#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wad s LYS 53 N 0.00 1.91 -0.22 1.09 -2.85 -1.26 -4.10 119.74 114.31 2wad s LYS 53 Ca 0.00 -1.06 0.01 0.00 -1.00 0.00 0.00 55.97 53.92 2wad s LYS 53 Cb 0.00 -2.09 0.05 0.00 -2.06 0.00 0.00 37.83 33.73 2wad s LYS 53 CO 0.00 0.52 -0.08 0.14 0.10 0.00 0.00 175.35 176.03 2wad s VAL 54 N -0.91 1.70 0.58 1.79 -7.23 -0.23 -5.01 120.40 111.09 2wad s VAL 54 Ca 0.14 -1.21 -0.16 0.00 -1.81 0.00 0.00 61.98 58.94 2wad s VAL 54 Cb -0.10 -1.86 -0.04 0.00 0.56 0.00 0.00 36.38 34.94 2wad s VAL 54 CO 0.04 0.02 1.04 0.28 -0.31 0.00 0.00 175.10 176.18 2wad s THR 55 N 1.34 3.96 -0.25 5.32 -1.32 -1.26 -2.62 115.64 120.82 2wad s THR 55 Ca -0.05 0.92 -0.06 0.00 -1.21 0.00 0.00 61.69 61.30 2wad s THR 55 Cb -0.18 -3.45 0.13 0.00 -1.51 0.00 0.00 72.50 67.48 2wad s THR 55 CO -0.07 -0.56 0.49 0.28 -2.21 0.00 0.00 174.62 172.56 2wad s THR 56 N -2.51 -0.78 0.39 5.08 -1.32 -0.09 -4.98 115.64 111.43 2wad s THR 56 Ca 0.62 0.05 -0.28 0.00 -1.21 0.00 0.00 61.69 60.87 2wad s THR 56 Cb -0.15 -0.83 -0.11 0.00 -1.51 0.00 0.00 72.50 69.90 2wad s THR 56 CO 0.36 -0.00 1.49 -0.44 -2.21 0.00 0.00 174.62 173.83 2wad s SER 57 N 2.70 6.28 0.00 8.08 0.01 -1.26 -1.76 113.70 127.75 2wad s SER 57 Ca 0.05 3.07 0.00 0.00 1.31 0.00 0.00 55.95 60.37 2wad s SER 57 Cb -0.13 -2.67 0.00 0.00 0.21 0.00 0.00 66.02 63.43 2wad s SER 57 CO -0.16 -0.92 0.00 -1.20 0.41 0.00 0.00 173.24 171.37 2wad n SER 58 N 0.38 0.02 -4.78 2.44 7.64 -1.26 -4.89 113.62 113.17 2wad n SER 58 Ca 0.01 -0.68 -0.36 0.00 1.01 0.00 0.00 58.87 58.85 2wad n SER 58 Cb 0.39 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.54 2wad n SER 58 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wad s ALA 59 N -2.00 3.13 0.24 -0.43 0.00 -1.26 -4.69 121.76 116.74 2wad s ALA 59 Ca 0.00 0.62 -0.26 0.00 0.00 0.00 0.00 51.96 52.32 2wad s ALA 59 Cb 0.00 -3.23 -0.09 0.00 0.00 0.00 0.00 23.12 19.80 2wad s ALA 59 CO 0.00 -0.06 0.86 0.50 0.00 0.00 0.00 175.76 177.06 2wad s ARG 60 N -2.41 4.60 1.03 0.00 3.52 -1.26 -1.87 118.95 122.57 2wad s ARG 60 Ca 0.56 1.25 -0.12 0.00 -0.13 0.00 0.00 55.73 57.28 2wad s ARG 60 Cb -0.20 -3.08 0.21 0.00 -1.56 0.00 0.00 34.95 30.32 2wad s ARG 60 CO 0.25 0.45 1.07 0.20 -0.81 0.00 0.00 175.30 176.47 2wad s GLY 61 N -1.37 1.59 0.34 8.12 0.00 0.38 -4.55 107.32 111.84 2wad s GLY 61 Ca 0.42 0.01 0.06 0.00 0.00 0.00 0.00 44.72 45.22 2wad s GLY 61 CO 0.26 0.60 -0.01 -0.54 0.00 0.00 0.00 173.10 173.41 2wad s GLU 62 N -4.67 1.74 -0.09 2.90 2.02 -1.26 -4.93 118.70 114.41 2wad s GLU 62 Ca 0.67 -1.94 0.01 0.00 0.02 0.00 0.00 54.97 53.72 2wad s GLU 62 Cb -0.22 -1.30 -0.02 0.00 0.10 0.00 0.00 34.13 32.68 2wad s GLU 62 CO 0.61 -0.03 -0.10 0.42 0.02 0.00 0.00 175.26 176.17 2wad s ILE 63 N -2.94 3.37 0.15 -1.63 -1.09 -1.26 -1.85 121.20 115.95 2wad s ILE 63 Ca 0.34 -0.58 0.07 0.00 -2.23 0.00 0.00 60.65 58.24 2wad s ILE 63 Cb 0.07 -2.39 -0.04 0.00 -1.58 0.00 0.00 42.46 38.52 2wad s ILE 63 CO 0.15 0.56 -0.15 -0.31 -1.23 0.00 0.00 174.94 173.97 2wad s TYR 64 N -0.27 1.54 0.96 3.97 2.02 -0.06 -1.43 117.35 124.08 2wad s TYR 64 Ca 0.03 -0.56 -0.11 0.00 -0.37 0.00 0.00 57.07 56.06 2wad s TYR 64 Cb -0.13 -0.77 0.17 0.00 -0.40 0.00 0.00 41.96 40.83 2wad s TYR 64 CO 0.03 0.22 1.10 0.34 -1.57 0.00 0.00 175.55 175.67 2wad s ASP 65 N -2.76 2.69 0.59 2.29 2.15 0.30 -1.14 116.67 120.79 2wad s ASP 65 Ca 0.14 1.87 0.29 0.00 0.43 0.00 0.00 52.55 55.28 2wad s ASP 65 Cb -0.03 -2.43 1.67 0.00 -0.30 0.00 0.00 42.92 41.83 2wad s ASP 65 CO 0.04 -3.19 2.12 0.00 -0.17 0.00 0.00 175.17 173.98 2wad h ALA 66 N -1.93 1.77 -0.69 3.66 0.00 -1.40 -1.45 119.26 119.22 2wad h ALA 66 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2wad h ALA 66 Cb 1.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2wad h ALA 66 CO 0.47 -0.25 0.00 -1.13 0.00 0.00 0.00 179.25 178.34 2wad n SER 67 N -3.83 3.89 0.00 0.00 3.41 -1.26 -4.95 113.62 110.88 2wad n SER 67 Ca 0.01 -2.02 0.00 0.00 -0.26 0.00 0.00 58.87 56.60 2wad n SER 67 Cb 0.29 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 2wad n SER 67 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wad n GLY 68 N 1.51 0.77 3.76 5.00 0.00 -0.54 -5.06 105.19 110.63 2wad n GLY 68 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 2wad n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wad s LYS 69 N -0.68 4.31 0.38 1.61 -0.14 -1.26 -4.62 119.74 119.34 2wad s LYS 69 Ca 0.00 2.25 -0.25 0.00 -1.36 0.00 0.00 55.97 56.61 2wad s LYS 69 Cb 0.00 -3.09 -0.09 0.00 -1.68 0.00 0.00 37.83 32.97 2wad s LYS 69 CO 0.00 -0.30 1.05 -1.25 -0.76 0.00 0.00 175.35 174.10 2wad s PRO 70 N -1.10 4.24 -0.01 -1.68 0.04 -1.26 0.11 135.00 135.34 2wad s PRO 70 Ca 0.54 1.55 0.06 0.00 0.04 0.00 0.00 61.00 63.19 2wad s PRO 70 Cb -0.41 -2.64 -0.09 0.00 0.04 0.00 0.00 34.50 31.40 2wad s PRO 70 CO 0.48 -0.08 0.18 1.28 0.04 0.00 0.00 177.00 178.90 2wad n LEU 71 N 0.13 0.09 -4.26 -3.56 4.77 -0.51 -4.84 117.00 108.81 2wad n LEU 71 Ca 0.04 -0.16 -0.15 0.00 -0.03 0.00 0.00 56.01 55.71 2wad n LEU 71 Cb 0.49 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.48 2wad n LEU 71 CO 0.46 0.02 -0.23 0.68 -1.33 0.00 0.00 177.39 177.00 2wad s VAL 72 N -2.16 0.23 -0.04 4.08 -7.23 -1.26 -2.63 120.40 111.39 2wad s VAL 72 Ca -0.01 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.11 2wad s VAL 72 Cb 0.04 -2.55 0.01 0.00 0.56 0.00 0.00 36.38 34.45 2wad s VAL 72 CO 0.26 0.00 0.14 -0.70 -0.31 0.00 0.00 175.10 174.49 2wad s GLU 73 N -4.02 0.22 -0.36 4.82 2.56 -0.01 -4.83 118.70 117.08 2wad s GLU 73 Ca 0.38 0.08 -0.12 0.00 0.00 0.00 0.00 54.97 55.31 2wad s GLU 73 Cb 0.07 0.10 0.00 0.00 2.00 0.00 0.00 34.13 36.30 2wad s GLU 73 CO 0.14 -0.04 0.23 -0.80 -0.56 0.00 0.00 175.26 174.24 2wad s ASN 74 N -0.20 5.89 -0.19 -1.70 0.01 -1.26 -1.54 114.94 115.95 2wad s ASN 74 Ca -0.03 -0.68 -0.03 0.00 -0.71 0.00 0.00 52.86 51.41 2wad s ASN 74 Cb -0.02 -2.09 -0.01 0.00 0.41 0.00 0.00 41.25 39.54 2wad s ASN 74 CO 0.00 -0.31 -0.08 0.28 -1.51 0.00 0.00 177.10 175.48 2wad s THR 75 N 1.65 3.17 0.03 1.60 -1.32 0.16 -4.93 115.64 116.00 2wad s THR 75 Ca 0.05 -0.57 -0.30 0.00 -1.21 0.00 0.00 61.69 59.65 2wad s THR 75 Cb -0.18 -2.41 -0.04 0.00 -1.51 0.00 0.00 72.50 68.36 2wad s THR 75 CO 0.09 0.46 1.04 -0.22 -2.21 0.00 0.00 174.62 173.77 2wad s LEU 76 N 1.18 4.38 0.11 9.08 0.20 -1.26 0.18 118.68 132.55 2wad s LEU 76 Ca 0.02 1.77 0.05 0.00 0.69 0.00 0.00 54.13 56.65 2wad s LEU 76 Cb -0.14 -3.57 -0.04 0.00 -0.43 0.00 0.00 46.19 42.00 2wad s LEU 76 CO -0.02 -0.30 -0.12 -1.59 -0.29 0.00 0.00 176.35 174.03 2wad s LYS 77 N 0.91 0.94 0.11 1.98 -2.85 0.91 -4.89 119.74 116.85 2wad s LYS 77 Ca 0.53 -1.22 -0.08 0.00 -1.00 0.00 0.00 55.97 54.21 2wad s LYS 77 Cb -0.23 -0.70 -0.06 0.00 -2.06 0.00 0.00 37.83 34.78 2wad s LYS 77 CO 0.29 0.12 0.40 -0.65 0.10 0.00 0.00 175.35 175.60 2wad s GLN 78 N -2.82 3.70 0.22 1.78 -0.21 -1.26 -0.15 119.66 120.92 2wad s GLN 78 Ca 0.08 0.07 -0.08 0.00 0.02 0.00 0.00 55.36 55.45 2wad s GLN 78 Cb -0.03 -2.92 -0.02 0.00 1.00 0.00 0.00 33.01 31.04 2wad s GLN 78 CO 0.01 0.51 0.33 0.08 -2.12 0.00 0.00 175.29 174.11 2wad s VAL 79 N -1.52 0.01 -0.25 1.09 1.01 0.66 -4.83 120.40 116.56 2wad s VAL 79 Ca 0.37 -1.62 -0.13 0.00 0.00 0.00 0.00 61.98 60.60 2wad s VAL 79 Cb -0.13 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 2wad s VAL 79 CO 0.21 -0.03 0.30 -0.69 0.00 0.00 0.00 175.10 174.88 2wad s VAL 80 N -4.06 5.25 -0.16 2.92 1.01 -1.26 -2.13 120.40 121.96 2wad s VAL 80 Ca 0.28 0.43 -0.02 0.00 0.00 0.00 0.00 61.98 62.67 2wad s VAL 80 Cb 0.02 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.76 2wad s VAL 80 CO 0.09 0.23 -0.08 -0.44 0.00 0.00 0.00 175.10 174.91 2wad s SER 81 N 1.43 4.34 -0.05 3.32 0.01 0.19 -0.91 113.70 122.02 2wad s SER 81 Ca 0.13 -0.28 0.04 0.00 1.31 0.00 0.00 55.95 57.15 2wad s SER 81 Cb -0.15 -1.70 -0.02 0.00 0.21 0.00 0.00 66.02 64.36 2wad s SER 81 CO 0.09 0.12 -0.18 0.12 0.41 0.00 0.00 173.24 173.80 2wad s PHE 82 N 0.62 2.61 -0.22 2.43 5.36 0.14 -1.45 117.98 127.46 2wad s PHE 82 Ca -0.05 -0.32 0.01 0.00 -0.96 0.00 0.00 56.93 55.61 2wad s PHE 82 Cb -0.15 -1.62 0.05 0.00 -0.34 0.00 0.00 43.02 40.96 2wad s PHE 82 CO 0.03 0.06 -0.08 0.99 -1.46 0.00 0.00 175.22 174.76 2wad s THR 83 N -0.54 1.66 0.84 0.12 2.01 -0.48 0.13 115.64 119.39 2wad s THR 83 Ca 0.07 -1.20 -0.12 0.00 0.31 0.00 0.00 61.69 60.75 2wad s THR 83 Cb -0.11 -1.84 0.10 0.00 0.01 0.00 0.00 72.50 70.66 2wad s THR 83 CO 0.01 0.01 1.16 -0.60 -0.69 0.00 0.00 174.62 174.51 2wad s ARG 84 N 1.35 1.70 0.01 4.92 3.52 -1.05 -4.61 118.95 124.80 2wad s ARG 84 Ca -0.05 0.20 0.01 0.00 -0.13 0.00 0.00 55.73 55.77 2wad s ARG 84 Cb -0.18 -1.91 -0.01 0.00 -1.56 0.00 0.00 34.95 31.29 2wad s ARG 84 CO -0.07 -1.79 -0.05 0.45 -0.81 0.00 0.00 175.30 173.03 2wad s SER 85 N -4.36 0.56 0.41 -2.12 0.15 -1.26 -3.63 113.70 103.45 2wad s SER 85 Ca 0.62 -0.24 0.22 0.00 0.70 0.00 0.00 55.95 57.25 2wad s SER 85 Cb -0.12 -0.01 1.21 0.00 -1.71 0.00 0.00 66.02 65.38 2wad s SER 85 CO 0.51 -0.05 1.72 -0.55 1.20 0.00 0.00 173.24 176.07 2wad h ASN 86 N 5.50 0.38 1.21 5.45 -1.07 -1.97 -2.12 115.58 122.95 2wad h ASN 86 Ca -0.30 0.10 0.00 0.00 0.07 0.00 0.00 56.30 56.18 2wad h ASN 86 Cb 1.20 0.05 0.00 0.00 -2.07 0.00 0.00 38.32 37.50 2wad h ASN 86 CO 0.47 -0.01 0.00 0.11 0.07 0.00 0.00 177.43 178.07 2wad h LYS 87 N 0.29 0.00 -6.26 4.14 1.57 -2.03 -3.45 116.57 110.82 2wad h LYS 87 Ca 0.67 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.89 2wad h LYS 87 Cb 1.85 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 34.13 2wad h LYS 87 CO -0.35 0.00 1.01 -1.64 -0.57 0.00 0.00 179.45 177.90 2wad s MET 88 N -3.21 4.00 0.65 3.15 -1.94 -0.80 -5.03 119.30 116.13 2wad s MET 88 Ca 0.08 1.59 -0.09 0.00 -1.71 0.00 0.00 55.69 55.55 2wad s MET 88 Cb 0.11 -3.90 0.01 0.00 2.01 0.00 0.00 34.83 33.05 2wad s MET 88 CO 0.52 -1.02 1.02 -0.08 -0.01 0.00 0.00 175.02 175.45 2wad s THR 89 N 4.32 3.72 0.35 2.05 -1.32 -1.26 -4.90 115.64 118.61 2wad s THR 89 Ca 0.62 0.37 0.08 0.00 -1.21 0.00 0.00 61.69 61.55 2wad s THR 89 Cb -0.22 -3.52 0.12 0.00 -1.51 0.00 0.00 72.50 67.36 2wad s THR 89 CO 0.23 -0.64 1.85 0.00 -2.21 0.00 0.00 174.62 173.85 2wad h ALA 90 N -0.44 1.38 -0.29 11.08 0.00 -1.96 0.27 119.26 129.30 2wad h ALA 90 Ca -0.45 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.11 2wad h ALA 90 Cb 1.25 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 2wad h ALA 90 CO 0.63 0.43 -0.17 1.15 0.00 0.00 0.00 179.25 181.29 2wad h THR 91 N 0.24 1.24 -0.36 0.00 2.02 -1.94 -2.13 112.91 111.99 2wad h THR 91 Ca 0.04 -1.12 -0.00 0.00 0.77 0.00 0.00 66.41 66.10 2wad h THR 91 Cb 0.50 1.21 -0.02 0.00 -1.74 0.00 0.00 68.15 68.10 2wad h THR 91 CO 0.03 0.36 0.22 0.44 0.37 0.00 0.00 175.52 176.94 2wad h ASP 92 N 0.47 0.44 -0.23 4.18 3.32 -1.53 -2.98 116.42 120.09 2wad h ASP 92 Ca 0.08 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 2wad h ASP 92 Cb 0.56 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 2wad h ASP 92 CO 0.04 0.37 0.13 -0.07 -1.72 0.00 0.00 179.24 177.98 2wad h LEU 93 N 0.47 0.29 -0.06 1.55 4.07 -0.73 -2.63 115.31 118.27 2wad h LEU 93 Ca 0.13 -0.09 0.03 0.00 0.08 0.00 0.00 57.88 58.04 2wad h LEU 93 Cb 0.01 -0.07 -0.06 0.00 1.08 0.00 0.00 40.66 41.62 2wad h LEU 93 CO -0.02 0.30 -0.45 0.11 -1.08 0.00 0.00 178.44 177.29 2wad h LYS 94 N 0.26 -0.54 0.00 1.13 1.57 -1.45 -0.29 116.57 117.25 2wad h LYS 94 Ca 0.08 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2wad h LYS 94 Cb 0.07 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.50 2wad h LYS 94 CO -0.01 -0.36 0.00 0.93 -0.57 0.00 0.00 179.45 179.44 2wad h GLU 95 N -0.56 0.00 0.13 3.15 4.39 -1.45 -0.45 114.58 119.78 2wad h GLU 95 Ca 0.05 0.00 -0.29 0.00 0.34 0.00 0.00 59.36 59.46 2wad h GLU 95 Cb 0.66 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 2wad h GLU 95 CO -0.36 0.00 -1.46 0.82 -1.16 0.00 0.00 179.01 176.84 2wad h ILE 96 N 0.00 1.03 0.07 3.13 2.04 -0.96 -3.28 117.51 119.53 2wad h ILE 96 Ca 0.00 -2.43 0.02 0.00 1.00 0.00 0.00 64.86 63.45 2wad h ILE 96 Cb 0.09 2.74 -0.02 0.00 -0.74 0.00 0.00 36.82 38.89 2wad h ILE 96 CO 0.00 0.74 -0.16 0.00 0.00 0.00 0.00 178.15 178.73 2wad h ALA 97 N -0.01 -0.25 -0.84 1.87 0.00 0.55 -1.45 119.26 119.13 2wad h ALA 97 Ca -0.31 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.55 2wad h ALA 97 Cb 1.83 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 19.84 2wad h ALA 97 CO 0.09 -0.67 0.39 1.57 0.00 0.00 0.00 179.25 180.63 2wad h LYS 98 N -0.30 1.22 -0.29 0.00 2.10 -1.56 0.02 116.57 117.76 2wad h LYS 98 Ca 0.03 -0.19 0.08 0.00 -2.00 0.00 0.00 60.65 58.58 2wad h LYS 98 Cb 0.33 -0.22 -0.01 0.00 -0.90 0.00 0.00 32.23 31.43 2wad h LYS 98 CO -0.10 0.94 0.21 0.87 -2.00 0.00 0.00 179.45 179.37 2wad h LYS 99 N 1.20 0.01 0.11 0.07 1.79 -1.57 -2.96 116.57 115.23 2wad h LYS 99 Ca 0.29 -0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.58 2wad h LYS 99 Cb 0.14 -0.00 0.02 0.00 -1.58 0.00 0.00 32.23 30.80 2wad h LYS 99 CO -0.03 0.01 -0.75 1.25 -1.08 0.00 0.00 179.45 178.85 2wad h LEU 100 N 0.01 0.46 -1.87 2.94 5.85 -0.07 -3.24 115.31 119.39 2wad h LEU 100 Ca 0.14 -0.93 0.12 0.00 0.84 0.00 0.00 57.88 58.05 2wad h LEU 100 Cb 0.54 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 2wad h LEU 100 CO -0.00 1.35 0.51 0.25 -0.34 0.00 0.00 178.44 180.20 2wad h LEU 101 N -0.36 0.00 -0.02 2.25 5.85 -0.88 0.17 115.31 122.32 2wad h LEU 101 Ca -0.13 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.59 2wad h LEU 101 Cb 1.56 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.59 2wad h LEU 101 CO 0.14 0.00 0.00 0.41 -0.34 0.00 0.00 178.44 178.65 2wad n THR 102 N -3.55 1.71 -0.00 1.05 -1.04 -1.20 -3.45 114.28 107.80 2wad n THR 102 Ca 0.07 0.43 0.00 0.00 -2.04 0.00 0.00 64.05 62.52 2wad n THR 102 Cb 0.68 -1.36 0.00 0.00 -1.82 0.00 0.00 70.33 67.82 2wad n THR 102 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2wad n TYR 103 N -1.51 0.00 -4.15 -1.42 4.01 0.59 -5.08 117.16 109.59 2wad n TYR 103 Ca 0.01 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.65 2wad n TYR 103 Cb 0.05 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 38.98 2wad n TYR 103 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 2wad s VAL 104 N -0.46 0.53 -0.27 -0.72 -7.23 -1.19 -4.98 120.40 106.08 2wad s VAL 104 Ca 0.00 -1.90 -0.08 0.00 -1.81 0.00 0.00 61.98 58.19 2wad s VAL 104 Cb 0.00 -1.69 -0.02 0.00 0.56 0.00 0.00 36.38 35.24 2wad s VAL 104 CO 0.00 -0.86 0.09 -0.44 -0.31 0.00 0.00 175.10 173.58 2wad s SER 105 N -3.02 5.23 -0.47 4.85 0.01 -1.26 -4.81 113.70 114.23 2wad s SER 105 Ca 0.12 -0.35 -0.05 0.00 1.31 0.00 0.00 55.95 56.98 2wad s SER 105 Cb 0.06 -1.94 0.12 0.00 0.21 0.00 0.00 66.02 64.48 2wad s SER 105 CO -0.05 -0.09 0.30 -0.63 0.41 0.00 0.00 173.24 173.17 2wad s ILE 106 N 1.60 3.66 -0.15 1.44 -1.09 -1.26 -2.67 121.20 122.72 2wad s ILE 106 Ca 0.05 -2.15 -0.08 0.00 -2.23 0.00 0.00 60.65 56.24 2wad s ILE 106 Cb -0.16 -3.45 -0.24 0.00 -1.58 0.00 0.00 42.46 37.03 2wad s ILE 106 CO 0.04 -0.75 0.27 -1.54 -1.23 0.00 0.00 174.94 171.73 2wad n SER 107 N 4.47 2.07 -4.08 3.58 3.41 -1.26 -4.76 113.62 117.05 2wad n SER 107 Ca -0.02 0.22 -0.39 0.00 -0.26 0.00 0.00 58.87 58.42 2wad n SER 107 Cb 0.41 -0.84 -0.03 0.00 -0.26 0.00 0.00 64.21 63.48 2wad n SER 107 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2wad n SER 108 N -3.63 4.94 -4.51 4.04 7.64 -1.26 -5.03 113.62 115.81 2wad n SER 108 Ca -0.34 -3.19 -0.43 0.00 1.01 0.00 0.00 58.87 55.92 2wad n SER 108 Cb 0.98 -1.14 -0.05 0.00 -1.01 0.00 0.00 64.21 62.99 2wad n SER 108 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2wad s PRO 109 N -1.74 3.29 -0.44 1.43 0.05 -1.26 -5.00 135.00 131.33 2wad s PRO 109 Ca 0.30 -0.39 -0.04 0.00 0.05 0.00 0.00 61.00 60.93 2wad s PRO 109 Cb -0.03 -4.03 0.12 0.00 0.05 0.00 0.00 34.50 30.61 2wad s PRO 109 CO -0.06 -1.29 0.24 -0.80 0.05 0.00 0.00 177.00 175.15 2wad s ASN 110 N 2.55 5.31 -0.23 6.66 -0.87 -1.26 -5.09 114.94 122.02 2wad s ASN 110 Ca 0.26 -2.10 -0.08 0.00 -1.57 0.00 0.00 52.86 49.36 2wad s ASN 110 Cb -0.14 -1.85 -0.04 0.00 -0.02 0.00 0.00 41.25 39.20 2wad s ASN 110 CO 0.18 -0.54 0.10 -0.76 -2.57 0.00 0.00 177.10 173.51 2wad s LEU 111 N 1.05 3.78 0.71 0.60 1.43 -1.26 -5.09 118.68 119.90 2wad s LEU 111 Ca 0.09 -0.02 -0.12 0.00 -1.03 0.00 0.00 54.13 53.05 2wad s LEU 111 Cb -0.23 -2.00 0.03 0.00 0.03 0.00 0.00 46.19 44.02 2wad s LEU 111 CO -0.04 0.06 1.08 0.42 0.23 0.00 0.00 176.35 178.10 2wad s THR 112 N 1.08 3.52 0.27 5.49 -4.23 -1.26 -4.90 115.64 115.60 2wad