0.44 -0.12 0.00 0.00 0.00 0.00 55.97 56.78 2wp8 s LYS 532 Cb -0.24 -2.38 0.07 0.00 0.00 0.00 0.00 37.83 35.28 2wp8 s LYS 532 CO 0.30 -0.07 0.31 0.34 0.00 0.00 0.00 175.35 176.22 2wp8 s ASP 533 N -3.32 5.83 -0.41 0.03 -1.08 -1.26 -1.15 116.67 115.30 2wp8 s ASP 533 Ca 0.51 -1.40 0.05 0.00 -0.52 0.00 0.00 52.55 51.18 2wp8 s ASP 533 Cb -0.10 -2.06 0.52 0.00 -1.46 0.00 0.00 42.92 39.82 2wp8 s ASP 533 CO 0.34 -0.57 1.65 0.18 0.52 0.00 0.00 175.17 177.29 2wp8 n LEU 534 N 5.03 5.65 0.00 -1.34 4.77 -0.43 -4.66 117.00 126.03 2wp8 n LEU 534 Ca -0.11 -4.02 0.13 0.00 -0.03 0.00 0.00 56.01 51.98 2wp8 n LEU 534 Cb 0.43 -0.71 0.58 0.00 -2.33 0.00 0.00 43.42 41.39 2wp8 n LEU 534 CO 0.42 1.41 0.93 0.54 -1.33 0.00 0.00 177.39 179.35 2wp8 n ARG 535 N -1.02 0.04 0.07 3.23 1.74 -1.25 -2.11 116.66 117.36 2wp8 n ARG 535 Ca 0.48 0.04 0.12 0.00 -0.77 0.00 0.00 57.85 57.72 2wp8 n ARG 535 Cb 1.08 -1.50 0.20 0.00 -1.02 0.00 0.00 32.46 31.22 2wp8 n ARG 535 CO 0.00 0.00 0.00 0.38 -1.52 0.00 0.00 177.63 176.49 2wp8 h ASP 536 N 0.00 0.00 -2.89 0.55 2.03 -1.94 -3.44 116.42 110.72 2wp8 h ASP 536 Ca 0.00 -0.17 -0.53 0.00 -0.73 0.00 0.00 57.03 55.59 2wp8 h ASP 536 Cb 0.44 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 38.95 2wp8 h ASP 536 CO 0.00 0.09 0.83 -0.54 -1.03 0.00 0.00 179.24 178.58 2wp8 s LYS 537 N -3.17 4.28 -1.29 4.15 -0.14 -0.90 -4.88 119.74 117.80 2wp8 s LYS 537 Ca 0.07 2.11 -0.17 0.00 -1.36 0.00 0.00 55.97 56.62 2wp8 s LYS 537 Cb 0.13 -3.41 0.01 0.00 -1.68 0.00 0.00 37.83 32.87 2wp8 s LYS 537 CO 0.71 -0.55 2.03 1.28 -0.76 0.00 0.00 175.35 178.05 2wp8 n LEU 538 N 4.73 5.61 -4.84 3.17 4.77 -1.26 -4.81 117.00 124.37 2wp8 n LEU 538 Ca 0.13 -3.81 -0.35 0.00 -0.03 0.00 0.00 56.01 51.95 2wp8 n LEU 538 Cb 0.42 -1.60 -0.06 0.00 -2.33 0.00 0.00 43.42 39.85 2wp8 n LEU 538 CO 0.60 0.39 0.31 -0.63 -1.33 0.00 0.00 177.39 176.72 2wp8 s ILE 539 N 4.38 4.75 0.22 -0.08 1.01 -1.26 -4.57 121.20 125.65 2wp8 s ILE 539 Ca 0.52 0.97 -0.06 0.00 0.00 0.00 0.00 60.65 62.08 2wp8 s ILE 539 Cb 0.10 -3.76 -0.02 0.00 0.01 0.00 0.00 42.46 38.79 2wp8 s ILE 539 CO 0.01 0.18 0.28 0.00 0.00 0.00 0.00 174.94 175.42 2wp8 s SER 541 N -3.10 2.97 -0.11 0.00 1.04 0.22 -0.84 113.70 113.89 2wp8 s SER 541 Ca 0.32 -1.11 -0.04 0.00 0.48 0.00 0.00 55.95 55.60 2wp8 s SER 541 Cb 0.04 -0.20 0.06 0.00 0.10 0.00 0.00 66.02 66.01 2wp8 s SER 541 CO 0.11 -0.20 0.22 -0.63 0.98 0.00 0.00 173.24 173.72 2wp8 s ILE 542 N -2.86 -0.35 0.31 -1.02 1.01 -1.25 -1.83 121.20 115.21 2wp8 s ILE 542 Ca 0.28 0.30 0.02 0.00 0.00 0.00 0.00 60.65 61.25 2wp8 s ILE 542 Cb 0.00 -0.38 -0.02 0.00 0.01 0.00 0.00 42.46 42.07 2wp8 s ILE 542 CO 0.11 0.12 0.32 -1.81 0.00 0.00 0.00 174.94 173.69 2wp8 s ASP 543 N 2.36 1.13 0.95 3.58 1.01 -1.04 -4.90 116.67 119.77 2wp8 s ASP 543 Ca 0.02 -1.58 -0.11 0.00 0.71 0.00 0.00 52.55 51.59 2wp8 s ASP 543 Cb -0.12 0.56 0.15 0.00 1.01 0.00 0.00 42.92 44.52 2wp8 s ASP 543 CO -0.07 -1.10 1.05 -0.81 0.21 0.00 0.00 175.17 174.45 2wp8 n PRO 544 N -0.54 -0.66 -2.33 8.23 -0.04 -1.26 -1.79 135.00 136.61 2wp8 n PRO 544 Ca 0.04 -0.13 -0.33 0.00 -0.04 0.00 0.00 63.50 63.04 2wp8 n PRO 544 Cb 0.63 -2.30 -0.02 0.00 -0.04 0.00 0.00 33.50 31.76 2wp8 n PRO 544 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2wp8 s PRO 545 N -4.51 3.72 -0.56 0.54 0.04 -1.26 -3.39 135.00 129.58 2wp8 s PRO 545 Ca 0.66 1.12 0.00 0.00 0.04 0.00 0.00 61.00 62.83 2wp8 s PRO 545 Cb -0.23 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.21 2wp8 s PRO 545 CO 0.60 -0.47 0.00 0.41 0.04 0.00 0.00 177.00 177.58 2wp8 n GLY 546 N -1.07 0.58 3.62 0.56 0.00 -1.26 -5.00 105.19 102.62 2wp8 n GLY 546 Ca 0.08 -0.75 -0.43 0.00 0.00 0.00 0.00 46.02 44.92 2wp8 n GLY 546 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wp8 h VAL 548 N 6.12 0.36 -3.43 0.00 -1.51 -1.94 -3.45 116.25 112.40 2wp8 h VAL 548 Ca -0.26 -1.42 -0.37 0.00 -1.23 0.00 0.00 66.70 63.42 2wp8 h VAL 548 Cb 1.10 2.10 -0.35 0.00 -2.13 0.00 0.00 31.29 32.00 2wp8 h VAL 548 CO 1.05 0.20 -0.75 1.51 -1.23 0.00 0.00 177.57 178.35 2wp8 s ASP 549 N -6.26 0.79 -0.54 4.19 1.47 -1.26 -4.48 116.67 110.57 2wp8 s ASP 549 Ca 0.05 -0.05 -0.10 0.00 1.18 0.00 0.00 52.55 53.63 2wp8 s ASP 549 Cb 0.07 -0.29 0.14 0.00 -0.34 0.00 0.00 42.92 42.49 2wp8 s ASP 549 CO 0.69 -0.12 0.42 -0.63 0.68 0.00 0.00 175.17 176.21 2wp8 s ILE 550 N 1.27 4.46 0.09 2.11 1.01 -1.26 -4.91 121.20 123.97 2wp8 s ILE 550 Ca -0.06 -1.94 0.03 0.00 0.00 0.00 0.00 60.65 58.68 2wp8 s ILE 550 Cb -0.13 -3.90 -0.24 0.00 0.01 0.00 0.00 42.46 38.20 2wp8 s ILE 550 CO -0.02 -0.83 1.19 0.78 0.00 0.00 0.00 174.94 176.06 2wp8 h ASN 551 N 8.29 0.14 -4.17 3.58 4.21 -1.93 -0.19 115.58 125.52 2wp8 h ASN 551 Ca -0.17 -0.16 -0.39 0.00 1.21 0.00 0.00 56.30 56.79 2wp8 h ASN 551 Cb 1.06 -0.05 -0.27 0.00 -1.12 0.00 0.00 38.32 37.94 2wp8 h ASN 551 CO 0.86 1.13 -0.78 1.51 -1.29 0.00 0.00 177.43 178.86 2wp8 s ASP 552 N -6.83 1.18 0.19 5.81 3.84 -1.26 -1.46 116.67 118.13 2wp8 s ASP 552 Ca -0.01 -0.27 -0.04 0.00 -0.00 0.00 0.00 52.55 52.23 2wp8 s ASP 552 Cb 0.09 -0.10 -0.03 0.00 -1.38 0.00 0.00 42.92 41.50 2wp8 s ASP 552 CO 0.84 0.06 0.20 0.00 -0.00 0.00 0.00 175.17 176.27 2wp8 s ALA 553 N -0.47 0.70 -0.06 2.11 0.00 -0.63 -4.54 121.76 118.88 2wp8 s ALA 553 Ca 0.02 -1.40 -0.11 0.00 0.00 0.00 0.00 51.96 50.47 2wp8 s ALA 553 Cb -0.05 1.16 0.02 0.00 0.00 0.00 0.00 23.12 24.25 2wp8 s ALA 553 CO 0.00 -0.62 0.26 -0.51 0.00 0.00 0.00 175.76 174.89 2wp8 s LEU 554 N -3.09 1.01 0.06 0.00 1.43 -0.02 -1.48 118.68 116.61 2wp8 s LEU 554 Ca 0.30 0.31 -0.08 0.00 -1.03 0.00 0.00 54.13 53.64 2wp8 s LEU 554 Cb 0.05 0.99 -0.01 0.00 0.03 0.00 0.00 46.19 47.26 2wp8 s LEU 554 CO 0.08 -0.23 0.15 -1.38 0.23 0.00 0.00 176.35 175.20 2wp8 s HIS 555 N -0.49 0.17 -0.11 0.29 -3.43 -0.96 -1.08 115.29 109.68 2wp8 s HIS 555 Ca -0.06 -0.54 -0.05 0.00 -0.80 0.00 0.00 55.06 53.62 2wp8 s HIS 555 Cb -0.04 -0.10 0.05 0.00 -1.43 0.00 0.00 32.58 31.07 2wp8 s HIS 555 CO 0.02 -0.47 0.23 0.00 -2.00 0.00 0.00 174.74 172.52 2wp8 s ALA 556 N -3.32 -0.47 -0.04 -1.38 0.00 -1.26 -1.72 121.76 113.57 2wp8 s ALA 556 Ca 0.01 0.88 0.01 0.00 0.00 0.00 0.00 51.96 52.85 2wp8 s ALA 556 Cb 0.03 -0.81 0.02 0.00 0.00 0.00 0.00 23.12 22.35 2wp8 s ALA 556 CO -0.08 -0.44 -0.03 0.21 0.00 0.00 0.00 175.76 175.41 2wp8 s LYS 557 N 1.92 0.70 -0.02 0.00 2.20 -0.82 -4.25 119.74 119.46 2wp8 s LYS 557 Ca -0.03 -0.06 -0.30 0.00 -0.36 0.00 0.00 55.97 55.22 2wp8 s LYS 557 Cb -0.11 -0.75 -0.04 0.00 -1.51 0.00 0.00 37.83 35.42 2wp8 s LYS 557 CO -0.08 -0.10 1.17 0.21 -0.36 0.00 0.00 175.35 176.19 2wp8 s LYS 558 N 0.95 4.40 0.46 4.03 2.20 -1.26 -1.83 119.74 128.69 2wp8 s LYS 558 Ca -0.11 1.66 -0.17 0.00 -0.36 0.00 0.00 55.97 56.99 2wp8 s LYS 558 Cb -0.14 -3.49 -0.09 0.00 -1.51 0.00 0.00 37.83 32.60 2wp8 s LYS 558 CO -0.00 -0.34 0.93 -0.51 -0.36 0.00 0.00 175.35 175.06 2wp8 s LEU 559 N 1.75 3.79 0.53 5.43 1.43 0.53 -4.92 118.68 127.21 2wp8 s LEU 559 Ca 0.56 1.54 0.32 0.00 -1.03 0.00 0.00 54.13 55.52 2wp8 s LEU 559 Cb -0.25 -4.43 1.47 0.00 0.03 0.00 0.00 46.19 43.01 2wp8 s LEU 559 CO 0.24 -0.46 1.84 1.55 0.23 0.00 0.00 176.35 179.76 2wp8 h PRO 560 N 1.40 0.04 0.00 1.29 0.13 -1.96 -2.24 132.00 130.66 2wp8 h PRO 560 Ca -0.48 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2wp8 h PRO 560 Cb 1.18 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2wp8 h PRO 560 CO 0.62 0.03 -0.30 0.27 -0.23 0.00 0.00 178.00 178.39 2wp8 n ASN 561 N -4.27 0.40 0.00 1.44 0.23 -1.26 -4.94 115.26 106.86 2wp8 n ASN 561 Ca 0.22 0.16 0.00 0.00 -0.53 0.00 0.00 54.58 54.43 2wp8 n ASN 561 Cb 1.07 -0.13 0.00 0.00 -2.08 0.00 0.00 39.78 38.63 2wp8 n ASN 561 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2wp8 n GLY 562 N 1.45 2.12 3.62 4.83 0.00 -0.84 -5.11 105.19 111.26 2wp8 n GLY 562 Ca 0.06 -0.73 -0.29 0.00 0.00 0.00 0.00 46.02 45.06 2wp8 n GLY 562 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wp8 s ASN 563 N -0.36 2.31 -0.19 1.61 0.01 -1.26 -4.73 114.94 112.33 2wp8 s ASN 563 Ca 0.00 1.61 -0.01 0.00 -0.71 0.00 0.00 52.86 53.74 2wp8 s ASN 563 Cb 0.00 -2.27 0.00 0.00 0.41 0.00 0.00 41.25 39.39 2wp8 s ASN 563 CO 0.00 -3.39 -0.12 0.26 -1.51 0.00 0.00 177.10 172.35 2wp8 s TRP 564 N -2.70 2.86 -0.05 2.20 0.52 -0.54 -0.34 118.94 120.90 2wp8 s TRP 564 Ca 0.66 -1.17 -0.30 0.00 0.02 0.00 0.00 56.10 55.31 2wp8 s TRP 564 Cb -0.22 -2.00 -0.03 0.00 -1.15 0.00 0.00 33.47 30.07 2wp8 s TRP 564 CO 0.60 -0.60 1.15 -2.00 0.02 0.00 0.00 176.95 176.12 2wp8 s GLU 565 N 1.26 4.39 0.02 4.98 2.12 -0.76 -0.91 118.70 129.80 2wp8 s GLU 565 Ca 0.03 1.62 0.03 0.00 0.36 0.00 0.00 54.97 57.01 2wp8 s GLU 565 Cb -0.14 -3.52 -0.02 0.00 0.26 0.00 0.00 34.13 30.71 2wp8 s GLU 565 CO -0.06 -0.37 -0.10 0.08 -0.54 0.00 0.00 175.26 174.27 2wp8 s VAL 566 N 1.95 0.80 -0.05 3.70 1.01 -0.91 -1.95 120.40 124.95 2wp8 s VAL 566 Ca 0.55 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.78 2wp8 s VAL 566 Cb -0.24 -0.73 0.02 0.00 0.00 0.00 0.00 36.38 35.43 2wp8 s VAL 566 CO 0.23 -0.01 -0.05 -0.83 0.00 0.00 0.00 175.10 174.44 2wp8 s GLY 567 N -0.86 0.47 -0.23 4.51 0.00 -0.70 -0.89 107.32 109.62 2wp8 s GLY 567 Ca -0.00 -0.07 -0.06 0.00 0.00 0.00 0.00 44.72 44.59 2wp8 s GLY 567 CO 0.00 0.44 0.02 0.14 0.00 0.00 0.00 173.10 173.70 2wp8 s VAL 568 N 0.93 3.87 -0.22 1.40 1.01 -0.55 -2.26 120.40 124.58 2wp8 s VAL 568 Ca -0.11 -0.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 2wp8 s VAL 568 Cb -0.14 -2.79 0.02 0.00 0.00 0.00 0.00 36.38 33.47 2wp8 s VAL 568 CO 0.00 0.38 -0.11 -1.00 0.00 0.00 0.00 175.10 174.37 2wp8 s HIS 569 N 1.52 2.95 0.04 5.22 0.09 -0.55 -0.50 115.29 124.07 2wp8 s HIS 569 Ca 0.06 -1.50 0.02 0.00 -0.00 0.00 0.00 55.06 53.63 2wp8 s HIS 569 Cb -0.15 -2.01 -0.04 0.00 -0.00 0.00 0.00 32.58 30.38 2wp8 s HIS 569 CO 0.00 -0.73 0.07 0.42 -0.00 0.00 0.00 174.74 174.51 2wp8 s ILE 570 N 1.33 4.54 -0.13 0.60 -1.09 0.56 -1.60 121.20 125.41 2wp8 s ILE 570 Ca 0.03 -0.64 -0.38 0.00 -2.23 0.00 0.00 60.65 57.43 2wp8 s ILE 570 Cb -0.15 -3.13 -0.15 0.00 -1.58 0.00 0.00 42.46 37.44 2wp8 s ILE 570 CO -0.07 0.23 1.64 0.00 -1.23 0.00 0.00 174.94 175.50 2wp8 n ALA 571 N 0.80 -0.21 -1.82 9.38 0.00 -0.54 -0.58 120.51 127.55 2wp8 n ALA 571 Ca -0.11 0.41 -0.42 0.00 0.00 0.00 0.00 53.44 53.33 2wp8 n ALA 571 Cb 0.52 -2.22 -0.00 0.00 0.00 0.00 0.00 19.45 17.75 2wp8 n ALA 571 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2wp8 n ASP 572 N 4.63 4.83 -0.01 0.00 -0.08 -1.25 -4.67 116.55 120.00 2wp8 n ASP 572 Ca 0.23 -2.88 -0.07 0.00 -1.51 0.00 0.00 54.79 50.56 2wp8 n ASP 572 Cb 0.17 -1.60 0.11 0.00 2.34 0.00 0.00 41.12 42.14 2wp8 n ASP 572 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 2wp8 h VAL 573 N 3.78 1.30 -0.11 5.18 2.07 -1.91 -2.90 116.25 123.66 2wp8 h VAL 573 Ca 0.57 -1.54 0.03 0.00 0.82 0.00 0.00 66.70 66.58 2wp8 h VAL 573 Cb 0.58 1.52 -0.00 0.00 -1.52 0.00 0.00 31.29 31.87 2wp8 h VAL 573 CO 1.81 0.49 0.11 0.71 0.02 0.00 0.00 177.57 180.71 2wp8 h THR 574 N 0.48 0.57 -0.07 2.57 1.35 -1.83 0.23 112.91 116.20 2wp8 h THR 574 Ca 0.04 0.00 -0.06 0.00 -0.55 0.00 0.00 66.41 65.84 2wp8 h THR 574 Cb 0.89 0.91 -0.01 0.00 -1.73 0.00 0.00 68.15 68.21 2wp8 h THR 574 CO 0.08 0.00 -0.26 -0.74 -0.25 0.00 0.00 175.52 174.35 2wp8 h HIS 575 N 0.00 0.12 0.00 4.73 6.17 -1.91 -3.29 115.15 120.98 2wp8 h HIS 575 Ca 0.05 -0.02 -0.34 0.00 0.71 0.00 0.00 60.37 60.77 2wp8 h HIS 575 Cb 0.27 -0.03 -0.06 0.00 2.52 0.00 0.00 27.41 30.11 2wp8 h HIS 575 CO 0.00 0.37 -2.13 1.19 0.71 0.00 0.00 177.93 178.07 2wp8 n PHE 576 N -4.19 0.40 -3.66 5.26 3.72 0.43 -4.85 117.46 114.57 2wp8 n PHE 576 Ca -0.02 0.14 -0.38 0.00 -0.05 0.00 0.00 57.45 57.14 2wp8 n PHE 576 Cb 0.34 -1.07 -0.09 0.00 -0.94 0.00 0.00 39.48 37.71 2wp8 n PHE 576 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2wp8 s VAL 577 N -2.53 3.83 0.07 -4.37 1.01 0.52 -4.86 120.40 114.07 2wp8 s VAL 577 Ca -0.09 -2.22 -0.07 0.00 0.00 0.00 0.00 61.98 59.61 2wp8 s VAL 577 Cb 0.07 -3.54 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 2wp8 s VAL 577 CO 0.82 -0.79 0.34 -0.54 0.00 0.00 0.00 175.10 174.94 2wp8 s LYS 578 N 0.86 3.65 0.91 2.72 -0.14 -1.26 -4.66 119.74 121.81 2wp8 s LYS 578 Ca 0.10 -0.01 -0.11 0.00 -1.36 0.00 0.00 55.97 54.60 2wp8 s LYS 578 Cb -0.23 -2.99 0.14 0.00 -1.68 0.00 0.00 37.83 33.07 2wp8 s LYS 578 CO -0.03 0.57 1.10 -2.14 -0.76 0.00 0.00 175.35 174.09 2wp8 s PRO 579 N -2.07 1.10 -1.46 -1.68 0.02 -1.26 -3.55 135.00 126.11 2wp8 s PRO 579 Ca 0.33 1.08 -0.11 0.00 0.02 0.00 0.00 61.00 62.33 2wp8 s PRO 579 Cb -0.13 -1.77 0.05 0.00 0.02 0.00 0.00 34.50 32.66 2wp8 s PRO 579 CO 0.19 -2.42 0.98 0.41 -0.33 0.00 0.00 177.00 175.83 2wp8 n GLY 580 N -0.54 -0.52 3.11 0.52 0.00 -1.26 -5.00 105.19 101.50 2wp8 n GLY 580 Ca 0.08 0.20 -0.12 0.00 0.00 0.00 0.00 46.02 46.18 2wp8 n GLY 580 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wp8 s THR 581 N -3.26 0.62 0.21 2.61 -4.23 -1.23 -5.04 115.64 105.32 2wp8 s THR 581 Ca 0.57 -1.44 -0.11 0.00 -1.18 0.00 0.00 61.69 59.53 2wp8 s THR 581 Cb -0.27 -1.07 0.20 0.00 1.34 0.00 0.00 72.50 72.70 2wp8 s THR 581 CO 0.71 -0.58 1.66 0.00 -0.54 0.00 0.00 174.62 175.86 2wp8 h ALA 582 N 3.86 0.56 -0.48 3.99 0.00 -1.90 -0.24 119.26 125.04 2wp8 h ALA 582 Ca -0.36 0.20 0.08 0.00 0.00 0.00 0.00 54.91 54.83 2wp8 h ALA 582 Cb 1.19 0.35 -0.07 0.00 0.00 0.00 0.00 17.79 19.26 2wp8 h ALA 582 CO 0.51 -0.40 0.09 1.25 0.00 0.00 0.00 179.25 180.70 2wp8 h LEU 583 N 0.09 0.00 -0.36 0.00 5.85 -1.85 -0.71 115.31 118.33 2wp8 h LEU 583 Ca 0.31 0.09 -0.07 0.00 0.84 0.00 0.00 57.88 59.05 2wp8 h LEU 583 Cb 0.51 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 2wp8 h LEU 583 CO -0.55 0.03 -0.05 -0.78 -0.34 0.00 0.00 178.44 176.75 2wp8 h ASP 584 N 0.23 0.66 -0.92 1.25 3.58 -1.39 -2.75 116.42 117.08 2wp8 h ASP 584 Ca 0.24 -0.34 0.08 0.00 0.42 0.00 0.00 57.03 57.43 2wp8 h ASP 584 Cb 0.32 -0.18 -0.07 0.00 1.72 0.00 0.00 39.33 41.12 2wp8 h ASP 584 CO -0.31 0.85 0.57 0.00 -2.88 0.00 0.00 179.24 177.46 2wp8 h ALA 585 N 0.84 1.31 0.79 -0.78 0.00 -0.64 -0.45 119.26 120.33 2wp8 h ALA 585 Ca 0.10 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2wp8 h ALA 585 Cb 0.54 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.12 2wp8 h ALA 585 CO 0.03 0.26 -0.38 1.49 0.00 0.00 0.00 179.25 180.65 2wp8 h GLU 586 N 0.98 -1.02 -0.62 0.00 4.57 -1.02 0.20 114.58 117.67 2wp8 h GLU 586 Ca 0.42 0.07 0.08 0.00 -1.18 0.00 0.00 59.36 58.75 2wp8 h GLU 586 Cb 0.29 0.23 -0.04 0.00 -0.16 0.00 0.00 28.75 29.08 2wp8 h GLU 586 CO -0.21 -0.68 0.41 0.78 -1.18 0.00 0.00 179.01 178.13 2wp8 h GLY 587 N -1.11 0.69 0.86 1.92 0.00 -1.32 0.14 103.07 104.25 2wp8 h GLY 587 Ca -0.11 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 2wp8 h GLY 587 CO 0.18 0.14 0.04 0.00 0.00 0.00 0.00 176.54 176.90 2wp8 h ALA 588 N 1.68 0.15 -0.73 3.60 0.00 -1.03 0.32 119.26 123.24 2wp8 h ALA 588 Ca 0.28 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2wp8 h ALA 588 Cb 0.42 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 2wp8 h ALA 588 CO -0.08 -0.26 0.46 0.00 0.00 0.00 0.00 179.25 179.37 2wp8 h ALA 589 N 0.87 0.93 0.04 0.00 0.00 0.57 -3.12 119.26 118.56 2wp8 h ALA 589 Ca 0.04 -0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.69 2wp8 h ALA 589 Cb 0.18 -0.30 0.02 0.00 0.00 0.00 0.00 17.79 17.70 2wp8 h ALA 589 CO -0.00 0.38 -0.76 0.00 0.00 0.00 0.00 179.25 178.87 2wp8 h ARG 590 N 1.00 0.45 0.00 0.00 3.08 -0.61 -3.48 114.38 114.81 2wp8 h ARG 590 Ca 0.27 -0.53 0.00 0.00 0.07 0.00 0.00 59.98 59.78 2wp8 h ARG 590 Cb -0.06 0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.15 2wp8 h ARG 590 CO -0.05 1.18 0.00 0.41 -1.07 0.00 0.00 179.97 180.44 2wp8 n GLY 591 N 1.21 2.39 3.57 0.04 0.00 0.11 -4.87 105.19 107.64 2wp8 n GLY 591 Ca -0.11 -0.58 -0.12 0.00 0.00 0.00 0.00 46.02 45.21 2wp8 n GLY 591 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2wp8 s THR 592 N -0.65 0.00 0.64 2.61 -1.32 -1.26 -0.56 115.64 115.10 2wp8 s THR 592 Ca 0.00 0.00 -0.15 0.00 -1.21 0.00 0.00 61.69 60.33 2wp8 s THR 592 Cb 0.00 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 69.98 2wp8 s THR 592 CO 0.00 0.00 1.10 -0.44 -2.21 0.00 0.00 174.62 173.07 2wp8 s SER 593 N -1.00 5.25 0.02 8.08 0.01 0.81 -4.60 113.70 122.27 2wp8 s SER 593 Ca -0.03 1.97 0.08 0.00 1.31 0.00 0.00 55.95 