s THR 112 Ca 0.05 0.56 0.32 0.00 -1.18 0.00 0.00 61.69 61.43 2wad s THR 112 Cb -0.14 -3.11 0.34 0.00 1.34 0.00 0.00 72.50 70.93 2wad s THR 112 CO 0.04 -0.58 2.03 -0.33 -0.54 0.00 0.00 174.62 175.23 2wad h GLU 113 N -0.65 0.00 -0.11 3.99 3.07 -2.00 -2.22 114.58 116.66 2wad h GLU 113 Ca -0.45 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.39 2wad h GLU 113 Cb 1.23 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.14 2wad h GLU 113 CO 0.54 0.08 -0.04 -0.09 -1.40 0.00 0.00 179.01 178.10 2wad h ARG 114 N 0.00 0.22 -0.48 2.33 9.65 -1.95 -2.96 114.38 121.18 2wad h ARG 114 Ca -0.00 -0.09 -0.05 0.00 -1.10 0.00 0.00 59.98 58.74 2wad h ARG 114 Cb 0.45 -0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.99 2wad h ARG 114 CO 0.01 0.55 0.10 1.96 2.80 0.00 0.00 179.97 185.38 2wad h GLN 115 N -0.12 0.73 -0.58 0.20 4.20 -1.78 -0.37 115.11 117.38 2wad h GLN 115 Ca 0.03 -0.15 -0.09 0.00 0.06 0.00 0.00 58.65 58.50 2wad h GLN 115 Cb 0.48 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.13 2wad h GLN 115 CO 0.01 0.68 -0.00 -0.07 -0.67 0.00 0.00 178.83 178.78 2wad h LEU 116 N 0.70 1.00 -0.20 1.46 3.38 -1.57 -2.33 115.31 117.75 2wad h LEU 116 Ca 0.16 -0.28 -0.20 0.00 0.09 0.00 0.00 57.88 57.65 2wad h LEU 116 Cb 0.29 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2wad h LEU 116 CO 0.00 1.05 -0.93 0.00 0.09 0.00 0.00 178.44 178.65 2wad h ALA 117 N 1.05 0.47 -0.15 1.53 0.00 -1.27 -1.42 119.26 119.48 2wad h ALA 117 Ca 0.17 -0.79 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 2wad h ALA 117 Cb 0.55 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2wad h ALA 117 CO 0.03 1.03 0.05 -0.44 0.00 0.00 0.00 179.25 179.92 2wad h ASP 118 N 0.05 0.21 -0.51 0.00 3.32 -1.10 -2.05 116.42 116.35 2wad h ASP 118 Ca -0.04 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 56.81 2wad h ASP 118 Cb 1.60 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 41.07 2wad h ASP 118 CO 0.13 0.35 0.29 0.22 -1.72 0.00 0.00 179.24 178.52 2wad h TYR 119 N 0.06 0.68 -0.80 4.55 3.20 -1.39 -2.36 116.97 120.92 2wad h TYR 119 Ca 0.05 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 2wad h TYR 119 Cb 0.21 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.23 2wad h TYR 119 CO -0.00 0.49 0.34 -0.92 -1.64 0.00 0.00 178.16 176.42 2wad h TYR 120 N 0.68 1.20 0.00 -3.82 3.20 -1.24 -2.81 116.97 114.18 2wad h TYR 120 Ca 0.18 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.97 2wad h TYR 120 Cb 0.02 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 37.92 2wad h TYR 120 CO -0.02 0.89 0.00 1.28 -1.64 0.00 0.00 178.16 178.67 2wad n LEU 121 N -4.28 0.00 0.29 2.82 4.77 -0.77 -3.78 117.00 116.04 2wad n LEU 121 Ca 0.07 0.48 0.16 0.00 -0.03 0.00 0.00 56.01 56.69 2wad n LEU 121 Cb 0.17 -0.48 0.88 0.00 -2.33 0.00 0.00 43.42 41.67 2wad n LEU 121 CO 0.40 -0.00 1.06 0.00 -1.33 0.00 0.00 177.39 177.52 2wad h ALA 122 N 3.04 1.23 -1.84 -1.18 0.00 -1.14 -3.36 119.26 116.00 2wad h ALA 122 Ca 0.00 -0.05 -0.57 0.00 0.00 0.00 0.00 54.91 54.29 2wad h ALA 122 Cb 0.47 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.20 2wad h ALA 122 CO 0.00 0.07 0.96 0.34 0.00 0.00 0.00 179.25 180.61 2wad s ASP 123 N -5.86 6.63 0.36 0.00 -1.08 -1.25 -4.47 116.67 111.01 2wad s ASP 123 Ca -0.03 0.86 0.06 0.00 -0.52 0.00 0.00 52.55 52.91 2wad s ASP 123 Cb 0.13 -2.54 0.70 0.00 -1.46 0.00 0.00 42.92 39.74 2wad s ASP 123 CO 0.53 -1.18 1.94 1.55 0.52 0.00 0.00 175.17 178.53 2wad h PRO 124 N 9.37 0.51 -0.26 4.34 0.13 -1.94 0.22 132.00 144.37 2wad h PRO 124 Ca -0.24 -0.08 -0.03 0.00 -0.87 0.00 0.00 66.00 64.78 2wad h PRO 124 Cb 1.08 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 2wad h PRO 124 CO 1.08 0.48 0.05 1.49 -0.23 0.00 0.00 178.00 180.86 2wad h GLU 125 N 0.50 0.37 0.02 0.86 4.81 -1.91 -2.10 114.58 117.14 2wad h GLU 125 Ca 0.12 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.25 2wad h GLU 125 Cb 0.21 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.53 2wad h GLU 125 CO -0.00 0.36 -0.20 0.82 -0.73 0.00 0.00 179.01 179.26 2wad h ILE 126 N 0.37 1.67 -0.52 2.32 1.08 -1.35 -3.01 117.51 118.07 2wad h ILE 126 Ca 0.09 -2.22 0.08 0.00 -0.39 0.00 0.00 64.86 62.41 2wad h ILE 126 Cb 0.17 3.16 -0.06 0.00 -3.07 0.00 0.00 36.82 37.01 2wad h ILE 126 CO -0.00 0.59 0.17 0.22 -0.69 0.00 0.00 178.15 178.44 2wad h TYR 127 N -0.75 0.30 0.15 1.37 3.20 -1.05 -0.48 116.97 119.71 2wad h TYR 127 Ca -0.03 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.88 2wad h TYR 127 Cb 1.08 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 39.26 2wad h TYR 127 CO 0.23 0.08 -0.33 -0.22 -1.64 0.00 0.00 178.16 176.28 2wad h LYS 128 N 0.34 -0.55 0.00 1.82 3.64 -1.52 -2.94 116.57 117.36 2wad h LYS 128 Ca 0.26 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 2wad h LYS 128 Cb 0.30 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 2wad h LYS 128 CO -0.28 -0.37 0.00 -0.22 -2.27 0.00 0.00 179.45 176.32 2wad h LYS 129 N -0.57 0.00 0.00 1.90 3.64 -1.08 -0.79 116.57 119.67 2wad h LYS 129 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2wad h LYS 129 Cb 0.59 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 2wad h LYS 129 CO -0.18 0.00 -1.05 0.25 -2.27 0.00 0.00 179.45 176.21 2wad n THR 130 N -2.75 0.15 0.71 1.00 -2.24 -0.31 -3.20 114.28 107.64 2wad n THR 130 Ca -0.01 -0.23 0.11 0.00 -2.27 0.00 0.00 64.05 61.64 2wad n THR 130 Cb 0.11 0.25 -0.07 0.00 -2.10 0.00 0.00 70.33 68.52 2wad n THR 130 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2wad n VAL 131 N -1.94 0.04 0.40 2.28 3.14 -0.76 -3.77 118.33 117.72 2wad n VAL 131 Ca 0.02 -0.15 0.12 0.00 -2.96 0.00 0.00 64.34 61.37 2wad n VAL 131 Cb 0.43 0.58 0.26 0.00 -1.06 0.00 0.00 33.84 34.05 2wad n VAL 131 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 2wad h GLU 132 N 0.00 0.00 -0.02 1.45 4.39 -1.24 -3.30 114.58 115.86 2wad h GLU 132 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2wad h GLU 132 Cb 0.65 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.30 2wad h GLU 132 CO 0.00 0.00 -0.24 0.00 -1.16 0.00 0.00 179.01 177.61 2wad n ALA 133 N -1.96 2.98 -1.16 3.43 0.00 -1.19 -4.99 120.51 117.63 2wad n ALA 133 Ca 0.04 -0.59 -0.29 0.00 0.00 0.00 0.00 53.44 52.60 2wad n ALA 133 Cb 0.48 -0.61 0.16 0.00 0.00 0.00 0.00 19.45 19.48 2wad n ALA 133 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2wad s LEU 134 N -1.92 1.99 0.45 0.00 1.43 -1.25 -5.07 118.68 114.31 2wad s LEU 134 Ca 0.17 1.40 -0.02 0.00 -1.03 0.00 0.00 54.13 54.65 2wad s LEU 134 Cb 0.14 -3.72 -0.02 0.00 0.03 0.00 0.00 46.19 42.63 2wad s LEU 134 CO 0.37 -2.88 0.69 -2.16 0.23 0.00 0.00 176.35 172.60 2wad s PRO 135 N -4.92 3.24 -0.18 1.29 0.04 -1.26 -5.06 135.00 128.15 2wad s PRO 135 Ca 0.64 -0.25 -0.17 0.00 0.04 0.00 0.00 61.00 61.26 2wad s PRO 135 Cb -0.19 -2.51 -0.07 0.00 0.04 0.00 0.00 34.50 31.77 2wad s PRO 135 CO 0.57 -0.21 0.65 0.43 0.04 0.00 0.00 177.00 178.48 2wad n SER 136 N -2.11 0.38 -1.30 6.66 7.64 -1.26 -5.17 113.62 118.47 2wad n SER 136 Ca 0.00 0.37 0.00 0.00 1.01 0.00 0.00 58.87 60.25 2wad n SER 136 Cb 0.57 -0.32 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 2wad n SER 136 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2wad n GLU 149 N 1.87 0.91 -0.00 1.43 2.13 -1.26 -5.29 120.64 120.43 2wad n GLU 149 Ca 0.14 0.00 0.07 0.00 0.66 0.00 0.00 57.16 58.03 2wad n GLU 149 Cb -0.02 0.00 -0.13 0.00 0.27 0.00 0.00 31.44 31.56 2wad n GLU 149 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2wad n SER 150 N 0.00 0.21 0.04 4.31 7.64 -1.26 -2.28 113.62 122.29 2wad n SER 150 Ca 0.00 0.09 0.11 0.00 1.01 0.00 0.00 58.87 60.08 2wad n SER 150 Cb 0.00 1.42 -0.07 0.00 -1.01 0.00 0.00 64.21 64.55 2wad n SER 150 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2wad n GLU 151 N -2.47 0.56 0.09 1.43 2.13 -1.26 -3.90 120.64 117.23 2wad n GLU 151 Ca -0.09 -0.03 0.12 0.00 0.66 0.00 0.00 57.16 57.83 2wad n GLU 151 Cb 0.69 -1.66 0.26 0.00 0.27 0.00 0.00 31.44 31.00 2wad n GLU 151 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 2wad h LEU 152 N 0.00 0.00 0.15 4.31 4.07 -2.00 -2.91 115.31 118.92 2wad h LEU 152 Ca 0.00 -0.10 -0.30 0.00 0.08 0.00 0.00 57.88 57.56 2wad h LEU 152 Cb 0.95 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.69 2wad h LEU 152 CO 0.00 0.05 -1.43 1.88 -1.08 0.00 0.00 178.44 177.86 2wad h TYR 153 N 0.00 0.56 -0.38 1.13 0.05 -1.60 -3.17 116.97 113.57 2wad h TYR 153 Ca 0.00 -0.41 -0.10 0.00 0.05 0.00 0.00 58.73 58.27 2wad h TYR 153 Cb 0.77 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.48 2wad h TYR 153 CO 0.00 1.39 -0.17 -0.97 -1.05 0.00 0.00 178.16 177.36 2wad h ASN 154 N 0.08 0.70 0.32 3.88 -1.24 -1.67 -2.27 115.58 115.38 2wad h ASN 154 Ca -0.21 -0.22 -0.14 0.00 0.71 0.00 0.00 56.30 56.44 2wad h ASN 154 Cb 2.03 -0.19 -0.01 0.00 0.73 0.00 0.00 38.32 40.88 2wad h ASN 154 CO 0.20 0.88 -0.57 0.78 -1.29 0.00 0.00 177.43 177.42 2wad h ASN 155 N 0.63 0.28 0.20 1.15 4.21 -1.65 -2.52 115.58 117.89 2wad h ASN 155 Ca 0.10 -0.15 -0.01 0.00 1.21 0.00 0.00 56.30 57.45 2wad h ASN 155 Cb 0.64 -0.08 0.00 0.00 -1.12 0.00 0.00 38.32 37.76 2wad h ASN 155 CO 0.04 0.79 -0.10 0.00 -1.29 0.00 0.00 177.43 176.88 2wad h ALA 156 N 1.21 -0.27 0.00 -0.83 0.00 -1.49 -3.21 119.26 114.67 2wad h ALA 156 Ca -0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2wad h ALA 156 Cb 1.06 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 2wad h ALA 156 CO 0.09 -0.45 -0.00 -0.39 0.00 0.00 0.00 179.25 178.50 2wad h VAL 157 N -0.67 0.00 -0.10 0.00 -1.51 -1.50 -2.96 116.25 109.51 2wad h VAL 157 Ca -0.03 -0.48 -0.11 0.00 -1.23 0.00 0.00 66.70 64.84 2wad h VAL 157 Cb 0.48 1.48 -0.01 0.00 -2.13 0.00 0.00 31.29 31.11 2wad h VAL 157 CO 0.05 0.00 -0.45 -0.78 -1.23 0.00 0.00 177.57 175.16 2wad h ASP 158 N 0.00 0.25 -0.04 4.19 1.82 -1.45 -2.71 116.42 118.47 2wad h ASP 158 Ca -0.00 -0.11 0.00 0.00 -0.39 0.00 0.00 57.03 56.53 2wad h ASP 158 Cb 0.48 -0.07 0.00 0.00 0.68 0.00 0.00 39.33 40.42 2wad h ASP 158 CO 0.00 0.67 0.00 -1.20 -1.61 0.00 0.00 179.24 177.10 2wad n SER 159 N -3.99 1.71 0.00 2.28 7.64 -1.12 -4.12 113.62 116.01 2wad n SER 159 Ca -0.02 -1.59 0.10 0.00 1.01 0.00 0.00 58.87 58.38 2wad n SER 159 Cb 0.51 -0.02 -0.10 0.00 -1.01 0.00 0.00 64.21 63.59 2wad n SER 159 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 2wad n VAL 160 N 0.33 0.02 -2.38 0.44 3.14 -1.02 -4.94 118.33 113.92 2wad n VAL 160 Ca 0.18 -0.14 -0.32 0.00 -2.96 0.00 0.00 64.34 61.10 2wad n VAL 160 Cb 0.38 0.64 -0.03 0.00 -1.06 0.00 0.00 33.84 33.77 2wad n VAL 160 CO 0.00 0.00 0.00 -2.84 -6.46 0.00 0.00 176.83 167.53 2wad s PRO 161 N -3.14 3.90 -0.20 1.45 0.02 -1.24 -5.03 135.00 130.77 2wad s PRO 161 Ca 0.04 0.98 -0.13 0.00 0.02 0.00 0.00 61.00 61.91 2wad s PRO 161 Cb 0.15 -2.13 -0.05 0.00 0.02 0.00 0.00 34.50 32.50 2wad s PRO 161 CO 0.86 -0.31 0.27 0.95 -0.33 0.00 0.00 177.00 178.44 2wad s THR 162 N -2.60 5.30 0.00 0.99 -4.23 -1.26 -4.96 115.64 108.88 2wad s THR 162 Ca 0.59 0.46 -0.01 0.00 -1.18 0.00 0.00 61.69 61.55 2wad s THR 162 Cb -0.10 -3.61 -0.04 0.00 1.34 0.00 0.00 72.50 70.09 2wad s THR 162 CO 0.31 0.35 1.57 -1.20 -0.54 0.00 0.00 174.62 175.11 2wad n SER 163 N 3.99 3.35 -0.84 3.99 7.64 -1.26 -3.59 113.62 126.90 2wad n SER 163 Ca -0.12 -1.95 0.04 0.00 1.01 0.00 0.00 58.87 57.86 2wad n SER 163 Cb 0.52 -0.76 0.22 0.00 -1.01 0.00 0.00 64.21 63.18 2wad n SER 163 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wad n GLN 164 N 1.94 2.22 -1.48 1.43 3.00 -1.26 -5.06 117.38 118.16 2wad n GLN 164 Ca 0.07 -2.94 -0.36 0.00 -0.01 0.00 0.00 57.00 53.76 2wad n GLN 164 Cb 0.38 -1.77 0.09 0.00 0.00 0.00 0.00 30.24 28.95 2wad n GLN 164 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2wad n LEU 165 N -0.91 5.40 -4.35 1.08 4.77 -1.24 -4.98 117.00 116.78 2wad n LEU 165 Ca 0.24 0.73 -0.43 0.00 -0.03 0.00 0.00 56.01 56.53 2wad n LEU 165 Cb 0.89 -1.54 -0.08 0.00 -2.33 0.00 0.00 43.42 40.36 2wad n LEU 165 CO 0.13 -1.28 -0.01 0.21 -1.33 0.00 0.00 177.39 175.12 2wad s ASN 166 N -1.67 5.99 -0.18 -1.43 2.47 -1.26 -5.04 114.94 113.82 2wad s ASN 166 Ca 0.79 -1.40 0.00 0.00 0.42 0.00 0.00 52.86 52.67 2wad s ASN 166 Cb -0.35 -2.12 0.04 0.00 -1.45 0.00 0.00 41.25 37.37 2wad s ASN 166 CO 0.44 -0.62 -0.08 -0.31 -3.72 0.00 0.00 177.10 172.81 2wad s TYR 167 N 1.57 2.06 0.97 0.43 2.02 -1.26 -5.12 117.35 118.03 2wad s TYR 167 Ca 0.04 -1.34 -0.15 0.00 -0.37 0.00 0.00 57.07 55.25 2wad s TYR 167 Cb -0.24 -1.48 -0.04 0.00 -0.40 0.00 0.00 41.96 39.79 2wad s TYR 167 CO 0.05 -0.68 -0.14 0.25 -1.57 0.00 0.00 175.55 173.46 2wad n THR 168 N 4.78 0.00 0.20 -0.71 -2.24 -1.26 -4.64 114.28 110.40 2wad n THR 168 Ca -0.13 -0.32 0.08 0.00 -2.27 0.00 0.00 64.05 61.40 2wad n THR 168 Cb 0.47 -0.35 0.31 0.00 -2.10 0.00 0.00 70.33 68.66 2wad n THR 168 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2wad h GLU 169 N -1.33 0.00 -0.31 -0.78 4.39 -2.00 -1.21 114.58 113.35 2wad h GLU 169 Ca -0.44 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.19 2wad h GLU 169 Cb 1.29 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.93 2wad h GLU 169 CO 0.29 0.30 -0.11 -0.44 -1.16 0.00 0.00 179.01 177.89 2wad h ASP 170 N 0.00 0.51 0.61 1.42 3.32 -2.01 -3.25 116.42 117.02 2wad h ASP 170 Ca -0.00 -0.13 -0.28 0.00 0.02 0.00 0.00 57.03 56.64 2wad h ASP 170 Cb 0.95 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.36 2wad h ASP 170 CO 0.04 0.66 -1.34 -0.08 -1.72 0.00 0.00 179.24 176.79 2wad h GLU 171 N 0.49 0.21 0.00 3.56 4.81 -1.70 -2.93 114.58 119.01 2wad h GLU 171 Ca 0.09 -0.36 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 2wad h GLU 171 Cb 0.49 0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.00 2wad h GLU 171 CO 0.03 1.11 0.00 1.63 -0.73 0.00 0.00 179.01 181.05 2wad n LYS 172 N -3.45 0.06 -0.01 1.92 5.02 -0.52 -2.36 118.16 118.82 2wad n LYS 172 Ca -0.11 0.29 -0.22 0.00 -2.02 0.00 0.00 58.31 56.25 2wad n LYS 172 Cb 1.02 -1.50 -0.14 0.00 -0.02 0.00 0.00 35.03 34.39 2wad n LYS 172 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2wad h LYS 173 N 0.00 0.23 0.00 1.97 1.57 -1.55 -3.06 116.57 115.73 2wad h LYS 173 Ca 0.00 -0.39 -0.08 0.00 -1.87 0.00 0.00 60.65 58.30 2wad h LYS 173 Cb 0.10 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 2wad h LYS 173 CO 0.00 1.19 -0.40 1.05 -0.57 0.00 0.00 179.45 180.72 2wad h GLU 174 N -0.11 0.00 -0.27 3.15 4.11 -1.55 -2.76 114.58 117.16 2wad h GLU 174 Ca -0.41 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 58.96 2wad h GLU 174 Cb 1.92 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.16 2wad h GLU 174 CO 0.04 0.40 -0.09 0.82 0.07 0.00 0.00 179.01 180.25 2wad h ILE 175 N 0.00 1.29 0.28 -1.06 2.04 -1.60 -0.27 117.51 118.19 2wad h ILE 175 Ca -0.00 -1.14 0.00 0.00 1.00 0.00 0.00 64.86 64.72 2wad h ILE 175 Cb 0.92 1.47 -0.02 0.00 -0.74 0.00 0.00 36.82 38.45 2wad h ILE 175 CO 0.05 0.36 -0.29 0.22 0.00 0.00 0.00 178.15 178.49 2wad h TYR 176 N 0.28 -0.78 -0.49 1.37 3.20 -1.51 -1.26 116.97 117.78 2wad h TYR 176 Ca 0.07 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.01 2wad h TYR 176 Cb 0.58 0.31 -0.06 0.00 1.54 0.00 0.00 36.73 39.10 2wad h TYR 176 CO 0.06 -0.42 0.15 -0.07 -1.64 0.00 0.00 178.16 176.24 2wad h LEU 177 N -0.61 0.12 -1.27 2.82 3.38 -1.49 -1.47 115.31 116.79 2wad h LEU 177 Ca -0.01 0.07 0.16 0.00 0.09 0.00 0.00 57.88 58.19 2wad h LEU 177 Cb 0.56 0.07 -0.08 0.00 0.09 0.00 0.00 40.66 41.31 2wad h LEU 177 CO -0.07 0.09 0.59 0.15 0.09 0.00 0.00 178.44 179.30 2wad h PHE 178 N 0.31 0.83 -0.93 1.13 3.57 -0.81 -0.37 116.94 120.67 2wad h PHE 178 Ca 0.24 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.77 2wad h PHE 178 Cb 0.28 -0.26 -0.05 0.00 2.79 0.00 0.00 35.95 38.72 2wad h PHE 178 CO -0.18 0.28 0.59 0.77 -2.23 0.00 0.00 178.31 177.53 2wad h SER 179 N 0.68 1.10 -0.11 0.41 0.02 -0.14 -1.83 113.55 113.68 2wad h SER 179 Ca 0.47 -0.05 -0.11 0.00 -0.84 0.00 0.00 61.79 61.26 2wad h SER 179 Cb 0.80 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 2wad h SER 179 CO -0.23 0.82 -0.30 1.56 -1.14 0.00 0.00 176.83 177.55 2wad h GLN 180 N 1.28 0.59 -0.06 3.45 1.08 -0.82 -1.44 115.11 119.19 2wad h GLN 180 Ca 0.34 -0.25 -0.16 0.00 -1.45 0.00 0.00 58.65 57.12 2wad h GLN 180 Cb -0.09 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.31 2wad h GLN 180 CO -0.07 0.82 -0.68 -0.07 -0.95 0.00 0.00 178.83 177.89 2wad h LEU 181 N 0.51 0.30 -0.29 1.46 3.38 -1.28 -3.12 115.31 116.26 2wad h LEU 181 Ca 0.06 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2wad h LEU 181 Cb 0.78 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.44 2wad h LEU 181 CO 0.06 0.89 0.00 -1.13 0.09 0.00 0.00 178.44 178.35 2wad h ASN 182 N 0.18 0.00 0.71 -0.43 -1.24 -1.01 -3.17 115.58 110.62 2wad h ASN 182 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.99 2wad h ASN 182 Cb 1.22 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.27 2wad h ASN 182 CO 0.11 0.00 -0.37 0.00 -1.29 0.00 0.00 177.43 175.88 2wad n ALA 183 N -2.03 3.11 -2.58 1.57 0.00 -0.57 -4.73 120.51 115.27 2wad n ALA 183 Ca 0.04 -0.26 -0.42 0.00 0.00 0.00 0.00 53.44 52.80 2wad n ALA 183 Cb 0.46 -1.23 -0.06 0.00 0.00 0.00 0.00 19.45 18.62 2wad n ALA 183 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2wad s VAL 184 N -3.02 4.82 1.04 0.00 1.01 -1.20 -5.05 120.40 117.99 2wad s VAL 184 Ca 0.11 0.74 -0.12 0.00 0.00 0.00 0.00 61.98 62.71 2wad s VAL 184 Cb 0.17 -4.14 0.21 0.00 0.00 0.00 0.00 36.38 32.63 2wad s VAL 184 CO 0.65 -0.37 1.07 -0.83 0.00 0.00 0.00 175.10 175.63 2wad s GLY 185 N 1.81 1.57 0.39 4.51 0.00 -1.26 -4.77 107.32 109.57 2wad s GLY 185 Ca 0.28 -0.22 -0.25 0.00 0.00 0.00 0.00 44.72 44.52 2wad s GLY 185 CO 0.16 0.41 1.04 0.70 0.00 0.00 0.00 173.10 175.40 2wad n ASN 186 N -4.40 1.42 0.00 1.64 4.13 -1.26 -1.58 115.26 115.21 2wad n ASN 186 Ca 0.05 1.07 0.00 0.00 1.68 0.00 0.00 54.58 57.38 2wad n ASN 186 Cb 0.56 -1.36 0.00 0.00 -1.54 0.00 0.00 39.78 37.44 2wad n ASN 186 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2wad n PHE 187 N -0.31 0.00 -2.18 3.10 3.01 -1.24 -4.92 117.46 114.93 2wad n PHE 187 Ca 0.09 0.00 -0.34 0.00 1.01 0.00 0.00 57.45 58.21 2wad n PHE 187 Cb 0.38 -1.20 0.00 0.00 -0.01 0.00 0.00 39.48 38.65 2wad n PHE 187 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2wad s ALA 188 N -0.82 2.72 -0.25 4.37 0.00 -0.62 -4.86 121.76 122.30 2wad s ALA 188 Ca 0.00 0.58 -0.04 0.00 0.00 0.00 0.00 51.96 52.50 2wad s ALA 188 Cb 0.00 -3.28 0.01 0.00 0.00 0.00 0.00 23.12 19.85 2wad s ALA 188 CO 0.00 -0.75 -0.02 0.99 0.00 0.00 0.00 175.76 175.98 2wad s THR 189 N -2.15 3.29 0.09 0.00 2.01 -1.26 -2.52 115.64 115.09 2wad s THR 189 Ca 0.67 -0.81 0.09 0.00 0.31 0.00 0.00 61.69 61.96 2wad s THR 189 Cb -0.19 -2.63 -0.04 0.00 0.01 0.00 0.00 72.50 69.65 2wad s THR 189 CO 0.31 0.22 -0.23 -0.83 -0.69 0.00 0.00 174.62 173.40 2wad s GLY 190 N 1.41 1.57 -0.38 4.40 0.00 0.34 -4.94 107.32 109.73 2wad s GLY 190 Ca 0.02 -1.33 -0.25 0.00 0.00 0.00 0.00 44.72 43.16 2wad s GLY 190 CO -0.02 -1.27 0.89 -1.59 0.00 0.00 0.00 173.10 171.10 2wad s THR 191 N -0.99 4.61 -0.30 0.90 2.01 -1.26 0.23 115.64 120.84 2wad s THR 191 Ca 0.15 1.06 -0.29 0.00 0.31 0.00 0.00 61.69 62.92 2wad s THR 191 Cb -0.10 -4.31 0.01 0.00 0.01 0.00 0.00 72.50 68.11 2wad s THR 191 CO 0.06 -0.54 1.09 -0.63 -0.69 0.00 0.00 174.62 173.92 2wad s ILE 192 N 3.40 4.50 0.03 1.82 -1.09 -0.09 -4.97 121.20 124.79 2wad s ILE 192 Ca 0.36 1.74 -0.27 0.00 -2.23 0.00 0.00 60.65 60.25 2wad s ILE 192 Cb -0.12 -4.37 -0.05 0.00 -1.58 0.00 0.00 42.46 36.35 2wad s ILE 192 CO 0.19 -0.42 0.85 0.00 -1.23 0.00 0.00 174.94 174.33 2wad s ALA 193 N 3.64 3.28 0.15 9.38 0.00 -1.26 -4.26 121.76 132.69 2wad s ALA 193 Ca 0.46 0.39 0.03 0.00 0.00 0.00 0.00 51.96 52.85 2wad s ALA 193 Cb -0.13 -3.14 -0.01 0.00 0.00 0.00 0.00 23.12 19.84 2wad s ALA 193 CO 0.15 -0.05 0.11 -2.37 0.00 0.00 0.00 175.76 173.60 2wad n THR 194 N 3.19 0.00 -2.81 0.00 5.66 -1.26 -5.06 114.28 114.00 2wad n THR 194 Ca 0.01 -1.03 -0.41 0.00 -3.05 0.00 0.00 64.05 59.56 2wad n THR 194 Cb 0.50 0.50 -0.04 0.00 -1.55 0.00 0.00 70.33 69.74 2wad n THR 194 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2wad s ASP 195 N -2.00 7.28 0.57 1.09 1.01 -1.09 -4.98 116.67 118.54 2wad s ASP 195 Ca 0.16 1.54 -0.10 0.00 0.71 0.00 0.00 52.55 54.86 2wad s ASP 195 Cb 0.01 -2.53 -0.09 0.00 1.01 0.00 0.00 42.92 41.32 2wad s ASP 195 CO 0.11 -0.19 -0.45 -2.65 0.21 0.00 0.00 175.17 172.20 2wad n PRO 196 N 3.73 0.00 -3.95 8.23 -0.02 -1.26 -4.75 135.00 136.97 2wad n PRO 196 Ca 0.03 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.21 2wad n PRO 196 Cb 0.51 -0.59 -0.15 0.00 -0.02 0.00 0.00 33.50 33.25 2wad n PRO 196 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2wad s LEU 197 N 4.59 4.20 0.34 2.45 1.43 -1.26 -4.97 118.68 125.46 2wad s LEU 197 Ca 0.24 -2.12 -0.26 0.00 -1.03 0.00 0.00 54.13 50.96 2wad s LEU 197 Cb -0.12 -1.47 -0.13 0.00 0.03 0.00 0.00 46.19 44.50 2wad s LEU 197 CO 0.48 -0.38 0.89 -0.46 0.23 0.00 0.00 176.35 177.12 2wad n ASN 198 N 4.28 0.72 0.00 2.29 0.23 -1.26 -4.45 115.26 117.06 2wad n ASN 198 Ca 0.03 1.09 0.00 0.00 -0.53 0.00 0.00 54.58 55.17 2wad n ASN 198 Cb 0.41 -1.25 0.00 0.00 -2.08 0.00 0.00 39.78 36.86 2wad n ASN 198 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2wad n ASP 199 N 1.09 0.00 -0.11 0.53 10.43 -1.26 -0.27 116.55 126.96 2wad n ASP 199 Ca 0.10 0.00 -0.22 0.00 2.57 0.00 0.00 54.79 57.24 2wad n ASP 199 Cb 0.35 0.00 -0.12 0.00 1.84 0.00 0.00 41.12 43.19 2wad n ASP 199 CO 0.00 0.00 0.00 -0.24 -1.07 0.00 0.00 177.20 175.89 2wad n SER 200 N -0.94 1.98 0.27 -2.24 2.88 -1.26 -3.65 113.62 110.66 2wad n SER 200 Ca 0.00 0.09 0.16 0.00 -1.33 0.00 0.00 58.87 57.80 2wad n SER 200 Cb 0.00 -0.63 0.91 0.00 -0.75 0.00 0.00 64.21 63.74 2wad n SER 200 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 2wad h GLN 201 N -0.38 0.00 -0.02 -1.46 4.15 -0.94 0.52 115.11 116.99 2wad h GLN 201 Ca -0.59 0.00 -0.20 0.00 0.77 0.00 0.00 58.65 58.63 2wad h GLN 201 Cb 1.79 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 29.47 2wad h GLN 201 CO -0.18 0.00 -0.85 0.28 -1.93 0.00 0.00 178.83 176.15 2wad h VAL 202 N 0.00 1.42 0.00 2.39 2.07 -1.53 -3.31 116.25 117.29 2wad h VAL 202 Ca 0.03 -2.39 0.00 0.00 0.82 0.00 0.00 66.70 65.16 2wad h VAL 202 Cb 0.18 2.32 0.00 0.00 -1.52 0.00 0.00 31.29 32.27 2wad h VAL 202 CO -0.00 0.71 -0.19 0.00 0.02 0.00 0.00 177.57 178.11 2wad n ALA 203 N -2.51 2.52 0.03 1.67 0.00 0.13 -2.39 120.51 119.96 2wad n ALA 203 Ca -0.05 -0.11 -0.09 0.00 0.00 0.00 0.00 53.44 53.19 2wad n ALA 203 Cb 0.78 -1.37 -0.07 0.00 0.00 0.00 0.00 19.45 18.79 2wad n ALA 203 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wad h VAL 204 N 0.00 0.75 -0.75 0.00 2.07 -1.56 -3.09 116.25 113.68 2wad h VAL 204 Ca 0.00 -1.23 0.14 0.00 0.82 0.00 0.00 66.70 66.43 2wad h VAL 204 Cb 0.70 1.32 -0.09 0.00 -1.52 0.00 0.00 31.29 31.70 2wad h VAL 204 CO 0.00 0.22 0.30 0.40 0.02 0.00 0.00 177.57 178.51 2wad h ILE 205 N -0.93 0.67 -0.45 4.57 2.04 -1.63 0.13 117.51 121.91 2wad h ILE 205 Ca -0.02 -0.15 0.06 0.00 1.00 0.00 0.00 64.86 65.75 2wad h ILE 205 Cb 0.49 0.18 -0.05 0.00 -0.74 0.00 0.00 36.82 36.70 2wad h ILE 205 CO 0.03 0.08 0.14 0.00 0.00 0.00 0.00 178.15 178.41 2wad h ALA 206 N 1.54 0.53 0.00 1.87 0.00 -1.62 -0.18 119.26 121.40 2wad h ALA 206 Ca 0.41 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.34 2wad h ALA 206 Cb 0.60 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2wad h ALA 206 CO -0.39 -0.25 -0.20 0.66 0.00 0.00 0.00 179.25 179.07 2wad h SER 207 N 0.31 0.00 0.00 0.00 4.64 -0.90 -3.14 113.55 114.45 2wad h SER 207 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2wad h SER 207 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2wad h SER 207 CO -0.23 0.20 -0.00 2.30 -0.87 0.00 0.00 176.83 178.23 2wad n ILE 208 N -3.93 1.01 0.32 0.95 -6.64 -0.83 -4.71 119.36 105.53 2wad n ILE 208 Ca -0.02 -1.05 0.21 0.00 -1.77 0.00 0.00 62.75 60.12 2wad n ILE 208 Cb 0.29 0.46 1.08 0.00 -1.44 0.00 0.00 39.64 40.03 2wad n ILE 208 CO 0.00 0.00 0.00 0.77 -1.77 0.00 0.00 176.55 175.55 2wad h SER 209 N 0.00 0.00 -0.63 7.28 4.64 -0.97 -1.33 113.55 122.54 2wad h SER 209 Ca 0.00 0.00 0.18 0.00 -0.47 0.00 0.00 61.79 61.50 2wad h SER 209 Cb 0.59 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.65 2wad h SER 209 CO 0.00 0.01 0.55 0.11 -0.87 0.00 0.00 176.83 176.63 2wad h LYS 210 N 0.00 0.00 -0.01 4.77 1.57 -1.84 -1.98 116.57 119.09 2wad h LYS 210 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wad h LYS 210 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.41 2wad h LYS 210 CO 0.00 0.00 -0.06 0.39 -0.57 0.00 0.00 179.45 179.21 2wad n GLU 211 N -3.96 1.07 -2.68 3.15 1.02 -0.50 -3.93 120.64 114.82 2wad n GLU 211 Ca 0.12 -0.43 -0.16 0.00 -0.02 0.00 0.00 57.16 56.68 2wad n GLU 211 Cb 0.79 -1.49 0.01 0.00 -0.02 0.00 0.00 31.44 30.73 2wad n GLU 211 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 2wad n MET 212 N -0.59 1.84 -1.65 3.49 2.81 -0.74 -5.09 117.12 117.18 2wad n MET 212 Ca 0.18 -3.68 -0.63 0.00 -1.81 0.00 0.00 57.70 51.76 2wad n MET 212 Cb 0.27 -1.60 -0.09 0.00 -0.71 0.00 0.00 33.22 31.09 2wad n MET 212 CO 0.00 0.00 0.00 -2.30 1.51 0.00 0.00 175.97 175.18 2wad n PRO 213 N -0.15 0.18 0.00 0.03 -0.02 -1.25 -0.92 135.00 132.87 2wad n PRO 213 Ca 0.20 0.07 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 2wad n PRO 213 Cb 0.74 -1.59 0.00 0.00 -0.02 0.00 0.00 33.50 32.63 2wad n PRO 213 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wad n GLY 214 N 3.11 1.98 3.88 -1.23 0.00 -1.26 -5.02 105.19 106.65 2wad n GLY 214 Ca 0.26 -0.52 -0.35 0.00 0.00 0.00 0.00 46.02 45.41 2wad n GLY 214 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wad s ILE 215 N -0.41 5.30 0.01 -0.61 -1.09 -0.10 -1.38 121.20 122.92 2wad s ILE 215 Ca 0.00 0.23 -0.29 0.00 -2.23 0.00 0.00 60.65 58.36 2wad s ILE 215 Cb 0.00 -3.56 0.10 0.00 -1.58 0.00 0.00 42.46 37.42 2wad s ILE 215 CO 0.00 0.40 0.95 -0.94 -1.23 0.00 0.00 174.94 174.12 2wad s SER 216 N -1.59 -0.29 -0.07 3.58 1.04 -0.53 -4.80 113.70 111.04 2wad s SER 216 Ca 0.26 -0.10 -0.19 0.00 0.48 0.00 0.00 55.95 56.40 2wad s SER 216 Cb -0.13 0.38 -0.05 0.00 0.10 0.00 0.00 66.02 66.32 2wad s SER 216 CO 0.15 -0.64 0.53 -0.63 0.98 0.00 0.00 173.24 173.63 2wad s ILE 217 N -3.07 5.07 0.35 -1.02 -1.09 -1.26 0.53 121.20 120.72 2wad s ILE 217 Ca 0.07 1.09 0.04 0.00 -2.23 0.00 0.00 60.65 59.63 2wad s ILE 217 Cb -0.01 -3.87 -0.03 0.00 -1.58 0.00 0.00 42.46 36.97 2wad s ILE 217 CO -0.06 0.37 0.15 -0.94 -1.23 0.00 0.00 174.94 173.23 2wad s SER 218 N 0.26 2.16 -0.10 3.58 1.04 -0.90 -4.92 113.70 114.82 2wad s SER 218 Ca 0.29 -1.62 0.04 0.00 0.48 0.00 0.00 55.95 55.13 2wad s SER 218 Cb -0.16 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.38 2wad s SER 218 CO 0.14 -0.91 -0.22 0.42 0.98 0.00 0.00 173.24 173.65 2wad s THR 219 N -3.39 1.93 0.35 2.02 -4.23 -1.26 -0.25 115.64 110.80 2wad s THR 219 Ca 0.31 -0.94 0.03 0.00 -1.18 0.00 0.00 61.69 59.91 2wad s THR 219 Cb 0.04 -1.68 -0.04 0.00 1.34 0.00 0.00 72.50 72.16 2wad s THR 219 CO 0.17 0.53 0.11 -0.94 -0.54 0.00 0.00 174.62 173.95 2wad s SER 220 N 0.42 2.26 -0.02 3.99 1.04 0.79 -4.91 113.70 117.25 2wad s SER 220 Ca -0.18 -1.53 -0.18 0.00 0.48 0.00 0.00 55.95 54.55 2wad s SER 220 Cb -0.18 0.26 -0.05 0.00 0.10 0.00 0.00 66.02 66.15 2wad s SER 220 CO 0.08 -0.80 0.50 0.26 0.98 0.00 0.00 173.24 174.26 2wad s TRP 221 N -3.37 3.67 -0.11 5.02 0.51 -1.26 -0.06 118.94 123.33 2wad s TRP 221 Ca 0.31 1.06 -0.06 0.00 -2.12 0.00 0.00 56.10 55.30 2wad s TRP 221 Cb 0.06 -2.48 -0.04 0.00 -0.81 0.00 0.00 33.47 30.19 2wad s TRP 221 CO 0.15 0.42 0.10 -0.51 -0.51 0.00 0.00 176.95 176.60 2wad s ASP 222 N -0.35 6.01 -0.37 2.95 1.01 0.47 -4.90 116.67 121.49 2wad s ASP 222 Ca 0.27 0.35 -0.11 0.00 0.71 0.00 0.00 52.55 53.77 2wad s ASP 222 Cb -0.17 -1.89 0.02 0.00 1.01 0.00 0.00 42.92 41.89 2wad s ASP 222 CO 0.14 0.39 0.21 -0.60 0.21 0.00 0.00 175.17 175.52 2wad s ARG 223 N -0.90 2.87 -0.06 8.23 6.06 -1.26 0.37 118.95 134.26 2wad s ARG 223 Ca 0.14 -1.05 0.03 0.00 -2.50 0.00 0.00 55.73 52.34 2wad s ARG 223 Cb -0.12 -3.74 -0.03 0.00 0.06 0.00 0.00 34.95 31.13 2wad s ARG 223 CO 0.03 -0.68 -0.12 -1.59 -2.50 0.00 0.00 175.30 170.44 2wad s LYS 224 N 1.57 2.61 -0.29 5.12 -2.85 -0.59 -4.97 119.74 120.34 2wad s LYS 224 Ca 0.02 -0.64 -0.16 0.00 -1.00 0.00 0.00 55.97 54.19 2wad s LYS 224 Cb -0.19 -2.46 -0.03 0.00 -2.06 0.00 0.00 37.83 33.09 2wad s LYS 224 CO 0.07 0.63 0.43 0.42 0.10 0.00 0.00 175.35 176.99 2wad s ILE 225 N -0.73 5.13 0.46 3.79 1.01 -1.26 -0.83 121.20 128.77 2wad s ILE 225 Ca 0.11 0.56 -0.23 0.00 0.00 0.00 0.00 60.65 61.09 2wad s ILE 225 Cb -0.11 -3.78 -0.07 0.00 0.01 0.00 0.00 42.46 38.51 2wad s ILE 225 CO 0.01 0.06 1.18 -0.76 0.00 0.00 0.00 174.94 175.43 2wad s LEU 226 N 2.17 4.02 -0.36 2.97 1.43 -1.08 -4.94 118.68 122.90 2wad s LEU 226 Ca 0.17 2.35 -0.28 0.00 -1.03 0.00 0.00 54.13 55.34 2wad s LEU 226 Cb -0.16 -4.21 -0.02 0.00 0.03 0.00 0.00 46.19 41.83 2wad s LEU 226 CO 0.10 -0.94 1.85 -1.61 0.23 0.00 0.00 176.35 175.99 2wad s GLU 227 N -2.66 3.21 0.19 1.70 2.02 -1.26 -4.66 118.70 117.23 2wad s GLU 227 Ca 0.63 1.39 -0.06 0.00 0.02 0.00 0.00 54.97 56.95 2wad s GLU 227 Cb -0.30 -4.24 -0.02 0.00 0.10 0.00 0.00 34.13 29.67 2wad s GLU 227 CO 0.36 -2.00 0.24 0.95 0.02 0.00 0.00 175.26 174.83 2wad s THR 228 N 7.36 0.04 -1.61 3.63 -4.23 -1.26 -5.02 115.64 114.55 2wad s THR 228 Ca 0.80 -1.66 0.14 0.00 -1.18 0.00 0.00 61.69 59.79 2wad s THR 228 Cb -0.22 -2.14 0.30 0.00 1.34 0.00 0.00 72.50 71.78 2wad s THR 228 CO 0.32 -0.18 1.35 -1.54 -0.54 0.00 0.00 174.62 174.03 2wad n SER 229 N -0.24 0.00 -0.78 3.99 3.41 -1.26 -2.10 113.62 116.64 2wad n SER 229 Ca -0.03 -0.08 0.08 0.00 -0.26 0.00 0.00 58.87 58.58 2wad n SER 229 Cb 0.64 -0.20 0.14 0.00 -0.26 0.00 0.00 64.21 64.53 2wad n SER 229 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2wad n LEU 230 N -1.20 2.83 -0.29 1.04 4.77 -1.26 -4.72 117.00 118.18 2wad n LEU 230 Ca 0.08 -1.50 -0.06 0.00 -0.03 0.00 0.00 56.01 54.50 2wad n LEU 230 Cb 0.09 -0.17 0.06 0.00 -2.33 0.00 0.00 43.42 41.08 2wad n LEU 230 CO 0.10 0.62 1.04 0.77 -1.33 0.00 0.00 177.39 178.59 2wad h SER 231 N 3.04 1.10 0.68 -1.43 4.64 -1.69 -1.77 113.55 118.11 2wad h SER 231 Ca 0.00 -0.18 -0.09 0.00 -0.47 0.00 0.00 61.79 61.05 2wad h SER 231 Cb 0.75 -0.29 -0.01 0.00 -0.31 0.00 0.00 62.40 62.54 2wad h SER 231 CO 0.00 0.98 -0.41 0.77 -0.87 0.00 0.00 176.83 177.30 2wad h SER 232 N 1.15 0.00 0.71 4.97 4.64 -1.84 -2.78 113.55 120.39 2wad h SER 232 Ca 0.26 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.48 2wad h SER 232 Cb 0.24 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 2wad h SER 232 CO -0.02 0.41 -0.47 0.40 -0.87 0.00 0.00 176.83 176.29 2wad h ILE 233 N 0.00 1.13 -0.20 0.95 1.08 -1.68 -3.30 117.51 115.50 2wad h ILE 233 Ca -0.00 -1.72 -0.02 0.00 -0.39 0.00 0.00 64.86 62.73 2wad h ILE 233 Cb 0.87 1.98 -0.01 0.00 -3.07 0.00 0.00 36.82 36.59 2wad h ILE 233 CO 0.05 0.46 0.05 0.58 -0.69 0.00 0.00 178.15 178.60 2wad h VAL 234 N 0.00 1.20 0.00 1.67 2.07 -1.12 -3.04 116.25 117.04 2wad h VAL 234 Ca -0.00 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 66.86 2wad h VAL 234 Cb 0.95 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.98 2wad h VAL 234 CO 0.06 0.20 0.00 0.61 0.02 0.00 0.00 177.57 178.46 2wad n GLY 235 N -0.53 0.04 3.82 2.17 0.00 -1.24 -1.72 105.19 107.72 2wad n GLY 235 Ca -0.04 -1.97 -0.23 0.00 0.00 0.00 0.00 46.02 43.78 2wad n GLY 235 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wad s SER 236 N -0.57 4.71 -0.02 1.61 1.04 -1.23 -4.83 113.70 114.41 2wad s SER 236 Ca 0.00 -0.97 0.02 0.00 0.48 0.00 0.00 55.95 55.48 2wad s SER 236 Cb 0.00 -0.37 0.00 0.00 0.10 0.00 0.00 66.02 65.76 2wad s SER 236 CO 0.00 -0.68 -0.08 -0.69 0.98 0.00 0.00 173.24 172.77 2wad s VAL 237 N -2.58 0.68 0.27 5.02 1.01 -1.26 -2.04 120.40 121.50 2wad s VAL 237 Ca 0.43 -0.33 -0.30 0.00 0.00 0.00 0.00 61.98 61.78 2wad s VAL 237 Cb 0.00 -0.60 -0.13 0.00 0.00 0.00 0.00 36.38 35.65 2wad s VAL 237 CO 0.24 0.21 1.45 -1.54 0.00 0.00 0.00 175.10 175.47 2wad n SER 238 N 3.18 3.09 -4.67 3.32 3.41 0.26 -4.91 113.62 117.30 2wad n SER 238 Ca -0.17 1.15 -0.30 0.00 -0.26 0.00 0.00 58.87 59.30 2wad n SER 238 Cb 0.55 -1.49 0.16 0.00 -0.26 0.00 0.00 64.21 63.18 2wad n SER 238 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2wad s SER 239 N 0.28 2.91 0.21 4.04 1.04 -1.26 -4.49 113.70 116.42 2wad s SER 239 Ca 0.65 1.64 0.11 0.00 0.48 0.00 0.00 55.95 58.84 2wad s SER 239 Cb -0.59 -2.29 0.00 0.00 0.10 0.00 0.00 66.02 63.24 2wad s SER 239 CO 0.51 -3.02 1.40 -0.08 0.98 0.00 0.00 173.24 173.03 2wad h GLU 240 N -1.81 0.00 0.26 4.02 4.81 -1.92 0.58 114.58 120.53 2wad h GLU 240 Ca -0.50 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.71 2wad h GLU 240 Cb 1.29 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.67 2wad h GLU 240 CO 0.51 0.73 -0.13 -0.22 -0.73 0.00 0.00 179.01 179.17 2wad h LYS 241 N 0.00 -0.34 -0.53 1.92 1.63 -1.94 -3.32 116.57 113.99 2wad h LYS 241 Ca -0.01 0.02 -0.09 0.00 -0.85 0.00 0.00 60.65 59.72 