59.27 2wp8 s SER 593 Cb -0.01 -2.55 -0.02 0.00 0.21 0.00 0.00 66.02 63.65 2wp8 s SER 593 CO 0.02 -1.53 -0.23 -0.69 0.41 0.00 0.00 173.24 171.22 2wp8 s VAL 594 N -2.35 1.86 -0.21 3.43 1.01 -0.04 -4.95 120.40 119.15 2wp8 s VAL 594 Ca 0.66 -1.15 0.01 0.00 0.00 0.00 0.00 61.98 61.50 2wp8 s VAL 594 Cb -0.20 -1.58 0.05 0.00 0.00 0.00 0.00 36.38 34.65 2wp8 s VAL 594 CO 0.40 0.39 -0.09 -0.31 0.00 0.00 0.00 175.10 175.50 2wp8 s TYR 595 N -0.68 2.36 0.53 5.22 1.51 -1.26 -0.36 117.35 124.67 2wp8 s TYR 595 Ca 0.09 -1.60 -0.02 0.00 -1.01 0.00 0.00 57.07 54.53 2wp8 s TYR 595 Cb -0.09 -1.60 0.01 0.00 -0.11 0.00 0.00 41.96 40.17 2wp8 s TYR 595 CO 0.01 -0.74 0.79 -0.51 -1.11 0.00 0.00 175.55 173.98 2wp8 s LEU 596 N 1.41 3.40 0.27 -1.29 1.02 0.12 -4.17 118.68 119.44 2wp8 s LEU 596 Ca -0.02 0.39 -0.05 0.00 0.02 0.00 0.00 54.13 54.47 2wp8 s LEU 596 Cb -0.17 -3.24 0.53 0.00 0.02 0.00 0.00 46.19 43.33 2wp8 s LEU 596 CO -0.08 -0.95 1.62 0.58 0.02 0.00 0.00 176.35 177.54 2wp8 h VAL 597 N 0.09 0.24 -0.25 -1.59 2.07 -1.87 -3.12 116.25 111.82 2wp8 h VAL 597 Ca -0.45 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.04 2wp8 h VAL 597 Cb 1.26 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 2wp8 h VAL 597 CO 0.58 0.01 0.00 -0.90 0.02 0.00 0.00 177.57 177.28 2wp8 n ASP 598 N -5.39 2.66 -3.56 0.57 5.75 -1.26 -5.03 116.55 110.29 2wp8 n ASP 598 Ca 0.16 -1.83 -0.15 0.00 -0.01 0.00 0.00 54.79 52.96 2wp8 n ASP 598 Cb 0.55 -0.17 -0.06 0.00 -1.03 0.00 0.00 41.12 40.42 2wp8 n ASP 598 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 2wp8 s LYS 599 N -1.00 0.89 -0.12 0.11 2.20 -1.18 -5.15 119.74 115.50 2wp8 s LYS 599 Ca 0.21 0.39 -0.01 0.00 -0.36 0.00 0.00 55.97 56.21 2wp8 s LYS 599 Cb 0.12 0.42 0.03 0.00 -1.51 0.00 0.00 37.83 36.89 2wp8 s LYS 599 CO 0.16 -0.24 -0.05 0.50 -0.36 0.00 0.00 175.35 175.36 2wp8 s ARG 600 N -0.79 1.23 -0.35 4.03 3.52 -1.26 0.16 118.95 125.48 2wp8 s ARG 600 Ca -0.06 -0.22 -0.22 0.00 -0.13 0.00 0.00 55.73 55.10 2wp8 s ARG 600 Cb -0.01 -1.54 0.00 0.00 -1.56 0.00 0.00 34.95 31.84 2wp8 s ARG 600 CO 0.06 -0.33 0.71 0.42 -0.81 0.00 0.00 175.30 175.35 2wp8 s ILE 601 N 1.77 4.82 0.34 4.11 1.09 0.52 -4.95 121.20 128.90 2wp8 s ILE 601 Ca 0.04 0.76 -0.26 0.00 -1.10 0.00 0.00 60.65 60.09 2wp8 s ILE 601 Cb -0.13 -4.13 -0.10 0.00 -1.06 0.00 0.00 42.46 37.04 2wp8 s ILE 601 CO -0.07 -0.35 0.98 -1.81 -0.10 0.00 0.00 174.94 173.58 2wp8 s ASP 602 N 1.79 7.20 0.14 3.58 1.01 -1.26 -0.86 116.67 128.27 2wp8 s ASP 602 Ca 0.28 1.92 0.01 0.00 0.71 0.00 0.00 52.55 55.46 2wp8 s ASP 602 Cb -0.14 -2.58 -0.07 0.00 1.01 0.00 0.00 42.92 41.13 2wp8 s ASP 602 CO 0.15 -0.17 1.33 -0.03 0.21 0.00 0.00 175.17 176.66 2wp8 h MET 603 N 3.07 0.22 -4.94 8.23 1.85 -1.81 -3.47 114.93 118.08 2wp8 h MET 603 Ca -0.47 -0.27 -0.32 0.00 -0.61 0.00 0.00 59.70 58.03 2wp8 h MET 603 Cb 1.20 0.08 -0.18 0.00 0.43 0.00 0.00 31.60 33.13 2wp8 h MET 603 CO 0.64 1.02 -0.73 -0.51 -0.40 0.00 0.00 176.91 176.93 2wp8 s LEU 604 N -7.38 2.39 0.57 3.39 1.02 -1.26 -4.08 118.68 113.32 2wp8 s LEU 604 Ca -0.03 -0.78 -0.19 0.00 0.02 0.00 0.00 54.13 53.15 2wp8 s LEU 604 Cb 0.09 -0.29 -0.07 0.00 0.02 0.00 0.00 46.19 45.94 2wp8 s LEU 604 CO 0.84 -0.25 0.80 -2.65 0.02 0.00 0.00 176.35 175.11 2wp8 n PRO 605 N 0.67 0.78 0.05 1.29 -0.02 -1.26 -4.72 135.00 131.78 2wp8 n PRO 605 Ca -0.17 0.30 0.02 0.00 -2.02 0.00 0.00 63.50 61.63 2wp8 n PRO 605 Cb 0.57 -1.98 0.36 0.00 -0.02 0.00 0.00 33.50 32.43 2wp8 n PRO 605 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 2wp8 h MET 606 N 0.48 0.42 -0.75 -0.52 2.86 -1.99 -2.05 114.93 113.38 2wp8 h MET 606 Ca -0.47 -0.08 0.18 0.00 -2.06 0.00 0.00 59.70 57.27 2wp8 h MET 606 Cb 1.38 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 32.92 2wp8 h MET 606 CO 0.50 0.45 0.51 1.25 1.06 0.00 0.00 176.91 180.68 2wp8 h LEU 607 N 0.41 0.22 0.00 1.22 7.12 -1.97 0.12 115.31 122.43 2wp8 h LEU 607 Ca 0.09 0.02 -0.06 0.00 0.13 0.00 0.00 57.88 58.06 2wp8 h LEU 607 Cb 0.26 -0.03 -0.01 0.00 -0.53 0.00 0.00 40.66 40.36 2wp8 h LEU 607 CO 0.01 0.11 -0.53 -0.07 -0.13 0.00 0.00 178.44 177.82 2wp8 h LEU 608 N 0.23 0.00 -0.24 2.25 3.38 -1.78 -0.11 115.31 119.03 2wp8 h LEU 608 Ca 0.37 -0.29 -0.17 0.00 0.09 0.00 0.00 57.88 57.87 2wp8 h LEU 608 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 2wp8 h LEU 608 CO -0.08 0.94 -0.52 1.23 0.09 0.00 0.00 178.44 180.10 2wp8 h GLY 609 N -1.00 0.86 0.64 0.83 0.00 -0.77 0.23 103.07 103.85 2wp8 h GLY 609 Ca -0.10 -1.03 -0.35 0.00 0.00 0.00 0.00 47.33 45.85 2wp8 h GLY 609 CO -0.06 0.92 -1.89 -0.91 0.00 0.00 0.00 176.54 174.61 2wp8 h THR 610 N 0.53 0.72 0.00 4.70 1.35 -1.01 -3.37 112.91 115.82 2wp8 h THR 610 Ca 0.00 -2.37 0.00 0.00 -0.55 0.00 0.00 66.41 63.50 2wp8 h THR 610 Cb 1.13 2.55 0.00 0.00 -1.73 0.00 0.00 68.15 70.10 2wp8 h THR 610 CO 0.11 0.86 0.00 -0.67 -0.25 0.00 0.00 175.52 175.57 2wp8 n ASP 611 N -3.58 0.00 -0.01 5.36 -0.08 -1.09 -4.66 116.55 112.49 2wp8 n ASP 611 Ca -0.30 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 52.86 2wp8 n ASP 611 Cb 1.03 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 44.43 2wp8 n ASP 611 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 2wp8 h LEU 612 N 0.00 0.13 -0.40 -2.67 3.38 -0.74 -3.02 115.31 111.99 2wp8 h LEU 612 Ca 0.00 -0.14 -0.18 0.00 0.09 0.00 0.00 57.88 57.65 2wp8 h LEU 612 Cb 0.00 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2wp8 h LEU 612 CO 0.00 0.23 -0.75 0.00 0.09 0.00 0.00 178.44 178.01 2wp8 n SER 614 N -3.81 2.40 -3.44 0.00 2.88 -1.14 -4.50 113.62 106.00 2wp8 n SER 614 Ca -0.04 1.17 -0.40 0.00 -1.33 0.00 0.00 58.87 58.27 2wp8 n SER 614 Cb 0.72 -1.40 -0.01 0.00 -0.75 0.00 0.00 64.21 62.77 2wp8 n SER 614 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2wp8 n LEU 615 N 1.61 8.23 -4.75 2.46 4.77 -0.08 -4.92 117.00 124.32 2wp8 n LEU 615 Ca 0.10 -4.69 -0.39 0.00 -0.03 0.00 0.00 56.01 50.99 2wp8 n LEU 615 Cb 0.32 -1.44 0.04 0.00 -2.33 0.00 0.00 43.42 40.01 2wp8 n LEU 615 CO 0.62 2.03 1.02 -0.54 -1.33 0.00 0.00 177.39 179.18 2wp8 s LYS 616 N 0.09 3.25 0.36 3.23 1.02 -1.26 -4.72 119.74 121.70 2wp8 s LYS 616 Ca 0.59 2.31 -0.28 0.00 0.02 0.00 0.00 55.97 58.61 2wp8 s LYS 616 Cb 0.18 -2.35 -0.11 0.00 -0.52 0.00 0.00 37.83 35.03 2wp8 s LYS 616 CO -0.08 -1.13 1.41 -1.25 -0.92 0.00 0.00 175.35 173.39 2wp8 s PRO 617 N -2.80 4.21 -1.23 -1.68 0.04 -1.26 -3.42 135.00 128.85 2wp8 s PRO 617 Ca 0.69 2.43 0.00 0.00 0.04 0.00 0.00 61.00 64.16 2wp8 s PRO 617 Cb -0.42 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.11 2wp8 s PRO 617 CO 0.51 -0.39 0.00 0.66 0.04 0.00 0.00 177.00 177.81 2wp8 n TYR 618 N 0.61 -0.19 -4.01 0.56 4.02 0.44 -4.96 117.16 113.63 2wp8 n TYR 618 Ca 0.01 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.73 2wp8 n TYR 618 Cb 0.40 -2.43 -0.16 0.00 -0.02 0.00 0.00 39.34 37.14 2wp8 n TYR 618 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2wp8 s VAL 619 N -2.51 0.26 0.39 -0.72 1.01 -1.22 -5.04 120.40 112.57 2wp8 s VAL 619 Ca 0.00 -0.02 -0.27 0.00 0.00 0.00 0.00 61.98 61.69 2wp8 s VAL 619 Cb 0.00 -0.30 -0.11 0.00 0.00 0.00 0.00 36.38 35.97 2wp8 s VAL 619 CO 0.00 0.13 1.43 0.47 0.00 0.00 0.00 175.10 177.13 2wp8 n ASP 620 N 3.75 3.45 -3.67 3.32 9.92 -1.26 -4.35 116.55 127.72 2wp8 n ASP 620 Ca -0.22 1.20 -0.09 0.00 -0.53 0.00 0.00 54.79 55.14 2wp8 n ASP 620 Cb 0.53 -1.59 -0.09 0.00 -0.64 0.00 0.00 41.12 39.33 2wp8 n ASP 620 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 2wp8 s ARG 621 N -2.14 0.54 0.66 -1.24 1.81 -0.45 -4.52 118.95 113.61 2wp8 s ARG 621 Ca 0.56 0.97 -0.17 0.00 -1.72 0.00 0.00 55.73 55.37 2wp8 s ARG 621 Cb -0.49 0.06 0.00 0.00 -0.45 0.00 0.00 34.95 34.08 2wp8 s ARG 621 CO 0.62 -0.15 1.20 -0.06 -0.68 0.00 0.00 175.30 176.23 2wp8 s PHE 622 N 1.43 2.26 0.17 -0.53 0.08 -1.26 -1.58 117.98 118.54 2wp8 s PHE 622 Ca -0.09 1.55 -0.14 0.00 0.12 0.00 0.00 56.93 58.37 2wp8 s PHE 622 Cb -0.07 -3.45 0.01 0.00 -0.57 0.00 0.00 43.02 38.95 2wp8 s PHE 622 CO -0.15 -2.35 0.40 0.00 -0.10 0.00 0.00 175.22 173.02 2wp8 s ALA 623 N -1.83 -0.57 -0.23 5.36 0.00 -0.50 -3.78 121.76 120.21 2wp8 s ALA 623 Ca 0.75 -0.45 -0.06 0.00 0.00 0.00 0.00 51.96 52.20 2wp8 s ALA 623 Cb -0.29 0.81 -0.02 0.00 0.00 0.00 0.00 23.12 23.62 2wp8 s ALA 623 CO 0.39 -0.71 0.03 0.12 0.00 0.00 0.00 175.76 175.60 2wp8 s PHE 624 N -3.90 3.05 -0.11 0.00 2.19 0.25 0.17 117.98 119.64 2wp8 s PHE 624 Ca 0.11 -0.56 0.02 0.00 0.33 0.00 0.00 56.93 56.83 2wp8 s PHE 624 Cb 0.01 -2.18 -0.01 0.00 -1.31 0.00 0.00 43.02 39.53 2wp8 s PHE 624 CO -0.04 -0.39 -0.18 -1.12 1.83 0.00 0.00 175.22 175.33 2wp8 s SER 625 N 1.49 3.61 -0.39 6.13 0.01 0.16 -0.33 113.70 124.39 2wp8 s SER 625 Ca 0.06 -0.42 -0.14 0.00 1.31 0.00 0.00 55.95 56.76 2wp8 s SER 625 Cb -0.15 -1.44 0.01 0.00 0.21 0.00 0.00 66.02 64.66 2wp8 s SER 625 CO 0.02 0.18 0.27 -0.69 0.41 0.00 0.00 173.24 173.43 2wp8 s VAL 626 N 0.24 5.13 -0.27 3.43 1.01 0.34 -1.52 120.40 128.76 2wp8 s VAL 626 Ca -0.12 -0.61 -0.06 0.00 0.00 0.00 0.00 61.98 61.19 2wp8 s VAL 626 Cb -0.16 -3.81 -0.00 0.00 0.00 0.00 0.00 36.38 32.41 2wp8 s VAL 626 CO 0.06 -0.23 0.05 -0.63 0.00 0.00 0.00 175.10 174.35 2wp8 s ILE 627 N 1.66 3.90 0.46 2.22 -1.09 -0.42 -1.49 121.20 126.45 2wp8 s ILE 627 Ca 0.05 -0.57 0.01 0.00 -2.23 0.00 0.00 60.65 57.91 2wp8 s ILE 627 Cb -0.19 -2.94 0.01 0.00 -1.58 0.00 0.00 42.46 37.76 2wp8 s ILE 627 CO 0.09 0.19 0.67 0.26 -1.23 0.00 0.00 174.94 174.93 2wp8 s TRP 628 N 1.51 3.10 -0.20 3.97 0.51 -0.07 -0.87 118.94 126.88 2wp8 s TRP 628 Ca 0.04 0.10 -0.00 0.00 -2.12 0.00 0.00 56.10 54.11 2wp8 s TRP 628 Cb -0.16 -2.40 0.02 0.00 -0.81 0.00 0.00 33.47 30.11 2wp8 s TRP 628 CO 0.01 -0.46 -0.14 -2.00 -0.51 0.00 0.00 176.95 173.85 2wp8 s GLU 629 N -4.56 2.99 -0.03 4.98 2.12 -1.17 -2.14 118.70 120.89 2wp8 s GLU 629 Ca 0.51 -0.85 0.06 0.00 0.36 0.00 0.00 54.97 55.05 2wp8 s GLU 629 Cb -0.10 -2.74 -0.02 0.00 0.26 0.00 0.00 34.13 31.52 2wp8 s GLU 629 CO 0.37 -0.26 -0.22 -0.51 -0.54 0.00 0.00 175.26 174.10 2wp8 s LEU 630 N 1.32 2.31 0.79 2.70 1.43 -0.09 -0.04 118.68 127.10 2wp8 s LEU 630 Ca 0.03 -0.37 -0.04 0.00 -1.03 0.00 0.00 54.13 52.72 2wp8 s LEU 630 Cb -0.14 -1.42 0.15 0.00 0.03 0.00 0.00 46.19 44.81 2wp8 s LEU 630 CO -0.09 0.33 1.09 1.51 0.23 0.00 0.00 176.35 179.42 2wp8 s ASP 631 N -0.66 3.95 0.50 2.29 -4.77 -0.77 -1.46 116.67 115.76 2wp8 s ASP 631 Ca 0.11 -0.26 0.27 0.00 -3.30 0.00 0.00 52.55 49.36 2wp8 s ASP 631 Cb -0.10 0.02 1.36 0.00 -1.09 0.00 0.00 42.92 43.10 2wp8 s ASP 631 CO -0.00 -2.14 1.89 -0.78 0.70 0.00 0.00 175.17 174.84 2wp8 h ASP 632 N -0.85 0.12 0.01 2.11 3.58 -1.92 -0.32 116.42 119.15 2wp8 h ASP 632 Ca -0.38 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.09 2wp8 h ASP 632 Cb 1.25 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 42.30 2wp8 h ASP 632 CO 0.38 0.04 -0.01 -1.20 -2.88 0.00 0.00 179.24 175.57 2wp8 n SER 633 N -4.35 1.14 -0.07 2.28 7.64 -1.26 -4.94 113.62 114.06 2wp8 n SER 633 Ca 0.18 -1.35 -0.01 0.00 1.01 0.00 0.00 58.87 58.70 2wp8 n SER 633 Cb 0.84 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 64.04 2wp8 n SER 633 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wp8 n ALA 634 N -0.13 -0.02 -2.26 -0.43 0.00 -0.13 -4.82 120.51 112.71 2wp8 n ALA 634 Ca 0.20 0.01 -0.28 0.00 0.00 0.00 0.00 53.44 53.37 2wp8 n ALA 634 Cb 0.30 -0.57 -0.01 0.00 0.00 0.00 0.00 19.45 19.17 2wp8 n ALA 634 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2wp8 s ASN 635 N -2.99 6.36 -0.31 0.00 0.01 -1.26 -4.81 114.94 111.93 2wp8 s ASN 635 Ca 0.00 0.97 -0.17 0.00 -0.71 0.00 0.00 52.86 52.95 2wp8 s ASN 635 Cb 0.00 -2.26 -0.02 0.00 0.41 0.00 0.00 41.25 39.38 2wp8 s ASN 635 CO 0.00 -0.49 0.48 -0.63 -1.51 0.00 0.00 177.10 174.95 2wp8 s ILE 636 N -2.58 5.06 -0.13 0.60 1.01 -1.26 -1.85 121.20 122.05 2wp8 s ILE 636 Ca 0.48 0.50 0.09 0.00 0.00 0.00 0.00 60.65 61.72 2wp8 s ILE 636 Cb -0.10 -3.88 -0.23 0.00 0.01 0.00 0.00 42.46 38.25 2wp8 s ILE 636 CO 0.39 -0.08 0.31 0.52 0.00 0.00 0.00 174.94 176.09 2wp8 n VAL 637 N 5.30 1.56 -3.31 2.92 0.31 0.94 -5.00 118.33 121.06 2wp8 n VAL 637 Ca -0.05 -0.76 -0.03 0.00 -0.01 0.00 0.00 64.34 63.49 2wp8 n VAL 637 Cb 0.49 -1.06 0.01 0.00 -0.91 0.00 0.00 33.84 32.37 2wp8 n VAL 637 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 2wp8 n ASN 638 N -3.07 -0.80 -3.72 4.52 0.23 -1.20 -4.97 115.26 106.24 2wp8 n ASN 638 Ca -0.28 -1.55 -0.14 0.00 -0.53 0.00 0.00 54.58 52.08 2wp8 n ASN 638 Cb 1.07 1.34 -0.09 0.00 -2.08 0.00 0.00 39.78 40.02 2wp8 n ASN 638 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 2wp8 s VAL 639 N -2.65 0.02 0.04 3.53 1.01 -1.26 -3.02 120.40 118.06 2wp8 s VAL 639 Ca 0.06 -0.15 0.02 0.00 0.00 0.00 0.00 61.98 61.91 2wp8 s VAL 639 Cb -0.02 -0.64 -0.02 0.00 0.00 0.00 0.00 36.38 35.70 2wp8 s VAL 639 CO 0.04 -0.08 -0.07 0.20 0.00 0.00 0.00 175.10 175.19 2wp8 s ASN 640 N -0.39 0.73 -0.04 3.32 -0.87 -0.05 -5.00 114.94 112.64 2wp8 s ASN 640 Ca -0.05 -0.53 0.06 0.00 -1.57 0.00 0.00 52.86 50.76 2wp8 s ASN 640 Cb -0.03 0.05 -0.01 0.00 -0.02 0.00 0.00 41.25 41.23 2wp8 s ASN 640 CO 0.03 -0.22 -0.22 -0.36 -2.57 0.00 0.00 177.10 173.75 2wp8 s PHE 641 N -1.38 2.12 -0.28 2.20 0.40 -1.26 -1.30 117.98 118.48 2wp8 s PHE 641 Ca -0.11 -0.54 -0.20 0.00 -0.60 0.00 0.00 56.93 55.49 2wp8 s PHE 641 Cb -0.10 -1.39 0.08 0.00 0.51 0.00 0.00 43.02 42.12 2wp8 s PHE 641 CO 0.00 -0.13 0.74 0.00 0.70 0.00 0.00 175.22 176.52 2wp8 s MET 642 N -0.27 0.73 0.27 0.44 0.23 -0.58 -5.00 119.30 115.12 2wp8 s MET 642 Ca 0.01 1.08 -0.30 0.00 -1.03 0.00 0.00 55.69 55.45 2wp8 s MET 642 Cb -0.11 0.24 -0.11 0.00 -1.53 0.00 0.00 34.83 33.32 2wp8 s MET 642 CO 0.01 -0.12 1.57 0.15 -2.03 0.00 0.00 175.02 174.60 2wp8 s LYS 643 N 1.08 4.16 0.21 3.16 -0.14 -1.26 -0.66 119.74 126.28 2wp8 s LYS 643 Ca -0.06 2.51 0.00 0.00 -1.36 0.00 0.00 55.97 57.07 2wp8 s LYS 643 Cb -0.05 -3.05 -0.04 0.00 -1.68 0.00 0.00 37.83 33.01 2wp8 s LYS 643 CO -0.11 -0.59 0.09 -1.54 -0.76 0.00 0.00 175.35 172.44 2wp8 s SER 644 N 0.52 0.67 0.07 2.83 1.04 0.13 -0.52 113.70 118.44 2wp8 s SER 644 Ca 0.63 -1.34 0.04 0.00 0.48 0.00 0.00 55.95 55.77 2wp8 s SER 644 Cb -0.46 0.26 -0.04 0.00 0.10 0.00 0.00 66.02 65.88 2wp8 s SER 644 CO 0.46 -0.75 0.01 -0.69 0.98 0.00 0.00 173.24 173.24 2wp8 s VAL 645 N -3.94 4.11 0.20 5.02 1.01 -0.30 -1.41 120.40 125.09 2wp8 s VAL 645 Ca 0.35 -0.89 -0.10 0.00 0.00 0.00 0.00 61.98 61.33 2wp8 s VAL 645 Cb 0.07 -2.94 -0.01 0.00 0.00 0.00 0.00 36.38 33.51 2wp8 s VAL 645 CO 0.10 0.17 0.36 0.27 0.00 0.00 0.00 175.10 176.00 2wp8 s ILE 646 N -1.28 0.03 -0.24 2.22 -4.36 -0.62 -1.31 121.20 115.64 2wp8 s ILE 646 Ca 0.25 -1.40 -0.03 0.00 -0.26 0.00 0.00 60.65 59.22 2wp8 s ILE 646 Cb -0.12 -2.02 0.11 0.00 1.25 0.00 0.00 42.46 41.69 2wp8 s ILE 646 CO 0.17 -0.14 0.26 -0.60 0.24 0.00 0.00 174.94 174.87 2wp8 s ARG 647 N -4.00 0.25 0.10 0.37 3.52 -1.26 -1.34 118.95 116.60 2wp8 s ARG 647 Ca 0.21 0.11 -0.31 0.00 -0.13 0.00 0.00 55.73 55.60 2wp8 s ARG 647 Cb 0.02 -0.95 -0.09 0.00 -1.56 0.00 0.00 34.95 32.36 2wp8 s ARG 647 CO 0.04 -0.78 1.65 0.45 -0.81 0.00 0.00 175.30 175.85 2wp8 s SER 648 N 2.35 6.57 0.11 -2.12 0.15 -1.26 -4.53 113.70 114.98 2wp8 s SER 648 Ca 0.08 2.56 -0.14 0.00 0.70 0.00 0.00 55.95 59.15 2wp8 s SER 648 Cb -0.15 -2.57 -0.08 0.00 -1.71 0.00 0.00 66.02 61.51 2wp8 s SER 648 CO -0.20 -0.89 1.44 0.03 1.20 0.00 0.00 173.24 174.82 2wp8 h ARG 649 N 7.91 0.72 -3.43 5.44 -0.00 0.19 0.13 114.38 125.34 2wp8 h ARG 649 Ca -0.43 -0.37 -0.14 0.00 -0.50 0.00 0.00 59.98 58.54 2wp8 h ARG 649 Cb 1.20 0.01 -0.21 0.00 0.00 0.00 0.00 29.97 30.97 2wp8 h ARG 649 CO 0.93 0.98 -0.46 -1.21 0.00 0.00 0.00 179.97 180.21 2wp8 s GLU 650 N -4.42 0.50 -0.43 0.04 2.02 -1.24 -4.52 118.70 110.65 2wp8 s GLU 650 Ca -0.12 -0.34 -0.08 0.00 0.02 0.00 0.00 54.97 54.45 2wp8 s GLU 650 Cb 0.09 0.21 0.09 0.00 0.10 0.00 0.00 34.13 34.62 2wp8 s GLU 650 CO 0.83 -0.12 0.26 0.00 0.02 0.00 0.00 175.26 176.25 2wp8 s ALA 651 N -1.30 3.27 0.07 5.21 0.00 -1.26 -0.61 121.76 127.15 2wp8 s ALA 651 Ca -0.14 -2.31 -0.04 0.00 0.00 0.00 0.00 51.96 49.47 2wp8 s ALA 651 Cb -0.07 -2.63 -0.05 0.00 0.00 0.00 0.00 23.12 20.37 2wp8 s ALA 651 CO 0.02 -1.73 0.30 -0.06 0.00 0.00 0.00 175.76 174.29 2wp8 s PHE 652 N 1.35 3.52 0.75 0.00 0.40 -0.76 -4.99 117.98 118.25 2wp8 s PHE 652 Ca 0.04 0.49 -0.12 