2wad h LYS 241 Cb 1.51 0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 33.19 2wad h LYS 241 CO 0.09 -0.08 -0.03 0.00 -3.45 0.00 0.00 179.45 175.98 2wad h ALA 242 N 0.11 0.94 -0.62 5.00 0.00 -1.89 -3.49 119.26 119.32 2wad h ALA 242 Ca -0.04 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2wad h ALA 242 Cb 0.41 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2wad h ALA 242 CO 0.06 0.63 0.00 0.41 0.00 0.00 0.00 179.25 180.35 2wad n GLY 243 N -0.48 1.06 3.62 0.00 0.00 0.18 -4.65 105.19 104.92 2wad n GLY 243 Ca 0.02 -0.72 -0.43 0.00 0.00 0.00 0.00 46.02 44.90 2wad n GLY 243 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wad s LEU 244 N 0.00 3.80 -0.27 0.99 1.02 -1.07 -4.66 118.68 118.48 2wad s LEU 244 Ca 0.00 1.54 -0.42 0.00 0.02 0.00 0.00 54.13 55.27 2wad s LEU 244 Cb 0.00 -3.53 -0.18 0.00 0.02 0.00 0.00 46.19 42.50 2wad s LEU 244 CO 0.00 -1.36 1.52 -0.81 0.02 0.00 0.00 176.35 175.72 2wad n PRO 245 N 7.85 0.49 -0.30 1.29 -0.04 -1.26 -4.66 135.00 138.37 2wad n PRO 245 Ca 0.20 0.18 0.09 0.00 -0.04 0.00 0.00 63.50 63.92 2wad n PRO 245 Cb 0.46 -1.75 0.31 0.00 -0.04 0.00 0.00 33.50 32.47 2wad n PRO 245 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wad h ALA 246 N 5.27 1.67 0.00 0.55 0.00 -1.92 0.23 119.26 125.05 2wad h ALA 246 Ca -0.46 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2wad h ALA 246 Cb 1.36 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2wad h ALA 246 CO 0.89 0.11 0.00 0.39 0.00 0.00 0.00 179.25 180.64 2wad n GLU 247 N -4.57 0.15 0.00 0.00 4.71 -1.26 -1.96 120.64 117.72 2wad n GLU 247 Ca 0.17 0.51 0.05 0.00 -0.01 0.00 0.00 57.16 57.89 2wad n GLU 247 Cb 0.37 -1.88 -0.05 0.00 -1.01 0.00 0.00 31.44 28.88 2wad n GLU 247 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2wad n GLU 248 N -2.18 3.29 -0.33 3.49 -0.58 0.02 -4.77 120.64 119.58 2wad n GLU 248 Ca 0.01 -0.10 0.23 0.00 -0.42 0.00 0.00 57.16 56.87 2wad n GLU 248 Cb 0.13 -1.01 0.43 0.00 -0.57 0.00 0.00 31.44 30.42 2wad n GLU 248 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wad h ALA 249 N 1.56 1.65 0.54 0.62 0.00 -0.87 0.39 119.26 123.14 2wad h ALA 249 Ca 0.00 0.31 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 2wad h ALA 249 Cb 0.27 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2wad h ALA 249 CO 0.00 -0.75 -0.26 1.49 0.00 0.00 0.00 179.25 179.73 2wad h GLU 250 N 0.01 -0.70 -0.99 0.00 4.81 -1.86 -1.60 114.58 114.26 2wad h GLU 250 Ca 0.72 0.05 0.03 0.00 -0.13 0.00 0.00 59.36 60.03 2wad h GLU 250 Cb 1.71 0.16 -0.06 0.00 0.63 0.00 0.00 28.75 31.19 2wad h GLU 250 CO -0.85 -0.46 0.65 0.66 -0.73 0.00 0.00 179.01 178.27 2wad h SER 251 N -0.72 1.09 -0.03 1.04 4.64 -1.28 -1.92 113.55 116.37 2wad h SER 251 Ca -0.07 -0.01 -0.05 0.00 -0.47 0.00 0.00 61.79 61.19 2wad h SER 251 Cb 0.56 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 2wad h SER 251 CO 0.12 0.75 -0.17 1.88 -0.87 0.00 0.00 176.83 178.54 2wad h TYR 252 N 1.26 0.22 -0.77 4.77 0.05 -1.46 -2.71 116.97 118.33 2wad h TYR 252 Ca 0.39 -0.10 0.13 0.00 0.05 0.00 0.00 58.73 59.20 2wad h TYR 252 Cb -0.02 -0.03 -0.09 0.00 1.01 0.00 0.00 36.73 37.60 2wad h TYR 252 CO -0.00 0.82 0.35 -0.07 -1.05 0.00 0.00 178.16 178.20 2wad h LEU 253 N -0.43 0.38 -0.30 3.88 3.38 -1.25 -1.44 115.31 119.53 2wad h LEU 253 Ca -0.01 0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.08 2wad h LEU 253 Cb 0.84 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 2wad h LEU 253 CO 0.03 0.17 0.12 0.50 0.09 0.00 0.00 178.44 179.35 2wad h LYS 254 N 0.52 0.25 -0.00 1.13 3.64 -1.38 -2.66 116.57 118.07 2wad h LYS 254 Ca 0.41 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.78 2wad h LYS 254 Cb 0.58 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.34 2wad h LYS 254 CO -0.36 0.17 0.03 0.87 -2.27 0.00 0.00 179.45 177.88 2wad h LYS 255 N 0.26 0.00 0.00 1.90 1.57 -0.95 -3.44 116.57 115.92 2wad h LYS 255 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2wad h LYS 255 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 2wad h LYS 255 CO -0.12 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.17 2wad n GLY 256 N -1.13 1.60 3.83 3.86 0.00 -1.01 -5.12 105.19 107.23 2wad n GLY 256 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 2wad n GLY 256 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wad s TYR 257 N -1.80 3.72 1.16 1.61 2.02 -0.85 -5.02 117.35 118.19 2wad s TYR 257 Ca 0.00 1.08 -0.16 0.00 -0.37 0.00 0.00 57.07 57.62 2wad s TYR 257 Cb 0.00 -2.36 0.27 0.00 -0.40 0.00 0.00 41.96 39.47 2wad s TYR 257 CO 0.00 0.58 1.06 0.45 -1.57 0.00 0.00 175.55 176.08 2wad s SER 258 N -1.25 1.21 0.12 2.29 0.15 -1.26 -4.25 113.70 110.70 2wad s SER 258 Ca 0.28 1.00 0.18 0.00 0.70 0.00 0.00 55.95 58.11 2wad s SER 258 Cb -0.17 -1.51 -0.08 0.00 -1.71 0.00 0.00 66.02 62.55 2wad s SER 258 CO 0.17 -3.99 0.95 0.25 1.20 0.00 0.00 173.24 171.81 2wad h LEU 259 N -2.48 0.00 -3.27 3.45 5.85 -1.99 -3.34 115.31 113.53 2wad h LEU 259 Ca -0.52 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.14 2wad h LEU 259 Cb 1.32 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.32 2wad h LEU 259 CO 0.45 0.45 -0.02 -0.46 -0.34 0.00 0.00 178.44 178.51 2wad n ASN 260 N -2.89 3.25 -4.72 1.25 0.23 -1.26 -2.61 115.26 108.51 2wad n ASN 260 Ca -0.06 -3.28 -0.33 0.00 -0.53 0.00 0.00 54.58 50.38 2wad n ASN 260 Cb 0.77 -0.57 0.10 0.00 -2.08 0.00 0.00 39.78 38.01 2wad n ASN 260 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 2wad s ASP 261 N -2.23 4.04 -0.20 0.53 1.01 -1.25 -4.72 116.67 113.85 2wad s ASP 261 Ca 0.42 2.22 -0.06 0.00 0.71 0.00 0.00 52.55 55.84 2wad s ASP 261 Cb 0.36 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.69 2wad s ASP 261 CO 0.05 -2.36 0.03 -0.13 0.21 0.00 0.00 175.17 172.97 2wad s ARG 262 N -4.21 3.72 0.19 8.23 0.52 -1.26 -3.24 118.95 122.90 2wad s ARG 262 Ca 0.70 -0.47 0.07 0.00 -0.52 0.00 0.00 55.73 55.51 2wad s ARG 262 Cb -0.25 -3.14 -0.05 0.00 0.52 0.00 0.00 34.95 32.03 2wad s ARG 262 CO 0.49 0.06 -0.13 0.14 0.02 0.00 0.00 175.30 175.88 2wad s VAL 263 N 0.90 1.57 -0.02 3.52 -7.23 -1.26 -4.88 120.40 113.00 2wad s VAL 263 Ca 0.02 -2.16 -0.30 0.00 -1.81 0.00 0.00 61.98 57.73 2wad s VAL 263 Cb -0.14 -1.98 -0.06 0.00 0.56 0.00 0.00 36.38 34.76 2wad s VAL 263 CO 0.02 -0.63 1.54 -0.83 -0.31 0.00 0.00 175.10 174.89 2wad s GLY 264 N -3.25 1.66 -0.01 2.32 0.00 -1.26 -0.58 107.32 106.20 2wad s GLY 264 Ca 0.21 0.93 0.17 0.00 0.00 0.00 0.00 44.72 46.03 2wad s GLY 264 CO 0.05 2.79 0.63 -1.30 0.00 0.00 0.00 173.10 175.26 2wad n THR 265 N 5.04 0.00 -3.71 0.90 -2.24 -0.87 -4.11 114.28 109.29 2wad n THR 265 Ca 0.15 -0.19 -0.14 0.00 -2.27 0.00 0.00 64.05 61.60 2wad n THR 265 Cb 0.43 0.72 -0.08 0.00 -2.10 0.00 0.00 70.33 69.29 2wad n THR 265 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2wad s SER 266 N -3.08 -0.31 0.59 3.42 1.04 -1.22 -4.89 113.70 109.25 2wad s SER 266 Ca 0.02 0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.78 2wad s SER 266 Cb 0.13 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.69 2wad s SER 266 CO 0.72 -0.43 0.00 -1.22 0.98 0.00 0.00 173.24 173.29 2wad n TYR 267 N 1.47 0.00 -0.27 5.02 4.02 -1.26 -2.70 117.16 123.45 2wad n TYR 267 Ca -0.20 0.00 0.19 0.00 -0.01 0.00 0.00 57.90 57.89 2wad n TYR 267 Cb 0.56 0.04 0.50 0.00 -0.02 0.00 0.00 39.34 40.42 2wad n TYR 267 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 2wad h LEU 268 N 0.00 0.43 -0.60 7.72 3.38 -1.40 0.10 115.31 124.95 2wad h LEU 268 Ca 0.00 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 2wad h LEU 268 Cb 0.00 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 2wad h LEU 268 CO 0.00 0.16 0.26 -0.33 0.09 0.00 0.00 178.44 178.62 2wad h GLU 269 N 0.43 0.88 0.62 1.13 4.39 -1.12 -0.47 114.58 120.45 2wad h GLU 269 Ca 0.50 -0.15 -0.03 0.00 0.34 0.00 0.00 59.36 60.02 2wad h GLU 269 Cb 1.22 -0.15 0.01 0.00 -0.10 0.00 0.00 28.75 29.73 2wad h GLU 269 CO -0.21 0.74 -0.30 -0.22 -1.16 0.00 0.00 179.01 177.86 2wad h LYS 270 N 0.83 -0.81 -0.91 2.33 3.64 -0.89 -2.29 116.57 118.47 2wad h LYS 270 Ca 0.20 0.06 0.25 0.00 -1.27 0.00 0.00 60.65 59.89 2wad h LYS 270 Cb 0.17 0.18 -0.15 0.00 -0.41 0.00 0.00 32.23 32.02 2wad h LYS 270 CO -0.02 -0.54 0.28 0.37 -2.27 0.00 0.00 179.45 177.27 2wad h GLN 271 N -1.08 0.21 -0.63 1.90 5.75 -1.06 -0.32 115.11 119.87 2wad h GLN 271 Ca -0.09 -0.01 -0.27 0.00 -0.15 0.00 0.00 58.65 58.14 2wad h GLN 271 Cb 0.64 -0.05 -0.16 0.00 1.07 0.00 0.00 27.48 28.99 2wad h GLN 271 CO 0.14 0.14 0.24 0.66 -2.65 0.00 0.00 178.83 177.35 2wad n TYR 272 N -5.21 2.01 -0.27 3.99 4.02 -0.19 -4.68 117.16 116.83 2wad n TYR 272 Ca 0.23 -1.48 0.07 0.00 -0.01 0.00 0.00 57.90 56.72 2wad n TYR 272 Cb 0.75 -0.66 0.31 0.00 -0.02 0.00 0.00 39.34 39.72 2wad n TYR 272 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 176.86 177.34 2wad h GLU 273 N 1.54 0.84 0.00 -0.72 4.57 -0.44 -0.97 114.58 119.40 2wad h GLU 273 Ca 0.33 -0.05 -0.06 0.00 -1.18 0.00 0.00 59.36 58.40 2wad h GLU 273 Cb 2.17 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 30.56 2wad h GLU 273 CO 0.67 0.55 -0.27 1.49 -1.18 0.00 0.00 179.01 180.28 2wad h GLU 274 N 0.86 0.00 0.00 1.92 4.81 -1.83 -1.79 114.58 118.55 2wad h GLU 274 Ca 0.40 0.00 -0.18 0.00 -0.13 0.00 0.00 59.36 59.45 2wad h GLU 274 Cb 0.40 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.75 2wad h GLU 274 CO -0.17 0.27 -1.32 0.28 -0.73 0.00 0.00 179.01 177.34 2wad h VAL 275 N 0.00 0.67 0.06 0.32 2.07 -1.57 -3.40 116.25 114.40 2wad h VAL 275 Ca -0.00 -2.22 -0.37 0.00 0.82 0.00 0.00 66.70 64.93 2wad h VAL 275 Cb 0.75 2.20 -0.04 0.00 -1.52 0.00 0.00 31.29 32.67 2wad h VAL 275 CO 0.04 0.38 -2.11 0.18 0.02 0.00 0.00 177.57 176.08 2wad n LEU 276 N -2.99 2.59 -4.65 2.57 4.77 -0.70 -1.74 117.00 116.85 2wad n LEU 276 Ca -0.09 0.14 -0.49 0.00 -0.03 0.00 0.00 56.01 55.54 2wad n LEU 276 Cb 0.87 -1.01 -0.05 0.00 -2.33 0.00 0.00 43.42 40.90 2wad n LEU 276 CO 0.43 0.79 1.17 1.67 -1.33 0.00 0.00 177.39 180.13 2wad n GLN 277 N -3.60 1.79 -2.31 3.23 -0.06 -0.69 -0.47 117.38 115.28 2wad n GLN 277 Ca -0.38 0.65 -0.33 0.00 -2.00 0.00 0.00 57.00 54.94 2wad n GLN 277 Cb 0.97 -2.39 -0.02 0.00 -4.06 0.00 0.00 30.24 24.74 2wad n GLN 277 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 2wad s GLY 278 N 1.56 2.14 0.22 1.69 0.00 -1.23 -4.50 107.32 107.20 2wad s GLY 278 Ca 0.84 0.30 -0.30 0.00 0.00 0.00 0.00 44.72 45.57 2wad s GLY 278 CO 0.45 0.60 1.41 1.25 0.00 0.00 0.00 173.10 176.81 2wad s LYS 279 N -3.95 4.30 0.29 2.90 2.20 -0.75 -4.55 119.74 120.19 2wad s LYS 279 Ca 0.61 2.22 -0.28 0.00 -0.36 0.00 0.00 55.97 58.17 2wad s LYS 279 Cb -0.13 -3.14 -0.10 0.00 -1.51 0.00 0.00 37.83 32.96 2wad s LYS 279 CO 0.31 -0.38 0.94 1.03 -0.36 0.00 0.00 175.35 176.89 2wad s ARG 280 N -0.13 4.69 0.29 4.03 0.52 -1.26 -2.12 118.95 124.97 2wad s ARG 280 Ca 0.59 1.38 -0.29 0.00 -0.52 0.00 0.00 55.73 56.90 2wad s ARG 280 Cb -0.40 -2.99 -0.10 0.00 0.52 0.00 0.00 34.95 31.98 2wad s ARG 280 CO 0.40 0.38 1.13 -2.14 0.02 0.00 0.00 175.30 175.09 2wad s PRO 281 N -1.71 4.57 -0.09 3.54 0.02 -0.72 -4.10 135.00 136.51 2wad s PRO 281 Ca 0.46 1.85 0.03 0.00 0.02 0.00 0.00 61.00 63.37 2wad s PRO 281 Cb -0.21 -3.13 0.01 0.00 0.02 0.00 0.00 34.50 31.18 2wad s PRO 281 CO 0.27 0.13 -0.19 0.08 -0.33 0.00 0.00 177.00 176.96 2wad s VAL 282 N -1.19 1.66 0.02 3.83 1.01 -0.62 -0.91 120.40 124.21 2wad s VAL 282 Ca 0.46 -0.79 0.05 0.00 0.00 0.00 0.00 61.98 61.70 2wad s VAL 282 Cb -0.33 -1.46 -0.02 0.00 0.00 0.00 0.00 36.38 34.57 2wad s VAL 282 CO 0.42 0.47 -0.15 -0.54 0.00 0.00 0.00 175.10 175.31 2wad s LYS 283 N 0.49 1.06 -0.33 2.72 1.02 -1.08 -2.31 119.74 121.31 2wad s LYS 283 Ca -0.17 -0.66 0.01 0.00 0.02 0.00 0.00 55.97 55.18 2wad s LYS 283 Cb -0.17 -1.06 0.10 0.00 -0.52 0.00 0.00 37.83 36.19 2wad s LYS 283 CO 0.07 0.28 0.09 -1.21 -0.92 0.00 0.00 175.35 173.65 2wad s GLU 284 N -0.79 1.09 -0.43 1.68 2.02 -1.10 -1.06 118.70 120.12 2wad s GLU 284 Ca 0.04 -1.50 -0.28 0.00 0.02 0.00 0.00 54.97 53.25 2wad s GLU 284 Cb -0.07 -2.54 0.02 0.00 0.10 0.00 0.00 34.13 31.64 2wad s GLU 284 CO 0.00 -0.98 1.07 0.42 0.02 0.00 0.00 175.26 175.79 2wad s ILE 285 N 1.20 4.36 0.46 -1.63 1.09 -1.26 -1.78 121.20 123.64 2wad s ILE 285 Ca 0.11 1.27 -0.20 0.00 -1.10 0.00 0.00 60.65 60.73 2wad s ILE 285 Cb -0.19 -4.51 -0.10 0.00 -1.06 0.00 0.00 42.46 36.61 2wad s ILE 285 CO -0.16 -0.81 0.98 -1.38 -0.10 0.00 0.00 174.94 173.47 2wad s HIS 286 N 4.06 3.21 0.00 3.97 -3.43 -0.59 -4.71 115.29 117.80 2wad s HIS 286 Ca 0.45 1.59 0.00 0.00 -0.80 0.00 0.00 55.06 56.30 2wad s HIS 286 Cb -0.09 -2.92 0.00 0.00 -1.43 0.00 0.00 32.58 28.14 2wad s HIS 286 CO 0.26 -0.37 0.00 1.47 -2.00 0.00 0.00 174.74 174.09 2wad n LEU 287 N -0.83 0.00 0.00 5.38 -0.00 -1.26 0.12 117.00 120.41 2wad n LEU 287 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.09 2wad n LEU 287 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.96 2wad n LEU 287 CO 0.39 0.00 0.00 -0.90 -0.00 0.00 0.00 177.39 176.88 2wad n ASP 288 N 0.00 0.00 0.33 1.45 5.75 -1.05 -4.65 116.55 118.39 2wad n ASP 288 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 54.79 54.61 2wad n ASP 288 Cb 0.00 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.00 2wad n ASP 288 CO 0.00 0.00 0.00 0.07 -0.11 0.00 0.00 177.20 177.16 2wad h LYS 289 N 0.00 -0.80 -0.75 0.11 2.10 -2.03 -3.24 116.57 111.97 2wad h LYS 289 Ca 0.00 0.05 0.09 0.00 -2.00 0.00 0.00 60.65 58.79 2wad h LYS 289 Cb 0.00 0.18 -0.05 0.00 -0.90 0.00 0.00 32.23 31.46 2wad h LYS 289 CO 0.00 -0.51 0.49 0.45 -2.00 0.00 0.00 179.45 177.89 2wad h HIS 290 N -0.90 0.72 0.00 0.07 3.86 -2.03 -3.46 115.15 113.41 2wad h HIS 290 Ca -0.08 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.14 2wad h HIS 290 Cb 0.66 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.89 2wad h HIS 290 CO -0.02 0.35 0.00 0.41 0.86 0.00 0.00 177.93 179.53 2wad n GLY 291 N -1.46 1.65 3.71 2.45 0.00 -1.22 -5.12 105.19 105.20 2wad n GLY 291 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2wad n GLY 291 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wad s ASP 292 N -1.36 3.53 0.47 1.61 1.01 -1.26 -4.69 116.67 115.98 2wad s ASP 292 Ca 0.00 2.13 -0.14 0.00 0.71 0.00 0.00 52.55 55.25 2wad s ASP 292 Cb 0.00 -2.56 -0.07 0.00 1.01 0.00 0.00 42.92 41.30 2wad s ASP 292 CO 0.00 -2.70 0.90 0.00 0.21 0.00 0.00 175.17 173.58 2wad s MET 293 N -4.57 3.87 0.00 8.23 0.23 -1.26 -2.51 119.30 123.28 2wad s MET 293 Ca 0.67 0.75 0.00 0.00 -1.03 0.00 0.00 55.69 56.08 2wad s MET 293 Cb -0.23 -2.24 0.00 0.00 -1.53 0.00 0.00 34.83 30.84 2wad s MET 293 CO 0.55 -0.18 0.00 0.39 -2.03 0.00 0.00 175.02 173.75 2wad n GLU 294 N -1.48 0.00 -4.08 3.16 1.02 0.12 -4.88 120.64 114.50 2wad n GLU 294 Ca 0.05 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.83 2wad n GLU 294 Cb 0.54 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.89 2wad n GLU 294 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2wad s SER 295 N 0.29 5.92 -0.53 1.62 0.01 -1.16 -4.83 113.70 115.02 2wad s SER 295 Ca 0.00 0.32 -0.22 0.00 1.31 0.00 0.00 55.95 57.36 2wad s SER 295 Cb 0.00 -1.82 0.05 0.00 0.21 0.00 0.00 66.02 64.46 2wad s SER 295 CO 0.00 0.38 0.82 -0.69 0.41 0.00 0.00 173.24 174.17 2wad s VAL 296 N -1.00 4.57 -0.99 3.43 1.01 -1.26 -1.54 120.40 124.62 2wad s VAL 296 Ca 0.15 0.03 -0.23 0.00 0.00 0.00 0.00 61.98 61.94 2wad s VAL 296 Cb -0.12 -4.44 0.06 0.00 0.00 0.00 0.00 36.38 31.88 2wad s VAL 296 CO 0.05 -0.98 1.39 -1.83 0.00 0.00 0.00 175.10 173.73 2wad s GLU 297 N 3.46 3.57 -0.91 2.72 -1.05 -0.73 -4.90 118.70 120.84 2wad s GLU 297 Ca 0.25 -1.16 -0.25 0.00 -0.15 0.00 0.00 54.97 53.66 2wad s GLU 297 Cb -0.15 -5.23 -0.08 0.00 -0.44 0.00 0.00 34.13 28.24 2wad s GLU 297 CO 0.17 -2.14 2.07 1.21 0.95 0.00 0.00 175.26 177.51 2wad s ASN 298 N 4.72 4.75 0.01 0.83 2.47 -1.26 -2.69 114.94 123.76 2wad s ASN 298 Ca 0.43 -0.61 -0.08 0.00 0.42 0.00 0.00 52.86 53.03 2wad s ASN 298 Cb -0.01 -2.56 -0.04 0.00 -1.45 0.00 0.00 41.25 37.18 2wad s ASN 298 CO -0.08 -3.15 0.99 0.40 -3.72 0.00 0.00 177.10 171.54 2wad h ILE 299 N 7.23 0.00 -3.53 -5.21 2.04 -1.82 -3.45 117.51 112.78 2wad h ILE 299 Ca 0.08 -0.03 -0.68 0.00 1.00 0.00 0.00 64.86 65.24 2wad h ILE 299 Cb 1.00 0.00 -0.30 0.00 -0.74 0.00 0.00 36.82 36.78 2wad h ILE 299 CO 1.15 0.00 -0.84 -1.61 0.00 0.00 0.00 178.15 176.85 2wad s GLU 300 N -3.37 3.01 -0.19 2.37 2.02 -1.15 -5.00 118.70 116.39 2wad s GLU 300 Ca -0.04 -0.81 -0.17 0.00 0.02 0.00 0.00 54.97 53.96 2wad s GLU 300 Cb 0.00 -2.38 -0.04 0.00 0.10 0.00 0.00 34.13 31.82 2wad s GLU 300 CO 0.12 0.27 0.46 -1.21 0.02 0.00 0.00 175.26 174.92 2wad s GLU 301 N 0.16 4.21 0.68 1.61 2.02 -1.26 -1.58 118.70 124.53 2wad s GLU 301 Ca -0.11 0.34 -0.13 0.00 0.02 0.00 0.00 54.97 55.08 2wad s GLU 301 Cb -0.16 -3.53 0.01 0.00 0.10 0.00 0.00 34.13 30.55 2wad s GLU 301 CO 0.06 -0.05 1.08 0.20 0.02 0.00 0.00 175.26 176.57 2wad s GLY 302 N 1.01 1.91 -0.03 -1.39 0.00 -1.26 -4.80 107.32 102.77 2wad s GLY 302 Ca 0.22 0.33 -0.08 0.00 0.00 0.00 0.00 44.72 45.19 2wad s GLY 302 CO 0.09 0.67 0.19 -1.35 0.00 0.00 0.00 173.10 172.70 2wad s SER 303 N -3.11 -0.10 0.27 1.64 1.04 -0.90 -4.89 113.70 107.65 2wad s SER 303 Ca 0.63 0.08 -0.28 0.00 0.48 0.00 0.00 55.95 56.85 2wad s SER 303 Cb -0.17 0.31 -0.14 0.00 0.10 0.00 0.00 66.02 66.11 2wad s SER 303 CO 0.47 -0.27 0.98 1.17 0.98 0.00 0.00 173.24 176.57 2wad n LYS 304 N 2.01 1.22 -0.96 4.02 4.81 -1.26 -1.80 118.16 126.19 2wad n LYS 304 Ca -0.19 0.43 -0.30 0.00 -0.87 0.00 0.00 58.31 57.38 2wad n LYS 304 Cb 0.57 -1.77 0.16 0.00 0.02 0.00 0.00 35.03 34.01 2wad n LYS 304 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 2wad s GLY 305 N -0.56 1.63 0.57 3.14 0.00 -0.78 -4.70 107.32 106.62 2wad s GLY 305 Ca 0.60 0.11 -0.09 0.00 0.00 0.00 0.00 44.72 45.35 2wad s GLY 305 CO 0.59 0.62 0.93 0.54 0.00 0.00 0.00 173.10 175.78 2wad s LYS 306 N -4.77 3.58 0.06 2.90 -0.14 -0.71 -3.60 119.74 117.05 2wad s LYS 306 Ca 0.65 0.53 -0.08 0.00 -1.36 0.00 0.00 55.97 55.71 2wad s LYS 306 Cb -0.20 -2.20 -0.05 0.00 -1.68 0.00 0.00 37.83 33.70 2wad s LYS 306 CO 0.59 -0.43 0.35 -0.80 -0.76 0.00 0.00 175.35 174.30 2wad s ASN 307 N -4.15 6.58 -0.09 2.83 -0.87 0.16 -4.02 114.94 115.37 2wad s ASN 307 Ca 0.52 0.70 -0.02 0.00 -1.57 0.00 0.00 52.86 52.49 2wad s ASN 307 Cb -0.11 -2.14 -0.03 0.00 -0.02 0.00 0.00 41.25 38.95 2wad s ASN 307 CO 0.50 0.19 -0.00 0.27 -2.57 0.00 0.00 177.10 175.49 2wad s ILE 308 N -1.38 4.28 -0.11 0.60 -4.36 -0.77 -0.11 121.20 119.35 2wad s ILE 308 Ca 0.32 -0.26 0.01 0.00 -0.26 0.00 0.00 60.65 60.46 2wad s ILE 308 Cb -0.14 -2.80 -0.02 0.00 1.25 0.00 0.00 42.46 40.76 2wad s ILE 308 CO 0.18 0.60 -0.15 -0.75 0.24 0.00 0.00 174.94 175.06 2wad s LYS 309 N -0.79 3.14 0.69 0.37 2.20 -0.89 -0.89 119.74 123.57 2wad s LYS 309 Ca 0.12 -0.71 -0.07 0.00 -0.36 0.00 0.00 55.97 54.95 2wad s LYS 309 Cb -0.11 -2.53 0.05 0.00 -1.51 0.00 0.00 37.83 33.73 2wad s LYS 309 CO 0.02 0.30 1.00 -0.51 -0.36 0.00 0.00 175.35 175.80 2wad s LEU 310 N 0.10 2.88 0.11 5.43 1.43 -0.30 0.05 118.68 128.39 2wad s LEU 310 Ca -0.07 0.51 0.24 0.00 -1.03 0.00 0.00 54.13 53.78 2wad s LEU 310 Cb -0.15 -3.19 0.25 0.00 0.03 0.00 0.00 46.19 43.13 2wad s LEU 310 CO 0.05 -1.51 1.23 0.71 0.23 0.00 0.00 176.35 177.05 2wad h THR 311 N -0.54 0.00 -3.35 5.49 1.35 -0.43 -3.27 112.91 112.17 2wad h THR 311 Ca -0.45 -0.53 -0.57 0.00 -0.55 0.00 0.00 66.41 64.32 2wad h THR 311 Cb 1.31 1.03 -0.06 0.00 -1.73 0.00 0.00 68.15 68.70 2wad h THR 311 CO 0.60 0.00 -0.00 -0.63 -0.25 0.00 0.00 175.52 175.24 2wad s ILE 312 N -3.19 5.08 -0.14 6.82 1.01 -1.22 -4.69 121.20 124.87 2wad s ILE 312 Ca 0.05 1.26 -0.24 0.00 0.00 0.00 0.00 60.65 61.71 2wad s ILE 312 Cb 0.13 -3.95 -0.02 0.00 0.01 0.00 0.00 42.46 38.63 2wad s ILE 312 CO 0.75 0.30 0.77 -0.62 0.00 0.00 0.00 174.94 176.13 2wad s ASP 313 N 0.63 6.93 0.28 3.58 -1.08 -1.26 -1.81 116.67 123.93 2wad s ASP 313 Ca 0.33 1.13 0.02 0.00 -0.52 0.00 0.00 52.55 53.51 2wad s ASP 313 Cb -0.17 -2.43 0.60 0.00 -1.46 0.00 0.00 42.92 39.47 2wad s ASP 313 CO 0.15 -0.30 1.78 0.25 0.52 0.00 0.00 175.17 177.57 2wad h LEU 314 N 7.85 0.67 -0.37 -1.34 5.85 -1.96 -0.48 115.31 125.53 2wad h LEU 314 Ca -0.33 0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.42 2wad h LEU 314 Cb 1.15 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 2wad h LEU 314 CO 0.80 0.28 0.02 0.00 -0.34 0.00 0.00 178.44 179.20 2wad h ALA 315 N 1.58 0.50 0.24 1.25 0.00 -1.98 0.10 119.26 120.96 2wad h ALA 315 Ca 0.51 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2wad h ALA 315 Cb 0.71 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2wad h ALA 315 CO -0.36 0.25 -0.12 0.35 0.00 0.00 0.00 179.25 179.38 2wad h PHE 316 N 0.47 -0.30 -0.95 0.00 3.57 -1.78 -1.93 116.94 116.02 2wad h PHE 316 Ca 0.11 -0.01 0.16 0.00 3.53 0.00 0.00 57.97 61.77 2wad h PHE 316 Cb 0.43 0.10 -0.10 0.00 2.79 0.00 0.00 35.95 39.17 2wad h PHE 316 CO 0.03 -0.10 0.56 0.37 -2.23 0.00 0.00 178.31 176.94 2wad h GLN 317 N -0.45 0.73 -0.80 1.11 5.75 -1.07 -0.99 115.11 119.40 2wad h GLN 317 Ca -0.03 -0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.38 2wad h GLN 317 Cb 0.34 -0.17 -0.04 0.00 1.07 0.00 0.00 27.48 28.69 2wad h GLN 317 CO 0.05 0.49 0.33 -0.44 -2.65 0.00 0.00 178.83 176.61 2wad h ASP 318 N 0.76 1.09 0.90 -0.69 3.32 -0.53 -1.90 116.42 119.37 2wad h ASP 318 Ca 0.53 -0.17 -0.19 0.00 0.02 0.00 0.00 57.03 57.22 2wad h ASP 318 Cb 0.75 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.99 2wad h ASP 318 CO -0.36 0.96 -0.91 0.77 -1.72 0.00 0.00 179.24 177.98 2wad h SER 319 N 1.16 0.01 -0.61 6.45 4.64 -0.50 -2.27 113.55 122.43 2wad h SER 319 Ca 0.27 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.56 2wad h SER 319 Cb 0.20 -0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.26 2wad h SER 319 CO -0.02 0.92 0.30 0.58 -0.87 0.00 0.00 176.83 177.73 2wad h VAL 320 N 0.00 1.21 -0.92 0.95 2.07 -1.17 -0.36 116.25 118.03 2wad h VAL 320 Ca -0.01 -0.59 -0.01 0.00 0.82 0.00 0.00 66.70 66.91 2wad h VAL 320 Cb 1.61 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.82 2wad h VAL 320 CO 0.12 0.24 0.52 0.44 0.02 0.00 0.00 177.57 178.92 2wad h ASP 321 N 0.83 1.13 -0.50 0.57 3.45 -1.27 -1.36 116.42 119.27 2wad h ASP 321 Ca 0.21 -0.09 -0.08 0.00 0.43 0.00 0.00 57.03 57.50 2wad h ASP 321 Cb 0.11 -0.29 -0.02 0.00 -0.56 0.00 0.00 39.33 38.58 2wad h ASP 321 CO -0.03 0.89 -0.02 0.00 -1.57 0.00 0.00 179.24 178.51 2wad h ALA 322 N 1.29 0.68 -0.70 3.45 0.00 -1.18 -1.85 119.26 120.95 2wad h ALA 322 Ca 0.33 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2wad h ALA 322 Cb -0.01 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2wad h ALA 322 CO -0.06 0.50 0.28 1.25 0.00 0.00 0.00 179.25 181.23 2wad h LEU 323 N 0.76 0.96 -0.53 0.00 5.85 -0.68 -0.75 115.31 120.92 2wad h LEU 323 Ca 0.14 -0.17 -0.15 0.00 0.84 0.00 0.00 57.88 58.54 2wad h LEU 323 Cb 0.54 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 2wad h LEU 323 CO 0.03 0.86 -0.41 -0.07 -0.34 0.00 0.00 178.44 178.51 2wad h LEU 324 N 0.99 0.78 -0.40 2.25 4.07 -1.16 -1.63 115.31 120.21 2wad h LEU 324 Ca 0.23 -0.36 -0.16 0.00 0.08 0.00 0.00 57.88 57.67 2wad h LEU 324 Cb 0.20 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.72 2wad h LEU 324 CO -0.02 1.09 -0.39 0.50 -1.08 0.00 0.00 178.44 178.54 2wad h LYS 325 N 0.59 0.93 0.43 1.13 3.64 -0.99 -0.69 116.57 121.62 2wad h LYS 325 Ca 0.05 -0.49 -0.02 0.00 -1.27 0.00 0.00 60.65 58.91 2wad h LYS 325 Cb 0.96 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.80 2wad h LYS 325 CO 0.09 1.15 -0.21 1.03 -2.27 0.00 0.00 179.45 179.24 2wad h SER 326 N 0.76 -0.49 -0.56 4.20 0.87 -0.97 -0.85 113.55 116.50 2wad h SER 326 Ca 0.06 0.01 0.03 0.00 -1.23 0.00 0.00 61.79 60.67 2wad h SER 326 Cb 0.99 0.13 -0.04 0.00 -0.44 0.00 0.00 62.40 63.04 2wad h SER 326 CO 0.10 -0.35 0.33 1.88 -0.53 0.00 0.00 176.83 178.25 2wad h TYR 327 N -0.59 0.61 -0.35 2.24 0.05 -1.31 -1.92 116.97 115.70 2wad h TYR 327 Ca -0.06 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.71 2wad h TYR 327 Cb 0.45 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 37.98 2wad h TYR 327 CO -0.04 0.33 0.11 0.35 -1.05 0.00 0.00 178.16 177.86 2wad h PHE 328 N 0.64 0.57 -0.94 4.88 3.57 -0.86 -1.60 116.94 123.20 2wad h PHE 328 Ca 0.23 -0.06 0.04 0.00 3.53 0.00 0.00 57.97 61.72 2wad h PHE 328 Cb 0.06 -0.16 -0.06 0.00 2.79 0.00 0.00 35.95 38.57 2wad h PHE 328 CO -0.07 0.55 0.62 -0.91 -2.23 0.00 0.00 178.31 176.27 2wad h ASN 329 N 0.42 1.00 -0.60 0.41 2.35 -1.10 -1.39 115.58 116.68 2wad h ASN 329 Ca 0.11 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.85 2wad h ASN 329 Cb 0.25 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.36 2wad h ASN 329 CO -0.00 0.67 0.36 -1.28 -1.65 0.00 0.00 177.43 175.53 2wad h SER 330 N 1.15 0.73 1.59 5.81 0.87 -0.94 0.15 113.55 122.92 2wad h SER 330 Ca 0.38 -0.04 -0.08 0.00 -1.23 0.00 0.00 61.79 60.83 2wad h SER 330 Cb 0.07 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 2wad h SER 330 CO -0.13 0.58 -0.42 -0.33 -0.53 0.00 0.00 176.83 176.00 2wad h GLU 331 N 0.84 0.00 -0.38 2.24 4.39 -0.76 -2.12 114.58 118.80 2wad h GLU 331 Ca 0.22 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.82 2wad h GLU 331 Cb -0.01 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 2wad h GLU 331 CO -0.04 0.34 -0.16 -0.07 -1.16 0.00 0.00 179.01 177.91 2wad h LEU 332 N 0.00 0.79 -0.32 1.33 3.38 -0.67 -0.42 115.31 119.41 2wad h LEU 332 Ca -0.01 -0.40 0.07 0.00 0.09 0.00 0.00 57.88 57.63 2wad h LEU 332 Cb 1.28 -0.22 -0.08 0.00 0.09 0.00 0.00 40.66 41.73 2wad h LEU 332 CO 0.04 1.02 -0.24 1.23 0.09 0.00 0.00 178.44 180.58 2wad h GLY 333 N 0.57 -0.08 1.00 0.83 0.00 -0.43 -2.65 103.07 102.31 2wad h GLY 333 Ca 0.09 0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.71 2wad h GLY 333 CO 0.05 -0.20 -0.16 1.16 0.00 0.00 0.00 176.54 177.39 2wad n ASN 334 N -5.38 0.46 0.00 0.19 0.23 -0.82 -4.93 115.26 105.01 2wad n ASN 334 Ca 0.01 -0.42 0.00 0.00 -0.53 0.00 0.00 54.58 53.64 2wad n ASN 334 Cb 0.30 -0.07 0.00 0.00 -2.08 0.00 0.00 39.78 37.93 2wad n ASN 334 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2wad n GLY 335 N 1.34 3.07 0.36 4.83 0.00 -0.94 -4.97 105.19 108.88 2wad n GLY 335 Ca 0.12 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.23 2wad n GLY 335 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wad h GLY 336 N 0.00 1.67 -1.87 -0.02 0.00 -1.57 -2.50 103.07 98.78 2wad h GLY 336 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.93 2wad h GLY 336 CO 0.00 0.08 0.00 0.00 0.00 0.00 0.00 176.54 176.62 2wad n ALA 337 N -2.35 2.47 -0.29 3.60 0.00 -0.26 -1.75 120.51 121.93 2wad n ALA 337 Ca 0.20 -0.89 0.08 0.00 0.00 0.00 0.00 53.44 52.83 2wad n ALA 337 Cb 0.44 -0.97 0.23 0.00 0.00 0.00 0.00 19.45 19.15 2wad n ALA 337 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2wad h LYS 338 N 2.88 0.51 -0.36 0.00 3.64 -1.67 -1.13 116.57 120.44 2wad h LYS 338 Ca 0.00 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.24 2wad h LYS 338 Cb 0.71 -0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 32.34 2wad h LYS 338 CO 0.02 0.34 0.02 0.66 -2.27 0.00 0.00 179.45 178.21 2wad n TYR 339 N -4.94 1.18 -2.81 1.91 4.01 -1.26 -4.99 117.16 110.26 2wad n TYR 339 Ca 0.17 -1.23 -0.40 0.00 -0.16 0.00 0.00 57.90 56.28 2wad n TYR 339 Cb 0.48 -0.44 -0.05 0.00 -0.31 0.00 0.00 39.34 39.02 2wad n TYR 339 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2wad s SER 340 N -2.10 7.45 0.00 7.72 0.15 -0.43 -4.84 113.70 121.65 2wad s SER 340 Ca 0.45 1.73 0.30 0.00 0.70 0.00 0.00 55.95 59.12 2wad s SER 340 Cb 0.38 -2.56 1.46 0.00 -1.71 0.00 0.00 66.02 63.59 2wad s SER 340 CO 0.06 0.01 2.01 -0.62 1.20 0.00 0.00 173.24 175.90 2wad n GLU 341 N 2.49 0.49 -1.92 5.44 4.71 -1.26 -4.62 120.64 125.98 2wad n GLU 341 Ca -0.00 -0.05 0.00 0.00 -0.01 0.00 0.00 57.16 57.10 2wad n GLU 341 Cb 0.49 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.42 2wad n GLU 341 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2wad n GLY 342 N 1.28 -0.09 2.99 0.62 0.00 -1.26 -1.04 105.19 107.69 2wad n GLY 342 Ca 0.14 -1.57 -0.12 0.00 0.00 0.00 0.00 46.02 44.47 2wad n GLY 342 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wad s VAL 343 N -2.55 0.01 0.04 1.61 0.11 -0.83 -4.06 120.40 114.73 2wad s VAL 343 Ca 0.00 -0.12 0.04 0.00 -2.93 0.00 0.00 61.98 58.97 2wad s VAL 343 Cb 0.00 -0.18 -0.02 0.00 -1.53 0.00 0.00 36.38 34.65 2wad s VAL 343 CO 0.00 -0.06 -0.12 -0.31 -3.33 0.00 0.00 175.10 171.28 2wad s TYR 344 N -0.16 1.01 -0.04 1.54 2.02 -0.04 -1.49 117.35 120.18 2wad s TYR 344 Ca -0.02 -0.37 -0.07 0.00 -0.37 0.00 0.00 57.07 56.23 2wad s TYR 344 Cb -0.02 -0.59 0.01 0.00 -0.40 0.00 0.00 41.96 40.96 2wad s TYR 344 CO 0.00 0.01 0.18 0.00 -1.57 0.00 0.00 175.55 174.16 2wad s ALA 345 N -0.95 -0.43 -0.04 3.71 0.00 -0.18 -0.91 121.76 122.95 2wad s ALA 345 Ca -0.02 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.18 2wad s ALA 345 Cb -0.08 -0.10 0.03 0.00 0.00 0.00 0.00 23.12 22.96 2wad s ALA 345 CO 0.01 -0.15 -0.02 0.08 0.00 0.00 0.00 175.76 175.68 2wad s VAL 346 N -0.64 0.35 -0.03 0.00 1.01 -0.93 -0.60 120.40 119.56 2wad s VAL 346 Ca -0.07 0.02 0.04 0.00 0.00 0.00 0.00 61.98 61.97 2wad s VAL 346 Cb -0.04 -0.44 -0.03 0.00 0.00 0.00 0.00 36.38 35.87 2wad s VAL 346 CO 0.01 0.20 -0.15 0.00 0.00 0.00 0.00 175.10 175.16 2wad s ALA 347 N 1.19 2.66 0.03 5.51 0.00 -0.36 -1.67 121.76 129.13 2wad s ALA 347 Ca -0.07 -1.02 0.02 0.00 0.00 0.00 0.00 51.96 50.89 2wad s ALA 347 Cb -0.14 -0.93 -0.02 0.00 0.00 0.00 0.00 23.12 22.04 2wad s ALA 347 CO -0.02 0.56 -0.07 -0.51 0.00 0.00 0.00 175.76 175.72 2wad s LEU 348 N -0.87 2.20 -0.37 0.00 1.43 0.24 -0.63 118.68 120.68 2wad s LEU 348 Ca 0.12 -0.45 -0.27 0.00 -1.03 0.00 0.00 54.13 52.50 2wad s LEU 348 Cb -0.11 -0.19 0.02 0.00 0.03 0.00 0.00 46.19 45.94 2wad s LEU 348 CO 0.02 -0.14 0.97 0.21 0.23 0.00 0.00 176.35 177.63 2wad s ASN 349 N -1.27 6.72 0.27 2.29 3.84 -0.06 -0.82 114.94 125.90 2wad s ASN 349 Ca -0.07 0.65 0.25 0.00 0.21 0.00 0.00 52.86 53.89 2wad s ASN 349 Cb -0.08 -2.48 0.97 0.00 -0.55 0.00 0.00 41.25 39.10 2wad s ASN 349 CO 0.00 -0.89 1.74 -0.81 -2.79 0.00 0.00 177.10 174.35 2wad n PRO 350 N 6.88 0.22 0.05 0.43 -0.04 -1.26 -0.12 135.00 141.15 2wad n PRO 350 Ca 0.08 0.40 -0.00 0.00 -0.04 0.00 0.00 63.50 63.94 2wad n PRO 350 Cb 0.48 -1.88 -0.07 0.00 -0.04 0.00 0.00 33.50 31.99 2wad n PRO 350 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2wad h GLN 351 N 0.00 0.00 0.00 0.54 4.20 -1.90 -3.42 115.11 114.53 2wad h GLN 351 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2wad h GLN 351 Cb 0.44 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.22 2wad h GLN 351 CO 0.00 0.38 -0.51 0.25 -0.67 0.00 0.00 178.83 178.27 2wad n THR 352 N -2.99 0.00 -0.24 -0.54 -2.24 -1.03 -5.02 114.28 102.21 2wad n THR 352 Ca -0.07 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 2wad n THR 352 Cb 0.84 0.33 0.00 0.00 -2.10 0.00 0.00 70.33 69.39 2wad n THR 352 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wad n GLY 353 N 1.32 1.54 3.69 3.38 0.00 0.82 -4.55 105.19 111.39 2wad n GLY 353 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 2wad n GLY 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wad n ALA 354 N -0.45 1.64 -2.66 4.61 0.00 -1.25 -0.87 120.51 121.53 2wad n ALA 354 Ca 0.00 0.42 -0.42 0.00 0.00 0.00 0.00 53.44 53.43 2wad n ALA 354 Cb 0.00 -2.36 -0.03 0.00 0.00 0.00 0.00 19.45 17.06 2wad n ALA 354 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2wad s VAL 355 N 0.41 4.79 -0.09 0.00 1.01 -0.29 -0.88 120.40 125.36 2wad s VAL 355 Ca 0.72 1.78 -0.09 0.00 0.00 0.00 0.00 61.98 64.39 2wad s VAL 355 Cb -0.62 -4.20 -0.28 0.00 0.00 0.00 0.00 36.38 31.27 2wad s VAL 355 CO 0.44 -0.07 0.52 -0.07 0.00 0.00 0.00 175.10 175.91 2wad h LEU 356 N 8.89 0.51 -7.02 3.92 3.38 -1.15 -3.23 115.31 120.62 2wad h LEU 356 Ca -0.24 -0.94 -0.03 0.00 0.09 0.00 0.00 57.88 56.75 2wad h LEU 356 Cb 1.10 -0.17 -0.14 0.00 0.09 0.00 0.00 40.66 41.54 2wad h LEU 356 CO 0.89 1.82 0.19 -0.94 0.09 0.00 0.00 178.44 180.49 2wad s SER 357 N -7.17 -0.58 -0.31 -0.43 1.04 -1.05 -4.30 113.70 100.90 2wad s SER 357 Ca -0.19 0.21 -0.01 0.00 0.48 0.00 0.00 55.95 56.43 2wad s SER 357 Cb 0.06 0.57 0.10 0.00 0.10 0.00 0.00 66.02 66.86 2wad s SER 357 CO 0.81 -0.85 0.12 -0.04 0.98 0.00 0.00 173.24 174.26 2wad s MET 358 N -2.95 0.60 0.12 4.02 1.00 -1.26 -1.22 119.30 119.60 2wad s MET 358 Ca -0.03 -1.00 0.09 0.00 0.00 0.00 0.00 55.69 54.75 2wad s MET 358 Cb -0.01 -1.76 -0.04 0.00 0.00 0.00 0.00 34.83 33.03 2wad s MET 358 CO -0.06 -1.02 -0.18 -1.12 0.00 0.00 0.00 175.02 172.65 2wad s SER 359 N 1.64 3.90 -0.02 3.03 0.01 0.23 -4.66 113.70 117.84 2wad s SER 359 Ca 0.10 -0.55 -0.22 0.00 1.31 0.00 0.00 55.95 56.60 2wad s SER 359 Cb -0.18 -0.55 0.04 0.00 0.21 0.00 0.00 66.02 65.54 2wad s SER 359 CO -0.26 0.18 0.47 -0.83 0.41 0.00 0.00 173.24 173.21 2wad s GLY 360 N -2.14 -0.34 -0.08 3.44 0.00 -1.24 -1.01 107.32 105.94 2wad s GLY 360 Ca 0.18 0.72 -0.00 0.00 0.00 0.00 0.00 44.72 45.61 2wad s GLY 360 CO 0.10 0.44 -0.05 -2.27 0.00 