0.00 -0.60 0.00 0.00 56.93 56.75 2wp8 s PHE 652 Cb -0.24 -1.94 0.04 0.00 0.51 0.00 0.00 43.02 41.39 2wp8 s PHE 652 CO 0.00 0.54 1.10 -1.54 0.70 0.00 0.00 175.22 176.02 2wp8 s SER 653 N -2.18 4.99 0.23 1.36 1.04 -1.26 -2.49 113.70 115.39 2wp8 s SER 653 Ca 0.35 1.16 -0.06 0.00 0.48 0.00 0.00 55.95 57.88 2wp8 s SER 653 Cb -0.13 -1.91 0.38 0.00 0.10 0.00 0.00 66.02 64.47 2wp8 s SER 653 CO 0.22 -1.64 1.75 1.88 0.98 0.00 0.00 173.24 176.44 2wp8 h TYR 654 N -0.86 0.54 -0.05 5.02 0.99 -1.68 -0.29 116.97 120.64 2wp8 h TYR 654 Ca -0.46 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.30 2wp8 h TYR 654 Cb 1.27 -0.13 -0.00 0.00 1.00 0.00 0.00 36.73 38.86 2wp8 h TYR 654 CO 0.47 0.13 0.01 1.49 -0.00 0.00 0.00 178.16 180.27 2wp8 h GLU 655 N 0.50 0.08 -0.93 4.88 4.81 -1.94 -0.80 114.58 121.19 2wp8 h GLU 655 Ca 0.37 -0.02 0.14 0.00 -0.13 0.00 0.00 59.36 59.72 2wp8 h GLU 655 Cb 0.48 -0.01 -0.09 0.00 0.63 0.00 0.00 28.75 29.76 2wp8 h GLU 655 CO -0.33 0.28 0.54 1.96 -0.73 0.00 0.00 179.01 180.72 2wp8 h GLN 656 N -0.13 0.77 -0.36 1.92 4.20 -1.78 0.40 115.11 120.14 2wp8 h GLN 656 Ca 0.02 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.63 2wp8 h GLN 656 Cb 0.23 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 2wp8 h GLN 656 CO -0.00 0.51 0.04 0.00 -0.67 0.00 0.00 178.83 178.71 2wp8 h ALA 657 N 1.56 0.48 0.20 3.87 0.00 -0.82 -1.93 119.26 122.62 2wp8 h ALA 657 Ca 0.49 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 55.19 2wp8 h ALA 657 Cb 0.61 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 2wp8 h ALA 657 CO -0.32 0.21 -0.28 0.37 0.00 0.00 0.00 179.25 179.23 2wp8 h GLN 658 N 0.44 -0.53 -0.61 0.00 5.75 -0.01 -2.35 115.11 117.79 2wp8 h GLN 658 Ca 0.11 0.04 0.11 0.00 -0.15 0.00 0.00 58.65 58.75 2wp8 h GLN 658 Cb 0.40 0.12 -0.12 0.00 1.07 0.00 0.00 27.48 28.95 2wp8 h GLN 658 CO 0.01 -0.35 -0.34 -0.07 -2.65 0.00 0.00 178.83 175.43 2wp8 h LEU 659 N -0.55 -1.18 -0.17 -2.39 4.07 -0.92 -1.62 115.31 112.55 2wp8 h LEU 659 Ca 0.01 0.23 0.04 0.00 0.08 0.00 0.00 57.88 58.24 2wp8 h LEU 659 Cb 0.54 0.59 -0.04 0.00 1.08 0.00 0.00 40.66 42.82 2wp8 h LEU 659 CO -0.11 -0.30 -0.11 -0.09 -1.08 0.00 0.00 178.44 176.75 2wp8 h ARG 660 N -0.15 -0.10 -0.75 1.13 2.43 -0.84 -1.13 114.38 114.96 2wp8 h ARG 660 Ca 0.24 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.42 2wp8 h ARG 660 Cb 0.55 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.09 2wp8 h ARG 660 CO -0.70 -0.07 0.50 0.82 -1.51 0.00 0.00 179.97 179.02 2wp8 h ILE 661 N -0.10 1.19 0.00 1.20 2.04 -1.02 -0.30 117.51 120.52 2wp8 h ILE 661 Ca 0.10 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.61 2wp8 h ILE 661 Cb 0.25 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.42 2wp8 h ILE 661 CO -0.24 0.19 0.00 0.47 0.00 0.00 0.00 178.15 178.57 2wp8 n ASP 662 N -4.56 0.00 -4.42 1.72 8.00 -0.65 -4.59 116.55 112.05 2wp8 n ASP 662 Ca 0.07 -0.27 -0.44 0.00 0.71 0.00 0.00 54.79 54.86 2wp8 n ASP 662 Cb 0.02 -0.20 -0.04 0.00 -0.02 0.00 0.00 41.12 40.88 2wp8 n ASP 662 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2wp8 s ASP 663 N -2.41 6.28 0.45 -2.24 2.15 -0.13 -4.90 116.67 115.88 2wp8 s ASP 663 Ca 0.27 -1.40 0.31 0.00 0.43 0.00 0.00 52.55 52.16 2wp8 s ASP 663 Cb 0.17 -2.37 1.54 0.00 -0.30 0.00 0.00 42.92 41.95 2wp8 s ASP 663 CO 0.35 -1.24 1.93 0.11 -0.17 0.00 0.00 175.17 176.15 2wp8 h LYS 664 N 9.25 0.00 -0.40 4.34 1.57 -1.82 -2.47 116.57 127.03 2wp8 h LYS 664 Ca -0.19 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.48 2wp8 h LYS 664 Cb 1.07 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.36 2wp8 h LYS 664 CO 1.13 0.00 -0.21 1.79 -0.57 0.00 0.00 179.45 181.59 2wp8 h THR 665 N 0.00 1.27 -3.21 -0.16 1.35 -1.93 -3.40 112.91 106.83 2wp8 h THR 665 Ca 0.00 -1.31 -0.58 0.00 -0.55 0.00 0.00 66.41 63.96 2wp8 h THR 665 Cb 0.16 1.18 -0.07 0.00 -1.73 0.00 0.00 68.15 67.69 2wp8 h THR 665 CO 0.00 0.44 0.75 -1.10 -0.25 0.00 0.00 175.52 175.36 2wp8 s GLN 666 N -4.63 4.16 -0.28 4.72 -0.21 -0.93 -4.92 119.66 117.57 2wp8 s GLN 666 Ca -0.09 1.15 0.20 0.00 0.02 0.00 0.00 55.36 56.64 2wp8 s GLN 666 Cb 0.13 -3.68 0.49 0.00 1.00 0.00 0.00 33.01 30.95 2wp8 s GLN 666 CO 0.83 -0.72 1.09 0.09 -2.12 0.00 0.00 175.29 174.47 2wp8 n ASN 667 N 6.47 1.95 -4.89 5.90 4.13 -1.26 -4.91 115.26 122.64 2wp8 n ASN 667 Ca 0.11 -2.34 -0.26 0.00 1.68 0.00 0.00 54.58 53.77 2wp8 n ASN 667 Cb 0.47 -0.47 0.07 0.00 -1.54 0.00 0.00 39.78 38.31 2wp8 n ASN 667 CO 0.00 0.00 0.00 1.51 0.28 0.00 0.00 177.26 179.05 2wp8 s ASP 668 N -3.67 4.75 0.22 6.41 -4.77 -1.26 -4.83 116.67 113.51 2wp8 s ASP 668 Ca 0.30 0.39 -0.08 0.00 -3.30 0.00 0.00 52.55 49.86 2wp8 s ASP 668 Cb 0.35 -1.02 0.29 0.00 -1.09 0.00 0.00 42.92 41.46 2wp8 s ASP 668 CO -0.02 -1.63 1.78 -0.08 0.70 0.00 0.00 175.17 175.92 2wp8 h GLU 669 N -0.61 0.58 0.00 2.11 4.81 -1.99 0.21 114.58 119.68 2wp8 h GLU 669 Ca -0.44 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 58.76 2wp8 h GLU 669 Cb 1.31 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.56 2wp8 h GLU 669 CO 0.58 0.38 -0.00 1.25 -0.73 0.00 0.00 179.01 180.49 2wp8 h LEU 670 N 0.60 -0.00 -0.43 1.64 5.85 -1.91 0.13 115.31 121.18 2wp8 h LEU 670 Ca 0.32 -0.49 0.09 0.00 0.84 0.00 0.00 57.88 58.64 2wp8 h LEU 670 Cb 0.31 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.26 2wp8 h LEU 670 CO -0.24 0.49 -0.08 0.74 -0.34 0.00 0.00 178.44 179.00 2wp8 h THR 671 N -0.49 0.59 -0.47 1.05 2.02 -1.90 0.57 112.91 114.29 2wp8 h THR 671 Ca -0.00 -0.01 0.07 0.00 0.77 0.00 0.00 66.41 67.25 2wp8 h THR 671 Cb 0.49 0.57 -0.06 0.00 -1.74 0.00 0.00 68.15 67.40 2wp8 h THR 671 CO 0.00 0.00 0.10 0.24 0.37 0.00 0.00 175.52 176.24 2wp8 h MET 672 N 0.02 0.24 -0.58 6.66 2.86 -0.11 0.18 114.93 124.20 2wp8 h MET 672 Ca 0.21 -0.01 0.07 0.00 -2.06 0.00 0.00 59.70 57.91 2wp8 h MET 672 Cb 0.32 -0.05 -0.06 0.00 0.06 0.00 0.00 31.60 31.86 2wp8 h MET 672 CO -0.42 0.16 0.25 0.78 1.06 0.00 0.00 176.91 178.74 2wp8 h GLY 673 N 0.24 0.81 0.52 8.32 0.00 -0.25 -1.46 103.07 111.26 2wp8 h GLY 673 Ca 0.23 -0.15 0.06 0.00 0.00 0.00 0.00 47.33 47.46 2wp8 h GLY 673 CO -0.29 0.05 0.08 -0.33 0.00 0.00 0.00 176.54 176.04 2wp8 h MET 674 N 0.47 0.20 -0.73 4.80 2.86 0.16 0.41 114.93 123.10 2wp8 h MET 674 Ca 0.28 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.87 2wp8 h MET 674 Cb 0.27 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.85 2wp8 h MET 674 CO -0.24 0.13 0.34 0.00 1.06 0.00 0.00 176.91 178.20 2wp8 h ARG 675 N 0.20 1.06 -0.92 1.72 3.08 -0.99 -1.67 114.38 116.86 2wp8 h ARG 675 Ca 0.19 -0.16 0.08 0.00 0.07 0.00 0.00 59.98 60.16 2wp8 h ARG 675 Cb 0.22 -0.19 -0.07 0.00 0.08 0.00 0.00 29.97 30.02 2wp8 h ARG 675 CO -0.25 0.83 0.60 0.00 -1.07 0.00 0.00 179.97 180.08 2wp8 h ALA 676 N 1.17 1.55 -0.04 0.04 0.00 -0.28 -2.32 119.26 119.38 2wp8 h ALA 676 Ca 0.25 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 2wp8 h ALA 676 Cb 0.14 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2wp8 h ALA 676 CO -0.03 0.28 0.02 -0.07 0.00 0.00 0.00 179.25 179.45 2wp8 h LEU 677 N 0.98 0.05 0.00 0.00 3.38 0.69 -2.37 115.31 118.04 2wp8 h LEU 677 Ca 0.42 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.30 2wp8 h LEU 677 Cb 0.32 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2wp8 h LEU 677 CO -0.18 0.13 -0.00 0.25 0.09 0.00 0.00 178.44 178.73 2wp8 h LEU 678 N -0.03 -0.00 -0.16 1.67 5.85 -1.09 0.32 115.31 121.86 2wp8 h LEU 678 Ca 0.01 -0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.73 2wp8 h LEU 678 Cb 0.09 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 2wp8 h LEU 678 CO -0.00 0.04 -0.06 0.11 -0.34 0.00 0.00 178.44 178.19 2wp8 h LYS 679 N -0.04 -0.03 -0.71 1.25 1.57 -1.47 -0.66 116.57 116.48 2wp8 h LYS 679 Ca -0.00 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.86 2wp8 h LYS 679 Cb 0.04 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.29 2wp8 h LYS 679 CO 0.00 -0.02 0.37 -0.07 -0.57 0.00 0.00 179.45 179.16 2wp8 h LEU 680 N -0.03 0.51 -0.90 2.94 3.38 -1.15 -3.03 115.31 117.02 2wp8 h LEU 680 Ca 0.08 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 2wp8 h LEU 680 Cb 0.16 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 2wp8 h LEU 680 CO -0.19 0.30 0.44 0.77 0.09 0.00 0.00 178.44 179.85 2wp8 h SER 681 N 0.64 1.10 -0.65 -0.43 4.64 0.48 -1.75 113.55 117.58 2wp8 h SER 681 Ca 0.34 -0.12 0.01 0.00 -0.47 0.00 0.00 61.79 61.55 2wp8 h SER 681 Cb 0.31 -0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 62.09 2wp8 h SER 681 CO -0.24 0.91 0.43 0.58 -0.87 0.00 0.00 176.83 177.64 2wp8 h VAL 682 N 1.22 1.17 -0.06 0.95 2.07 -1.03 -2.08 116.25 118.48 2wp8 h VAL 682 Ca 0.30 -0.32 -0.04 0.00 0.82 0.00 0.00 66.70 67.46 2wp8 h VAL 682 Cb 0.08 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.06 2wp8 h VAL 682 CO -0.04 0.17 -0.13 0.11 0.02 0.00 0.00 177.57 177.69 2wp8 h LYS 683 N 0.89 0.20 -1.00 1.57 1.57 -1.31 -2.67 116.57 115.81 2wp8 h LYS 683 Ca 0.24 -0.13 0.24 0.00 -1.87 0.00 0.00 60.65 59.12 2wp8 h LYS 683 Cb -0.10 0.02 -0.12 0.00 0.08 0.00 0.00 32.23 32.11 2wp8 h LYS 683 CO -0.05 0.72 0.60 -0.07 -0.57 0.00 0.00 179.45 180.07 2wp8 h LEU 684 N -0.29 0.69 -0.31 2.94 3.38 -1.11 0.82 115.31 121.44 2wp8 h LEU 684 Ca 0.00 0.13 -0.19 0.00 0.09 0.00 0.00 57.88 57.92 2wp8 h LEU 684 Cb 0.71 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.49 2wp8 h LEU 684 CO 0.03 0.13 -0.56 0.50 0.09 0.00 0.00 178.44 178.63 2wp8 h LYS 685 N 0.61 0.86 -0.46 1.13 3.64 -1.33 -2.70 116.57 118.31 2wp8 h LYS 685 Ca 0.64 -0.55 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2wp8 h LYS 685 Cb 1.18 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 33.04 2wp8 h LYS 685 CO -0.46 1.18 0.31 0.37 -2.27 0.00 0.00 179.45 178.57 2wp8 h GLN 686 N 0.65 0.61 -0.62 1.90 5.75 -0.76 0.32 115.11 122.96 2wp8 h GLN 686 Ca 0.01 -0.04 0.12 0.00 -0.15 0.00 0.00 58.65 58.60 2wp8 h GLN 686 Cb 1.16 -0.14 -0.12 0.00 1.07 0.00 0.00 27.48 29.46 2wp8 h GLN 686 CO 0.12 0.40 -0.20 0.87 -2.65 0.00 0.00 178.83 177.38 2wp8 h LYS 687 N 0.62 -0.04 0.00 1.69 1.57 -0.86 -0.08 116.57 119.47 2wp8 h LYS 687 Ca 0.17 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.85 2wp8 h LYS 687 Cb -0.07 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 2wp8 h LYS 687 CO -0.04 -0.03 -0.50 0.00 -0.57 0.00 0.00 179.45 178.31 2wp8 h ARG 688 N -0.04 0.00 -0.17 3.15 3.08 -0.91 -2.93 114.38 116.56 2wp8 h ARG 688 Ca 0.29 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 60.12 2wp8 h ARG 688 Cb 0.49 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.55 2wp8 h ARG 688 CO -0.66 0.50 -0.75 -0.07 -1.07 0.00 0.00 179.97 177.92 2wp8 h LEU 689 N 0.00 0.94 0.00 3.04 3.38 0.45 -0.01 115.31 123.12 2wp8 h LEU 689 Ca -0.01 -0.60 0.00 0.00 0.09 0.00 0.00 57.88 57.36 2wp8 h LEU 689 Cb 1.08 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2wp8 h LEU 689 CO 0.07 1.40 0.00 -0.62 0.09 0.00 0.00 178.44 179.38 2wp8 n GLU 690 N -3.94 0.02 -0.23 1.13 1.02 -0.13 -0.58 120.64 117.94 2wp8 n GLU 690 Ca -0.07 0.23 0.12 0.00 -0.02 0.00 0.00 57.16 57.41 2wp8 n GLU 690 Cb 0.73 -1.50 0.25 0.00 -0.02 0.00 0.00 31.44 30.90 2wp8 n GLU 690 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2wp8 n ALA 691 N -1.48 2.42 -1.13 0.62 0.00 -1.12 -4.96 120.51 114.86 2wp8 n ALA 691 Ca 0.04 -1.02 0.00 0.00 0.00 0.00 0.00 53.44 52.46 2wp8 n ALA 691 Cb 0.17 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 18.71 2wp8 n ALA 691 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wp8 n GLY 692 N 1.51 1.08 3.78 0.00 0.00 0.26 -4.78 105.19 107.04 2wp8 n GLY 692 Ca 0.20 -0.49 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 2wp8 n GLY 692 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wp8 s ALA 693 N -2.02 2.69 0.01 4.61 0.00 -0.02 -3.94 121.76 123.08 2wp8 s ALA 693 Ca 0.00 0.72 -0.30 0.00 0.00 0.00 0.00 51.96 52.38 2wp8 s ALA 693 Cb 0.00 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 2wp8 s ALA 693 CO 0.00 -0.79 1.08 -0.51 0.00 0.00 0.00 175.76 175.54 2wp8 s LEU 694 N -3.98 4.35 -0.47 0.00 1.43 0.78 -4.75 118.68 116.05 2wp8 s LEU 694 Ca 0.70 1.79 -0.28 0.00 -1.03 0.00 0.00 54.13 55.31 2wp8 s LEU 694 Cb -0.22 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.43 2wp8 s LEU 694 CO 0.29 -0.39 1.55 0.21 0.23 0.00 0.00 176.35 178.25 2wp8 s ASN 695 N 1.09 6.03 -0.41 2.29 2.47 -1.26 -4.86 114.94 120.28 2wp8 s ASN 695 Ca 0.54 0.69 0.05 0.00 0.42 0.00 0.00 52.86 54.56 2wp8 s ASN 695 Cb -0.24 -2.54 0.44 0.00 -1.45 0.00 0.00 41.25 37.47 2wp8 s ASN 695 CO 0.27 -1.71 1.35 0.18 -3.72 0.00 0.00 177.10 173.48 2wp8 n LEU 696 N 9.90 5.47 -0.08 3.21 4.77 -1.26 -4.76 117.00 134.25 2wp8 n LEU 696 Ca 0.17 -4.77 -0.14 0.00 -0.03 0.00 0.00 56.01 51.24 2wp8 n LEU 696 Cb 0.49 -0.50 -0.05 0.00 -2.33 0.00 0.00 43.42 41.02 2wp8 n LEU 696 CO 0.70 2.01 0.54 0.00 -1.33 0.00 0.00 177.39 179.32 2wp8 h ALA 697 N 2.27 0.36 -2.55 -1.18 0.00 -1.99 -3.41 119.26 112.76 2wp8 h ALA 697 Ca 0.41 -0.41 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 2wp8 h ALA 697 Cb 1.22 -0.07 0.03 0.00 0.00 0.00 0.00 17.79 18.97 2wp8 h ALA 697 CO 0.95 0.38 0.84 0.45 0.00 0.00 0.00 179.25 181.87 2wp8 s SER 698 N -6.51 6.69 0.46 0.00 0.15 -1.26 -4.88 113.70 108.34 2wp8 s SER 698 Ca -0.13 2.46 0.15 0.00 0.70 0.00 0.00 55.95 59.14 2wp8 s SER 698 Cb 0.08 -2.58 1.04 0.00 -1.71 0.00 0.00 66.02 62.84 2wp8 s SER 698 CO 0.82 -0.77 2.01 1.55 1.20 0.00 0.00 173.24 178.05 2wp8 h PRO 699 N 7.08 0.00 -0.32 5.44 0.13 -1.88 -0.62 132.00 141.83 2wp8 h PRO 699 Ca -0.42 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.59 2wp8 h PRO 699 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2wp8 h PRO 699 CO 0.90 0.17 -0.27 0.93 -0.23 0.00 0.00 178.00 179.50 2wp8 h GLU 700 N 0.00 0.65 -0.15 0.86 5.08 -1.91 -2.21 114.58 116.90 2wp8 h GLU 700 Ca -0.00 -0.27 -0.07 0.00 -1.00 0.00 0.00 59.36 58.02 2wp8 h GLU 700 Cb 0.30 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 2wp8 h GLU 700 CO 0.02 0.86 -0.17 0.28 -1.00 0.00 0.00 179.01 179.00 2wp8 h VAL 701 N 0.57 1.35 -1.03 3.13 2.07 -1.77 -3.31 116.25 117.24 2wp8 h VAL 701 Ca 0.07 -1.35 0.27 0.00 0.82 0.00 0.00 66.70 66.52 2wp8 h VAL 701 Cb 0.75 1.88 -0.07 0.00 -1.52 0.00 0.00 31.29 32.34 2wp8 h VAL 701 CO 0.06 0.40 0.70 0.11 0.02 0.00 0.00 177.57 178.86 2wp8 h LYS 702 N 0.01 0.25 -0.38 1.57 6.56 -0.66 -0.59 116.57 123.33 2wp8 h LYS 702 Ca 0.02 -0.01 -0.02 0.00 -1.06 0.00 0.00 60.65 59.57 2wp8 h LYS 702 Cb 0.71 -0.06 -0.02 0.00 -0.57 0.00 0.00 32.23 32.30 2wp8 h LYS 702 CO 0.04 0.16 0.13 0.28 -2.06 0.00 0.00 179.45 178.00 2wp8 h VAL 703 N 0.25 1.16 -0.12 0.50 2.07 -1.50 -3.01 116.25 115.60 2wp8 h VAL 703 Ca 0.55 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 67.55 2wp8 h VAL 703 Cb 1.66 0.73 0.00 0.00 -1.52 0.00 0.00 31.29 32.16 2wp8 h VAL 703 CO -0.18 0.19 0.00 1.41 0.02 0.00 0.00 177.57 179.02 2wp8 n HIS 704 N -4.37 0.15 -4.09 1.57 8.25 -0.23 -4.81 115.22 111.69 2wp8 n HIS 704 Ca 0.02 -0.08 -0.04 0.00 -0.26 0.00 0.00 57.72 57.36 2wp8 n HIS 704 Cb 0.16 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.26 2wp8 n HIS 704 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2wp8 n MET 705 N -0.16 1.70 -1.40 -0.41 2.81 -1.14 -4.82 117.12 113.70 2wp8 n MET 705 Ca 0.04 -0.47 -0.30 0.00 -1.81 0.00 0.00 57.70 55.16 2wp8 n MET 705 Cb 0.10 0.14 0.11 0.00 -0.71 0.00 0.00 33.22 32.87 2wp8 n MET 705 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2wp8 s ASP 706 N -1.35 3.98 -0.17 7.83 1.01 -1.26 -5.06 116.67 121.64 2wp8 s ASP 706 Ca 0.00 1.36 -0.02 0.00 0.71 0.00 0.00 52.55 54.61 2wp8 s ASP 706 Cb 0.00 -2.06 -0.01 0.00 1.01 0.00 0.00 42.92 41.86 2wp8 s ASP 706 CO 0.00 -2.30 -0.10 -0.94 0.21 0.00 0.00 175.17 172.04 2wp8 s SER 707 N -3.70 4.09 0.00 0.27 1.04 -1.26 -4.93 113.70 109.21 2wp8 s SER 707 Ca 0.62 -0.37 0.24 0.00 0.48 0.00 0.00 55.95 56.92 2wp8 s SER 707 Cb -0.16 -1.66 1.15 0.00 0.10 0.00 0.00 66.02 65.45 2wp8 s SER 707 CO 0.55 0.08 1.77 -0.62 0.98 0.00 0.00 173.24 176.01 2wp8 n GLU 708 N 4.09 1.34 -0.01 4.02 -0.58 -1.26 -2.61 120.64 125.63 2wp8 n GLU 708 Ca -0.18 -0.50 0.10 0.00 -0.42 0.00 0.00 57.16 56.16 2wp8 n GLU 708 Cb 0.52 -1.40 -0.15 0.00 -0.57 0.00 0.00 31.44 29.84 2wp8 n GLU 708 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2wp8 n THR 709 N -0.33 0.00 -2.11 2.62 -2.24 -1.26 -4.89 114.28 106.07 2wp8 n THR 709 Ca 0.18 -0.34 -0.00 0.00 -2.27 0.00 0.00 64.05 61.61 2wp8 n THR 709 Cb 0.20 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 2wp8 n THR 709 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2wp8 n SER 710 N -2.00 -1.28 -4.72 3.42 7.64 -1.07 -4.84 113.62 110.77 2wp8 n SER 710 Ca -0.01 -0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.48 2wp8 n SER 710 Cb 0.48 -0.57 -0.06 0.00 -1.01 0.00 0.00 64.21 63.05 2wp8 n SER 710 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2wp8 s ASP 711 N -2.99 6.77 0.43 6.43 1.01 -1.26 -5.05 116.67 122.01 2wp8 s ASP 711 Ca 0.00 0.92 -0.25 0.00 0.71 0.00 0.00 52.55 53.94 2wp8 s ASP 711 Cb -0.00 -2.33 -0.08 0.00 1.01 0.00 0.00 42.92 41.52 2wp8 s ASP 711 CO 0.00 -0.05 1.23 -2.16 0.21 0.00 0.00 175.17 174.40 2wp8 s PRO 712 N 0.74 3.87 0.56 8.23 0.04 -1.26 -4.86 135.00 142.33 2wp8 s PRO 712 Ca 0.29 1.95 -0.19 0.00 0.04 0.00 0.00 61.00 63.10 2wp8 s PRO 712 Cb -0.16 -2.60 -0.05 0.00 0.04 0.00 0.00 34.50 31.73 2wp8 s PRO 712 CO 0.13 -0.51 1.17 -0.80 0.04 0.00 0.00 177.00 177.02 2wp8 s ASN 713 N -1.05 5.49 0.42 6.66 -0.87 -1.26 -5.04 114.94 119.29 2wp8 s ASN 713 Ca 0.60 2.28 -0.10 0.00 -1.57 0.00 0.00 52.86 54.07 2wp8 s ASN 713 Cb -0.33 -2.59 -0.06 0.00 -0.02 0.00 0.00 41.25 38.25 2wp8 s ASN 713 CO 0.42 -1.38 0.77 -1.61 -2.57 0.00 0.00 177.10 172.73 2wp8 s GLU 714 N -3.29 3.74 -0.03 -0.60 0.41 -1.26 -5.00 118.70 112.66 2wp8 s GLU 714 Ca 0.75 0.43 -0.17 0.00 -0.41 0.00 0.00 54.97 55.56 2wp8 s GLU 714 Cb -0.27 -2.39 -0.10 0.00 -1.78 0.00 0.00 34.13 29.60 2wp8 s GLU 714 CO 0.30 -0.07 0.71 0.28 -0.49 0.00 0.00 175.26 176.00 2wp8 h VAL 715 N 0.95 0.00 -3.34 2.63 2.07 -1.96 -3.41 116.25 113.19 2wp8 h VAL 715 Ca -0.47 -0.54 -0.60 0.00 0.82 0.00 0.00 66.70 65.91 2wp8 h VAL 715 Cb 1.19 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.87 2wp8 h VAL 715 CO 0.63 0.00 0.48 -0.70 0.02 0.00 0.00 177.57 178.00 2wp8 s GLU 716 N -3.56 4.10 -0.10 1.57 2.12 -1.26 -4.58 118.70 116.98 2wp8 s GLU 716 Ca -0.09 0.83 -0.29 0.00 0.36 0.00 0.00 54.97 55.78 2wp8 s GLU 716 Cb 0.01 -3.68 -0.05 0.00 0.26 0.00 0.00 34.13 30.67 2wp8 s GLU 716 CO 0.27 -0.60 1.68 0.42 -0.54 0.00 0.00 175.26 176.49 2wp8 s ILE 717 N 2.95 3.57 0.44 -3.70 -1.09 -1.09 -4.97 121.20 117.32 2wp8 s ILE 717 Ca 0.35 0.68 -0.21 0.00 -2.23 0.00 0.00 60.65 59.23 2wp8 s ILE 717 Cb -0.15 -3.49 -0.10 0.00 -1.58 0.00 0.00 42.46 37.15 2wp8 s ILE 717 CO 0.10 -0.12 1.00 -1.59 -1.23 0.00 0.00 174.94 173.10 2wp8 s LYS 718 N 4.32 4.07 0.39 2.79 -2.85 -1.26 -5.04 119.74 122.16 2wp8 s LYS 718 Ca 0.74 1.28 -0.26 0.00 -1.00 0.00 0.00 55.97 56.74 2wp8 s LYS 718 Cb -0.31 -2.23 -0.09 0.00 -2.06 0.00 0.00 37.83 33.14 2wp8 s LYS 718 CO 0.30 -0.19 1.21 0.15 0.10 0.00 0.00 175.35 176.93 2wp8 s LYS 719 N -3.04 4.08 0.55 1.78 3.01 -1.26 -4.84 119.74 120.02 2wp8 s LYS 719 Ca 0.63 1.96 -0.07 0.00 -1.01 0.00 0.00 55.97 57.47 2wp8 s LYS 719 Cb -0.14 -2.75 -0.03 0.00 -1.01 0.00 0.00 37.83 33.90 2wp8 s LYS 719 CO 0.18 -0.34 0.89 -0.51 0.51 0.00 0.00 175.35 176.08 2wp8 s LEU 720 N -2.37 3.42 0.32 3.17 1.43 -1.26 -5.10 118.68 118.29 2wp8 s LEU 720 Ca 0.56 1.04 0.06 0.00 -1.03 0.00 0.00 54.13 54.75 2wp8 s LEU 720 Cb -0.34 -3.99 -0.06 0.00 0.03 0.00 0.00 46.19 41.83 2wp8 s LEU 720 CO 0.43 -0.77 -0.00 -0.76 0.23 0.00 0.00 176.35 175.47 2wp8 s LEU 721 N -4.93 2.44 0.31 1.79 1.43 -1.26 -5.03 118.68 113.43 2wp8 s LEU 721 Ca 0.51 -1.29 0.08 0.00 -1.03 0.00 0.00 54.13 52.40 2wp8 s LEU 721 Cb -0.11 -0.59 0.81 0.00 0.03 0.00 0.00 46.19 46.33 2wp8 s LEU 721 CO 0.48 -0.46 1.76 0.00 0.23 0.00 0.00 176.35 178.36 2wp8 h ALA 722 N 2.13 1.74 -0.21 4.21 0.00 -1.99 -2.23 119.26 122.91 2wp8 h ALA 722 Ca -0.41 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 2wp8 h ALA 722 Cb 1.24 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2wp8 h ALA 722 CO 0.70 -0.15 0.00 1.79 0.00 0.00 0.00 179.25 181.60 2wp8 h THR 723 N 0.68 1.13 -0.55 0.00 1.35 -1.96 -0.89 112.91 112.68 2wp8 h THR 723 Ca 0.61 -0.51 0.07 0.00 -0.55 0.00 0.00 66.41 66.03 2wp8 h THR 723 Cb 1.04 0.98 -0.06 0.00 -1.73 0.00 0.00 68.15 68.38 2wp8 h THR 723 CO -0.41 0.17 0.22 0.78 -0.25 0.00 0.00 175.52 176.03 2wp8 h ASN 724 N 0.30 0.26 -0.20 5.36 4.21 -1.74 -0.51 115.58 123.26 2wp8 h ASN 724 Ca 0.07 0.06 -0.21 0.00 1.21 0.00 0.00 56.30 57.43 2wp8 h ASN 724 Cb 0.20 0.02 0.01 0.00 -1.12 0.00 0.00 38.32 37.43 2wp8 h ASN 724 CO 0.00 0.17 -0.69 -1.28 -1.29 0.00 0.00 177.43 174.35 2wp8 h SER 725 N 0.42 0.95 -0.32 5.81 0.87 -1.29 -2.10 113.55 117.90 2wp8 h SER 725 Ca 0.27 -0.60 0.07 0.00 -1.23 0.00 0.00 61.79 60.30 2wp8 h SER 725 Cb 0.27 -0.28 -0.08 0.00 -0.44 0.00 0.00 62.40 61.87 2wp8 h SER 725 CO -0.25 1.38 -0.30 0.25 -0.53 0.00 0.00 176.83 177.38 2wp8 h LEU 726 N 0.57 -0.99 -1.30 2.23 6.46 -0.89 -0.49 115.31 120.90 2wp8 h LEU 726 Ca -0.03 0.17 -0.02 0.00 -0.12 0.00 0.00 57.88 57.88 2wp8 h LEU 726 Cb 1.31 0.46 -0.03 0.00 -0.73 0.00 0.00 40.66 41.67 2wp8 h LEU 726 CO 0.15 -0.32 0.24 1.62 -0.62 0.00 0.00 178.44 179.50 2wp8 h VAL 727 N -0.28 1.18 0.05 1.05 3.04 -1.05 -3.15 116.25 117.09 2wp8 h VAL 727 Ca 0.15 -0.51 -0.00 0.00 -1.01 0.00 0.00 66.70 65.33 2wp8 h VAL 727 Cb 0.52 0.53 0.00 0.00 -2.01 0.00 0.00 31.29 30.34 2wp8 h VAL 727 CO -0.47 0.21 -0.03 -0.08 -1.01 0.00 0.00 177.57 176.19 2wp8 h GLU 728 N 0.72 -0.07 -0.05 4.17 4.81 -0.45 -2.50 114.58 121.20 2wp8 h GLU 728 Ca 0.18 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.43 2wp8 h GLU 728 Cb 0.09 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.49 2wp8 h GLU 728 CO -0.02 0.52 0.06 0.93 -0.73 0.00 0.00 179.01 179.77 2wp8 h GLU 729 N -0.76 0.00 0.12 1.92 4.39 -1.22 0.21 114.58 119.23 2wp8 h GLU 729 Ca -0.01 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.42 2wp8 h GLU 729 Cb 0.63 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.27 2wp8 h GLU 729 CO 0.01 0.00 -1.39 0.74 -1.16 0.00 0.00 179.01 177.22 2wp8 h PHE 730 N 0.00 0.45 -0.49 4.33 -1.00 -1.49 -1.63 116.94 117.11 2wp8 h PHE 730 Ca 0.03 -0.32 0.10 0.00 2.81 0.00 0.00 57.97 60.58 2wp8 h PHE 730 Cb 0.15 -0.02 -0.10 0.00 3.61 0.00 0.00 35.95 39.59 2wp8 h PHE 730 CO 0.00 1.54 -0.17 0.52 -1.61 0.00 0.00 178.31 178.59 2wp8 h MET 731 N -0.31 -0.05 -0.68 1.51 2.86 -1.26 -0.21 114.93 116.80 2wp8 h MET 731 Ca -0.30 0.00 0.14 0.00 -2.06 0.00 0.00 59.70 57.49 2wp8 h MET 731 Cb 1.75 0.01 -0.10 0.00 0.06 0.00 0.00 31.60 33.33 2wp8 h MET 731 CO 0.06 -0.04 0.15 -0.07 1.06 0.00 0.00 176.91 178.08 2wp8 h LEU 732 N -0.06 -0.00 -0.14 1.22 -0.00 -0.62 0.61 115.31 116.33 2wp8 h LEU 732 Ca 0.23 0.13 -0.01 0.00 -0.00 0.00 0.00 57.88 58.23 2wp8 h LEU 732 Cb 0.41 0.18 -0.01 0.00 -0.00 0.00 0.00 40.66 41.25 2wp8 h LEU 732 CO -0.53 -0.02 0.04 0.25 -0.00 0.00 0.00 178.44 178.18 2wp8 h LEU 733 N 0.26 0.20 -1.01 1.67 5.85 -0.26 -0.44 115.31 121.59 2wp8 h LEU 733 Ca 0.37 -0.21 0.13 0.00 0.84 0.00 0.00 57.88 59.01 2wp8 h LEU 733 Cb 0.60 -0.05 -0.09 0.00 0.37 0.00 0.00 40.66 41.49 2wp8 h LEU 733 CO -0.47 0.36 0.63 0.00 -0.34 0.00 0.00 178.44 178.63 2wp8 h ALA 734 N 0.85 1.55 -0.22 1.25 0.00 -0.70 0.50 119.26 122.48 2wp8 h ALA 734 Ca 0.04 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2wp8 h ALA 734 Cb 0.24 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2wp8 h ALA 734 CO -0.00 0.18 0.04 -0.91 0.00 0.00 0.00 179.25 178.56 2wp8 h ASN 735 N 0.96 0.35 0.56 0.00 2.35 -0.35 -1.90 115.58 117.55 2wp8 h ASN 735 Ca 0.51 -0.25 -0.02 0.00 -0.55 0.00 0.00 56.30 55.99 2wp8 h ASN 735 Cb 0.57 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 2wp8 h ASN 735 CO -0.29 0.51 -0.38 0.40 -1.65 0.00 0.00 177.43 176.02 2wp8 h ILE 736 N 0.16 0.22 -0.38 2.81 2.04 -0.43 -0.50 117.51 121.45 2wp8 h ILE 736 Ca 0.07 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.92 2wp8 h ILE 736 Cb 0.31 0.22 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 2wp8 h ILE 736 CO 0.00 0.00 0.18 0.28 0.00 0.00 0.00 178.15 178.62 2wp8 h SER 737 N -0.91 0.46 -0.25 1.72 0.02 -0.94 -0.92 113.55 112.73 2wp8 h SER 737 Ca -0.07 -0.03 -0.19 0.00 -0.84 0.00 0.00 61.79 60.66 2wp8 h SER 737 Cb 0.75 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.18 2wp8 h SER 737 CO 0.04 0.39 -0.60 0.58 -1.14 0.00 0.00 176.83 176.10 2wp8 h VAL 738 N 0.52 1.28 -0.32 2.27 2.07 -1.25 -2.39 116.25 118.43 2wp8 h VAL 738 Ca 0.13 -1.79 0.07 0.00 0.82 0.00 0.00 66.70 65.94 2wp8 h VAL 738 Cb 0.05 1.73 -0.07 0.00 -1.52 0.00 0.00 31.29 31.48 2wp8 h VAL 738 CO -0.02 0.58 -0.13 0.00 0.02 0.00 0.00 177.57 178.02 2wp8 h ALA 739 N 0.64 0.14 0.33 1.67 0.00 0.24 0.13 119.26 122.40 2wp8 h ALA 739 Ca -0.00 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2wp8 h ALA 739 Cb 1.22 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 2wp8 h ALA 739 CO 0.13 -0.51 -0.25 0.00 0.00 0.00 0.00 179.25 178.62 2wp8 h ARG 740 N -0.07 -0.55 0.09 0.00 3.08 -1.32 -1.01 114.38 114.60 2wp8 h ARG 740 Ca 0.16 0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.24 2wp8 h ARG 740 Cb 0.31 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.49 2wp8 h ARG 740 CO -0.37 -0.37 -0.05 -0.22 -1.07 0.00 0.00 179.97 177.90 2wp8 h LYS 741 N -0.58 -0.12 0.00 0.04 1.63 -1.06 0.11 116.57 116.59 2wp8 h LYS 741 Ca -0.02 0.01 -0.04 0.00 -0.85 0.00 0.00 60.65 59.75 2wp8 h LYS 741 Cb 0.50 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.15 2wp8 h LYS 741 CO -0.00 -0.08 -0.18 -0.84 -3.45 0.00 0.00 179.45 174.90 2wp8 h ILE 742 N -0.13 0.54 0.21 2.00 3.07 -0.73 -1.22 117.51 121.26 2wp8 h ILE 742 Ca -0.01 -0.86 -0.01 0.00 1.55 0.00 0.00 64.86 65.53 2wp8 h ILE 742 Cb 0.10 1.58 0.00 0.00 -0.27 0.00 0.00 36.82 38.23 2wp8 h ILE 742 CO 0.02 0.17 -0.10 0.22 -1.05 0.00 0.00 178.15 177.41 2wp8 h TYR 743 N 0.00 -0.26 -0.64 0.16 3.20 -0.66 -2.57 116.97 116.20 2wp8 h TYR 743 Ca -0.00 -0.01 0.13 0.00 3.14 0.00 0.00 58.73 61.99 2wp8 h TYR 743 Cb 0.57 0.09 -0.10 0.00 1.54 0.00 0.00 36.73 38.82 2wp8 h TYR 743 CO 0.00 0.13 0.07 0.22 -1.64 0.00 0.00 178.16 176.94 2wp8 h ASP 744 N -0.81 -0.15 0.63 -2.11 3.58 -0.58 -0.49 116.42 116.49 2wp8 h ASP 744 Ca -0.03 0.14 -0.06 0.00 0.42 0.00 0.00 57.03 57.51 2wp8 h ASP 744 Cb 0.51 0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.79 2wp8 h ASP 744 CO 0.05 -0.07 -0.27 0.00 -2.88 0.00 0.00 179.24 176.07 2wp8 h ALA 745 N 1.56 1.15 -1.57 -0.78 0.00 -1.31 -3.39 119.26 114.93 2wp8 h ALA 745 Ca 0.34 -0.24 -0.45 0.00 0.00 0.00 0.00 54.91 54.56 2wp8 h ALA 745 Cb 0.56 -0.04 -0.34 0.00 0.00 0.00 0.00 17.79 17.96 2wp8 h ALA 745 CO -0.50 0.33 -1.01 1.19 0.00 0.00 0.00 179.25 179.26 2wp8 n PHE 746 N -3.63 -0.67 0.31 0.00 3.01 -0.26 -4.96 117.46 111.25 2wp8 n PHE 746 Ca -0.01 -3.35 0.19 0.00 1.01 0.00 0.00 57.45 55.29 2wp8 n PHE 746 Cb 0.39 0.04 1.03 0.00 -0.01 0.00 0.00 39.48 40.93 2wp8 n PHE 746 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2wp8 h PRO 747 N 3.35 0.00 0.57 -1.08 0.13 -1.59 -0.61 132.00 132.77 2wp8 h PRO 747 Ca 0.04 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.15 2wp8 h PRO 747 Cb 0.97 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.10 2wp8 h PRO 747 CO 0.42 0.00 -0.27 1.96 -0.23 0.00 0.00 178.00 179.88 2wp8 h GLN 748 N 0.00 -0.74 -0.16 0.86 1.08 -1.92 -3.28 115.11 110.94 2wp8 h GLN 748 Ca 0.02 0.05 -0.20 0.00 -1.45 0.00 0.00 58.65 57.07 2wp8 h GLN 748 Cb 0.22 0.17 -0.36 0.00 -0.05 0.00 0.00 27.48 27.47 2wp8 h GLN 748 CO -0.00 -0.44 -0.95 0.25 -0.95 0.00 0.00 178.83 176.74 2wp8 n THR 749 N -5.35 0.48 -1.78 -0.54 -2.24 -0.47 0.55 114.28 104.94 2wp8 n THR 749 Ca -0.12 -1.65 -0.42 0.00 -2.27 0.00 0.00 64.05 59.59 2wp8 n THR 749 Cb 0.34 1.08 -0.03 0.00 -2.10 0.00 0.00 70.33 69.62 2wp8 n THR 749 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wp8 s ALA 750 N -1.45 3.87 -0.15 6.98 0.00 -0.36 -4.67 121.76 125.98 2wp8 s ALA 750 Ca 0.27 1.55 -0.29 0.00 0.00 0.00 0.00 51.96 53.49 2wp8 s ALA 750 Cb 0.33 -3.67 -0.01 0.00 0.00 0.00 0.00 23.12 19.78 2wp8 s ALA 750 CO -0.10 -0.91 1.00 1.41 0.00 0.00 0.00 175.76 177.15 2wp8 s MET 751 N 0.81 4.36 0.23 0.00 1.75 -1.26 -1.14 119.30 124.05 2wp8 s MET 751 Ca 0.71 1.34 -0.07 0.00 -1.25 0.00 0.00 55.69 56.42 2wp8 s MET 751 Cb -0.48 -3.57 -0.02 0.00 2.84 0.00 0.00 34.83 33.59 2wp8 s MET 751 CO 0.35 -0.40 0.32 -0.51 -0.65 0.00 0.00 175.02 174.13 2wp8 s LEU 752 N 2.36 0.71 -0.04 4.11 1.43 0.12 -4.80 118.68 122.56 2wp8 s LEU 752 Ca 0.46 -1.15 0.01 0.00 -1.03 0.00 0.00 54.13 52.42 2wp8 s LEU 752 Cb -0.17 1.14 0.02 0.00 0.03 0.00 0.00 46.19 47.21 2wp8 s LEU 752 CO 0.14 -1.01 -0.04 -0.60 0.23 0.00 0.00 176.35 175.07 2wp8 s ARG 753 N -4.06 0.75 0.30 1.70 3.52 -0.43 -0.46 118.95 120.26 2wp8 s ARG 753 Ca 0.30 -0.07 0.09 0.00 -0.13 0.00 0.00 55.73 55.91 2wp8 s ARG 753 Cb 0.03 -0.80 -0.06 0.00 -1.56 0.00 0.00 34.95 32.56 2wp8 s ARG 753 CO 0.11 -0.10 -0.10 -0.98 -0.81 0.00 0.00 175.30 173.42 2wp8 s ARG 754 N 0.97 1.66 -0.19 5.12 1.70 -0.41 -4.36 118.95 123.44 2wp8 s ARG 754 Ca -0.10 -1.83 -0.04 0.00 -0.47 0.00 0.00 55.73 53.29 2wp8 s ARG 754 Cb -0.14 -1.45 0.09 0.00 -0.57 0.00 0.00 34.95 32.88 2wp8 s ARG 754 CO -0.00 0.13 0.22 -1.58 -1.08 0.00 0.00 175.30 172.98 2wp8 s HIS 755 N -2.78 -0.27 0.40 5.89 2.46 -0.69 -1.38 115.29 118.92 2wp8 s HIS 755 Ca 0.30 0.27 -0.24 0.00 0.47 0.00 0.00 55.06 55.86 2wp8 s HIS 755 Cb 0.02 -0.35 -0.09 0.00 -0.13 0.00 0.00 32.58 32.03 2wp8 s HIS 755 CO 0.14 -0.57 1.06 0.00 -2.47 0.00 0.00 174.74 172.90 2wp8 s ALA 756 N 2.32 3.09 0.23 1.58 0.00 -1.26 -2.10 121.76 125.63 2wp8 s ALA 756 Ca 0.06 0.72 -0.30 0.00 0.00 0.00 0.00 51.96 52.45 2wp8 s ALA 756 Cb -0.15 -3.28 -0.09 0.00 0.00 0.00 0.00 23.12 19.59 2wp8 s ALA 756 CO -0.11 -0.24 1.29 0.00 0.00 0.00 0.00 175.76 176.69 2wp8 s ALA 757 N -1.63 3.51 0.59 0.00 0.00 -1.26 -4.56 121.76 118.41 2wp8 s ALA 757 Ca 0.58 1.11 -0.18 0.00 0.00 0.00 0.00 51.96 53.47 2wp8 s ALA 757 Cb -0.23 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.39 2wp8 s ALA 757 CO 0.29 -0.52 1.13 -1.25 0.00 0.00 0.00 175.76 175.41 2wp8 s PRO 758 N -0.55 3.11 0.22 0.00 0.04 -1.26 -4.98 135.00 131.58 2wp8 s PRO 758 Ca 0.54 1.56 -0.30 0.00 0.04 0.00 0.00 61.00 62.84 2wp8 s PRO 758 Cb -0.37 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.11 2wp8 s PRO 758 CO 0.41 -1.03 1.32 -1.25 0.04 0.00 0.00 177.00 176.49 2wp8 s PRO 759 N -3.57 4.38 0.42 0.56 0.04 -1.26 -4.87 135.00 130.70 2wp8 s PRO 759 Ca 0.71 2.09 0.18 0.00 0.04 0.00 0.00 61.00 64.02 2wp8 s PRO 759 Cb -0.23 -3.17 0.95 0.00 0.04 0.00 0.00 34.50 32.09 2wp8 s PRO 759 CO 0.33 -0.26 1.47 0.66 0.04 0.00 0.00 177.00 179.23 2wp8 h SER 760 N 5.13 0.00 -0.23 6.66 4.64 -1.95 0.15 113.55 127.96 2wp8 h SER 760 Ca -0.45 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.85 2wp8 h SER 760 Cb 1.22 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.29 2wp8 h SER 760 CO 0.76 0.00 0.09 0.74 -0.87 0.00 0.00 176.83 177.55 2wp8 h THR 761 N 0.00 1.13 -0.35 2.95 2.02 -1.91 -2.89 112.91 113.86 2wp8 h THR 761 Ca 0.00 -0.45 0.10 0.00 0.77 0.00 0.00 66.41 66.83 2wp8 h THR 761 Cb 0.63 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 2wp8 h THR 761 CO 0.00 0.16 0.27 0.78 0.37 0.00 0.00 175.52 177.10 2wp8 h ASN 762 N 0.41 0.00 0.25 4.18 4.21 -1.04 -2.86 115.58 120.74 2wp8 h ASN 762 Ca 0.10 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.61 2wp8 h ASN 762 Cb 0.14 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.34 2wp8 h ASN 762 CO -0.01 0.00 -0.58 0.49 -1.29 0.00 0.00 177.43 176.05 2wp8 n PHE 763 N -4.32 0.00 -0.16 1.19 3.01 -1.09 -4.59 117.46 111.49 2wp8 n PHE 763 Ca 0.05 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.41 2wp8 n PHE 763 Cb 0.44 -0.12 -0.08 0.00 -0.01 0.00 0.00 39.48 39.71 2wp8 n PHE 763 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 2wp8 h GLU 764 N 0.57 -0.22 -0.32 -1.08 4.81 -1.60 0.17 114.58 116.92 2wp8 h GLU 764 Ca 0.00 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.34 2wp8 h GLU 764 Cb 0.53 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 2wp8 h GLU 764 CO 0.00 -0.14 0.23 0.82 -0.73 0.00 0.00 179.01 179.19 2wp8 h ILE 765 N -0.22 0.84 0.10 2.32 1.08 -1.83 -1.53 117.51 118.27 2wp8 h ILE 765 Ca 0.07 -0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.54 2wp8 h ILE 765 Cb 0.42 0.83 0.00 0.00 -3.07 0.00 0.00 36.82 35.00 2wp8 h ILE 765 CO -0.52 0.00 -0.05 0.25 -0.69 0.00 0.00 178.15 177.14 2wp8 h LEU 766 N 0.01 -0.11 -1.70 1.44 5.85 -1.00 -1.27 115.31 118.53 2wp8 h LEU 766 Ca 0.15 -0.45 -0.04 0.00 0.84 0.00 0.00 57.88 58.39 2wp8 h LEU 766 Cb 0.61 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 2wp8 h LEU 766 CO -0.00 0.44 -0.18 0.78 -0.34 0.00 0.00 178.44 179.14 2wp8 h ASN 767 N -0.73 0.00 0.41 1.25 2.35 -0.92 0.73 115.58 118.66 2wp8 h ASN 767 Ca -0.01 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.51 2wp8 h ASN 767 Cb 0.55 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.92 2wp8 h ASN 767 CO 0.02 0.18 -0.95 -0.33 -1.65 0.00 0.00 177.43 174.71 2wp8 h GLU 768 N 0.00 0.36 -0.40 0.81 5.08 -1.29 0.10 114.58 119.24 2wp8 h GLU 768 Ca -0.00 -0.40 -0.14 0.00 -1.00 0.00 0.00 59.36 57.82 2wp8 h GLU 768 Cb 0.41 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 2wp8 h GLU 768 CO 0.02 1.08 -0.28 0.52 -1.00 0.00 0.00 179.01 179.35 2wp8 h MET 769 N 0.19 0.90 -0.46 2.33 2.86 -0.33 -2.70 114.93 117.73 2wp8 h MET 769 Ca -0.08 -0.43 -0.14 0.00 -2.06 0.00 0.00 59.70 56.99 2wp8 h MET 769 Cb 1.59 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 33.23 2wp8 h MET 769 CO 0.16 1.08 -0.26 -0.07 1.06 0.00 0.00 176.91 178.88 2wp8 h LEU 770 N 0.72 1.03 0.21 1.22 3.38 0.52 -1.92 115.31 120.46 2wp8 h LEU 770 Ca 0.08 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.62 2wp8 h LEU 770 Cb 0.86 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2wp8 h LEU 770 CO 0.08 1.22 -0.10 -1.13 0.09 0.00 0.00 178.44 178.59 2wp8 h ASN 771 N 0.84 -0.24 -0.76 -0.43 -0.73 -0.11 -1.43 115.58 112.71 2wp8 h ASN 771 Ca 0.10 0.01 0.18 0.00 1.87 0.00 0.00 56.30 58.45 2wp8 h ASN 771 Cb 0.85 0.06 -0.12 0.00 0.27 0.00 0.00 38.32 39.38 2wp8 h ASN 771 CO 0.08 -0.15 0.12 0.74 -0.37 0.00 0.00 177.43 177.85 2wp8 h THR 772 N -0.33 0.41 0.00 -3.57 2.02 -1.55 -0.99 112.91 108.90 2wp8 h THR 772 Ca -0.03 -0.07 -0.24 0.00 0.77 0.00 0.00 66.41 66.85 2wp8 h THR 772 Cb 0.22 0.20 -0.04 0.00 -1.74 0.00 0.00 68.15 66.79 2wp8 h THR 772 CO 0.05 0.04 -1.77 0.54 0.37 0.00 0.00 175.52 174.74 2wp8 n ARG 773 N -5.24 0.64 0.00 6.66 5.12 -0.72 -4.69 116.66 118.43 2wp8 n ARG 773 Ca 0.15 0.16 0.00 0.00 -1.93 0.00 0.00 57.85 56.23 2wp8 n ARG 773 Cb 0.50 -1.71 0.00 0.00 -1.16 0.00 0.00 32.46 30.09 2wp8 n ARG 773 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 2wp8 n LYS 774 N -2.85 0.25 -4.05 5.56 3.00 -0.61 -5.02 118.16 114.43 2wp8 n LYS 774 Ca -0.17 -0.45 -0.33 0.00 -0.00 0.00 0.00 58.31 57.36 2wp8 n LYS 774 Cb 0.96 -0.66 -0.04 0.00 0.00 0.00 0.00 35.03 35.29 2wp8 n LYS 774 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2wp8 n ASN 775 N -0.07 -1.08 -3.83 3.14 3.02 -0.39 -4.94 115.26 111.11 2wp8 n ASN 775 Ca 0.00 -1.11 -0.15 0.00 -0.03 0.00 0.00 54.58 53.29 2wp8 n ASN 775 Cb 0.28 -1.35 -0.09 0.00 -0.61 0.00 0.00 39.78 38.01 2wp8 n ASN 775 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2wp8 s MET 776 N -6.93 1.46 -0.02 3.52 -1.94 -0.77 -4.97 119.30 109.65 2wp8 s MET 776 Ca 0.19 -1.77 -0.29 0.00 -1.71 0.00 0.00 55.69 52.11 2wp8 s MET 776 Cb -0.11 0.31 0.09 0.00 2.01 0.00 0.00 34.83 37.13 2wp8 s MET 776 CO 0.85 -0.51 0.77 -1.54 -0.01 0.00 0.00 175.02 174.57 2wp8 s SER 777 N -3.24 -0.53 -0.12 3.03 1.04 -1.26 -1.94 113.70 110.67 2wp8 s SER 777 Ca 0.39 0.37 -0.05 0.00 0.48 0.00 0.00 55.95 57.14 2wp8 s SER 777 Cb 0.05 0.48 -0.04 0.00 0.10 0.00 0.00 66.02 66.60 2wp8 s SER 777 CO 0.18 -0.63 0.08 -0.63 0.98 0.00 0.00 173.24 173.22 2wp8 s ILE 778 N -2.06 4.97 -0.05 -1.02 1.01 -1.26 -4.84 121.20 117.94 2wp8 s ILE 778 Ca -0.04 0.01 -0.03 0.00 0.00 0.00 0.00 60.65 60.59 2wp8 s ILE 778 Cb -0.00 -3.16 -0.04 0.00 0.01 0.00 0.00 42.46 39.27 2wp8 s ILE 778 CO -0.00 0.58 0.11 -0.55 0.00 0.00 0.00 174.94 175.09 2wp8 s SER 779 N -0.70 6.01 -0.03 3.58 0.15 -1.26 -4.98 113.70 116.47 2wp8 s SER 779 Ca 0.12 0.30 0.04 0.00 0.70 0.00 0.00 55.95 57.11 2wp8 s SER 779 Cb -0.12 -1.84 0.07 0.00 -1.71 0.00 0.00 66.02 62.42 2wp8 s SER 779 CO 0.03 0.33 0.95 0.18 1.20 0.00 0.00 173.24 175.93 2wp8 n LEU 780 N 1.52 1.60 -0.29 3.45 4.77 -1.26 -2.68 117.00 124.11 2wp8 n LEU 780 Ca -0.16 -1.84 0.11 0.00 -0.03 0.00 0.00 56.01 54.09 2wp8 n LEU 780 Cb 0.54 -0.10 0.27 0.00 -2.33 0.00 0.00 43.42 41.80 2wp8 n LEU 780 CO 0.36 0.45 1.01 -0.33 -1.33 0.00 0.00 177.39 177.54 2wp8 h GLU 781 N 0.00 0.35 -2.67 3.23 3.07 -1.96 -3.45 114.58 113.16 2wp8 h GLU 781 Ca 0.00 -0.02 0.12 0.00 -0.50 0.00 0.00 59.36 58.96 2wp8 h GLU 781 Cb 0.76 -0.08 -0.06 0.00 -0.84 0.00 0.00 28.75 28.53 2wp8 h GLU 781 CO 0.00 0.23 0.36 -1.54 -1.40 0.00 0.00 179.01 176.66 2wp8 s SER 782 N -5.20 -0.21 0.45 1.42 1.04 -1.26 -4.98 113.70 104.96 2wp8 s SER 782 Ca -0.12 -0.52 0.15 0.00 0.48 0.00 0.00 55.95 55.94 2wp8 s SER 782 Cb 0.24 0.61 1.04 0.00 0.10 0.00 0.00 66.02 68.01 2wp8 s SER 782 CO 0.77 -1.13 2.00 0.77 0.98 0.00 0.00 173.24 176.64 2wp8 h SER 783 N 2.00 0.00 -0.08 7.02 4.64 -1.87 -0.87 113.55 124.39 2wp8 h SER 783 Ca -0.22 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.06 2wp8 h SER 783 Cb 1.24 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2wp8 h SER 783 CO 0.25 0.17 -0.10 0.50 -0.87 0.00 0.00 176.83 176.78 2wp8 h LYS 784 N 0.00 0.21 -0.97 4.77 1.63 -1.87 -1.76 116.57 118.58 2wp8 h LYS 784 Ca -0.00 -0.12 0.20 0.00 -0.85 0.00 0.00 60.65 59.88 2wp8 h LYS 784 Cb 0.31 0.01 -0.09 0.00 -0.60 0.00 0.00 32.23 31.86 2wp8 h LYS 784 CO 0.02 0.66 0.61 0.00 -3.45 0.00 0.00 179.45 177.29 2wp8 h ALA 785 N 0.55 1.89 0.20 5.00 0.00 -1.69 -1.04 119.26 124.17 2wp8 h ALA 785 Ca 0.01 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2wp8 h ALA 785 Cb 0.62 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2wp8 h ALA 785 CO 0.02 -0.23 -0.10 1.25 0.00 0.00 0.00 179.25 180.20 2wp8 h LEU 786 N 0.63 -0.23 -0.60 0.00 5.85 -0.96 -2.40 115.31 117.59 2wp8 h LEU 786 Ca 0.54 -0.27 0.12 0.00 0.84 0.00 0.00 57.88 59.11 2wp8 h LEU 786 Cb 1.02 0.06 -0.12 0.00 0.37 0.00 0.00 40.66 41.99 2wp8 h LEU 786 CO -0.30 0.30 -0.18 0.00 -0.34 0.00 0.00 178.44 177.93 2wp8 h ALA 787 N -0.50 0.35 -0.61 1.25 0.00 -0.93 0.32 119.26 119.14 2wp8 h ALA 787 Ca -0.03 0.23 0.04 0.00 0.00 0.00 0.00 54.91 55.15 2wp8 h ALA 787 Cb 0.49 0.50 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 2wp8 h ALA 787 CO 0.05 -0.46 0.35 -0.44 0.00 0.00 0.00 179.25 178.75 2wp8 h ASP 788 N -0.03 0.55 0.33 0.00 5.19 -1.31 -2.66 116.42 118.50 2wp8 h ASP 788 Ca 0.29 0.02 -0.07 0.00 -0.62 0.00 0.00 57.03 56.64 2wp8 h ASP 788 Cb 0.47 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 39.87 2wp8 h ASP 788 CO -0.63 0.38 -0.33 0.77 -3.12 0.00 0.00 179.24 176.30 2wp8 h SER 789 N 0.68 0.00 -0.06 6.45 4.64 0.08 -2.45 113.55 122.89 2wp8 h SER 789 Ca 0.26 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.58 2wp8 h SER 789 Cb 0.09 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2wp8 h SER 789 CO -0.14 0.33 0.03 -0.07 -0.87 0.00 0.00 176.83 176.11 2wp8 h LEU 790 N 0.00 0.08 -1.15 5.97 4.07 -0.73 -2.01 115.31 121.53 2wp8 h LEU 790 Ca -0.00 -0.14 0.29 0.00 0.08 0.00 0.00 57.88 58.11 2wp8 h LEU 790 Cb 0.58 -0.02 -0.12 0.00 1.08 0.00 0.00 40.66 42.18 2wp8 h LEU 790 CO 0.04 0.19 0.64 0.44 -1.08 0.00 0.00 178.44 178.67 2wp8 h ASP 791 N -0.04 0.52 0.91 -0.43 3.32 -1.11 0.20 116.42 119.79 2wp8 h ASP 791 Ca 0.02 0.14 -0.04 0.00 0.02 0.00 0.00 57.03 57.17 2wp8 h ASP 791 Cb 0.14 0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 2wp8 h ASP 791 CO -0.00 0.00 -0.17 0.03 -1.72 0.00 0.00 179.24 177.38 2wp8 h ARG 792 N 0.40 0.00 -5.77 3.56 3.08 -1.00 -3.40 114.38 111.26 2wp8 h ARG 792 Ca 0.68 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 60.26 2wp8 h ARG 792 Cb 1.58 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 31.56 2wp8 h ARG 792 CO -0.46 0.17 1.36 0.00 -1.07 0.00 0.00 179.97 179.98 2wp8 s VAL 794 N 7.78 1.24 -0.34 0.00 1.01 -1.26 -4.19 120.40 124.64 2wp8 s VAL 794 Ca 0.60 -0.51 -0.16 0.00 0.00 0.00 0.00 61.98 61.91 2wp8 s VAL 794 Cb -0.01 -1.15 -0.01 0.00 0.00 0.00 0.00 36.38 35.21 2wp8 s VAL 794 CO 0.03 0.39 0.42 -0.62 0.00 0.00 0.00 175.10 175.31 2wp8 s ASP 795 N 0.90 6.23 0.24 3.32 3.68 -1.26 -4.95 116.67 124.83 2wp8 s ASP 795 Ca -0.10 -0.14 -0.07 0.00 2.13 0.00 0.00 52.55 54.37 2wp8 s ASP 795 Cb -0.15 -2.22 0.24 0.00 -1.45 0.00 0.00 42.92 39.34 2wp8 s ASP 795 CO 0.01 -0.38 1.91 1.55 0.13 0.00 0.00 175.17 178.39 2wp8 h PRO 796 N 8.45 1.29 0.04 4.34 0.13 -1.99 -2.37 132.00 141.88 2wp8 h PRO 796 Ca -0.29 -0.09 0.03 0.00 -0.87 0.00 0.00 66.00 64.78 2wp8 h PRO 796 Cb 1.14 -0.29 -0.05 0.00 0.13 0.00 0.00 31.00 31.93 2wp8 h PRO 796 CO 0.72 0.86 -0.41 0.93 -0.23 0.00 0.00 178.00 179.87 2wp8 h GLU 797 N 1.32 -0.57 -4.95 0.86 3.07 -2.06 -3.42 114.58 108.83 2wp8 h GLU 797 Ca 0.35 0.04 -0.67 0.00 -0.50 0.00 0.00 59.36 58.59 2wp8 h GLU 797 Cb -0.13 0.13 -0.36 0.00 -0.84 0.00 0.00 28.75 27.55 2wp8 h GLU 797 CO -0.07 -0.38 -0.83 0.34 -1.40 0.00 0.00 179.01 176.67 2wp8 s ASP 798 N -4.77 3.72 0.22 1.42 3.68 -0.89 -5.01 116.67 115.03 2wp8 s ASP 798 Ca -0.16 -0.99 -0.08 0.00 2.13 0.00 0.00 52.55 53.45 2wp8 s ASP 798 Cb 0.08 -1.50 0.26 0.00 -1.45 0.00 0.00 42.92 40.32 2wp8 s ASP 798 CO 0.64 -0.09 1.82 -0.65 0.13 0.00 0.00 175.17 177.02 2wp8 h PRO 799 N 7.87 0.76 0.00 4.34 0.11 -1.82 -3.12 132.00 140.14 2wp8 h PRO 799 Ca -0.33 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 65.60 2wp8 h PRO 799 Cb 1.09 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.01 2wp8 h PRO 799 CO 0.55 0.50 -0.61 -0.92 -0.21 0.00 0.00 178.00 177.31 2wp8 h TYR 800 N 0.78 0.00 -0.93 0.65 3.20 -1.95 -3.26 116.97 115.46 2wp8 h TYR 800 Ca 0.32 0.00 0.18 0.00 3.14 0.00 0.00 58.73 62.37 2wp8 h TYR 800 Cb 0.17 0.00 -0.17 0.00 1.54 0.00 0.00 36.73 38.26 2wp8 h TYR 800 CO -0.06 0.61 -0.25 0.34 -1.64 0.00 0.00 178.16 177.16 2wp8 n PHE 801 N -3.76 0.29 -0.27 -3.82 7.35 -1.18 0.34 117.46 116.41 2wp8 n PHE 801 Ca -0.01 1.14 0.01 0.00 -0.76 0.00 0.00 57.45 57.83 2wp8 n PHE 801 Cb 0.62 -1.01 0.08 0.00 0.35 0.00 0.00 39.48 39.52 2wp8 n PHE 801 CO 0.00 0.00 0.00 -0.97 -0.76 0.00 0.00 176.76 175.03 2wp8 h ASN 802 N 0.00 -0.76 0.18 -2.13 -0.73 -1.72 0.13 115.58 110.54 2wp8 h ASN 802 Ca 0.43 0.23 -0.10 0.00 1.87 0.00 0.00 56.30 58.73 2wp8 h ASN 802 Cb 0.66 0.49 -0.01 0.00 0.27 0.00 0.00 38.32 39.73 2wp8 h ASN 802 CO -0.96 -0.26 -0.38 0.71 -0.37 0.00 0.00 177.43 176.18 2wp8 h THR 803 N -0.01 1.30 0.13 -3.57 1.35 -0.34 -1.87 112.91 109.89 2wp8 h THR 803 Ca 0.36 -1.44 0.00 0.00 -0.55 0.00 0.00 66.41 64.78 2wp8 h THR 803 Cb 0.56 1.62 -0.01 0.00 -1.73 0.00 0.00 68.15 68.59 2wp8 h THR 803 CO -0.79 0.44 -0.12 0.25 -0.25 0.00 0.00 175.52 175.05 2wp8 h LEU 804 N 0.23 -0.31 -0.29 3.87 5.85 -0.23 0.19 115.31 124.62 2wp8 h LEU 804 Ca 0.02 0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.84 2wp8 h LEU 804 Cb 0.77 0.11 -0.08 0.00 0.37 0.00 0.00 40.66 41.83 2wp8 h LEU 804 CO 0.06 -0.18 -0.34 0.58 -0.34 0.00 0.00 178.44 178.21 2wp8 h VAL 805 N -0.27 0.23 -0.47 1.05 2.07 -0.54 0.40 116.25 118.72 2wp8 h VAL 805 Ca 0.00 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.60 2wp8 h VAL 805 Cb 0.25 0.23 -0.10 0.00 -1.52 0.00 0.00 31.29 30.15 2wp8 h VAL 805 CO -0.03 0.00 -0.40 0.03 0.02 0.00 0.00 177.57 177.19 2wp8 h ARG 806 N -0.32 -0.26 -0.83 1.57 3.08 -0.99 0.16 114.38 116.79 2wp8 h ARG 806 Ca 0.14 0.02 0.19 0.00 0.07 0.00 0.00 59.98 60.40 2wp8 h ARG 806 Cb 0.55 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.61 2wp8 h ARG 806 CO -0.47 -0.17 0.56 0.82 -1.07 0.00 0.00 179.97 179.64 2wp8 h ILE 807 N -0.27 0.69 0.12 2.04 2.04 0.78 -1.76 117.51 121.16 2wp8 h ILE 807 Ca 0.17 -0.11 -0.29 0.00 1.00 0.00 0.00 64.86 65.63 2wp8 h ILE 807 Cb 0.57 0.36 -0.00 0.00 -0.74 0.00 0.00 36.82 37.01 2wp8 h ILE 807 CO -0.61 0.06 -1.36 0.24 0.00 0.00 0.00 178.15 176.48 2wp8 h MET 808 N 0.31 0.26 0.00 2.37 2.86 0.11 -3.25 114.93 117.59 2wp8 h MET 808 Ca 0.42 -0.45 -0.07 0.00 -2.06 0.00 0.00 59.70 57.54 2wp8 h MET 808 Cb 1.16 0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.98 2wp8 h MET 808 CO -0.12 1.17 -0.34 0.66 1.06 0.00 0.00 176.91 179.34 2wp8 h SER 809 N 0.07 0.00 -0.57 1.22 4.64 0.04 -3.02 113.55 115.93 2wp8 h SER 809 Ca -0.18 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.09 2wp8 h SER 809 Cb 1.99 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 64.06 2wp8 h SER 809 CO 0.19 0.34 0.14 0.74 -0.87 0.00 0.00 176.83 177.37 2wp8 h THR 810 N 0.00 1.25 -0.19 2.95 2.02 -1.40 -2.08 112.91 115.46 2wp8 h THR 810 Ca -0.00 -0.89 0.06 0.00 0.77 0.00 0.00 66.41 66.34 2wp8 h THR 810 Cb 0.85 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 2wp8 h THR 810 CO 0.04 0.33 0.47 0.03 0.37 0.00 0.00 175.52 176.76 2wp8 h ARG 811 N 0.81 0.00 0.00 6.66 -0.00 -1.58 0.14 114.38 120.41 2wp8 h ARG 811 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.66 2wp8 h ARG 811 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.32 2wp8 h ARG 811 CO 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 179.97 179.59 2wp8 s MET 813 N -3.22 2.20 0.63 0.00 -1.94 0.49 -4.88 119.30 112.58 2wp8 s MET 813 Ca 0.06 1.34 -0.08 0.00 -1.71 0.00 0.00 55.69 55.30 2wp8 s MET 813 Cb 0.09 -1.88 0.01 0.00 2.01 0.00 0.00 34.83 35.06 2wp8 s MET 813 CO 0.70 -1.71 0.98 -1.64 -0.01 0.00 0.00 175.02 173.33 2wp8 s MET 814 N -4.56 2.97 0.18 2.03 -1.94 -1.26 -5.05 119.30 111.67 2wp8 s MET 814 Ca 0.65 0.23 -0.30 0.00 -1.71 0.00 0.00 55.69 54.56 2wp8 s MET 814 Cb -0.20 -2.17 -0.07 0.00 2.01 0.00 0.00 34.83 34.40 2wp8 s MET 814 CO 0.51 -0.80 1.02 0.00 -0.01 0.00 0.00 175.02 175.75 2wp8 s ALA 815 N -3.13 3.33 0.81 3.03 0.00 -1.26 -4.93 121.76 119.60 2wp8 s ALA 815 Ca 0.55 0.70 -0.11 0.00 0.00 0.00 0.00 51.96 53.10 2wp8 s ALA 815 Cb -0.11 -3.30 0.08 0.00 0.00 0.00 0.00 23.12 19.80 2wp8 s ALA 815 CO 0.48 -0.06 1.12 0.00 0.00 0.00 0.00 175.76 177.30 2wp8 s ALA 816 N -0.43 2.01 -0.06 0.00 0.00 -1.26 -4.56 121.76 117.46 2wp8 s ALA 816 Ca 0.46 0.42 -0.08 0.00 0.00 0.00 0.00 51.96 52.76 2wp8 s ALA 816 Cb -0.27 -3.34 0.02 0.00 0.00 0.00 0.00 23.12 19.53 2wp8 s ALA 816 CO 0.33 -2.06 0.21 1.14 0.00 0.00 0.00 175.76 175.38 2wp8 s GLN 817 N -4.73 0.34 0.68 0.00 -2.07 -0.48 -5.00 119.66 108.41 2wp8 s GLN 817 Ca 0.64 0.12 -0.12 0.00 -1.82 0.00 0.00 55.36 54.18 2wp8 s GLN 817 Cb -0.20 0.16 0.00 0.00 -1.09 0.00 0.00 33.01 31.88 2wp8 s GLN 817 CO 0.55 -0.06 1.07 0.71 -1.32 0.00 0.00 175.29 176.24 2wp8 s TYR 818 N -0.32 2.96 -0.16 9.60 1.51 -1.26 -1.28 117.35 128.39 2wp8 s TYR 818 Ca -0.04 1.48 -0.31 0.00 -1.01 0.00 0.00 57.07 57.19 2wp8 s TYR 818 Cb -0.03 -2.96 0.14 0.00 -0.11 0.00 0.00 41.96 39.00 2wp8 s TYR 818 CO 0.01 -1.32 1.08 -0.59 -1.11 0.00 0.00 175.55 173.62 2wp8 s PHE 819 N -2.82 -0.27 0.22 2.71 -0.71 0.39 -4.89 117.98 112.61 2wp8 s PHE 819 Ca 0.61 0.38 -0.08 0.00 -1.04 0.00 0.00 56.93 56.80 2wp8 s PHE 819 Cb -0.15 0.48 -0.07 0.00 -1.21 0.00 0.00 43.02 42.07 2wp8 s PHE 819 CO 0.49 -0.29 0.52 1.52 -1.34 0.00 0.00 175.22 176.12 2wp8 s TYR 820 N -1.59 3.44 0.48 3.49 1.13 -1.26 -0.70 117.35 122.34 2wp8 s TYR 820 Ca 0.03 0.77 0.15 0.00 -1.41 0.00 0.00 57.07 56.61 2wp8 s TYR 820 Cb -0.01 -2.18 1.13 0.00 -1.10 0.00 0.00 41.96 39.80 2wp8 s TYR 820 CO -0.03 0.28 2.06 0.66 -2.51 0.00 0.00 175.55 176.02 2wp8 h SER 821 N 2.45 0.00 -0.22 -0.18 4.64 -1.26 -2.93 113.55 116.06 2wp8 h SER 821 Ca -0.47 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 60.88 2wp8 h SER 821 Cb 1.