0.00 0.00 173.10 171.33 2wad s LEU 361 N -1.34 1.01 -0.18 0.66 2.96 -0.56 0.01 118.68 121.24 2wad s LEU 361 Ca -0.12 -0.19 -0.09 0.00 -0.22 0.00 0.00 54.13 53.51 2wad s LEU 361 Cb -0.03 -0.63 -0.05 0.00 0.50 0.00 0.00 46.19 45.99 2wad s LEU 361 CO 0.06 -0.13 0.13 -0.75 -1.32 0.00 0.00 176.35 174.34 2wad s LYS 362 N 1.61 4.01 -0.29 1.98 2.20 0.14 -1.97 119.74 127.42 2wad s LYS 362 Ca 0.01 -0.21 -0.05 0.00 -0.36 0.00 0.00 55.97 55.36 2wad s LYS 362 Cb -0.13 -3.35 0.02 0.00 -1.51 0.00 0.00 37.83 32.86 2wad s LYS 362 CO -0.05 0.40 0.05 -1.58 -0.36 0.00 0.00 175.35 173.80 2wad s HIS 363 N 0.07 3.15 -0.17 4.03 5.65 -0.20 -0.94 115.29 126.88 2wad s HIS 363 Ca 0.09 -1.24 -0.29 0.00 0.25 0.00 0.00 55.06 53.86 2wad s HIS 363 Cb -0.11 -2.20 -0.01 0.00 -1.18 0.00 0.00 32.58 29.08 2wad s HIS 363 CO -0.01 -0.65 1.20 0.34 -0.65 0.00 0.00 174.74 174.97 2wad s ASP 364 N 1.43 7.00 0.00 9.88 -1.08 -0.61 -4.49 116.67 128.80 2wad s ASP 364 Ca 0.01 1.62 0.22 0.00 -0.52 0.00 0.00 52.55 53.87 2wad s ASP 364 Cb -0.18 -2.54 1.09 0.00 -1.46 0.00 0.00 42.92 39.83 2wad s ASP 364 CO 0.01 -0.72 1.71 0.18 0.52 0.00 0.00 175.17 176.87 2wad n LEU 365 N 6.40 0.00 -0.11 -1.34 4.77 -1.26 -0.92 117.00 124.54 2wad n LEU 365 Ca 0.13 0.31 -0.24 0.00 -0.03 0.00 0.00 56.01 56.19 2wad n LEU 365 Cb 0.45 -0.31 -0.11 0.00 -2.33 0.00 0.00 43.42 41.12 2wad n LEU 365 CO 0.55 -0.09 -1.18 0.29 -1.33 0.00 0.00 177.39 175.63 2wad n LYS 366 N -1.31 0.63 -0.01 3.23 5.02 -1.26 -4.69 118.16 119.77 2wad n LYS 366 Ca 0.10 0.28 0.09 0.00 -2.02 0.00 0.00 58.31 56.76 2wad n LYS 366 Cb 0.19 -1.57 -0.13 0.00 -0.02 0.00 0.00 35.03 33.49 2wad n LYS 366 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2wad n THR 367 N -3.86 0.00 0.00 -0.18 -2.24 -1.23 -4.99 114.28 101.78 2wad n THR 367 Ca -0.45 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.00 2wad n THR 367 Cb 0.91 0.34 0.00 0.00 -2.10 0.00 0.00 70.33 69.48 2wad n THR 367 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wad n GLY 368 N 1.43 2.21 3.77 3.38 0.00 -0.10 -5.03 105.19 110.85 2wad n GLY 368 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 2wad n GLY 368 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wad s GLU 369 N -0.41 3.98 -0.17 1.61 0.41 -1.26 -4.60 118.70 118.25 2wad s GLU 369 Ca 0.00 2.16 -0.06 0.00 -0.41 0.00 0.00 54.97 56.66 2wad s GLU 369 Cb 0.00 -2.77 -0.04 0.00 -1.78 0.00 0.00 34.13 29.55 2wad s GLU 369 CO 0.00 -0.49 0.03 -0.51 -0.49 0.00 0.00 175.26 173.81 2wad s LEU 370 N -2.41 3.66 -0.01 1.80 1.43 -1.26 -1.57 118.68 120.33 2wad s LEU 370 Ca 0.57 0.03 0.02 0.00 -1.03 0.00 0.00 54.13 53.71 2wad s LEU 370 Cb -0.38 -1.91 -0.00 0.00 0.03 0.00 0.00 46.19 43.92 2wad s LEU 370 CO 0.49 0.18 -0.06 0.42 0.23 0.00 0.00 176.35 177.61 2wad s THR 371 N 0.34 0.50 0.20 5.49 -4.23 -0.11 -4.95 115.64 112.88 2wad s THR 371 Ca 0.01 -0.26 -0.31 0.00 -1.18 0.00 0.00 61.69 59.95 2wad s THR 371 Cb -0.13 -0.43 -0.16 0.00 1.34 0.00 0.00 72.50 73.12 2wad s THR 371 CO 0.01 0.15 0.95 -0.81 -0.54 0.00 0.00 174.62 174.38 2wad n PRO 372 N 2.99 0.84 -2.84 3.99 -0.04 -1.26 0.29 135.00 138.97 2wad n PRO 372 Ca -0.14 0.30 -0.11 0.00 -0.04 0.00 0.00 63.50 63.51 2wad n PRO 372 Cb 0.57 -1.64 0.06 0.00 -0.04 0.00 0.00 33.50 32.45 2wad n PRO 372 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2wad n ASP 373 N 1.74 -0.98 -0.23 3.54 2.03 0.10 -4.69 116.55 118.06 2wad n ASP 373 Ca 0.15 -3.17 0.03 0.00 0.52 0.00 0.00 54.79 52.32 2wad n ASP 373 Cb 0.26 0.80 0.15 0.00 -0.72 0.00 0.00 41.12 41.60 2wad n ASP 373 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2wad h SER 374 N 2.81 0.28 0.33 1.67 0.02 -1.83 -1.84 113.55 114.98 2wad h SER 374 Ca -0.08 0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 2wad h SER 374 Cb 1.11 0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.72 2wad h SER 374 CO 0.23 0.14 -0.06 -0.07 -1.14 0.00 0.00 176.83 175.92 2wad h LEU 375 N 0.45 0.00 -1.94 5.07 3.38 -1.94 -1.74 115.31 118.59 2wad h LEU 375 Ca 0.36 0.00 0.33 0.00 0.09 0.00 0.00 57.88 58.66 2wad h LEU 375 Cb 0.49 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.19 2wad h LEU 375 CO -0.35 0.06 0.81 1.23 0.09 0.00 0.00 178.44 180.28 2wad h GLY 376 N 0.73 0.11 2.00 0.83 0.00 -1.73 -1.30 103.07 103.71 2wad h GLY 376 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.31 2wad h GLY 376 CO 0.01 -0.01 0.00 -0.91 0.00 0.00 0.00 176.54 175.62 2wad h THR 377 N 0.03 0.00 0.00 4.70 1.35 -1.47 -2.39 112.91 115.13 2wad h THR 377 Ca 0.55 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 66.20 2wad h THR 377 Cb 2.12 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 69.64 2wad h THR 377 CO -0.03 0.00 0.00 1.33 -0.25 0.00 0.00 175.52 176.57 2wad n VAL 378 N -2.87 0.00 -0.02 6.82 0.24 -0.73 -1.19 118.33 120.59 2wad n VAL 378 Ca -0.01 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.80 2wad n VAL 378 Cb 0.17 1.00 -0.05 0.00 -1.47 0.00 0.00 33.84 33.49 2wad n VAL 378 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2wad n THR 379 N -0.82 0.19 -3.98 3.34 -2.24 -0.57 -1.33 114.28 108.87 2wad n THR 379 Ca 0.00 -0.19 -0.29 0.00 -2.27 0.00 0.00 64.05 61.30 2wad n THR 379 Cb 0.00 -0.23 -0.05 0.00 -2.10 0.00 0.00 70.33 67.95 2wad n THR 379 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2wad s ASN 380 N -3.20 6.00 0.06 3.42 0.01 -0.91 -4.74 114.94 115.58 2wad s ASN 380 Ca -0.03 0.12 0.09 0.00 -0.71 0.00 0.00 52.86 52.33 2wad s ASN 380 Cb 0.03 -1.74 -0.03 0.00 0.41 0.00 0.00 41.25 39.92 2wad s ASN 380 CO 0.25 0.14 -0.25 0.68 -1.51 0.00 0.00 177.10 176.40 2wad s VAL 381 N -1.55 2.07 0.02 1.60 -7.23 -1.26 -4.12 120.40 109.93 2wad s VAL 381 Ca 0.33 -1.42 -0.00 0.00 -1.81 0.00 0.00 61.98 59.08 2wad s VAL 381 Cb -0.12 -1.78 -0.02 0.00 0.56 0.00 0.00 36.38 35.02 2wad s VAL 381 CO 0.26 0.29 -0.03 -0.36 -0.31 0.00 0.00 175.10 174.95 2wad s PHE 382 N -0.85 0.27 0.17 2.82 0.08 0.04 -4.82 117.98 115.69 2wad s PHE 382 Ca 0.11 -0.54 -0.31 0.00 0.12 0.00 0.00 56.93 56.30 2wad s PHE 382 Cb -0.10 -0.19 -0.10 0.00 -0.57 0.00 0.00 43.02 42.06 2wad s PHE 382 CO 0.03 -0.20 1.54 0.14 -0.10 0.00 0.00 175.22 176.63 2wad s VAL 383 N -1.55 2.69 -0.08 -0.44 -7.23 -1.26 -1.41 120.40 111.13 2wad s VAL 383 Ca -0.15 0.50 0.13 0.00 -1.81 0.00 0.00 61.98 60.65 2wad s VAL 383 Cb -0.09 -3.32 -0.03 0.00 0.56 0.00 0.00 36.38 33.49 2wad s VAL 383 CO -0.01 0.04 1.32 1.55 -0.31 0.00 0.00 175.10 177.69 2wad h PRO 384 N 6.68 0.00 0.00 4.82 0.13 -1.78 -3.48 132.00 138.37 2wad h PRO 384 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2wad h PRO 384 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2wad h PRO 384 CO 0.90 0.61 0.00 0.41 -0.23 0.00 0.00 178.00 179.69 2wad n GLY 385 N 1.28 0.07 0.00 1.56 0.00 -0.12 -4.08 105.19 103.90 2wad n GLY 385 Ca -0.00 -0.97 0.06 0.00 0.00 0.00 0.00 46.02 45.11 2wad n GLY 385 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2wad n SER 386 N -1.58 0.00 0.32 1.61 7.64 -1.25 -2.76 113.62 117.58 2wad n SER 386 Ca 0.00 0.15 0.19 0.00 1.01 0.00 0.00 58.87 60.22 2wad n SER 386 Cb 0.00 -0.30 1.06 0.00 -1.01 0.00 0.00 64.21 63.95 2wad n SER 386 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 2wad h VAL 387 N 0.00 0.19 -0.04 0.44 -1.51 -1.69 -2.94 116.25 110.70 2wad h VAL 387 Ca 0.00 -0.09 0.00 0.00 -1.23 0.00 0.00 66.70 65.38 2wad h VAL 387 Cb 0.12 1.08 0.00 0.00 -2.13 0.00 0.00 31.29 30.36 2wad h VAL 387 CO 0.00 0.01 0.00 1.33 -1.23 0.00 0.00 177.57 177.68 2wad n VAL 388 N -3.34 0.04 0.25 7.19 0.24 -1.11 -4.32 118.33 117.28 2wad n VAL 388 Ca -0.03 -0.15 0.11 0.00 -2.04 0.00 0.00 64.34 62.24 2wad n VAL 388 Cb 0.11 0.04 0.65 0.00 -1.47 0.00 0.00 33.84 33.17 2wad n VAL 388 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2wad h LYS 389 N 1.21 0.00 0.00 7.34 1.57 -1.80 -0.64 116.57 124.26 2wad h LYS 389 Ca 0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 2wad h LYS 389 Cb 0.26 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 2wad h LYS 389 CO 0.00 0.15 -0.37 0.00 -0.57 0.00 0.00 179.45 178.66 2wad h ALA 390 N 1.85 1.35 -0.02 3.86 0.00 -1.87 -2.58 119.26 121.86 2wad h ALA 390 Ca -0.00 -0.34 -0.21 0.00 0.00 0.00 0.00 54.91 54.36 2wad h ALA 390 Cb 0.43 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2wad h ALA 390 CO 0.02 0.46 -0.88 0.00 0.00 0.00 0.00 179.25 178.85 2wad h ALA 391 N 1.63 0.44 -0.18 0.00 0.00 -1.42 -2.66 119.26 117.07 2wad h ALA 391 Ca -0.00 -0.69 -0.02 0.00 0.00 0.00 0.00 54.91 54.20 2wad h ALA 391 Cb 0.67 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2wad h ALA 391 CO 0.05 0.82 0.04 1.15 0.00 0.00 0.00 179.25 181.31 2wad h THR 392 N 0.21 1.21 -0.80 0.00 2.02 -1.43 -2.49 112.91 111.63 2wad h THR 392 Ca -0.06 -0.66 0.06 0.00 0.77 0.00 0.00 66.41 66.52 2wad h THR 392 Cb 1.51 1.30 -0.06 0.00 -1.74 0.00 0.00 68.15 69.16 2wad h THR 392 CO 0.15 0.20 0.49 0.40 0.37 0.00 0.00 175.52 177.13 2wad h ILE 393 N 0.10 1.03 -0.97 3.11 2.04 -1.55 -0.98 117.51 120.29 2wad h ILE 393 Ca 0.06 -0.31 0.18 0.00 1.00 0.00 0.00 64.86 65.78 2wad h ILE 393 Cb 0.27 0.05 -0.09 0.00 -0.74 0.00 0.00 36.82 36.31 2wad h ILE 393 CO 0.00 0.16 0.61 0.28 0.00 0.00 0.00 178.15 179.21 2wad h SER 394 N 0.90 0.70 0.45 1.72 0.02 -1.28 -0.19 113.55 115.87 2wad h SER 394 Ca 0.35 0.07 -0.15 0.00 -0.84 0.00 0.00 61.79 61.22 2wad h SER 394 Cb 0.16 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 2wad h SER 394 CO -0.17 0.29 -0.64 -1.28 -1.14 0.00 0.00 176.83 173.89 2wad h SER 395 N 0.71 0.21 -0.51 3.07 0.87 -0.75 -0.81 113.55 116.34 2wad h SER 395 Ca 0.53 -0.13 -0.02 0.00 -1.23 0.00 0.00 61.79 60.94 2wad h SER 395 Cb 0.89 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.76 2wad h SER 395 CO -0.29 0.80 0.24 1.23 -0.53 0.00 0.00 176.83 178.27 2wad h GLY 396 N 1.61 0.80 0.90 5.77 0.00 -0.44 -0.66 103.07 111.04 2wad h GLY 396 Ca -0.01 -0.40 -0.04 0.00 0.00 0.00 0.00 47.33 46.88 2wad h GLY 396 CO 0.10 0.38 0.06 1.49 0.00 0.00 0.00 176.54 178.57 2wad h TRP 397 N 0.68 0.55 -0.81 5.60 6.55 -0.79 0.16 115.95 127.90 2wad h TRP 397 Ca 0.18 -0.07 -0.04 0.00 0.95 0.00 0.00 58.89 59.90 2wad h TRP 397 Cb 0.13 -0.15 -0.04 0.00 -0.86 0.00 0.00 29.16 28.25 2wad h TRP 397 CO -0.00 0.59 0.34 0.93 -1.05 0.00 0.00 178.44 179.24 2wad h GLU 398 N 0.35 1.19 -0.65 0.49 5.08 -0.94 -2.69 114.58 117.42 2wad h GLU 398 Ca 0.10 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2wad h GLU 398 Cb 0.33 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2wad h GLU 398 CO 0.00 0.95 0.00 0.09 -1.00 0.00 0.00 179.01 179.05 2wad n ASN 399 N -4.28 4.74 -0.46 1.42 3.02 -0.27 -4.90 115.26 114.52 2wad n ASN 399 Ca 0.07 -2.67 -0.06 0.00 -0.03 0.00 0.00 54.58 51.90 2wad n ASN 399 Cb 0.17 -0.62 -0.03 0.00 -0.61 0.00 0.00 39.78 38.70 2wad n ASN 399 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wad n GLY 400 N 0.67 0.80 0.11 7.41 0.00 -1.01 -4.88 105.19 108.29 2wad n GLY 400 Ca 0.23 -0.37 -0.15 0.00 0.00 0.00 0.00 46.02 45.73 2wad n GLY 400 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wad h VAL 401 N 0.00 0.97 -3.93 1.61 2.07 -0.94 -3.46 116.25 112.56 2wad h VAL 401 Ca -0.12 -2.69 -0.68 0.00 0.82 0.00 0.00 66.70 64.03 2wad h VAL 401 Cb 0.56 2.61 -0.22 0.00 -1.52 0.00 0.00 31.29 32.71 2wad h VAL 401 CO 0.18 0.75 -0.87 -0.76 0.02 0.00 0.00 177.57 176.89 2wad s LEU 402 N -6.72 2.31 -0.17 2.57 1.43 -0.85 -4.99 118.68 112.26 2wad s LEU 402 Ca -0.10 -0.74 -0.00 0.00 -1.03 0.00 0.00 54.13 52.26 2wad s LEU 402 Cb 0.07 -1.19 0.04 0.00 0.03 0.00 0.00 46.19 45.14 2wad s LEU 402 CO 0.82 0.17 -0.07 -0.55 0.23 0.00 0.00 176.35 176.96 2wad s SER 403 N -2.01 2.91 0.99 2.29 0.15 -1.26 -4.34 113.70 112.43 2wad s SER 403 Ca 0.13 -0.69 0.00 0.00 0.70 0.00 0.00 55.95 56.09 2wad s SER 403 Cb -0.10 -0.98 0.00 0.00 -1.71 0.00 0.00 66.02 63.23 2wad s SER 403 CO 0.06 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.94 2wad n GLY 404 N 4.84 1.36 2.43 9.45 0.00 -1.26 -3.34 105.19 118.67 2wad n GLY 404 Ca -0.13 -0.56 -0.40 0.00 0.00 0.00 0.00 46.02 44.93 2wad n GLY 404 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wad n ASN 405 N -2.29 7.74 -4.75 1.61 5.15 -1.26 -4.91 115.26 116.55 2wad n ASN 405 Ca 0.00 -2.73 -0.41 0.00 -0.60 0.00 0.00 54.58 50.83 2wad n ASN 405 Cb 0.00 -1.54 -0.02 0.00 -0.53 0.00 0.00 39.78 37.69 2wad n ASN 405 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 2wad s GLN 406 N 1.69 4.31 0.02 1.20 0.74 -1.21 -4.35 119.66 122.06 2wad s GLN 406 Ca 0.62 2.22 -0.26 0.00 0.05 0.00 0.00 55.36 57.99 2wad s GLN 406 Cb 0.17 -3.13 -0.05 0.00 1.10 0.00 0.00 33.01 31.10 2wad s GLN 406 CO -0.07 -0.34 0.82 0.99 -0.55 0.00 0.00 175.29 176.14 2wad s THR 407 N -0.10 4.79 0.24 -0.34 2.01 -1.26 -3.11 115.64 117.87 2wad s THR 407 Ca 0.57 1.74 0.05 0.00 0.31 0.00 0.00 61.69 64.37 2wad s THR 407 Cb -0.40 -4.17 -0.05 0.00 0.01 0.00 0.00 72.50 67.89 2wad s THR 407 CO 0.43 0.29 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.84 2wad s LEU 408 N 0.33 2.39 -0.24 4.42 1.43 -0.35 -4.94 118.68 121.72 2wad s LEU 408 Ca 0.42 -1.17 -0.21 0.00 -1.03 0.00 0.00 54.13 52.14 2wad s LEU 408 Cb -0.20 -0.48 -0.02 0.00 0.03 0.00 0.00 46.19 45.52 2wad s LEU 408 CO 0.24 -0.39 0.65 -0.89 0.23 0.00 0.00 176.35 176.19 2wad s THR 409 N -3.18 4.97 -0.23 5.49 2.01 -1.26 -1.05 115.64 122.39 2wad s THR 409 Ca 0.27 1.19 -0.29 0.00 0.31 0.00 0.00 61.69 63.17 2wad s THR 409 Cb 0.04 -3.96 -0.01 0.00 0.01 0.00 0.00 72.50 68.59 2wad s THR 409 CO 0.09 0.03 1.29 -0.62 -0.69 0.00 0.00 174.62 174.73 2wad s ASP 410 N 1.41 6.79 0.10 3.53 -1.08 0.16 -4.86 116.67 122.73 2wad s ASP 410 Ca 0.28 1.45 -0.16 0.00 -0.52 0.00 0.00 52.55 53.60 2wad s ASP 410 Cb -0.16 -2.54 0.03 0.00 -1.46 0.00 0.00 42.92 38.80 2wad s ASP 410 CO 0.09 -0.93 0.40 0.00 0.52 0.00 0.00 175.17 175.24 2wad s GLN 411 N 3.86 1.03 0.26 4.34 -2.07 -1.26 -1.53 119.66 124.28 2wad s GLN 411 Ca 0.56 -0.64 -0.30 0.00 -1.82 0.00 0.00 55.36 53.16 2wad s GLN 411 Cb -0.19 0.45 -0.11 0.00 -1.09 0.00 0.00 33.01 32.07 2wad s GLN 411 CO 0.19 -0.39 1.55 -2.14 -1.32 0.00 0.00 175.29 173.18 2wad s PRO 412 N -3.50 4.18 -0.27 9.60 0.02 -1.26 -4.69 135.00 139.08 2wad s PRO 412 Ca 0.01 2.47 -0.16 0.00 0.02 0.00 0.00 61.00 63.34 2wad s PRO 412 Cb 0.01 -3.07 -0.03 0.00 0.02 0.00 0.00 34.50 31.43 2wad s PRO 412 CO -0.10 -0.57 0.42 0.42 -0.33 0.00 0.00 177.00 176.84 2wad s ILE 413 N 0.23 5.14 -0.28 2.83 -1.09 -0.66 -4.89 121.20 122.47 2wad s ILE 413 Ca 0.64 0.66 0.02 0.00 -2.23 0.00 0.00 60.65 59.74 2wad s ILE 413 Cb -0.46 -3.74 0.08 0.00 -1.58 0.00 0.00 42.46 36.76 2wad s ILE 413 CO 0.43 0.13 -0.03 -0.69 -1.23 0.00 0.00 174.94 173.56 2wad s VAL 414 N 2.14 1.95 -0.10 2.92 1.01 -1.26 -0.91 120.40 126.15 2wad s VAL 414 Ca 0.17 -1.76 -0.09 0.00 0.00 0.00 0.00 61.98 60.30 2wad s VAL 414 Cb -0.16 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 2wad s VAL 414 CO 0.10 -0.29 0.19 -0.36 0.00 0.00 0.00 175.10 174.74 2wad s PHE 415 N 1.15 3.61 -0.24 5.22 0.08 -1.26 -1.50 117.98 125.03 2wad s PHE 415 Ca 0.00 0.61 -0.40 0.00 0.12 0.00 0.00 56.93 57.26 2wad s PHE 415 Cb -0.19 -2.02 -0.16 0.00 -0.57 0.00 0.00 43.02 40.07 2wad s PHE 415 CO -0.08 0.69 1.67 0.94 -0.10 0.00 0.00 175.22 178.34 2wad n GLN 416 N 2.06 1.06 -0.40 0.44 -0.06 -0.86 -2.69 117.38 116.93 2wad n GLN 416 Ca -0.18 0.39 0.00 0.00 -2.00 0.00 0.00 57.00 55.20 2wad n GLN 416 Cb 0.54 -2.05 0.00 0.00 -4.06 0.00 0.00 30.24 24.67 2wad n GLN 416 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2wad n GLY 417 N 3.93 0.77 3.48 1.69 0.00 -1.26 -4.83 105.19 108.98 2wad n GLY 417 Ca 0.26 -0.26 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2wad n GLY 417 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wad s SER 418 N -2.23 -0.07 0.60 1.61 1.04 -1.10 -5.16 113.70 108.39 2wad s SER 418 Ca 0.00 -0.87 -0.16 0.00 0.48 0.00 0.00 55.95 55.40 2wad s SER 418 Cb 0.00 0.53 -0.03 0.00 0.10 0.00 0.00 66.02 66.62 2wad s SER 418 CO 0.00 -1.04 1.06 0.00 0.98 0.00 0.00 173.24 174.24 2wad s ALA 419 N -3.99 2.74 0.47 5.32 0.00 -1.26 -4.64 121.76 120.40 2wad s ALA 419 Ca 0.20 0.38 -0.23 0.00 0.00 0.00 0.00 51.96 52.31 2wad s ALA 419 Cb 0.01 -3.23 -0.07 0.00 0.00 0.00 0.00 23.12 19.83 2wad s ALA 419 CO 0.05 -0.82 1.19 -2.14 0.00 0.00 0.00 175.76 174.04 2wad s PRO 420 N -4.12 3.69 -0.14 0.00 0.02 -1.26 -4.77 135.00 128.42 2wad s PRO 420 Ca 0.63 1.84 -0.16 0.00 0.02 0.00 0.00 61.00 63.34 2wad s PRO 420 Cb -0.16 -2.40 -0.04 0.00 0.02 0.00 0.00 34.50 31.92 2wad s PRO 420 CO 0.38 -0.63 0.38 0.42 -0.33 0.00 0.00 177.00 177.22 2wad s ILE 421 N -1.51 5.25 0.43 2.83 1.01 -0.09 -4.90 121.20 124.23 2wad s ILE 421 Ca 0.64 0.74 0.05 0.00 0.00 0.00 0.00 60.65 62.08 2wad s ILE 421 Cb -0.30 -3.72 -0.06 0.00 0.01 0.00 0.00 42.46 38.39 2wad s ILE 421 CO 0.37 0.36 0.01 -0.31 0.00 0.00 0.00 174.94 175.37 2wad s TYR 422 N 0.53 2.32 0.50 3.97 2.02 -1.26 -1.66 117.35 123.78 2wad s TYR 422 Ca 0.21 -0.77 0.07 0.00 -0.37 0.00 0.00 57.07 56.22 2wad s TYR 422 Cb -0.14 -1.70 0.03 0.00 -0.40 0.00 0.00 41.96 39.75 2wad s TYR 422 CO 0.07 0.36 0.49 -1.12 -1.57 0.00 0.00 175.55 173.78 2wad s SER 423 N -3.74 4.91 0.47 2.29 0.01 -1.26 -4.74 113.70 111.65 2wad s SER 423 Ca 0.28 -0.96 0.29 0.00 1.31 0.00 0.00 55.95 56.86 2wad s SER 423 Cb 0.08 0.03 1.36 0.00 0.21 0.00 0.00 66.02 67.69 2wad s SER 423 CO 0.14 -1.00 1.77 4.11 0.41 0.00 0.00 173.24 178.68 2wad h TRP 424 N 0.71 0.32 -0.00 2.43 5.08 -1.91 0.92 115.95 123.49 2wad h TRP 424 Ca -0.37 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.61 2wad h TRP 424 Cb 1.29 -0.09 0.00 0.00 -3.00 0.00 0.00 29.16 27.36 2wad h TRP 424 CO 0.68 0.01 -0.00 2.48 -1.28 0.00 0.00 178.44 180.33 2wad n TYR 425 N -4.41 0.00 0.00 0.12 4.11 -1.26 -4.97 117.16 110.75 2wad n TYR 425 Ca 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 58.17 2wad n TYR 425 Cb 1.12 -0.00 0.00 0.00 -0.00 0.00 0.00 39.34 40.45 2wad n TYR 425 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 2wad n LYS 426 N -0.69 0.00 -0.11 -3.48 4.76 0.32 -1.51 118.16 117.44 2wad n LYS 426 Ca 0.23 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.78 2wad n LYS 426 Cb 0.18 0.00 0.23 0.00 -1.84 0.00 0.00 35.03 33.60 2wad n LYS 426 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2wad n LEU 427 N 0.00 2.96 -0.34 -0.35 4.77 -1.26 -4.63 117.00 118.15 2wad n LEU 427 Ca 0.00 -1.19 0.16 0.00 -0.03 0.00 0.00 56.01 54.95 2wad n LEU 427 Cb 0.00 -0.15 0.38 0.00 -2.33 0.00 0.00 43.42 41.32 2wad n LEU 427 CO 0.00 0.59 1.20 0.00 -1.33 0.00 0.00 177.39 177.85 2wad h ALA 428 N 4.49 1.83 -0.32 -1.18 0.00 -1.69 -1.87 119.26 120.52 2wad h ALA 428 Ca 0.00 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 2wad h ALA 428 Cb 0.88 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 2wad h ALA 428 CO 0.00 -0.21 0.01 0.66 0.00 0.00 0.00 179.25 179.70 2wad n TYR 429 N -4.74 1.09 -2.10 0.00 4.01 -1.26 -5.08 117.16 109.08 2wad n TYR 429 Ca 0.24 -1.15 0.00 0.00 -0.16 0.00 0.00 57.90 56.83 2wad n TYR 429 Cb 0.66 -0.40 0.00 0.00 -0.31 0.00 0.00 39.34 39.29 2wad n TYR 429 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wad n GLY 430 N -0.73 0.90 3.91 2.72 0.00 -0.71 -4.62 105.19 106.66 2wad n GLY 430 Ca 0.27 -0.63 -0.30 0.00 0.00 0.00 0.00 46.02 45.36 2wad n GLY 430 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wad s SER 431 N -4.00 6.44 -0.11 1.61 0.01 -1.26 -4.87 113.70 111.52 2wad s SER 431 Ca 0.00 0.50 -0.30 0.00 1.31 0.00 0.00 55.95 57.46 2wad s SER 431 Cb 0.00 -2.05 0.12 0.00 0.21 0.00 0.00 66.02 64.30 2wad s SER 431 CO 0.00 0.03 0.98 0.72 0.41 0.00 0.00 173.24 175.38 2wad s PHE 432 N -1.72 -0.34 0.38 2.43 -0.71 -0.58 -4.98 117.98 112.46 2wad s PHE 432 Ca 0.40 0.45 -0.26 0.00 -1.04 0.00 0.00 56.93 56.48 2wad s PHE 432 Cb -0.12 0.48 -0.09 0.00 -1.21 0.00 0.00 43.02 42.09 2wad s PHE 432 CO 0.26 -0.40 1.17 -1.25 -1.34 0.00 0.00 175.22 173.67 2wad s PRO 433 N -1.87 4.13 -0.11 1.99 0.04 -1.26 0.39 135.00 138.31 2wad s PRO 433 Ca 0.01 1.85 -0.08 0.00 0.04 0.00 0.00 61.00 62.83 2wad s PRO 433 Cb -0.01 -2.74 0.04 0.00 0.04 0.00 0.00 34.50 31.83 2wad s PRO 433 CO -0.02 -0.25 0.28 -1.50 0.04 0.00 0.00 177.00 175.54 2wad s ILE 434 N -1.38 -0.02 0.75 0.56 2.07 -0.21 -4.82 121.20 118.15 2wad s ILE 434 Ca 0.55 0.07 -0.05 0.00 -1.41 0.00 0.00 60.65 59.82 2wad s ILE 434 Cb -0.31 -0.41 0.12 0.00 0.13 0.00 0.00 42.46 41.99 2wad s ILE 434 CO 0.39 0.03 1.05 0.42 -1.91 0.00 0.00 174.94 174.92 2wad s THR 435 N 0.76 2.19 0.17 4.00 -4.23 -1.26 -1.22 115.64 116.05 2wad s THR 435 Ca -0.05 -0.41 -0.11 0.00 -1.18 0.00 0.00 61.69 59.94 2wad s THR 435 Cb -0.06 -2.78 0.06 0.00 1.34 0.00 0.00 72.50 71.06 2wad s THR 435 CO -0.05 0.00 1.67 0.00 -0.54 0.00 0.00 174.62 175.70 2wad h ALA 436 N -0.72 0.77 -0.63 3.99 0.00 -1.74 0.37 119.26 121.31 2wad h ALA 436 Ca -0.40 -0.24 0.07 0.00 0.00 0.00 0.00 54.91 54.34 2wad h ALA 436 Cb 1.27 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 2wad h ALA 436 CO 0.45 0.50 0.31 0.28 0.00 0.00 0.00 179.25 180.79 2wad h VAL 437 N 0.86 0.89 0.01 0.00 2.07 -1.91 -2.31 116.25 115.86 2wad h VAL 437 Ca 0.18 -0.19 -0.26 0.00 0.82 0.00 0.00 66.70 67.25 2wad h VAL 437 Cb 0.38 0.28 0.02 0.00 -1.52 0.00 0.00 31.29 30.45 2wad h VAL 437 CO 0.01 0.10 -1.04 -0.33 0.02 0.00 0.00 177.57 176.33 2wad h GLU 438 N 0.55 0.61 -0.87 1.57 5.08 -1.85 -1.43 114.58 118.24 2wad h GLU 438 Ca 0.30 -0.68 0.23 0.00 -1.00 0.00 0.00 59.36 58.21 2wad h GLU 438 Cb 0.27 0.20 -0.14 0.00 0.50 0.00 0.00 28.75 29.58 2wad h GLU 438 CO -0.23 1.27 0.24 0.00 -1.00 0.00 0.00 179.01 179.30 2wad h ALA 439 N 0.49 1.26 -0.07 3.43 0.00 -0.10 0.15 119.26 124.42 2wad h ALA 439 Ca -0.12 0.22 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 2wad h ALA 439 Cb 1.69 0.30 0.01 0.00 0.00 0.00 0.00 17.79 19.79 2wad h ALA 439 CO 0.20 -0.45 -0.54 -0.07 0.00 0.00 0.00 179.25 178.39 2wad h LEU 440 N 0.23 0.59 -0.61 0.00 3.38 -1.04 -0.67 115.31 117.19 2wad h LEU 440 Ca 0.54 -0.68 0.10 0.00 0.09 0.00 0.00 57.88 57.93 2wad h LEU 440 Cb 1.08 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.58 2wad h LEU 440 CO -0.64 1.18 0.21 -0.08 0.09 0.00 0.00 178.44 179.20 2wad h GLU 441 N 0.04 0.37 0.00 1.13 4.81 -0.42 -2.76 114.58 117.76 2wad h GLU 441 Ca -0.05 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 2wad h GLU 441 Cb 1.20 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.50 2wad h GLU 441 CO 0.11 0.24 -0.98 0.66 -0.73 0.00 0.00 179.01 178.32 2wad n TYR 442 N -5.02 0.05 -3.31 0.92 4.01 0.46 -2.40 117.16 111.87 2wad n TYR 442 Ca 0.09 0.01 -0.16 0.00 -0.16 0.00 0.00 57.90 57.68 2wad n TYR 442 Cb 0.28 -0.17 0.08 0.00 -0.31 0.00 0.00 39.34 39.22 2wad n TYR 442 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2wad n SER 443 N -1.64 -4.78 -4.70 7.72 2.88 -0.43 -4.88 113.62 107.79 2wad n SER 443 Ca 0.03 -0.67 -0.42 0.00 -1.33 0.00 0.00 58.87 56.48 2wad n SER 443 Cb 0.37 -5.15 -0.03 0.00 -0.75 0.00 0.00 64.21 58.65 2wad n SER 443 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2wad s SER 444 N -3.78 6.88 0.09 -3.46 0.15 -0.39 -4.75 113.70 108.44 2wad s SER 444 Ca 0.27 2.12 -0.07 0.00 0.70 0.00 0.00 55.95 58.97 2wad s SER 444 Cb -0.04 -2.57 -0.22 0.00 -1.71 0.00 0.00 66.02 61.49 2wad s SER 444 CO 0.73 -0.67 1.19 0.78 1.20 0.00 0.00 173.24 176.46 2wad h ASN 445 N 7.52 0.59 -1.00 5.45 2.35 -1.91 -3.32 115.58 125.26 2wad h ASN 445 Ca -0.39 -0.55 0.14 0.00 -0.55 0.00 0.00 56.30 54.95 2wad h ASN 445 Cb 1.19 -0.19 -0.09 0.00 0.05 0.00 0.00 38.32 39.28 2wad h ASN 445 CO 0.88 1.39 0.63 0.00 -1.65 0.00 0.00 177.43 178.68 2wad h ALA 446 N 0.55 1.58 0.06 -0.83 0.00 -1.88 -0.95 119.26 117.79 2wad h ALA 446 Ca -0.13 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2wad h ALA 446 Cb 1.83 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.45 2wad h ALA 446 CO 0.20 0.14 -0.03 -0.92 0.00 0.00 0.00 179.25 178.64 2wad h TYR 447 N 0.92 -0.08 0.00 0.00 3.20 -1.89 -2.13 116.97 116.99 2wad h TYR 447 Ca 0.52 -0.00 -0.10 0.00 3.14 0.00 0.00 58.73 62.29 2wad h TYR 447 Cb 0.62 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.90 2wad h TYR 447 CO -0.00 0.14 -0.48 -0.39 -1.64 0.00 0.00 178.16 175.78 2wad h VAL 448 N -0.29 1.07 -0.15 1.81 -1.51 -1.64 -1.50 116.25 114.04 2wad h VAL 448 Ca -0.01 -1.85 -0.20 0.00 -1.23 0.00 0.00 66.70 63.41 2wad h VAL 448 Cb 0.25 2.08 0.00 0.00 -2.13 0.00 0.00 31.29 31.50 2wad h VAL 448 CO 0.01 0.47 -0.71 0.58 -1.23 0.00 0.00 177.57 176.70 2wad h VAL 449 N 0.00 1.31 -0.37 7.19 2.07 -1.20 -1.46 116.25 123.80 2wad h VAL 449 Ca -0.00 -1.98 -0.13 0.00 0.82 0.00 0.00 66.70 65.40 2wad h VAL 449 Cb 1.04 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 2wad h VAL 449 CO 0.06 0.62 -0.29 1.56 0.02 0.00 0.00 177.57 179.54 2wad h GLN 450 N 0.46 0.84 -0.63 1.57 4.20 -1.28 -0.39 115.11 119.88 2wad h GLN 450 Ca -0.03 -0.42 0.10 0.00 0.06 0.00 0.00 58.65 58.36 2wad h GLN 450 Cb 1.31 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 29.02 2wad h GLN 450 CO 0.14 1.05 0.24 1.15 -0.67 0.00 0.00 178.83 180.74 2wad h THR 451 N 0.64 0.76 -0.33 -0.54 2.02 -1.30 -1.84 112.91 112.32 2wad h THR 451 Ca 0.07 -0.14 -0.18 0.00 0.77 0.00 0.00 66.41 66.93 2wad h THR 451 Cb 0.86 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 67.57 2wad h THR 451 CO 0.08 0.08 -0.48 0.00 0.37 0.00 0.00 175.52 175.56 2wad h ALA 452 N 1.43 0.50 -1.01 6.16 0.00 -0.99 -1.93 119.26 123.42 2wad h ALA 452 Ca 0.32 -0.49 0.11 0.00 0.00 0.00 0.00 54.91 54.85 2wad h ALA 452 Cb 0.40 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.02 2wad h ALA 452 CO -0.32 0.67 0.64 1.25 0.00 0.00 0.00 179.25 181.49 2wad h LEU 453 N 0.70 0.95 -0.78 0.00 5.85 -0.85 -2.50 115.31 118.68 2wad h LEU 453 Ca 0.03 0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.70 2wad h LEU 453 Cb 1.09 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 2wad h LEU 453 CO 0.11 0.53 -0.08 1.23 -0.34 0.00 0.00 178.44 179.89 2wad h GLY 454 N 1.04 0.90 2.00 3.75 0.00 -0.84 -1.58 103.07 108.34 2wad h GLY 454 Ca 0.48 -0.67 -0.03 0.00 0.00 0.00 0.00 47.33 47.12 2wad h GLY 454 CO -0.25 0.62 -0.14 -2.22 0.00 0.00 0.00 176.54 174.55 2wad h ILE 455 N 0.76 0.92 -0.21 2.60 2.04 -0.95 0.09 117.51 122.75 2wad h ILE 455 Ca 0.13 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.50 2wad h ILE 455 Cb 0.58 1.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.94 2wad h ILE 455 CO 0.04 0.13 0.00 0.80 0.00 0.00 0.00 178.15 179.12 2wad n MET 456 N -4.12 1.61 -1.00 2.37 1.56 -0.89 -4.65 117.12 112.01 2wad n MET 456 Ca -0.02 -0.81 0.00 0.00 -0.27 0.00 0.00 57.70 56.59 2wad n MET 456 Cb 0.22 -1.26 0.00 0.00 2.15 0.00 0.00 33.22 34.33 2wad n MET 456 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2wad n GLY 457 N 0.74 0.41 3.52 -5.12 0.00 0.02 -4.70 105.19 100.07 2wad n GLY 457 Ca 0.07 -0.78 -0.25 0.00 0.00 0.00 0.00 46.02 45.06 2wad n GLY 457 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wad s GLN 458 N -1.42 1.76 -0.08 1.61 -0.21 -0.65 -4.99 119.66 115.69 2wad s GLN 458 Ca 0.00 -1.88 0.04 0.00 0.02 0.00 0.00 55.36 53.55 2wad s GLN 458 Cb 0.00 -1.72 -0.01 0.00 1.00 0.00 0.00 33.01 32.29 2wad s GLN 458 CO 0.00 0.21 -0.22 0.99 -2.12 0.00 0.00 175.29 174.14 2wad s THR 459 N -2.58 2.29 0.24 -0.19 2.01 -1.26 -2.85 115.64 113.29 2wad s THR 459 Ca 0.32 -0.97 -0.31 0.00 0.31 0.00 0.00 61.69 61.04 2wad s THR 459 Cb -0.00 -1.87 -0.12 0.00 0.01 0.00 0.00 72.50 70.52 2wad s THR 459 CO 0.16 0.56 1.64 0.00 -0.69 0.00 0.00 174.62 176.29 2wad n TYR 460 N 3.13 2.70 -3.90 4.92 9.36 -1.26 -5.01 117.16 127.10 2wad n TYR 460 Ca -0.18 0.16 -0.12 0.00 3.32 0.00 0.00 57.90 61.08 2wad n TYR 460 Cb 0.52 -2.62 -0.14 0.00 -0.63 0.00 0.00 39.34 36.47 2wad n TYR 460 CO 0.00 0.00 0.00 1.14 0.22 0.00 0.00 176.86 178.22 2wad s GLN 461 N 0.44 0.05 0.63 2.98 0.00 -1.26 -5.13 119.66 117.37 2wad s GLN 461 Ca 0.71 -0.02 -0.18 0.00 -0.00 0.00 0.00 55.36 55.87 2wad s GLN 461 Cb -0.53 -0.05 -0.03 0.00 0.00 0.00 0.00 33.01 32.40 2wad s GLN 461 CO 0.40 0.01 1.05 -2.30 0.00 0.00 0.00 175.29 174.45 2wad n PRO 462 N 3.07 0.90 -1.51 9.60 -0.02 -1.26 -2.29 135.00 143.49 2wad n PRO 462 Ca -0.12 0.36 -0.17 0.00 -2.02 0.00 0.00 63.50 61.54 2wad n PRO 462 Cb 0.60 -2.28 -0.07 0.00 -0.02 0.00 0.00 33.50 31.73 2wad n PRO 462 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2wad n ASN 463 N -1.21 -5.38 -4.77 2.55 3.02 -0.57 -4.96 115.26 103.96 2wad n ASN 463 Ca 0.15 0.43 -0.41 0.00 -0.03 0.00 0.00 54.58 54.72 2wad n ASN 463 Cb 0.48 -4.42 -0.02 0.00 -0.61 0.00 0.00 39.78 35.21 2wad n ASN 463 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wad s MET 464 N -3.47 4.28 -0.12 3.52 0.23 -0.97 -4.49 119.30 118.29 2wad s MET 464 Ca 0.00 2.32 -0.30 0.00 -1.03 0.00 0.00 55.69 56.68 2wad s MET 464 Cb 0.00 -3.06 -0.02 0.00 -1.53 0.00 0.00 34.83 30.22 2wad s MET 464 CO 0.00 -0.33 1.16 -0.06 -2.03 0.00 0.00 175.02 173.76 2wad s PHE 465 N -0.83 3.18 -0.11 3.16 0.08 -1.26 -2.02 117.98 120.19 2wad s PHE 465 Ca 0.53 1.27 -0.28 0.00 0.12 0.00 0.00 56.93 58.56 2wad s PHE 465 Cb -0.42 -3.38 -0.02 0.00 -0.57 0.00 0.00 43.02 38.64 2wad s PHE 465 CO 0.53 -1.10 0.93 0.54 -0.10 0.00 0.00 175.22 176.02 2wad s VAL 466 N 2.63 4.84 -0.25 -0.44 0.11 -1.26 -5.03 120.40 121.00 2wad s VAL 466 Ca 0.53 1.89 -0.16 0.00 -2.93 0.00 0.00 61.98 61.30 2wad s VAL 466 Cb -0.21 -4.25 -0.03 0.00 -1.53 0.00 0.00 36.38 30.36 2wad s VAL 466 CO 0.17 0.05 0.43 -0.83 -3.33 0.00 0.00 175.10 171.59 2wad s GLY 467 N 1.08 1.91 -0.32 6.54 0.00 -1.26 -4.99 107.32 110.28 2wad s GLY 467 Ca 0.45 -0.67 0.06 0.00 0.00 0.00 0.00 44.72 44.56 2wad s GLY 467 CO 0.18 1.04 1.70 -1.30 0.00 0.00 0.00 173.10 174.72 2wad n THR 468 N 4.96 2.69 0.13 0.90 -2.24 -1.26 -4.53 114.28 114.93 2wad n THR 468 Ca -0.07 -1.47 -0.02 0.00 -2.27 0.00 0.00 64.05 60.22 2wad n THR 468 Cb 0.50 -0.46 0.18 0.00 -2.10 0.00 0.00 70.33 68.45 2wad n THR 468 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2wad h SER 469 N 1.79 0.06 -0.83 3.42 4.64 -1.95 -2.69 113.55 117.99 2wad h SER 469 Ca 0.34 -0.03 -0.40 0.00 -0.47 0.00 0.00 61.79 61.23 2wad h SER 469 Cb 2.30 -0.02 -0.24 0.00 -0.31 0.00 0.00 62.40 64.13 2wad h SER 469 CO 0.75 0.63 0.45 0.59 -0.87 0.00 0.00 176.83 178.38 2wad n ASN 470 N -3.85 3.71 -0.01 4.97 3.02 -1.26 -4.70 115.26 117.14 2wad n ASN 470 Ca -0.01 -3.57 -0.13 0.00 -0.03 0.00 0.00 54.58 50.84 2wad n ASN 470 Cb 0.59 -0.78 -0.09 0.00 -0.61 0.00 0.00 39.78 38.89 2wad n ASN 470 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2wad h LEU 471 N 1.29 0.03 -0.27 3.41 5.85 -1.80 -1.69 115.31 122.14 2wad h LEU 471 Ca 0.49 -0.39 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 2wad h LEU 471 Cb 2.55 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 43.56 2wad h LEU 471 CO 0.91 0.41 0.08 -0.33 -0.34 0.00 0.00 178.44 179.16 2wad h GLU 472 N -0.35 0.42 -0.79 1.25 5.08 -1.84 -0.97 114.58 117.39 2wad h GLU 472 Ca 0.00 -0.09 0.01 0.00 -1.00 0.00 0.00 59.36 58.28 2wad h GLU 472 Cb 0.40 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.55 2wad h GLU 472 CO 0.00 0.50 0.52 1.03 -1.00 0.00 0.00 179.01 180.06 2wad h SER 473 N 0.27 0.90 0.16 1.42 0.87 -1.89 0.04 113.55 115.32 2wad h SER 473 Ca 0.09 -0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.62 2wad h SER 473 Cb 0.26 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 2wad h SER 473 CO -0.00 0.64 -0.08 0.00 -0.53 0.00 0.00 176.83 176.86 2wad h ALA 474 N 1.30 -0.22 -0.95 6.23 0.00 -1.15 -1.43 119.26 123.04 2wad h ALA 474 Ca 0.29 -0.15 0.09 0.00 0.00 0.00 0.00 54.91 55.15 2wad h ALA 474 Cb -0.10 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.70 2wad h ALA 474 CO -0.07 -0.50 0.61 1.98 0.00 0.00 0.00 179.25 181.27 2wad h MET 475 N -0.47 0.98 -0.86 0.00 -1.53 -1.07 0.35 114.93 112.32 2wad h MET 475 Ca -0.02 -0.06 -0.00 0.00 -3.44 0.00 0.00 59.70 56.18 2wad h MET 475 Cb 0.36 -0.22 -0.04 0.00 -0.55 0.00 0.00 31.60 31.15 2wad h MET 475 CO 0.04 0.65 0.53 0.78 0.14 0.00 0.00 176.91 179.04 2wad h GLY 476 N 1.00 1.24 0.93 1.39 0.00 -0.91 -0.96 103.07 105.78 2wad h GLY 476 Ca 0.44 -0.51 -0.06 0.00 0.00 0.00 0.00 47.33 47.20 2wad h GLY 476 CO -0.19 0.49 0.01 0.50 0.00 0.00 0.00 176.54 177.34 2wad h LYS 477 N 1.18 0.67 -0.20 4.80 1.57 -0.47 -0.62 116.57 123.50 2wad h LYS 477 Ca 0.31 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 2wad h LYS 477 Cb -0.06 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 2wad h LYS 477 CO -0.06 0.76 0.10 1.25 -0.57 0.00 0.00 179.45 180.93 2wad h LEU 478 N 0.49 0.25 -1.10 2.94 5.85 -0.83 -2.51 115.31 120.39 2wad h LEU 478 Ca 0.11 -0.11 -0.08 0.00 0.84 0.00 0.00 57.88 58.63 2wad h LEU 478 Cb 0.46 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 2wad h LEU 478 CO 0.02 0.29 -0.39 0.03 -0.34 0.00 0.00 178.44 178.06 2wad h ARG 479 N 0.20 0.00 -0.40 1.25 3.08 -1.09 -1.70 114.38 115.71 2wad h ARG 479 Ca 0.07 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.04 2wad h ARG 479 Cb 0.10 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 2wad h ARG 479 CO -0.01 0.39 -0.05 1.03 -1.07 0.00 0.00 179.97 180.25 2wad h SER 480 N 0.00 0.74 -0.33 7.04 0.87 -0.94 0.41 113.55 121.33 2wad h SER 480 Ca -0.00 -0.34 -0.02 0.00 -1.23 0.00 0.00 61.79 