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 2wp8 h SER 821 CO 0.69 0.10 0.15 1.23 -0.87 0.00 0.00 176.83 178.13 2wp8 h GLY 822 N 0.30 0.18 1.75 -0.77 0.00 0.05 -3.08 103.07 101.51 2wp8 h GLY 822 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2wp8 h GLY 822 CO 0.01 0.06 -0.03 0.00 0.00 0.00 0.00 176.54 176.57 2wp8 n ALA 823 N -2.54 2.47 -2.21 3.60 0.00 -1.10 -4.88 120.51 115.85 2wp8 n ALA 823 Ca 0.01 -0.14 -0.10 0.00 0.00 0.00 0.00 53.44 53.22 2wp8 n ALA 823 Cb 0.18 -1.45 -0.10 0.00 0.00 0.00 0.00 19.45 18.08 2wp8 n ALA 823 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2wp8 s TYR 824 N -2.84 0.86 0.29 0.00 1.51 -1.16 -5.12 117.35 110.89 2wp8 s TYR 824 Ca 0.19 -1.21 0.04 0.00 -1.01 0.00 0.00 57.07 55.08 2wp8 s TYR 824 Cb 0.19 -0.45 -0.02 0.00 -0.11 0.00 0.00 41.96 41.57 2wp8 s TYR 824 CO 0.52 -0.56 0.44 -1.54 -1.11 0.00 0.00 175.55 173.30 2wp8 s SER 825 N -3.06 6.21 0.17 2.29 1.04 -1.26 -4.95 113.70 114.14 2wp8 s SER 825 Ca 0.26 0.10 -0.20 0.00 0.48 0.00 0.00 55.95 56.58 2wp8 s SER 825 Cb 0.07 -1.73 0.09 0.00 0.10 0.00 0.00 66.02 64.55 2wp8 s SER 825 CO 0.03 -0.23 1.62 0.22 0.98 0.00 0.00 173.24 175.86 2wp8 h TYR 826 N 0.99 -0.66 0.00 5.02 3.20 -2.00 -0.65 116.97 122.86 2wp8 h TYR 826 Ca -0.50 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.42 2wp8 h TYR 826 Cb 1.24 0.35 0.00 0.00 1.54 0.00 0.00 36.73 39.86 2wp8 h TYR 826 CO 0.45 -0.33 0.00 -2.30 -1.64 0.00 0.00 178.16 174.35 2wp8 n PRO 827 N -5.40 0.16 0.00 1.82 -0.02 -1.26 0.68 135.00 130.98 2wp8 n PRO 827 Ca 0.02 0.17 0.14 0.00 -2.02 0.00 0.00 63.50 61.81 2wp8 n PRO 827 Cb 0.31 -1.50 0.54 0.00 -0.02 0.00 0.00 33.50 32.83 2wp8 n PRO 827 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2wp8 n ASP 828 N -1.34 0.73 0.21 2.55 8.00 -0.26 -4.01 116.55 122.43 2wp8 n ASP 828 Ca 0.06 -0.78 0.09 0.00 0.71 0.00 0.00 54.79 54.87 2wp8 n ASP 828 Cb 0.13 0.00 0.32 0.00 -0.02 0.00 0.00 41.12 41.56 2wp8 n ASP 828 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 2wp8 h PHE 829 N 0.93 0.00 -0.54 1.24 0.05 0.30 -3.45 116.94 115.46 2wp8 h PHE 829 Ca 0.00 0.00 -0.43 0.00 3.82 0.00 0.00 57.97 61.36 2wp8 h PHE 829 Cb 0.41 0.00 0.03 0.00 2.00 0.00 0.00 35.95 38.38 2wp8 h PHE 829 CO 0.00 0.22 0.06 0.54 -0.18 0.00 0.00 178.31 178.95 2wp8 n ARG 830 N -3.25 0.00 -3.19 1.51 5.12 -0.86 -4.48 116.66 111.51 2wp8 n ARG 830 Ca 0.01 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.53 2wp8 n ARG 830 Cb 0.51 -0.81 -0.07 0.00 -1.16 0.00 0.00 32.46 30.93 2wp8 n ARG 830 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 2wp8 s HIS 831 N 0.15 3.22 0.02 -1.55 5.65 -0.07 -1.70 115.29 121.00 2wp8 s HIS 831 Ca 0.50 0.49 -0.20 0.00 0.25 0.00 0.00 55.06 56.09 2wp8 s HIS 831 Cb -0.70 -2.87 -0.18 0.00 -1.18 0.00 0.00 32.58 27.65 2wp8 s HIS 831 CO 0.32 -0.42 1.22 -0.92 -0.65 0.00 0.00 174.74 174.29 2wp8 h TYR 832 N 8.21 0.49 0.16 3.88 3.20 -1.72 -0.33 116.97 130.86 2wp8 h TYR 832 Ca -0.28 -0.20 -0.30 0.00 3.14 0.00 0.00 58.73 61.09 2wp8 h TYR 832 Cb 1.13 -0.08 0.01 0.00 1.54 0.00 0.00 36.73 39.33 2wp8 h TYR 832 CO 0.75 0.92 -1.36 0.78 -1.64 0.00 0.00 178.16 177.61 2wp8 h GLY 833 N -0.09 0.40 1.80 1.82 0.00 -1.91 -2.89 103.07 102.20 2wp8 h GLY 833 Ca -0.01 -1.02 0.00 0.00 0.00 0.00 0.00 47.33 46.30 2wp8 h GLY 833 CO 0.07 0.89 -0.11 1.04 0.00 0.00 0.00 176.54 178.43 2wp8 n LEU 834 N -3.57 0.24 -3.35 3.11 4.77 -1.25 -0.15 117.00 116.78 2wp8 n LEU 834 Ca -0.12 0.42 -0.18 0.00 -0.03 0.00 0.00 56.01 56.09 2wp8 n LEU 834 Cb 1.05 -0.42 0.07 0.00 -2.33 0.00 0.00 43.42 41.79 2wp8 n LEU 834 CO 0.55 -0.01 0.01 0.00 -1.33 0.00 0.00 177.39 176.62 2wp8 n ALA 835 N -1.56 -2.47 -2.91 -1.18 0.00 -0.24 -4.73 120.51 107.42 2wp8 n ALA 835 Ca 0.06 0.05 -0.12 0.00 0.00 0.00 0.00 53.44 53.43 2wp8 n ALA 835 Cb 0.36 -5.25 -0.14 0.00 0.00 0.00 0.00 19.45 14.42 2wp8 n ALA 835 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2wp8 s VAL 836 N -3.41 -0.00 0.19 0.00 -7.23 -0.55 -4.84 120.40 104.56 2wp8 s VAL 836 Ca 0.43 0.00 -0.11 0.00 -1.81 0.00 0.00 61.98 60.49 2wp8 s VAL 836 Cb -0.08 -0.05 0.11 0.00 0.56 0.00 0.00 36.38 36.92 2wp8 s VAL 836 CO 0.76 0.00 1.77 0.44 -0.31 0.00 0.00 175.10 177.77 2wp8 h ASP 837 N 6.12 0.35 -4.84 4.85 3.32 -1.92 -0.17 116.42 124.13 2wp8 h ASP 837 Ca -0.25 0.05 -0.16 0.00 0.02 0.00 0.00 57.03 56.69 2wp8 h ASP 837 Cb 1.21 -0.01 -0.22 0.00 0.22 0.00 0.00 39.33 40.53 2wp8 h ASP 837 CO 0.49 0.23 -0.60 -0.51 -1.72 0.00 0.00 179.24 177.13 2wp8 s ILE 838 N -6.11 0.09 -0.03 0.35 2.07 -1.26 -2.03 121.20 114.27 2wp8 s ILE 838 Ca -0.13 -0.71 -0.29 0.00 -1.41 0.00 0.00 60.65 58.11 2wp8 s ILE 838 Cb 0.15 -0.32 0.09 0.00 0.13 0.00 0.00 42.46 42.51 2wp8 s ILE 838 CO 0.74 -0.39 0.76 -0.47 -1.91 0.00 0.00 174.94 173.67 2wp8 s TYR 839 N -1.26 -0.53 0.20 3.50 6.14 -1.26 -4.72 117.35 119.42 2wp8 s TYR 839 Ca -0.14 0.75 -0.19 0.00 0.64 0.00 0.00 57.07 58.13 2wp8 s TYR 839 Cb -0.08 0.46 0.04 0.00 0.42 0.00 0.00 41.96 42.80 2wp8 s TYR 839 CO 0.00 -0.59 0.58 -0.08 0.64 0.00 0.00 175.55 176.10 2wp8 s THR 840 N -1.91 0.01 -0.28 4.34 -1.32 -1.25 -1.32 115.64 113.91 2wp8 s THR 840 Ca -0.05 -0.64 -0.17 0.00 -1.21 0.00 0.00 61.69 59.63 2wp8 s THR 840 Cb -0.00 -1.52 -0.03 0.00 -1.51 0.00 0.00 72.50 69.44 2wp8 s THR 840 CO 0.01 -0.07 0.47 -1.00 -2.21 0.00 0.00 174.62 171.82 2wp8 s HIS 841 N -3.85 3.24 0.00 9.09 3.76 -1.26 -4.67 115.29 121.59 2wp8 s HIS 841 Ca 0.08 0.46 0.00 0.00 -0.15 0.00 0.00 55.06 55.45 2wp8 s HIS 841 Cb -0.02 -2.71 0.00 0.00 1.11 0.00 0.00 32.58 30.96 2wp8 s HIS 841 CO -0.03 -0.32 0.00 0.34 -0.85 0.00 0.00 174.74 173.88 2wp8 n PHE 842 N 5.51 0.00 1.89 1.40 7.35 -1.26 -2.96 117.46 129.39 2wp8 n PHE 842 Ca -0.06 0.00 0.03 0.00 -0.76 0.00 0.00 57.45 56.66 2wp8 n PHE 842 Cb 0.50 0.00 0.14 0.00 0.35 0.00 0.00 39.48 40.46 2wp8 n PHE 842 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 2wp8 n THR 843 N -0.77 0.04 -2.98 -2.13 -2.24 -1.26 -4.39 114.28 100.55 2wp8 n THR 843 Ca 0.00 -0.05 -0.14 0.00 -2.27 0.00 0.00 64.05 61.59 2wp8 n THR 843 Cb 0.07 -0.03 0.01 0.00 -2.10 0.00 0.00 70.33 68.27 2wp8 n THR 843 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2wp8 n SER 844 N -0.46 0.30 0.20 3.42 2.88 -1.26 -4.55 113.62 114.15 2wp8 n SER 844 Ca 0.04 -3.03 0.04 0.00 -1.33 0.00 0.00 58.87 54.59 2wp8 n SER 844 Cb 0.04 -0.10 0.45 0.00 -0.75 0.00 0.00 64.21 63.85 2wp8 n SER 844 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2wp8 h PRO 845 N 2.94 0.03 -0.43 -1.46 0.13 -1.77 -2.18 132.00 129.27 2wp8 h PRO 845 Ca 0.01 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 65.07 2wp8 h PRO 845 Cb 1.05 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 2wp8 h PRO 845 CO 0.41 0.25 0.00 0.82 -0.23 0.00 0.00 178.00 179.25 2wp8 h ILE 846 N 0.03 1.23 -0.02 -3.56 2.04 -1.93 -3.23 117.51 112.06 2wp8 h ILE 846 Ca 0.00 -0.93 0.00 0.00 1.00 0.00 0.00 64.86 64.94 2wp8 h ILE 846 Cb 0.41 0.90 0.00 0.00 -0.74 0.00 0.00 36.82 37.39 2wp8 h ILE 846 CO 0.03 0.32 -0.21 0.54 0.00 0.00 0.00 178.15 178.84 2wp8 n ARG 847 N -4.24 1.81 -3.73 2.37 1.74 -0.97 -4.44 116.66 109.21 2wp8 n ARG 847 Ca 0.02 -1.50 -0.12 0.00 -0.77 0.00 0.00 57.85 55.48 2wp8 n ARG 847 Cb 0.28 -1.46 -0.11 0.00 -1.02 0.00 0.00 32.46 30.16 2wp8 n ARG 847 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2wp8 s ARG 848 N -2.17 0.42 0.34 5.56 0.52 -0.86 -0.14 118.95 122.62 2wp8 s ARG 848 Ca 0.23 0.61 0.21 0.00 -0.52 0.00 0.00 55.73 56.26 2wp8 s ARG 848 Cb 0.19 0.13 0.19 0.00 0.52 0.00 0.00 34.95 35.97 2wp8 s ARG 848 CO 0.41 -0.09 1.42 -0.92 0.02 0.00 0.00 175.30 176.14 2wp8 h TYR 849 N 6.08 0.00 -0.68 -0.53 3.20 -1.08 -3.31 116.97 120.66 2wp8 h TYR 849 Ca -0.30 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.58 2wp8 h TYR 849 Cb 1.18 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 39.41 2wp8 h TYR 849 CO 0.35 0.15 0.44 0.00 -1.64 0.00 0.00 178.16 177.46 2wp8 h ASP 851 N 0.88 0.47 -0.04 0.00 5.19 -1.62 -0.97 116.42 120.34 2wp8 h ASP 851 Ca 0.26 -0.18 0.04 0.00 -0.62 0.00 0.00 57.03 56.53 2wp8 h ASP 851 Cb -0.06 -0.13 -0.05 0.00 0.18 0.00 0.00 39.33 39.27 2wp8 h ASP 851 CO -0.07 0.76 -0.32 0.58 -3.12 0.00 0.00 179.24 177.07 2wp8 h VAL 852 N 0.39 0.30 -0.45 -1.35 2.07 -1.56 0.43 116.25 116.08 2wp8 h VAL 852 Ca 0.05 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.58 2wp8 h VAL 852 Cb 0.76 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 2wp8 h VAL 852 CO 0.06 0.00 0.29 0.58 0.02 0.00 0.00 177.57 178.52 2wp8 h VAL 853 N -0.45 1.10 -0.27 2.57 2.07 -1.14 -2.54 116.25 117.59 2wp8 h VAL 853 Ca 0.07 -0.20 -0.04 0.00 0.82 0.00 0.00 66.70 67.35 2wp8 h VAL 853 Cb 0.55 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 2wp8 h VAL 853 CO -0.29 0.11 0.00 0.00 0.02 0.00 0.00 177.57 177.41 2wp8 h ALA 854 N 1.18 1.51 0.64 1.67 0.00 -0.98 -0.56 119.26 122.71 2wp8 h ALA 854 Ca 0.17 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2wp8 h ALA 854 Cb -0.05 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.63 2wp8 h ALA 854 CO -0.05 0.36 -0.31 0.45 0.00 0.00 0.00 179.25 179.70 2wp8 h HIS 855 N 0.39 -0.80 -0.83 0.00 3.86 -0.66 0.22 115.15 117.33 2wp8 h HIS 855 Ca 0.09 -0.02 0.19 0.00 -1.16 0.00 0.00 60.37 59.47 2wp8 h HIS 855 Cb 0.26 0.26 -0.11 0.00 1.06 0.00 0.00 27.41 28.88 2wp8 h HIS 855 CO 0.01 -0.47 0.33 0.00 0.86 0.00 0.00 177.93 178.66 2wp8 h ARG 856 N -0.95 0.38 -0.16 2.45 3.08 -1.32 0.24 114.38 118.09 2wp8 h ARG 856 Ca -0.09 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 2wp8 h ARG 856 Cb 0.69 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 2wp8 h ARG 856 CO 0.14 0.25 0.06 1.96 -1.07 0.00 0.00 179.97 181.32 2wp8 h GLN 857 N 0.40 0.25 -0.62 0.04 4.20 -0.80 -2.01 115.11 116.56 2wp8 h GLN 857 Ca 0.49 -0.05 0.01 0.00 0.06 0.00 0.00 58.65 59.16 2wp8 h GLN 857 Cb 0.87 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.58 2wp8 h GLN 857 CO -0.49 0.35 0.40 1.25 -0.67 0.00 0.00 178.83 179.67 2wp8 h LEU 858 N 0.10 0.68 -0.73 1.46 5.85 0.13 -0.53 115.31 122.27 2wp8 h LEU 858 Ca 0.05 -0.01 0.16 0.00 0.84 0.00 0.00 57.88 58.92 2wp8 h LEU 858 Cb 0.20 -0.16 -0.13 0.00 0.37 0.00 0.00 40.66 40.94 2wp8 h LEU 858 CO -0.00 0.49 -0.01 0.00 -0.34 0.00 0.00 178.44 178.58 2wp8 h ALA 859 N 1.24 0.73 -0.43 1.25 0.00 -0.83 -0.75 119.26 120.46 2wp8 h ALA 859 Ca 0.23 0.23 -0.06 0.00 0.00 0.00 0.00 54.91 55.31 2wp8 h ALA 859 Cb -0.07 0.41 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2wp8 h ALA 859 CO -0.06 -0.42 0.03 0.78 0.00 0.00 0.00 179.25 179.59 2wp8 h GLY 860 N 0.10 0.80 1.93 0.00 0.00 -0.53 -1.38 103.07 104.00 2wp8 h GLY 860 Ca 0.39 -0.57 0.01 0.00 0.00 0.00 0.00 47.33 47.16 2wp8 h GLY 860 CO -0.64 0.52 0.03 0.00 0.00 0.00 0.00 176.54 176.44 2wp8 h ALA 861 N 0.92 1.92 -0.20 3.60 0.00 0.29 -1.87 119.26 123.93 2wp8 h ALA 861 Ca 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2wp8 h ALA 861 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2wp8 h ALA 861 CO 0.02 -0.04 0.00 0.44 0.00 0.00 0.00 179.25 179.66 2wp8 n ILE 862 N -4.37 0.25 -1.40 0.00 -5.35 -0.70 -4.97 119.36 102.82 2wp8 n ILE 862 Ca -0.02 -0.63 -0.09 0.00 -0.27 0.00 0.00 62.75 61.75 2wp8 n ILE 862 Cb 0.12 1.23 -0.03 0.00 -1.74 0.00 0.00 39.64 39.22 2wp8 n ILE 862 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wp8 n GLY 863 N 1.34 0.88 0.21 3.28 0.00 -0.70 -4.93 105.19 105.27 2wp8 n GLY 863 Ca 0.16 -0.63 -0.14 0.00 0.00 0.00 0.00 46.02 45.41 2wp8 n GLY 863 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2wp8 h TYR 864 N 0.00 0.90 -1.76 1.61 5.03 -1.49 -3.47 116.97 117.80 2wp8 h TYR 864 Ca -0.18 -0.38 0.02 0.00 2.58 0.00 0.00 58.73 60.76 2wp8 h TYR 864 Cb 0.66 -0.14 -0.24 0.00 1.55 0.00 0.00 36.73 38.55 2wp8 h TYR 864 CO 0.24 1.19 0.33 -2.00 -1.32 0.00 0.00 178.16 176.60 2wp8 s GLU 865 N -3.76 0.64 0.37 1.82 2.12 -1.20 -5.01 118.70 113.67 2wp8 s GLU 865 Ca -0.09 0.76 -0.28 0.00 0.36 0.00 0.00 54.97 55.72 2wp8 s GLU 865 Cb 0.09 0.31 -0.10 0.00 0.26 0.00 0.00 34.13 34.69 2wp8 s GLU 865 CO 0.88 -0.08 1.43 -2.14 -0.54 0.00 0.00 175.26 174.81 2wp8 s PRO 866 N 0.28 4.13 0.26 4.30 0.02 -1.26 -3.07 135.00 139.67 2wp8 s PRO 866 Ca 0.02 2.45 -0.30 0.00 0.02 0.00 0.00 61.00 63.19 2wp8 s PRO 866 Cb -0.05 -2.96 -0.10 0.00 0.02 0.00 0.00 34.50 31.41 2wp8 s PRO 866 CO -0.03 -0.46 1.38 -1.17 -0.33 0.00 0.00 177.00 176.38 2wp8 s LEU 867 N -2.08 4.40 0.26 -5.54 2.96 -1.26 -4.89 118.68 112.53 2wp8 s LEU 867 Ca 0.53 2.62 -0.31 0.00 -0.22 0.00 0.00 54.13 56.75 2wp8 s LEU 867 Cb -0.44 -3.63 -0.13 0.00 0.50 0.00 0.00 46.19 42.49 2wp8 s LEU 867 CO 0.59 -0.62 1.49 -0.24 -1.32 0.00 0.00 176.35 176.25 2wp8 n SER 868 N 1.97 3.23 0.00 3.68 2.88 -1.26 -4.84 113.62 119.28 2wp8 n SER 868 Ca 0.05 1.14 0.10 0.00 -1.33 0.00 0.00 58.87 58.83 2wp8 n SER 868 Cb 0.41 -1.50 0.52 0.00 -0.75 0.00 0.00 64.21 62.89 2wp8 n SER 868 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2wp8 h LEU 869 N 4.50 0.31 -0.89 2.46 3.38 -2.00 0.68 115.31 123.75 2wp8 h LEU 869 Ca -0.46 0.00 0.23 0.00 0.09 0.00 0.00 57.88 57.74 2wp8 h LEU 869 Cb 1.25 -0.07 -0.17 0.00 0.09 0.00 0.00 40.66 41.77 2wp8 h LEU 869 CO 0.78 0.20 -0.03 0.41 0.09 0.00 0.00 178.44 179.89 2wp8 n THR 870 N -4.47 -0.37 0.47 0.22 -1.04 -1.26 -1.00 114.28 106.81 2wp8 n THR 870 Ca 0.06 1.97 0.04 0.00 -2.04 0.00 0.00 64.05 64.08 2wp8 n THR 870 Cb 0.25 -2.84 0.18 0.00 -1.82 0.00 0.00 70.33 66.10 2wp8 n THR 870 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2wp8 n HIS 871 N -5.32 0.75 0.24 -1.42 8.25 0.23 -2.22 115.22 115.73 2wp8 n HIS 871 Ca 0.20 -0.29 0.03 0.00 -0.26 0.00 0.00 57.72 57.39 2wp8 n HIS 871 Cb 0.64 -0.16 -0.00 0.00 1.12 0.00 0.00 29.99 31.59 2wp8 n HIS 871 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2wp8 n ARG 872 N 0.41 2.73 -3.03 -0.41 5.12 -0.17 -4.81 116.66 116.50 2wp8 n ARG 872 Ca 0.13 -0.39 -0.45 0.00 -1.93 0.00 0.00 57.85 55.21 2wp8 n ARG 872 Cb 0.51 -0.91 -0.03 0.00 -1.16 0.00 0.00 32.46 30.87 2wp8 n ARG 872 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2wp8 s ASP 873 N -1.01 6.54 0.32 0.55 3.68 -0.94 -4.90 116.67 120.90 2wp8 s ASP 873 Ca 0.04 -1.97 0.05 0.00 2.13 0.00 0.00 52.55 52.81 2wp8 s ASP 873 Cb 0.04 -2.35 0.86 0.00 -1.45 0.00 0.00 42.92 40.03 2wp8 s ASP 873 CO 0.14 -1.01 1.59 0.11 0.13 0.00 0.00 175.17 176.12 2wp8 h LYS 874 N 8.76 0.04 0.23 4.34 1.57 -1.93 0.25 116.57 129.83 2wp8 h LYS 874 Ca 0.03 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2wp8 h LYS 874 Cb 1.04 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.33 2wp8 h LYS 874 CO 1.05 0.03 -0.21 -0.91 -0.57 0.00 0.00 179.45 178.83 2wp8 h ASN 875 N 0.04 -0.57 -0.43 0.86 2.35 -1.95 -0.12 115.58 115.77 2wp8 h ASN 875 Ca 0.64 0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 56.41 2wp8 h ASN 875 Cb 1.41 0.19 -0.02 0.00 0.05 0.00 0.00 38.32 39.95 2wp8 h ASN 875 CO -0.85 -0.32 0.16 0.11 -1.65 0.00 0.00 177.43 174.88 2wp8 h LYS 876 N -0.47 0.72 0.00 0.81 1.57 -0.94 -2.44 116.57 115.83 2wp8 h LYS 876 Ca -0.01 -0.12 -0.03 0.00 -1.87 0.00 0.00 60.65 58.62 2wp8 h LYS 876 Cb 0.43 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.61 2wp8 h LYS 876 CO -0.04 0.62 -0.16 1.98 -0.57 0.00 0.00 179.45 181.29 2wp8 h MET 877 N 0.71 0.00 -0.04 3.15 4.05 -0.65 -1.43 114.93 120.72 2wp8 h MET 877 Ca 0.17 0.00 -0.11 0.00 -0.28 0.00 0.00 59.70 59.47 2wp8 h MET 877 Cb 0.20 0.00 0.01 0.00 -0.80 0.00 0.00 31.60 31.01 2wp8 h MET 877 CO -0.01 0.16 -0.40 0.22 0.23 0.00 0.00 176.91 177.10 2wp8 h ASP 878 N 0.00 0.43 0.20 1.39 -0.00 -0.56 -2.58 116.42 115.30 2wp8 h ASP 878 Ca -0.00 -0.70 -0.02 0.00 -0.00 0.00 0.00 57.03 56.31 2wp8 h ASP 878 Cb 0.85 -0.13 -0.00 0.00 -0.00 0.00 0.00 39.33 40.05 2wp8 h ASP 878 CO 0.02 1.06 -0.12 0.24 -0.00 0.00 0.00 179.24 180.45 2wp8 h MET 879 N -0.16 0.00 -0.02 0.28 2.07 -1.27 0.73 114.93 116.55 2wp8 h MET 879 Ca -0.04 0.00 -0.07 0.00 -2.07 0.00 0.00 59.70 57.52 2wp8 h MET 879 Cb 1.09 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.82 2wp8 h MET 879 CO 0.08 0.12 -0.27 0.82 1.07 0.00 0.00 176.91 178.73 2wp8 h ILE 880 N 0.00 1.49 0.40 -1.22 2.04 -1.32 -2.92 117.51 115.98 2wp8 h ILE 880 Ca -0.00 -1.83 -0.02 0.00 1.00 0.00 0.00 64.86 64.01 2wp8 h ILE 880 Cb 0.25 2.58 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 2wp8 h ILE 880 CO 0.02 0.51 -0.21 0.00 0.00 0.00 0.00 178.15 178.47 2wp8 h ARG 882 N -0.56 -0.02 0.98 0.00 3.08 -1.02 -1.68 114.38 115.16 2wp8 h ARG 882 Ca -0.05 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.95 2wp8 h ARG 882 Cb 0.44 0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.51 2wp8 h ARG 882 CO 0.08 -0.02 -0.47 -0.97 -1.07 0.00 0.00 179.97 177.52 2wp8 h ASN 883 N -0.02 -1.11 -0.82 7.04 -1.24 -1.26 -2.49 115.58 115.67 2wp8 h ASN 883 Ca 0.33 0.04 0.02 0.00 0.71 0.00 0.00 56.30 57.40 2wp8 h ASN 883 Cb 0.53 0.29 -0.04 0.00 0.73 0.00 0.00 38.32 39.83 2wp8 h ASN 883 CO -0.74 -0.79 0.54 0.16 -1.29 0.00 0.00 177.43 175.31 2wp8 h ILE 884 N -1.34 1.17 -0.63 2.57 3.07 -0.88 0.20 117.51 121.67 2wp8 h ILE 884 Ca -0.13 -0.36 0.06 0.00 1.55 0.00 0.00 64.86 65.97 2wp8 h ILE 884 Cb 1.01 0.02 -0.05 0.00 -0.27 0.00 0.00 36.82 37.53 2wp8 h ILE 884 CO 0.22 0.19 0.34 0.78 -1.05 0.00 0.00 178.15 178.64 2wp8 h ASN 885 N 1.05 0.50 0.33 2.16 2.35 -1.33 -0.41 115.58 120.24 2wp8 h ASN 885 Ca 0.31 0.03 -0.02 0.00 -0.55 0.00 0.00 56.30 56.08 2wp8 h ASN 885 Cb -0.04 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.27 2wp8 h ASN 885 CO -0.08 0.33 -0.16 -0.09 -1.65 0.00 0.00 177.43 175.78 2wp8 h ARG 886 N 0.64 -0.43 -0.28 0.81 1.12 -0.62 -0.62 114.38 115.01 2wp8 h ARG 886 Ca 0.28 0.03 -0.01 0.00 -1.11 0.00 0.00 59.98 59.17 2wp8 h ARG 886 Cb 0.18 0.10 -0.01 0.00 -0.01 0.00 0.00 29.97 30.23 2wp8 h ARG 886 CO -0.18 -0.18 0.11 0.87 -3.11 0.00 0.00 179.97 177.48 2wp8 h LYS 887 N -0.62 0.38 -0.04 0.20 1.79 -0.42 0.20 116.57 118.05 2wp8 h LYS 887 Ca -0.05 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.37 2wp8 h LYS 887 Cb 0.45 -0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 31.02 2wp8 h LYS 887 CO 0.07 0.32 -0.03 1.25 -1.08 0.00 0.00 179.45 179.99 2wp8 h HIS 888 N 0.38 0.11 0.19 -1.35 2.76 -1.01 0.27 115.15 116.51 2wp8 h HIS 888 Ca 0.10 -0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.25 2wp8 h HIS 888 Cb 0.08 -0.03 -0.04 0.00 1.55 0.00 0.00 27.41 28.97 2wp8 h HIS 888 CO 0.00 0.50 -0.48 -0.09 -1.30 0.00 0.00 177.93 176.56 2wp8 h ARG 889 N -0.31 -0.74 -0.40 5.26 2.43 -0.11 -1.26 114.38 119.25 2wp8 h ARG 889 Ca 0.01 0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.26 2wp8 h ARG 889 Cb 0.47 0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.17 2wp8 h ARG 889 CO 0.01 -0.49 0.27 -0.91 -1.51 0.00 0.00 179.97 177.33 2wp8 h ASN 890 N -0.77 0.38 0.04 -3.80 2.35 -0.63 -1.90 115.58 111.25 2wp8 h ASN 890 Ca -0.01 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 2wp8 h ASN 890 Cb 0.76 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.04 2wp8 h ASN 890 CO -0.23 0.27 -0.02 0.00 -1.65 0.00 0.00 177.43 175.80 2wp8 h ALA 891 N 1.77 -0.05 -0.40 -0.83 0.00 0.31 0.12 119.26 120.17 2wp8 h ALA 891 Ca 0.16 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2wp8 h ALA 891 Cb 0.09 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2wp8 h ALA 891 CO -0.04 -0.44 0.18 1.96 0.00 0.00 0.00 179.25 180.91 2wp8 h GLN 892 N -0.24 0.58 -0.73 0.00 4.20 -0.90 -1.41 115.11 116.60 2wp8 h GLN 892 Ca -0.01 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 2wp8 h GLN 892 Cb 0.22 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 27.87 2wp8 h GLN 892 CO 0.01 0.53 0.44 0.74 -0.67 0.00 0.00 178.83 179.88 2wp8 h PHE 893 N 0.50 0.96 0.13 2.96 0.05 -1.24 -0.18 116.94 120.13 2wp8 h PHE 893 Ca 0.13 -0.00 0.01 0.00 3.82 0.00 0.00 57.97 61.94 2wp8 h PHE 893 Cb 0.15 -0.32 -0.03 0.00 2.00 0.00 0.00 35.95 37.76 2wp8 h PHE 893 CO -0.01 0.65 -0.23 0.00 -0.18 0.00 0.00 178.31 178.54 2wp8 h ALA 894 N 1.23 -0.40 0.00 2.45 0.00 -0.53 -2.56 119.26 119.45 2wp8 h ALA 894 Ca 0.26 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 2wp8 h ALA 894 Cb -0.03 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2wp8 h ALA 894 CO -0.05 -0.77 -0.20 0.78 0.00 0.00 0.00 179.25 179.01 2wp8 h GLY 895 N -0.44 0.00 1.73 0.00 0.00 -0.77 -2.35 103.07 101.25 2wp8 h GLY 895 Ca 0.02 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.22 2wp8 h GLY 895 CO -0.12 0.00 -0.81 3.21 0.00 0.00 0.00 176.54 178.82 2wp8 h ARG 896 N 0.00 0.00 -0.09 4.80 3.08 -0.98 -3.03 114.38 118.16 2wp8 h ARG 896 Ca -0.00 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.88 2wp8 h ARG 896 Cb 0.36 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 2wp8 h ARG 896 CO 0.03 0.50 -0.67 0.00 -1.07 0.00 0.00 179.97 178.76 2wp8 h ALA 897 N 1.41 0.68 0.06 0.04 0.00 -1.01 -1.71 119.26 118.74 2wp8 h ALA 897 Ca -0.05 -0.58 -0.00 0.00 0.00 0.00 0.00 54.91 54.28 2wp8 h ALA 897 Cb 1.49 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2wp8 h ALA 897 CO 0.07 0.75 -0.03 1.03 0.00 0.00 0.00 179.25 181.07 2wp8 h SER 898 N 0.27 -0.06 -0.77 0.00 0.87 -1.45 -1.41 113.55 110.98 2wp8 h SER 898 Ca -0.02 -0.14 0.07 0.00 -1.23 0.00 0.00 61.79 60.47 2wp8 h SER 898 Cb 1.22 0.02 -0.06 0.00 -0.44 0.00 0.00 62.40 63.13 2wp8 h SER 898 CO 0.11 0.10 0.46 0.40 -0.53 0.00 0.00 176.83 177.37 2wp8 h ILE 899 N -0.23 0.99 -0.21 2.23 2.04 -1.56 -0.98 117.51 119.79 2wp8 h ILE 899 Ca -0.01 -0.28 -0.07 0.00 1.00 0.00 0.00 64.86 65.50 2wp8 h ILE 899 Cb 0.20 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.36 2wp8 h ILE 899 CO 0.01 0.15 -0.18 -0.33 0.00 0.00 0.00 178.15 177.80 2wp8 h GLU 900 N 0.82 0.36 -0.02 2.37 5.08 -1.03 -0.57 114.58 121.58 2wp8 h GLU 900 Ca 0.35 -0.11 -0.18 0.00 -1.00 0.00 0.00 59.36 58.42 2wp8 h GLU 900 Cb 0.21 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.44 2wp8 h GLU 900 CO -0.19 0.53 -0.70 -0.92 -1.00 0.00 0.00 179.01 176.73 2wp8 h TYR 901 N 0.33 0.74 -0.17 4.33 3.20 -0.89 -3.00 116.97 121.52 2wp8 h TYR 901 Ca 0.06 -0.39 -0.03 0.00 3.14 0.00 0.00 58.73 61.51 2wp8 h TYR 901 Cb 0.51 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 2wp8 h TYR 901 CO 0.01 1.21 0.01 1.88 -1.64 0.00 0.00 178.16 179.63 2wp8 h TYR 902 N 0.07 0.31 -0.91 -3.82 -1.99 -0.82 -2.18 116.97 107.63 2wp8 h TYR 902 Ca -0.08 -0.05 0.21 0.00 2.00 0.00 0.00 58.73 60.81 2wp8 h TYR 902 Cb 1.39 -0.08 -0.07 0.00 2.00 0.00 0.00 36.73 39.97 2wp8 h TYR 902 CO 0.13 0.49 0.61 0.28 -0.00 0.00 0.00 178.16 179.67 2wp8 h VAL 903 N 0.04 0.65 -0.31 -2.88 2.07 -1.23 0.29 116.25 114.89 2wp8 h VAL 903 Ca 0.05 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 2wp8 h VAL 903 Cb 0.36 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 2wp8 h VAL 903 CO 0.01 0.07 0.02 1.23 0.02 0.00 0.00 177.57 178.91 2wp8 h GLY 904 N 0.37 0.58 0.87 2.17 0.00 -1.27 -2.08 103.07 103.70 2wp8 h GLY 904 Ca 0.47 -0.41 -0.10 0.00 0.00 0.00 0.00 47.33 47.29 2wp8 h GLY 904 CO -0.17 0.38 -0.29 1.46 0.00 0.00 0.00 176.54 177.92 2wp8 h GLN 905 N 0.34 0.54 -1.00 4.80 1.08 -0.65 -2.66 115.11 117.56 2wp8 h GLN 905 Ca 0.09 -0.32 0.04 0.00 -1.45 0.00 0.00 58.65 57.01 2wp8 h GLN 905 Cb 0.40 0.03 -0.06 0.00 -0.05 0.00 0.00 27.48 27.80 2wp8 h GLN 905 CO 0.01 0.92 0.65 0.28 -0.95 0.00 0.00 178.83 179.74 2wp8 h VAL 906 N 0.20 1.17 -0.03 -0.54 2.07 -0.41 1.24 116.25 119.96 2wp8 h VAL 906 Ca 0.02 -0.43 -0.15 0.00 0.82 0.00 0.00 66.70 66.96 2wp8 h VAL 906 Cb 0.86 -0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 2wp8 h VAL 906 CO 0.07 0.23 -0.66 0.24 0.02 0.00 0.00 177.57 177.47 2wp8 h MET 907 N 1.26 0.14 0.19 1.57 2.86 -1.44 -1.01 114.93 118.50 2wp8 h MET 907 Ca 0.40 -0.11 -0.01 0.00 -2.06 0.00 0.00 59.70 57.92 2wp8 h MET 907 Cb 0.00 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.68 2wp8 h MET 907 CO -0.13 0.75 -0.09 -0.09 1.06 0.00 0.00 176.91 178.41 2wp8 h ARG 908 N 0.10 -0.24 0.14 1.72 2.43 -0.79 -0.93 114.38 116.81 2wp8 h ARG 908 Ca -0.01 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 2wp8 h ARG 908 Cb 1.17 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.76 2wp8 h ARG 908 CO 0.10 0.15 -0.16 -0.91 -1.51 0.00 0.00 179.97 177.64 2wp8 h ASN 909 N -0.73 -0.42 -0.09 -3.80 2.35 0.15 -2.20 115.58 110.84 2wp8 h ASN 909 Ca -0.03 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2wp8 h ASN 909 Cb 0.50 0.15 0.00 0.00 0.05 0.00 0.00 38.32 39.02 2wp8 h ASN 909 CO 0.04 -0.23 0.00 0.59 -1.65 0.00 0.00 177.43 176.18 2wp8 n ASN 910 N -5.28 0.55 -4.38 5.81 3.02 -0.39 -4.90 115.26 109.69 2wp8 n ASN 910 Ca -0.07 -1.81 -0.35 0.00 -0.03 0.00 0.00 54.58 52.31 2wp8 n ASN 910 Cb 0.20 -0.06 -0.08 0.00 -0.61 0.00 0.00 39.78 39.23 2wp8 n ASN 910 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2wp8 n GLU 911 N -0.29 -1.11 -3.09 3.52 1.02 -0.78 -4.82 120.64 115.08 2wp8 n GLU 911 Ca 0.08 0.14 -0.35 0.00 -0.02 0.00 0.00 57.16 57.01 2wp8 n GLU 911 Cb 0.11 -4.15 -0.06 0.00 -0.02 0.00 0.00 31.44 27.32 2wp8 n GLU 911 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2wp8 s SER 912 N -3.90 7.00 -0.20 1.62 0.15 -0.42 -4.99 113.70 112.96 2wp8 s SER 912 Ca 0.36 1.41 -0.06 0.00 0.70 0.00 0.00 55.95 58.36 2wp8 s SER 912 Cb -0.21 -2.42 -0.03 0.00 -1.71 0.00 0.00 66.02 61.66 2wp8 s SER 912 CO 1.00 -0.03 0.02 -0.89 1.20 0.00 0.00 173.24 174.54 2wp8 s THR 913 N -1.64 4.17 0.18 6.45 2.01 -1.26 -4.28 115.64 121.27 2wp8 s THR 913 Ca 0.46 -0.24 0.06 0.00 0.31 0.00 0.00 61.69 62.28 2wp8 s THR 913 Cb -0.15 -2.89 -0.05 0.00 0.01 0.00 0.00 72.50 69.42 2wp8 s THR 913 CO 0.20 0.42 -0.11 -1.61 -0.69 0.00 0.00 174.62 172.83 2wp8 s GLU 914 N 0.92 1.19 -0.28 4.92 0.41 -0.02 -4.98 118.70 120.86 2wp8 s GLU 914 Ca 0.02 -1.52 -0.19 0.00 -0.41 0.00 0.00 54.97 52.86 2wp8 s GLU 914 Cb -0.14 -0.82 -0.02 0.00 -1.78 0.00 0.00 34.13 31.37 2wp8 s GLU 914 CO 0.02 0.11 0.58 -0.08 -0.49 0.00 0.00 175.26 175.40 2wp8 s THR 915 N -3.19 5.01 0.38 3.63 -1.32 -1.26 -0.41 115.64 118.47 2wp8 s THR 915 Ca 0.20 0.90 0.08 0.00 -1.21 0.00 0.00 61.69 61.66 2wp8 s THR 915 Cb 0.01 -3.91 -0.04 0.00 -1.51 0.00 0.00 72.50 67.05 2wp8 s THR 915 CO 0.04 -0.01 0.21 -0.83 -2.21 0.00 0.00 174.62 171.81 2wp8 s GLY 916 N 1.57 2.11 -0.01 6.08 0.00 0.04 -4.06 107.32 113.05 2wp8 s GLY 916 Ca 0.23 -1.93 0.03 0.00 0.00 0.00 0.00 44.72 43.06 2wp8 s GLY 916 CO 0.10 -1.79 -0.10 -0.19 0.00 0.00 0.00 173.10 171.12 2wp8 s TYR 917 N -2.49 0.95 -0.36 1.90 1.51 -0.26 -0.30 117.35 118.30 2wp8 s TYR 917 Ca 0.41 -0.19 -0.26 0.00 -1.01 0.00 0.00 57.07 56.02 2wp8 s TYR 917 Cb -0.01 -0.63 0.01 0.00 -0.11 0.00 0.00 41.96 41.23 2wp8 s TYR 917 CO 0.24 -0.04 0.93 0.08 -1.11 0.00 0.00 175.55 175.65 2wp8 s VAL 918 N -0.15 4.59 -1.93 0.71 1.01 -0.60 -1.14 120.40 122.90 2wp8 s VAL 918 Ca 0.02 1.24 0.16 0.00 0.00 0.00 0.00 61.98 63.41 2wp8 s VAL 918 Cb -0.05 -4.33 0.19 0.00 0.00 0.00 0.00 36.38 32.19 2wp8 s VAL 918 CO -0.00 -0.51 1.09 2.30 0.00 0.00 0.00 175.10 177.97 2wp8 n ILE 919 N 5.93 0.18 -3.60 2.22 -5.35 -0.65 0.11 119.36 118.21 2wp8 n ILE 919 Ca 0.07 -0.59 -0.15 0.00 -0.27 0.00 0.00 62.75 61.81 2wp8 n ILE 919 Cb 0.48 1.19 -0.07 0.00 -1.74 0.00 0.00 39.64 39.50 2wp8 n ILE 919 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 2wp8 s LYS 920 N -1.30 0.88 -0.12 6.28 2.47 -1.14 -4.94 119.74 121.87 2wp8 s LYS 920 Ca 0.22 0.73 -0.02 0.00 -1.56 0.00 0.00 55.97 55.34 2wp8 s LYS 920 Cb 0.14 0.42 0.04 0.00 -1.46 0.00 0.00 37.83 36.98 2wp8 s LYS 920 CO 0.21 -0.17 -0.00 0.08 0.16 0.00 0.00 175.35 175.63 2wp8 s VAL 921 N -0.15 0.54 0.54 4.02 1.01 -1.26 -1.92 120.40 123.17 2wp8 s VAL 921 Ca -0.03 -0.17 0.07 0.00 0.00 0.00 0.00 61.98 61.84 2wp8 s VAL 921 Cb -0.03 -0.78 0.04 0.00 0.00 0.00 0.00 36.38 35.61 2wp8 s VAL 921 CO 0.03 0.13 0.48 -0.36 0.00 0.00 0.00 175.10 175.39 2wp8 s PHE 922 N 1.89 1.69 0.19 5.22 0.40 0.25 -4.90 117.98 122.70 2wp8 s PHE 922 Ca 0.03 -0.78 0.22 0.00 -0.60 0.00 0.00 56.93 55.80 2wp8 s PHE 922 Cb -0.14 -2.00 0.88 0.00 0.51 0.00 0.00 43.02 42.27 2wp8 s PHE 922 CO -0.07 -0.58 1.82 -0.97 0.70 0.00 0.00 175.22 176.12 2wp8 h ASN 923 N 0.66 0.00 0.00 1.36 -0.73 -1.31 -3.33 115.58 112.23 2wp8 h ASN 923 Ca -0.36 0.00 -0.05 0.00 1.87 0.00 0.00 56.30 57.76 2wp8 h ASN 923 Cb 1.30 0.00 -0.11 0.00 0.27 0.00 0.00 38.32 39.77 2wp8 h ASN 923 CO 0.54 0.27 -0.55 -0.46 -0.37 0.00 0.00 177.43 176.86 2wp8 n ASN 924 N -3.50 1.22 0.00 1.15 6.94 -1.26 -4.86 115.26 114.96 2wp8 n ASN 924 Ca -0.00 -2.72 0.00 0.00 -0.02 0.00 0.00 54.58 51.84 2wp8 n ASN 924 Cb 0.44 -0.36 0.00 0.00 -2.36 0.00 0.00 39.78 37.50 2wp8 n ASN 924 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2wp8 n GLY 925 N -0.44 1.16 3.41 4.83 0.00 -1.25 -0.20 105.19 112.69 2wp8 n GLY 925 Ca 0.10 -0.97 -0.20 0.00 0.00 0.00 0.00 46.02 44.95 2wp8 n GLY 925 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2wp8 s ILE 926 N -2.00 1.47 -0.11 -0.61 -4.36 -0.72 -0.59 121.20 114.28 2wp8 s ILE 926 Ca 0.00 -2.09 0.04 0.00 -0.26 0.00 0.00 60.65 58.33 2wp8 s ILE 926 Cb 0.00 -2.45 0.00 0.00 1.25 0.00 0.00 42.46 41.26 2wp8 s ILE 926 CO 0.00 -0.28 -0.23 -0.69 0.24 0.00 0.00 174.94 173.97 2wp8 s VAL 927 N -3.13 2.11 -0.06 8.37 1.01 -0.81 -1.31 120.40 126.58 2wp8 s VAL 927 Ca 0.30 -1.00 0.03 0.00 0.00 0.00 0.00 61.98 61.31 2wp8 s VAL 927 Cb 0.05 -1.81 -0.02 0.00 0.00 0.00 0.00 36.38 34.59 2wp8 s VAL 927 CO 0.11 0.56 -0.15 -0.69 0.00 0.00 0.00 175.10 174.93 2wp8 s VAL 928 N 0.43 3.01 -0.05 2.92 1.01 -0.64 -1.63 120.40 125.44 2wp8 s VAL 928 Ca -0.16 -0.74 -0.15 0.00 0.00 0.00 0.00 61.98 60.93 2wp8 s VAL 928 Cb -0.17 -2.18 -0.05 0.00 0.00 0.00 0.00 36.38 33.97 2wp8 s VAL 928 CO 0.07 0.58 0.39 -0.22 0.00 0.00 0.00 175.10 175.92 2wp8 s LEU 929 N -0.56 4.40 -0.76 3.92 2.96 -0.29 -1.22 118.68 127.12 2wp8 s LEU 929 Ca 0.08 0.84 -0.06 0.00 -0.22 0.00 0.00 54.13 54.77 2wp8 s LEU 929 Cb -0.11 -2.54 0.20 0.00 0.50 0.00 0.00 46.19 44.23 2wp8 s LEU 929 CO 0.01 0.24 0.64 -0.69 -1.32 0.00 0.00 176.35 175.23 2wp8 s VAL 930 N -0.55 4.50 0.25 1.68 1.01 0.35 -1.11 120.40 126.54 2wp8 s VAL 930 Ca 0.23 -3.04 -0.03 0.00 0.00 0.00 0.00 61.98 59.14 2wp8 s VAL 930 Cb -0.16 -3.84 0.37 0.00 0.00 0.00 0.00 36.38 32.76 2wp8 s VAL 930 CO 0.11 -0.98 1.31 -2.65 0.00 0.00 0.00 175.10 172.89 2wp8 n PRO 931 N 3.34 -0.07 -0.12 2.72 -0.02 -1.26 0.70 135.00 140.29 2wp8 n PRO 931 Ca 0.13 1.29 -0.06 0.00 -2.02 0.00 0.00 63.50 62.84 2wp8 n PRO 931 Cb 0.40 -1.98 0.01 0.00 -0.02 0.00 0.00 33.50 31.91 2wp8 n PRO 931 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2wp8 h LYS 932 N 0.00 -0.16 -0.01 -0.52 3.64 -1.94 -2.27 116.57 115.31 2wp8 h LYS 932 Ca 0.45 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.84 2wp8 h LYS 932 Cb 0.81 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 2wp8 h LYS 932 CO -0.83 -0.11 -0.53 1.19 -2.27 0.00 0.00 179.45 176.90 2wp8 n PHE 933 N -5.40 0.00 -3.57 1.91 3.01 -0.21 -2.66 117.46 110.54 2wp8 n PHE 933 Ca 0.02 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 58.23 2wp8 n PHE 933 Cb 0.31 -0.03 0.03 0.00 -0.01 0.00 0.00 39.48 39.79 2wp8 n PHE 933 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2wp8 n GLY 934 N 1.42 -1.09 2.92 1.37 0.00 0.22 -4.91 105.19 105.13 2wp8 n GLY 934 Ca 0.09 0.49 -0.13 0.00 0.00 0.00 0.00 46.02 46.47 2wp8 n GLY 934 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wp8 s VAL 935 N -3.32 -0.01 0.21 1.61 1.01 -1.22 -4.95 120.40 113.72 2wp8 s VAL 935 Ca 0.34 0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.34 2wp8 s VAL 935 Cb -0.11 -0.11 -0.04 0.00 0.00 0.00 0.00 36.38 36.11 2wp8 s VAL 935 CO 0.84 0.01 0.41 -1.61 0.00 0.00 0.00 175.10 174.75 2wp8 s GLU 936 N 0.22 3.54 0.15 2.72 2.02 -1.26 -0.49 118.70 125.59 2wp8 s GLU 936 Ca -0.01 -0.29 -0.07 0.00 0.02 0.00 0.00 54.97 54.61 2wp8 s GLU 936 Cb -0.02 -2.82 -0.02 0.00 0.10 0.00 0.00 34.13 31.37 2wp8 s GLU 936 CO -0.01 0.38 0.22 0.20 0.02 0.00 0.00 175.26 176.08 2wp8 s GLY 937 N -3.13 0.60 -0.26 -1.39 0.00 -0.36 -4.99 107.32 97.79 2wp8 s GLY 937 Ca 0.39 -1.03 -0.07 0.00 0.00 0.00 0.00 44.72 44.01 2wp8 s GLY 937 CO 0.29 -0.97 0.05 -2.27 0.00 0.00 0.00 173.10 170.20 2wp8 s LEU 938 N -2.99 3.46 -0.35 0.66 2.96 -1.26 -1.62 118.68 119.54 2wp8 s LEU 938 Ca 0.19 -0.38 -0.19 0.00 -0.22 0.00 0.00 54.13 53.52 2wp8 s LEU 938 Cb 0.04 -1.88 -0.00 0.00 0.50 0.00 0.00 46.19 44.86 2wp8 s LEU 938 CO 0.00 -0.08 0.58 -0.63 -1.32 0.00 0.00 176.35 174.91 2wp8 s ILE 939 N 1.56 4.95 0.48 6.68 1.01 -0.43 -4.70 121.20 130.75 2wp8 s ILE 939 Ca 0.05 0.49 -0.19 0.00 0.00 0.00 0.00 60.65 61.00 2wp8 s ILE 939 Cb -0.16 -4.02 -0.09 0.00 0.01 0.00 0.00 42.46 38.20 2wp8 s ILE 939 CO 0.02 -0.26 0.99 -0.13 0.00 0.00 0.00 174.94 175.56 2wp8 s ARG 940 N 2.57 3.96 0.18 2.79 0.52 -1.26 -1.76 118.95 125.94 2wp8 s ARG 940 Ca 0.22 1.15 -0.13 0.00 -0.52 0.00 0.00 55.73 56.45 2wp8 s ARG 940 Cb -0.15 -2.13 0.14 0.00 0.52 0.00 0.00 34.95 33.33 2wp8 s ARG 940 CO 0.14 -0.27 1.77 1.25 0.02 0.00 0.00 175.30 178.21 2wp8 h LEU 941 N 1.45 0.29 -0.31 2.53 5.85 -0.95 -0.64 115.31 123.53 2wp8 h LEU 941 Ca -0.48 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.28 2wp8 h LEU 941 Cb 1.20 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.22 2wp8 h LEU 941 CO 0.60 0.20 -0.00 -0.90 -0.34 0.00 0.00 178.44 178.00 2wp8 n ASP 942 N -4.93 0.48 -0.80 1.25 5.75 -1.26 -0.31 116.55 116.72 2wp8 n ASP 942 Ca 0.04 -1.16 0.12 0.00 -0.01 0.00 0.00 54.79 53.79 2wp8 n ASP 942 Cb 0.16 -0.00 0.28 0.00 -1.03 0.00 0.00 41.12 40.53 2wp8 n ASP 942 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2wp8 n ASN 943 N -0.63 2.46 -0.00 -1.12 3.02 -0.33 -4.34 115.26 114.32 2wp8 n ASN 943 Ca 0.22 -1.81 0.06 0.00 -0.03 0.00 0.00 54.58 53.02 2wp8 n ASN 943 Cb 0.19 -0.06 -0.08 0.00 -0.61 0.00 0.00 39.78 39.22 2wp8 n ASN 943 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2wp8 n LEU 944 N 0.89 0.47 -3.60 3.41 4.77 0.57 -4.80 117.00 118.71 2wp8 n LEU 944 Ca 0.17 -0.40 -0.16 0.00 -0.03 0.00 0.00 56.01 55.59 2wp8 n LEU 944 Cb 0.49 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.51 2wp8 n LEU 944 CO 0.15 0.12 0.31 0.28 -1.33 0.00 0.00 177.39 176.92 2wp8 s THR 945 N -2.33 0.01 -0.44 -5.08 -1.32 -0.84 -3.65 115.64 101.98 2wp8 s THR 945 Ca 0.03 -0.12 0.25 0.00 -1.21 0.00 0.00 61.69 60.63 2wp8 s THR 945 Cb 0.09 -0.88 0.33 0.00 -1.51 0.00 0.00 72.50 70.54 2wp8 s THR 945 CO 0.52 -0.07 1.67 -0.33 -2.21 0.00 0.00 174.62 174.21 2wp8 h GLU 946 N 3.53 0.00 -3.92 7.08 5.08 -1.84 -3.42 114.58 121.09 2wp8 h GLU 946 Ca -0.28 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.48 2wp8 h GLU 946 Cb 1.15 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 30.01 2wp8 h GLU 946 CO 0.35 0.00 -0.75 0.34 -1.00 0.00 0.00 179.01 177.95 2wp8 s ASP 947 N -5.83 4.04 0.14 1.42 2.15 -1.26 -5.01 116.67 112.32 2wp8 s ASP 947 Ca 0.07 -1.58 -0.06 0.00 0.43 0.00 0.00 52.55 51.40 2wp8 s ASP 947 Cb 0.07 -1.05 -0.06 0.00 -0.30 0.00 0.00 42.92 41.58 2wp8 s ASP 947 CO 0.64 -0.37 1.35 1.55 -0.17 0.00 0.00 175.17 178.17 2wp8 h PRO 948 N 7.98 0.55 0.00 4.34 0.13 -1.90 -3.35 132.00 139.75 2wp8 h PRO 948 Ca -0.13 -0.49 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 2wp8 h PRO 948 Cb 1.04 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2wp8 h PRO 948 CO 0.46 1.11 0.00 0.09 -0.23 0.00 0.00 178.00 179.43 2wp8 n ASN 949 N -3.85 0.00 -1.16 1.44 4.13 -1.26 -1.08 115.26 113.48 2wp8 n ASN 949 Ca -0.06 0.46 0.09 0.00 1.68 0.00 0.00 54.58 56.75 2wp8 n ASN 949 Cb 0.76 -0.46 0.28 0.00 -1.54 0.00 0.00 39.78 38.81 2wp8 n ASN 949 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2wp8 n SER 950 N -1.46 3.79 -4.82 6.41 3.41 -1.26 -5.03 113.62 114.66 2wp8 n SER 950 Ca 0.00 -2.12 -0.34 0.00 -0.26 0.00 0.00 58.87 56.15 2wp8 n SER 950 Cb 0.00 -0.43 -0.07 0.00 -0.26 0.00 0.00 64.21 63.46 2wp8 n SER 950 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wp8 s ALA 951 N -1.22 3.19 -0.15 7.33 0.00 -0.24 -4.88 121.76 125.79 2wp8 s ALA 951 Ca 0.41 0.28 -0.02 0.00 0.00 0.00 0.00 51.96 52.63 2wp8 s ALA 951 Cb 0.23 -3.00 -0.02 0.00 0.00 0.00 0.00 23.12 20.34 2wp8 s ALA 951 CO 0.26 0.22 -0.09 0.00 0.00 0.00 0.00 175.76 176.14 2wp8 s ALA 952 N -1.99 2.75 -0.08 0.00 0.00 0.42 -4.97 121.76 117.89 2wp8 s ALA 952 Ca 0.56 -0.90 0.03 0.00 0.00 0.00 0.00 51.96 51.65 2wp8 s ALA 952 Cb -0.11 -1.36 -0.02 0.00 0.00 0.00 0.00 23.12 21.63 2wp8 s ALA 952 CO 0.16 0.16 -0.18 0.12 0.00 0.00 0.00 175.76 176.03 2wp8 s PHE 953 N 0.48 2.64 -0.17 0.00 5.36 -1.26 0.03 117.98 125.06 2wp8 s PHE 953 Ca -0.07 -0.56 0.01 0.00 -0.96 0.00 0.00 56.93 55.34 2wp8 s PHE 953 Cb -0.15 -1.70 0.03 0.00 -0.34 0.00 0.00 43.02 40.86 2wp8 s PHE 953 CO 0.04 -0.12 -0.14 0.34 -1.46 0.00 0.00 175.22 173.88 2wp8 s ASP 954 N -0.12 2.99 0.21 6.13 -1.08 -0.57 -5.02 116.67 119.21 2wp8 s ASP 954 Ca -0.03 -0.64 0.25 0.00 -0.52 0.00 0.00 52.55 51.61 2wp8 s ASP 954 Cb -0.14 -1.25 0.50 0.00 -1.46 0.00 0.00 42.92 40.57 2wp8 s ASP 954 CO 0.04 -0.07 1.51 1.05 0.52 0.00 0.00 175.17 178.22 2wp8 h GLU 955 N 8.01 0.00 0.10 4.34 9.09 -1.96 -1.76 114.58 132.40 2wp8 h GLU 955 Ca -0.36 0.00 -0.34 0.00 0.05 0.00 0.00 59.36 58.71 2wp8 h GLU 955 Cb 1.12 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.20 2wp8 h GLU 955 CO 0.53 0.00 -1.86 -0.39 0.05 0.00 0.00 179.01 177.35 2wp8 h VAL 956 N 0.00 0.76 -0.01 -1.06 -1.51 -1.97 -3.36 116.25 109.10 2wp8 h VAL 956 Ca 0.00 -2.49 0.00 0.00 -1.23 0.00 0.00 66.70 62.98 2wp8 h VAL 956 Cb 0.80 2.54 0.00 0.00 -2.13 0.00 0.00 31.29 32.50 2wp8 h VAL 956 CO 0.00 0.80 -0.20 -0.62 -1.23 0.00 0.00 177.57 176.31 2wp8 n GLU 957 N -3.39 1.15 -3.65 5.19 -0.58 -1.24 -4.96 120.64 113.15 2wp8 n GLU 957 Ca -0.26 -0.73 -0.26 0.00 -0.42 0.00 0.00 57.16 55.50 2wp8 n GLU 957 Cb 1.05 -1.48 0.04 0.00 -0.57 0.00 0.00 31.44 30.47 2wp8 n GLU 957 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2wp8 n TYR 958 N -0.29 -1.96 -4.08 -0.32 4.02 -0.71 -4.80 117.16 109.01 2wp8 n TYR 958 Ca 0.14 0.64 -0.18 0.00 -0.01 0.00 0.00 57.90 58.49 2wp8 n TYR 958 Cb 0.37 -3.81 -0.16 0.00 -0.02 0.00 0.00 39.34 35.73 2wp8 n TYR 958 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 176.86 176.06 2wp8 s LYS 959 N -5.80 0.51 -0.11 -0.72 2.20 -0.89 -2.23 119.74 112.70 2wp8 s LYS 959 Ca 0.31 -0.07 0.03 0.00 -0.36 0.00 0.00 55.97 55.88 2wp8 s LYS 959 Cb -0.09 -0.57 -0.00 0.00 -1.51 0.00 0.00 37.83 35.65 2wp8 s LYS 959 CO 0.83 -0.04 -0.21 -1.17 -0.36 0.00 0.00 175.35 174.41 2wp8 s LEU 960 N 0.62 2.26 -0.11 5.43 2.96 0.98 -1.52 118.68 129.29 2wp8 s LEU 960 Ca -0.07 -0.50 0.01 0.00 -0.22 0.00 0.00 54.13 53.35 2wp8 s LEU 960 Cb -0.10 -1.47 -0.01 0.00 0.50 0.00 0.00 46.19 45.11 2wp8 s LEU 960 CO -0.01 0.15 -0.16 -0.89 -1.32 0.00 0.00 176.35 174.12 2wp8 s THR 961 N 0.39 2.77 0.22 3.68 2.01 0.10 -0.09 115.64 124.73 2wp8 s THR 961 Ca -0.16 -0.77 -0.22 0.00 0.31 0.00 0.00 61.69 60.85 2wp8 s THR 961 Cb -0.17 -2.13 0.04 0.00 0.01 0.00 0.00 72.50 70.25 2wp8 s THR 961 CO 0.07 0.54 0.68 0.72 -0.69 0.00 0.00 174.62 175.94 2wp8 s PHE 962 N 0.25 -0.33 -0.41 4.92 -0.71 0.63 -0.44 117.98 121.89 2wp8 s PHE 962 Ca -0.11 -0.02 -0.15 0.00 -1.04 0.00 0.00 56.93 55.62 2wp8 s PHE 962 Cb -0.16 0.64 0.02 0.00 -1.21 0.00 0.00 43.02 42.31 2wp8 s PHE 962 CO 0.06 -1.06 0.29 0.08 -1.34 0.00 0.00 175.22 173.25 2wp8 s VAL 963 N -3.83 5.23 0.92 -2.49 1.01 -1.26 0.15 120.40 120.14 2wp8 s VAL 963 Ca 0.07 -0.66 -0.11 0.00 0.00 0.00 0.00 61.98 61.29 2wp8 s VAL 963 Cb -0.04 -3.91 0.15 0.00 0.00 0.00 0.00 36.38 32.58 2wp8 s VAL 963 CO -0.02 -0.30 1.12 -2.84 0.00 0.00 0.00 175.10 173.06 2wp8 s PRO 964 N 1.68 0.98 0.60 2.72 0.02 -1.26 -4.36 135.00 135.37 2wp8 s PRO 964 Ca 0.05 1.34 -0.14 0.00 0.02 0.00 0.00 61.00 62.26 2wp8 s PRO 964 Cb -0.19 -1.74 -0.04 0.00 0.02 0.00 0.00 34.50 32.56 2wp8 s PRO 964 CO 0.10 -2.59 1.04 0.99 -0.33 0.00 0.00 177.00 176.21 2wp8 s THR 965 N -2.69 4.09 -0.87 0.99 2.01 -1.24 -3.54 115.64 114.39 2wp8 s THR 965 Ca 0.66 0.90 0.00 0.00 0.31 0.00 0.00 61.69 63.55 2wp8 s THR 965 Cb -0.22 -3.50 0.00 0.00 0.01 0.00 0.00 72.50 68.79 2wp8 s THR 965 CO 0.58 -0.68 0.00 -0.46 -0.69 0.00 0.00 174.62 173.38 2wp8 n ASN 966 N -2.23 -5.35 -3.90 3.53 2.04 -1.26 -4.93 115.26 103.16 2wp8 n ASN 966 Ca 0.08 0.20 -0.09 0.00 -0.44 0.00 0.00 54.58 54.33 2wp8 n ASN 966 Cb 0.53 -3.57 -0.04 0.00 -2.53 0.00 0.00 39.78 34.17 2wp8 n ASN 966 CO 0.00 0.00 0.00 -0.55 -0.44 0.00 0.00 177.26 176.27 2wp8 s SER 967 N -2.38 -0.17 0.00 0.53 0.15 -1.23 -5.08 113.70 105.52 2wp8 s SER 967 Ca 0.00 -0.73 0.00 0.00 0.70 0.00 0.00 55.95 55.92 2wp8 s SER 967 Cb 0.00 0.61 0.00 0.00 -1.71 0.00 0.00 66.02 64.92 2wp8 s SER 967 CO 0.00 -1.16 0.09 -0.67 1.20 0.00 0.00 173.24 172.71 2wp8 n ASP 968 N -0.38 0.18 -4.86 5.45 2.03 -1.26 -4.62 116.55 113.09 2wp8 n ASP 968 Ca -0.05 -0.54 -0.36 0.00 0.52 0.00 0.00 54.79 54.36 2wp8 n ASP 968 Cb 0.61 0.65 -0.06 0.00 -0.72 0.00 0.00 41.12 41.60 2wp8 n ASP 968 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2wp8 s LYS 969 N -0.65 3.38 0.30 -0.67 1.02 -1.26 -4.98 119.74 116.89 2wp8 s LYS 969 Ca 0.00 -0.20 -0.29 0.00 0.02 0.00 0.00 55.97 55.50 2wp8 s LYS 969 Cb 0.00 -3.13 -0.10 0.00 -0.52 0.00 0.00 37.83 34.08 2wp8 s LYS 969 CO 0.00 0.75 1.44 -1.25 -0.92 0.00 0.00 175.35 175.37 2wp8 s PRO 970 N -1.19 4.23 -0.07 -1.68 0.04 -1.26 -4.09 135.00 130.99 2wp8 s PRO 970 Ca 0.17 2.38 0.06 0.00 0.04 0.00 0.00 61.00 63.65 2wp8 s PRO 970 Cb -0.12 -3.06 -0.01 0.00 0.04 0.00 0.00 34.50 31.35 2wp8 s PRO 970 CO 0.07 -0.42 -0.25 0.50 0.04 0.00 0.00 177.00 176.94 2wp8 s ARG 971 N -1.07 2.67 -0.22 4.56 3.52 0.40 -4.95 118.95 123.87 2wp8 s ARG 971 Ca 0.56 -0.90 -0.09 0.00 -0.13 0.00 0.00 55.73 55.17 2wp8 s ARG 971 Cb -0.43 -2.20 -0.04 0.00 -1.56 0.00 0.00 34.95 30.71 2wp8 s ARG 971 CO 0.50 0.34 0.11 -0.51 -0.81 0.00 0.00 175.30 174.93 2wp8 s ASP 972 N -0.05 5.84 -0.03 -2.12 1.01 -1.26 -0.27 116.67 119.80 2wp8 s ASP 972 Ca -0.07 0.07 0.08 0.00 0.71 0.00 0.00 52.55 53.34 2wp8 s ASP 972 Cb -0.15 -2.04 -0.02 0.00 1.01 0.00 0.00 42.92 41.73 2wp8 s ASP 972 CO 0.05 0.10 -0.26 -0.69 0.21 0.00 0.00 175.17 174.58 2wp8 s VAL 973 N 0.83 2.03 0.36 -1.27 1.01 0.87 -5.01 120.40 119.23 2wp8 s VAL 973 Ca 0.06 -1.09 0.05 0.00 0.00 0.00 0.00 61.98 61.00 2wp8 s VAL 973 Cb -0.13 -1.69 -0.07 0.00 0.00 0.00 0.00 36.38 34.49 2wp8 s VAL 973 CO 0.02 0.57 0.03 -0.31 0.00 0.00 0.00 175.10 175.42 2wp8 s TYR 974 N -0.51 2.22 0.46 5.22 1.51 -1.26 -0.02 117.35 124.97 2wp8 s TYR 974 Ca 0.07 -0.82 -0.23 0.00 -1.01 0.00 0.00 57.07 55.09 2wp8 s TYR 974 Cb -0.11 -1.50 -0.07 0.00 -0.11 0.00 0.00 41.96 40.17 2wp8 s TYR 974 CO -0.00 0.22 1.15 0.54 -1.11 0.00 0.00 175.55 176.35 2wp8 s VAL 975 N -3.02 3.16 0.00 0.71 0.11 -0.95 -3.21 120.40 117.20 2wp8 s VAL 975 Ca 0.36 0.86 0.00 0.00 -2.93 0.00 0.00 61.98 60.27 2wp8 s VAL 975 Cb 0.09 -3.43 0.00 0.00 -1.53 0.00 0.00 36.38 31.51 2wp8 s VAL 975 CO 0.17 -0.02 0.00 0.49 -3.33 0.00 0.00 175.10 172.40 2wp8 n PHE 976 N -0.51 0.00 -2.63 1.54 3.72 0.30 -4.97 117.46 114.91 2wp8 n PHE 976 Ca 0.07 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.05 2wp8 n PHE 976 Cb 0.48 -0.47 -0.03 0.00 -0.94 0.00 0.00 39.48 38.52 2wp8 n PHE 976 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2wp8 s ASP 977 N -2.20 7.25 -0.05 4.37 1.11 -1.20 -4.70 116.67 121.26 2wp8 s ASP 977 Ca 0.00 1.70 -0.30 0.00 0.18 0.00 0.00 52.55 54.14 2wp8 s ASP 977 Cb 0.00 -2.57 -0.05 0.00 1.07 0.00 0.00 42.92 41.37 2wp8 s ASP 977 CO 0.00 -0.38 1.59 -0.75 1.18 0.00 0.00 175.17 176.81 2wp8 s LYS 978 N 1.41 4.20 0.44 8.23 2.20 -1.26 -1.55 119.74 133.41 2wp8 s LYS 978 Ca 0.53 2.12 0.03 0.00 -0.36 0.00 0.00 55.97 58.29 2wp8 s LYS 978 Cb -0.22 -3.88 -0.02 0.00 -1.51 0.00 0.00 37.83 32.20 2wp8 s LYS 978 CO 0.25 -0.79 0.10 0.14 -0.36 0.00 0.00 175.35 174.69 2wp8 s VAL 979 N 3.66 0.70 0.01 4.02 -7.23 0.59 -4.99 120.40 117.16 2wp8 s VAL 979 Ca 0.70 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.93 2wp8 s VAL 979 Cb -0.33 -2.26 -0.02 0.00 0.56 0.00 0.00 36.38 34.33 2wp8 s VAL 979 CO 0.28 0.00 -0.18 -1.61 -0.31 0.00 0.00 175.10 173.28 2wp8 s GLU 980 N -3.73 1.37 0.10 4.82 2.02 -1.26 -0.78 118.70 121.23 2wp8 s GLU 980 Ca 0.18 -0.75 -0.05 0.00 0.02 0.00 0.00 54.97 54.37 2wp8 s GLU 980 Cb 0.02 -1.38 -0.02 0.00 0.10 0.00 0.00 34.13 32.85 2wp8 s GLU 980 CO 0.12 0.37 0.12 0.54 0.02 0.00 0.00 175.26 176.42 2wp8 s VAL 981 N -0.59 0.14 0.21 2.63 0.11 0.45 -0.81 120.40 122.54 2wp8 s VAL 981 Ca 0.06 -1.53 -0.23 0.00 -2.93 0.00 0.00 61.98 57.35 2wp8 s VAL 981 Cb -0.08 -1.61 0.05 0.00 -1.53 0.00 0.00 36.38 33.21 2wp8 s VAL 981 CO 0.00 -0.66 0.83 0.00 -3.33 0.00 0.00 175.10 171.95 2wp8 s GLN 982 N -3.93 1.46 -0.04 1.54 -2.07 -0.91 -0.84 119.66 114.87 2wp8 s GLN 982 Ca 0.11 -0.79 0.06 0.00 -1.82 0.00 0.00 55.36 52.92 2wp8 s GLN 982 Cb 0.06 0.51 -0.01 0.00 -1.09 0.00 0.00 33.01 32.48 2wp8 s GLN 982 CO -0.06 -0.67 -0.22 0.08 -1.32 0.00 0.00 175.29 173.10 2wp8 s VAL 983 N -3.59 1.81 0.13 3.63 1.01 -1.26 -0.38 120.40 121.75 2wp8 s VAL 983 Ca 0.11 -0.94 -0.09 0.00 0.00 0.00 0.00 61.98 61.05 2wp8 s VAL 983 Cb -0.03 -1.53 -0.00 0.00 0.00 0.00 0.00 36.38 34.82 2wp8 s VAL 983 CO 0.03 0.51 0.25 -0.13 0.00 0.00 0.00 175.10 175.77 2wp8 s ARG 984 N -0.21 1.02 -0.56 2.72 0.52 -1.03 -4.43 118.95 116.99 2wp8 s ARG 984 Ca -0.00 -1.05 -0.23 0.00 -0.52 0.00 0.00 55.73 53.92 2wp8 s ARG 984 Cb -0.12 0.37 0.05 0.00 0.52 0.00 0.00 34.95 35.77 2wp8 s ARG 984 CO 0.02 -0.36 0.91 0.45 0.02 0.00 0.00 175.30 176.35 2wp8 s SER 985 N -2.91 6.31 -0.12 0.23 0.15 -1.26 -1.65 113.70 114.45 2wp8 s SER 985 Ca 0.11 -0.47 -0.07 0.00 0.70 0.00 0.00 55.95 56.22 2wp8 s SER 985 Cb 0.04 -2.42 -0.04 0.00 -1.71 0.00 0.00 66.02 61.89 2wp8 s SER 985 CO -0.06 -1.22 0.13 -0.69 1.20 0.00 0.00 173.24 172.61 2wp8 s VAL 986 N 3.83 5.46 -0.21 4.45 1.01 -0.94 -4.98 120.40 129.03 2wp8 s VAL 986 Ca 0.28 0.19 -0.09 0.00 0.00 0.00 0.00 61.98 62.37 2wp8 s VAL 986 Cb -0.14 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 2wp8 s VAL 986 CO 0.18 0.61 0.11 -0.32 0.00 0.00 0.00 175.10 175.67 2wp8 s MET 987 N -0.95 4.03 -0.03 2.72 -2.45 -1.26 -3.01 119.30 118.35 2wp8 s MET 987 Ca 0.15 -0.30 -0.28 0.00 -1.25 0.00 0.00 55.69 54.01 2wp8 s MET 987 Cb -0.12 -3.37 -0.03 0.00 1.25 0.00 0.00 34.83 32.56 2wp8 s MET 987 CO 0.04 0.18 0.89 0.34 1.05 0.00 0.00 175.02 177.52 2wp8 s ASP 988 N 0.66 7.23 0.37 1.11 -1.08 -0.86 -4.97 116.67 119.14 2wp8 s ASP 988 Ca 0.06 1.49 0.10 0.00 -0.52 0.00 0.00 52.55 53.68 2wp8 s ASP 988 Cb -0.13 -2.52 0.73 0.00 -1.46 0.00 0.00 42.92 39.55 2wp8 s ASP 988 CO 0.01 -0.22 1.87 -0.65 0.52 0.00 0.00 175.17 176.70 2wp8 h PRO 989 N 6.81 0.20 0.00 4.34 0.11 -1.96 -3.34 132.00 138.17 2wp8 h PRO 989 Ca -0.40 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.61 2wp8 h PRO 989 Cb 1.21 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2wp8 h PRO 989 CO 0.76 0.41 -0.26 0.82 -0.21 0.00 0.00 178.00 179.51 2wp8 h ILE 990 N 0.19 0.96 -3.53 4.15 5.03 -1.97 -3.42 117.51 118.92 2wp8 h ILE 990 Ca 0.03 -1.80 -0.61 0.00 -0.12 0.00 0.00 64.86 62.37 2wp8 h ILE 990 Cb 0.47 1.89 -0.11 0.00 -3.03 0.00 0.00 36.82 36.05 2wp8 h ILE 990 CO 0.03 0.32 0.46 -0.89 -0.68 0.00 0.00 178.15 177.39 2wp8 s THR 991 N -2.06 4.67 -1.20 -0.27 2.01 -1.25 -4.94 115.64 112.60 2wp8 s THR 991 Ca -0.15 0.94 0.00 0.00 0.31 0.00 0.00 61.69 62.79 2wp8 s THR 991 Cb -0.00 -4.27 0.00 0.00 0.01 0.00 0.00 72.50 68.24 2wp8 s THR 991 CO 0.43 -0.51 0.82 -1.20 -0.69 0.00 0.00 174.62 173.47 2wp8 n SER 992 N 6.60 0.00 -4.77 3.53 7.64 -1.26 -3.74 113.62 121.62 2wp8 n SER 992 Ca 0.04 0.33 -0.39 0.00 1.01 0.00 0.00 58.87 59.87 2wp8 n SER 992 Cb 0.48 -0.33 -0.02 0.00 -1.01 0.00 0.00 64.21 63.33 2wp8 n SER 992 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2wp8 s LYS 993 N -2.64 4.12 -0.77 1.43 1.02 -1.26 -4.77 119.74 116.88 2wp8 s LYS 993 Ca 0.00 1.87 0.03 0.00 0.02 0.00 0.00 55.97 57.89 2wp8 s LYS 993 Cb 0.00 -2.75 0.23 0.00 -0.52 0.00 0.00 37.83 34.79 2wp8 s LYS 993 CO 0.00 -0.27 0.79 -2.13 -0.92 0.00 0.00 175.35 172.82 2wp8 n ARG 994 N 0.22 2.64 -1.81 1.68 0.63 -1.26 -2.03 116.66 116.73 2wp8 n ARG 994 Ca 0.03 -4.58 -0.30 0.00 -0.92 0.00 0.00 57.85 52.09 2wp8 n ARG 994 Cb 0.46 -2.33 0.16 0.00 0.45 0.00 0.00 32.46 31.20 2wp8 n ARG 994 CO 0.00 0.00 0.00 -1.59 -2.51 0.00 0.00 177.63 173.53 2wp8 s LYS 995 N -2.07 0.86 -0.88 -0.14 0.00 -1.16 -4.81 119.74 111.53 2wp8 s LYS 995 Ca 0.33 -0.18 -0.07 0.00 0.00 0.00 0.00 55.97 56.05 2wp8 s LYS 995 Cb 0.05 -1.85 0.22 0.00 0.00 0.00 0.00 37.83 36.25 2wp8 s LYS 995 CO -0.06 -2.30 0.79 0.00 0.00 0.00 0.00 175.35 173.78 2wp8 s ALA 996 N -3.68 4.20 0.48 0.59 0.00 -1.26 -2.22 121.76 119.87 2wp8 s ALA 996 Ca 0.70 -3.60 -0.10 0.00 0.00 0.00 0.00 51.96 48.96 2wp8 s ALA 996 Cb -0.07 -3.16 -0.05 0.00 0.00 0.00 0.00 23.12 19.84 2wp8 s ALA 996 CO 0.52 -2.19 0.85 -1.21 0.00 0.00 0.00 175.76 173.73 2wp8 s GLU 997 N -0.69 3.70 -0.09 0.00 2.02 -0.66 -4.71 118.70 118.27 2wp8 s GLU 997 Ca 0.24 0.51 -0.27 0.00 0.02 0.00 0.00 54.97 55.47 2wp8 s GLU 997 Cb -0.11 -2.30 -0.02 0.00 0.10 0.00 0.00 34.13 31.80 2wp8 s GLU 997 CO -0.09 -0.21 0.87 -1.17 0.02 0.00 0.00 175.26 174.69 2wp8 s LEU 998 N -4.37 4.27 0.42 1.80 2.96 -1.26 -2.45 118.68 120.05 2wp8 s LEU 998 Ca 0.52 1.37 0.06 0.00 -0.22 0.00 0.00 54.13 55.85 2wp8 s LEU 998 Cb -0.10 -3.34 -0.07 0.00 0.50 0.00 0.00 46.19 43.17 2wp8 s LEU 998 CO 0.39 -0.31 0.01 -0.76 -1.32 0.00 0.00 176.35 174.37 2wp8 s LEU 999 N 1.53 2.73 -0.30 -0.68 1.43 0.49 -4.50 118.68 119.39 2wp8 s LEU 999 Ca 0.43 -1.42 -0.12 0.00 -1.03 0.00 0.00 54.13 52.00 2wp8 s LEU 999 Cb -0.18 -0.83 -0.04 0.00 0.03 0.00 0.00 46.19 45.17 2wp8 s LEU 999 CO 0.19 -0.53 0.22 -0.22 0.23 0.00 0.00 176.35 176.24 2wp8 s LEU 1000N -3.72 4.15 0.00 1.79 2.96 -1.26 -2.13 118.68 120.47 2wp8 s LEU 1000Ca 0.30 -0.10 0.00 0.00 -0.22 0.00 0.00 54.13 54.12 2wp8 s LEU 1000Cb 0.09 -2.15 0.00 0.00 0.50 0.00 0.00 46.19 44.62 2wp8 s LEU 1000CO 0.15 -0.11 0.00 2.29 -1.32 0.00 0.00 176.35 177.36