60.19 2wad h SER 480 Cb 0.80 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.55 2wad h SER 480 CO 0.05 0.90 0.12 0.74 -0.53 0.00 0.00 176.83 178.11 2wad h THR 481 N 0.56 1.20 -0.72 2.23 2.02 -1.15 -2.65 112.91 114.39 2wad h THR 481 Ca 0.11 -0.62 0.10 0.00 0.77 0.00 0.00 66.41 66.77 2wad h THR 481 Cb 0.56 0.99 -0.08 0.00 -1.74 0.00 0.00 68.15 67.88 2wad h THR 481 CO 0.03 0.21 0.34 -0.26 0.37 0.00 0.00 175.52 176.22 2wad h PHE 482 N 0.38 0.61 0.00 3.16 0.04 -1.10 -1.83 116.94 118.19 2wad h PHE 482 Ca 0.11 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.89 2wad h PHE 482 Cb 0.22 -0.16 -0.00 0.00 2.20 0.00 0.00 35.95 38.20 2wad h PHE 482 CO 0.00 0.19 -0.10 0.78 -0.60 0.00 0.00 178.31 178.58 2wad h GLY 483 N 0.56 0.00 2.00 -1.45 0.00 -0.76 -0.74 103.07 102.68 2wad h GLY 483 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.69 2wad h GLY 483 CO -0.30 0.00 0.00 0.83 0.00 0.00 0.00 176.54 177.07 2wad h GLU 484 N 0.00 0.00 -0.02 4.80 5.08 -0.97 -2.29 114.58 121.19 2wad h GLU 484 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2wad h GLU 484 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2wad h GLU 484 CO 0.01 0.00 -0.20 0.66 -1.00 0.00 0.00 179.01 178.49 2wad n TYR 485 N -2.52 0.00 -0.30 4.33 4.01 -0.55 -4.68 117.16 117.45 2wad n TYR 485 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 2wad n TYR 485 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.28 2wad n TYR 485 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wad n GLY 486 N 1.18 0.73 3.47 2.72 0.00 -0.86 -2.73 105.19 109.69 2wad n GLY 486 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 2wad n GLY 486 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wad s LEU 487 N 0.00 4.26 0.00 0.99 1.43 -0.40 -3.71 118.68 121.26 2wad s LEU 487 Ca 0.00 -0.89 0.00 0.00 -1.03 0.00 0.00 54.13 52.21 2wad s LEU 487 Cb 0.00 -2.46 0.00 0.00 0.03 0.00 0.00 46.19 43.76 2wad s LEU 487 CO 0.00 -1.46 0.00 0.61 0.23 0.00 0.00 176.35 175.73 2wad n GLY 488 N 5.31 0.72 3.39 -3.19 0.00 -1.26 -3.00 105.19 107.16 2wad n GLY 488 Ca -0.03 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.80 2wad n GLY 488 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wad s SER 489 N -2.57 1.91 0.39 1.61 1.04 -1.24 -4.84 113.70 109.99 2wad s SER 489 Ca 0.00 -1.35 -0.27 0.00 0.48 0.00 0.00 55.95 54.81 2wad s SER 489 Cb 0.00 0.01 -0.10 0.00 0.10 0.00 0.00 66.02 66.03 2wad s SER 489 CO 0.00 -0.62 1.41 0.00 0.98 0.00 0.00 173.24 175.01 2wad s ALA 490 N -3.46 3.44 -0.07 5.32 0.00 -1.26 -4.85 121.76 120.88 2wad s ALA 490 Ca 0.35 1.44 0.13 0.00 0.00 0.00 0.00 51.96 53.89 2wad s ALA 490 Cb 0.08 -3.56 -0.08 0.00 0.00 0.00 0.00 23.12 19.55 2wad s ALA 490 CO 0.14 -0.97 1.16 1.79 0.00 0.00 0.00 175.76 177.87 2wad h THR 491 N 2.76 0.96 0.00 0.00 1.35 -1.91 -3.47 112.91 112.60 2wad h THR 491 Ca -0.50 -2.49 0.00 0.00 -0.55 0.00 0.00 66.41 62.87 2wad h THR 491 Cb 1.24 2.42 0.00 0.00 -1.73 0.00 0.00 68.15 70.08 2wad h THR 491 CO 0.63 0.55 0.00 0.61 -0.25 0.00 0.00 175.52 177.06 2wad n GLY 492 N 1.33 0.48 3.43 5.82 0.00 -1.26 -4.25 105.19 110.74 2wad n GLY 492 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 2wad n GLY 492 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2wad n ILE 493 N -2.00 1.61 -1.45 -0.61 0.13 -1.25 -4.62 119.36 111.17 2wad n ILE 493 Ca 0.00 -0.50 -0.29 0.00 -1.10 0.00 0.00 62.75 60.86 2wad n ILE 493 Cb 0.00 -0.40 -0.07 0.00 -0.84 0.00 0.00 39.64 38.34 2wad n ILE 493 CO 0.00 0.00 0.00 -0.90 2.80 0.00 0.00 176.55 178.45 2wad n ASP 494 N 1.59 7.05 -4.39 9.51 5.75 -1.23 -4.85 116.55 129.98 2wad n ASP 494 Ca 0.12 -2.86 -0.21 0.00 -0.01 0.00 0.00 54.79 51.83 2wad n ASP 494 Cb 0.36 -1.39 -0.10 0.00 -1.03 0.00 0.00 41.12 38.97 2wad n ASP 494 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2wad s LEU 495 N -1.08 2.55 0.34 -2.12 1.43 -1.26 -4.82 118.68 113.72 2wad s LEU 495 Ca 0.62 -1.00 0.07 0.00 -1.03 0.00 0.00 54.13 52.79 2wad s LEU 495 Cb 0.27 -0.85 0.60 0.00 0.03 0.00 0.00 46.19 46.24 2wad s LEU 495 CO -0.10 -0.08 1.81 -0.65 0.23 0.00 0.00 176.35 177.57 2wad h PRO 496 N 2.54 0.30 -2.19 1.29 0.11 -1.89 -3.43 132.00 128.74 2wad h PRO 496 Ca -0.39 -0.10 -0.25 0.00 0.11 0.00 0.00 66.00 65.37 2wad h PRO 496 Cb 1.23 -0.03 -0.33 0.00 0.11 0.00 0.00 31.00 31.99 2wad h PRO 496 CO 0.60 0.52 -0.57 0.34 -0.21 0.00 0.00 178.00 178.68 2wad s ASP 497 N -6.85 0.99 0.14 -2.05 2.15 -1.26 -5.13 116.67 104.65 2wad s ASP 497 Ca -0.05 -0.18 0.06 0.00 0.43 0.00 0.00 52.55 52.81 2wad s ASP 497 Cb 0.14 0.70 -0.04 0.00 -0.30 0.00 0.00 42.92 43.43 2wad s ASP 497 CO 0.76 -0.33 0.03 -1.83 -0.17 0.00 0.00 175.17 173.62 2wad s GLU 498 N 2.42 2.56 0.38 4.34 -1.05 -1.26 -4.93 118.70 121.16 2wad s GLU 498 Ca 0.10 -0.94 -0.25 0.00 -0.15 0.00 0.00 54.97 53.73 2wad s GLU 498 Cb -0.15 -2.49 -0.09 0.00 -0.44 0.00 0.00 34.13 30.95 2wad s GLU 498 CO -0.18 0.50 1.02 0.45 0.95 0.00 0.00 175.26 178.00 2wad s SER 499 N -2.70 6.91 -0.04 0.83 0.15 -0.44 -4.96 113.70 113.46 2wad s SER 499 Ca 0.27 1.99 0.13 0.00 0.70 0.00 0.00 55.95 59.04 2wad s SER 499 Cb -0.10 -2.58 0.38 0.00 -1.71 0.00 0.00 66.02 62.00 2wad s SER 499 CO 0.19 -0.38 1.31 0.35 1.20 0.00 0.00 173.24 175.91 2wad n THR 500 N 0.09 1.25 0.00 6.45 -2.24 -1.26 -4.87 114.28 113.70 2wad n THR 500 Ca 0.04 -1.16 0.00 0.00 -2.27 0.00 0.00 64.05 60.66 2wad n THR 500 Cb 0.50 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 2wad n THR 500 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wad n GLY 501 N 0.42 -1.80 3.12 3.38 0.00 -1.26 -3.97 105.19 105.08 2wad n GLY 501 Ca 0.14 -2.22 -0.37 0.00 0.00 0.00 0.00 46.02 43.58 2wad n GLY 501 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wad s LEU 502 N 0.00 5.29 -0.52 0.99 0.20 -0.55 -4.99 118.68 119.10 2wad s LEU 502 Ca 0.00 -2.14 0.03 0.00 0.69 0.00 0.00 54.13 52.72 2wad s LEU 502 Cb 0.00 -1.85 0.13 0.00 -0.43 0.00 0.00 46.19 44.04 2wad s LEU 502 CO 0.00 -0.53 0.26 -0.69 -0.29 0.00 0.00 176.35 175.10 2wad s VAL 503 N 0.99 2.67 0.19 1.68 1.01 -1.26 -2.15 120.40 123.53 2wad s VAL 503 Ca 0.09 -3.24 -0.31 0.00 0.00 0.00 0.00 61.98 58.53 2wad s VAL 503 Cb -0.23 -2.85 -0.10 0.00 0.00 0.00 0.00 36.38 33.20 2wad s VAL 503 CO -0.04 -0.79 1.51 -2.84 0.00 0.00 0.00 175.10 172.93 2wad s PRO 504 N -0.21 4.24 0.28 2.72 0.02 -1.26 -4.89 135.00 135.90 2wad s PRO 504 Ca 0.17 2.32 0.24 0.00 0.02 0.00 0.00 61.00 63.75 2wad s PRO 504 Cb -0.25 -3.14 0.40 0.00 0.02 0.00 0.00 34.50 31.53 2wad s PRO 504 CO -0.01 -0.53 1.50 0.87 -0.33 0.00 0.00 177.00 178.51 2wad h LYS 505 N 6.10 0.00 -5.30 5.54 1.57 -2.05 -3.43 116.57 119.00 2wad h LYS 505 Ca -0.44 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 57.72 2wad h LYS 505 Cb 1.21 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 33.34 2wad h LYS 505 CO 0.86 0.00 -0.61 -2.00 -0.57 0.00 0.00 179.45 177.13 2wad s GLU 506 N -3.20 3.84 0.14 3.15 2.12 -1.26 -5.09 118.70 118.39 2wad s GLU 506 Ca 0.06 -0.42 -0.24 0.00 0.36 0.00 0.00 54.97 54.74 2wad s GLU 506 Cb 0.09 -3.08 0.07 0.00 0.26 0.00 0.00 34.13 31.47 2wad s GLU 506 CO 0.68 0.27 0.72 1.52 -0.54 0.00 0.00 175.26 177.91 2wad s TYR 507 N 0.33 -0.41 0.00 5.30 1.13 -1.26 -5.15 117.35 117.29 2wad s TYR 507 Ca 0.00 0.17 0.00 0.00 -1.41 0.00 0.00 57.07 55.83 2wad s TYR 507 Cb -0.13 0.58 0.00 0.00 -1.10 0.00 0.00 41.96 41.31 2wad s TYR 507 CO 0.01 -0.83 0.00 0.27 -2.51 0.00 0.00 175.55 172.49 2wad n ASN 508 N -0.37 1.94 -0.14 -0.18 0.23 -1.26 -5.01 115.26 110.47 2wad n ASN 508 Ca -0.12 -0.93 -0.09 0.00 -0.53 0.00 0.00 54.58 52.90 2wad n ASN 508 Cb 0.63 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 38.32 2wad n ASN 508 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 2wad h PHE 509 N 0.93 0.64 -0.74 -2.53 3.57 -1.99 -2.39 116.94 114.43 2wad h PHE 509 Ca 0.00 -0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.49 2wad h PHE 509 Cb 0.00 -0.19 -0.04 0.00 2.79 0.00 0.00 35.95 38.51 2wad h PHE 509 CO 0.00 0.58 0.48 0.00 -2.23 0.00 0.00 178.31 177.14 2wad h ALA 510 N 0.99 1.63 -0.65 2.41 0.00 -1.99 -1.26 119.26 120.39 2wad h ALA 510 Ca 0.13 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2wad h ALA 510 Cb 0.23 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2wad h ALA 510 CO -0.01 0.27 0.18 -0.91 0.00 0.00 0.00 179.25 178.78 2wad h ASN 511 N 0.83 0.97 -0.43 0.00 2.35 -1.87 -1.23 115.58 116.21 2wad h ASN 511 Ca 0.31 -0.22 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 2wad h ASN 511 Cb 0.16 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 2wad h ASN 511 CO -0.10 0.94 0.23 0.15 -1.65 0.00 0.00 177.43 177.01 2wad h PHE 512 N 0.96 0.59 -0.41 1.19 3.57 -0.80 0.06 116.94 122.09 2wad h PHE 512 Ca 0.21 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.66 2wad h PHE 512 Cb 0.34 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 2wad h PHE 512 CO 0.03 0.46 0.14 0.82 -2.23 0.00 0.00 178.31 177.52 2wad h ILE 513 N 0.56 1.21 -0.05 1.41 1.08 -1.05 -2.79 117.51 117.89 2wad h ILE 513 Ca 0.15 -0.69 -0.11 0.00 -0.39 0.00 0.00 64.86 63.82 2wad h ILE 513 Cb 0.06 0.89 -0.01 0.00 -3.07 0.00 0.00 36.82 34.69 2wad h ILE 513 CO -0.02 0.25 -0.49 0.71 -0.69 0.00 0.00 178.15 177.90 2wad h THR 514 N 0.52 1.35 -0.88 -0.27 1.35 -1.05 -2.94 112.91 111.00 2wad h THR 514 Ca 0.13 -1.70 0.03 0.00 -0.55 0.00 0.00 66.41 64.33 2wad h THR 514 Cb 0.25 1.86 -0.05 0.00 -1.73 0.00 0.00 68.15 68.48 2wad h THR 514 CO -0.01 0.49 0.58 -1.13 -0.25 0.00 0.00 175.52 175.20 2wad h ASN 515 N 0.09 0.94 -0.44 5.36 -1.24 -0.84 0.14 115.58 119.59 2wad h ASN 515 Ca 0.00 -0.01 0.13 0.00 0.71 0.00 0.00 56.30 57.13 2wad h ASN 515 Cb 0.90 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.71 2wad h ASN 515 CO 0.07 0.65 0.35 0.00 -1.29 0.00 0.00 177.43 177.21 2wad h ALA 516 N 1.49 2.33 -0.19 1.57 0.00 -1.30 -2.23 119.26 120.92 2wad h ALA 516 Ca 0.35 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.19 2wad h ALA 516 Cb 0.02 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2wad h ALA 516 CO -0.10 -0.58 -0.08 1.97 0.00 0.00 0.00 179.25 180.46 2wad n PHE 517 N -4.20 0.63 -1.76 0.00 -1.74 -0.79 -4.75 117.46 104.85 2wad n PHE 517 Ca 0.08 -1.19 -0.01 0.00 -0.56 0.00 0.00 57.45 55.77 2wad n PHE 517 Cb 0.55 -0.32 -0.00 0.00 1.52 0.00 0.00 39.48 41.23 2wad n PHE 517 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 2wad n GLY 518 N -1.00 0.36 2.13 4.97 0.00 -0.84 -3.97 105.19 106.86 2wad n GLY 518 Ca 0.23 -0.91 -0.25 0.00 0.00 0.00 0.00 46.02 45.09 2wad n GLY 518 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2wad n GLN 519 N -1.56 3.52 0.00 1.61 1.13 0.42 -0.94 117.38 121.55 2wad n GLN 519 Ca -0.01 -4.17 0.00 0.00 -1.94 0.00 0.00 57.00 50.88 2wad n GLN 519 Cb 0.38 -2.28 0.00 0.00 0.11 0.00 0.00 30.24 28.46 2wad n GLN 519 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2wad n PHE 520 N -0.68 -0.04 -1.93 1.08 7.35 -1.26 -4.48 117.46 117.50 2wad n PHE 520 Ca 0.44 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.72 2wad n PHE 520 Cb 0.89 0.04 -0.01 0.00 0.35 0.00 0.00 39.48 40.75 2wad n PHE 520 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 2wad s ASP 521 N 0.85 6.53 -0.14 -2.13 1.01 -1.26 -4.96 116.67 116.57 2wad s ASP 521 Ca 0.00 2.89 -0.06 0.00 0.71 0.00 0.00 52.55 56.08 2wad s ASP 521 Cb 0.00 -2.66 -0.04 0.00 1.01 0.00 0.00 42.92 41.23 2wad s ASP 521 CO 0.00 -0.73 0.09 0.20 0.21 0.00 0.00 175.17 174.94 2wad s ASN 522 N -0.22 5.97 0.27 0.27 0.02 -0.92 -4.46 114.94 115.87 2wad s ASN 522 Ca 0.52 0.29 0.09 0.00 -1.02 0.00 0.00 52.86 52.74 2wad s ASN 522 Cb -0.44 -1.92 -0.05 0.00 0.02 0.00 0.00 41.25 38.86 2wad s ASN 522 CO 0.57 0.33 -0.12 -0.31 0.02 0.00 0.00 177.10 177.59 2wad s TYR 523 N -0.54 2.05 0.46 2.20 2.02 -0.50 -1.48 117.35 121.55 2wad s TYR 523 Ca 0.11 -0.54 -0.07 0.00 -0.37 0.00 0.00 57.07 56.21 2wad s TYR 523 Cb -0.12 -1.05 -0.04 0.00 -0.40 0.00 0.00 41.96 40.35 2wad s TYR 523 CO 0.02 0.46 0.78 0.95 -1.57 0.00 0.00 175.55 176.19 2wad s THR 524 N -2.81 4.88 0.36 -0.71 -4.23 -1.26 -0.78 115.64 111.09 2wad s THR 524 Ca 0.28 0.32 0.07 0.00 -1.18 0.00 0.00 61.69 61.19 2wad s THR 524 Cb 0.00 -3.83 0.31 0.00 1.34 0.00 0.00 72.50 70.32 2wad s THR 524 CO 0.12 -0.75 1.91 -0.65 -0.54 0.00 0.00 174.62 174.71 2wad h PRO 525 N 0.53 0.71 -0.61 3.99 0.11 -1.74 -1.53 132.00 133.47 2wad h PRO 525 Ca -0.47 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 2wad h PRO 525 Cb 1.20 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 2wad h PRO 525 CO 0.62 0.47 0.29 1.98 -0.21 0.00 0.00 178.00 181.16 2wad h MET 526 N 0.73 0.88 -0.63 1.05 -1.53 -1.51 -1.31 114.93 112.60 2wad h MET 526 Ca 0.38 -0.13 0.04 0.00 -3.44 0.00 0.00 59.70 56.55 2wad h MET 526 Cb 0.49 -0.16 -0.04 0.00 -0.55 0.00 0.00 31.60 31.34 2wad h MET 526 CO -0.15 0.71 0.37 1.96 0.14 0.00 0.00 176.91 179.94 2wad h GLN 527 N 0.83 0.70 -0.00 0.39 4.20 -1.63 -1.27 115.11 118.33 2wad h GLN 527 Ca 0.21 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.78 2wad h GLN 527 Cb 0.12 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 2wad h GLN 527 CO -0.03 0.46 -0.46 -0.07 -0.67 0.00 0.00 178.83 178.07 2wad h LEU 528 N 0.72 0.01 -0.59 1.46 3.38 -1.08 -1.13 115.31 118.08 2wad h LEU 528 Ca 0.26 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.08 2wad h LEU 528 Cb 0.08 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2wad h LEU 528 CO -0.13 0.47 -0.62 0.00 0.09 0.00 0.00 178.44 178.25 2wad h ALA 529 N 1.53 0.78 -0.05 1.53 0.00 -0.81 -2.74 119.26 119.50 2wad h ALA 529 Ca -0.00 -0.55 -0.17 0.00 0.00 0.00 0.00 54.91 54.18 2wad h ALA 529 Cb 0.82 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2wad h ALA 529 CO 0.06 0.73 -0.73 0.37 0.00 0.00 0.00 179.25 179.68 2wad h GLN 530 N 0.23 0.27 0.37 0.00 4.15 -0.97 -0.37 115.11 118.79 2wad h GLN 530 Ca -0.01 -0.23 -0.01 0.00 0.77 0.00 0.00 58.65 59.18 2wad h GLN 530 Cb 1.14 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.87 2wad h GLN 530 CO 0.10 0.88 -0.26 -0.92 -1.93 0.00 0.00 178.83 176.70 2wad h TYR 531 N 0.18 -0.68 -0.07 3.99 3.20 -1.01 0.18 116.97 122.76 2wad h TYR 531 Ca -0.03 -0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.71 2wad h TYR 531 Cb 1.29 0.25 -0.01 0.00 1.54 0.00 0.00 36.73 39.80 2wad h TYR 531 CO 0.03 -0.39 -0.56 -0.24 -1.64 0.00 0.00 178.16 175.36 2wad h VAL 532 N -0.62 1.38 -0.49 1.81 3.04 -1.44 -2.52 116.25 117.41 2wad h VAL 532 Ca -0.03 -1.88 -0.06 0.00 -1.01 0.00 0.00 66.70 63.72 2wad h VAL 532 Cb 0.53 1.95 -0.02 0.00 -2.01 0.00 0.00 31.29 31.73 2wad h VAL 532 CO 0.01 0.55 0.08 0.00 -1.01 0.00 0.00 177.57 177.20 2wad h ALA 533 N 1.27 1.21 -0.82 3.17 0.00 -0.81 -1.62 119.26 121.66 2wad h ALA 533 Ca -0.00 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.71 2wad h ALA 533 Cb 1.03 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.57 2wad h ALA 533 CO 0.08 0.53 0.53 1.15 0.00 0.00 0.00 179.25 181.55 2wad h THR 534 N 0.74 1.16 -0.48 0.00 2.02 -0.22 -0.64 112.91 115.49 2wad h THR 534 Ca 0.16 -0.36 -0.10 0.00 0.77 0.00 0.00 66.41 66.87 2wad h THR 534 Cb 0.34 0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 66.74 2wad h THR 534 CO 0.01 0.19 -0.08 0.40 0.37 0.00 0.00 175.52 176.41 2wad h ILE 535 N 1.06 1.27 0.00 3.11 2.04 -1.16 0.83 117.51 124.65 2wad h ILE 535 Ca 0.32 -1.20 -0.00 0.00 1.00 0.00 0.00 64.86 64.97 2wad h ILE 535 Cb -0.05 1.06 -0.00 0.00 -0.74 0.00 0.00 36.82 37.09 2wad h ILE 535 CO -0.09 0.42 -0.02 0.00 0.00 0.00 0.00 178.15 178.46 2wad h ALA 536 N 0.90 1.01 -0.97 1.87 0.00 -1.10 -2.45 119.26 118.51 2wad h ALA 536 Ca 0.13 -0.01 -0.55 0.00 0.00 0.00 0.00 54.91 54.47 2wad h ALA 536 Cb 0.63 -0.00 -0.30 0.00 0.00 0.00 0.00 17.79 18.12 2wad h ALA 536 CO 0.04 0.02 0.68 -1.71 0.00 0.00 0.00 179.25 178.28 2wad n ASN 537 N -3.12 4.81 -4.22 0.00 5.15 -0.27 -4.72 115.26 112.90 2wad n ASN 537 Ca -0.00 -3.67 -0.36 0.00 -0.60 0.00 0.00 54.58 49.95 2wad n ASN 537 Cb 0.28 -0.87 -0.02 0.00 -0.53 0.00 0.00 39.78 38.64 2wad n ASN 537 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2wad n ASN 538 N -1.08 -3.36 0.00 1.20 3.02 -0.92 -2.33 115.26 111.79 2wad n ASN 538 Ca 0.60 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.14 2wad n ASN 538 Cb 1.37 -2.79 0.00 0.00 -0.61 0.00 0.00 39.78 37.75 2wad n ASN 538 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wad n GLY 539 N -1.40 0.38 3.42 7.41 0.00 0.25 -4.95 105.19 110.31 2wad n GLY 539 Ca 0.07 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 2wad n GLY 539 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wad s VAL 540 N -2.13 4.99 -0.10 1.61 1.01 -0.98 -0.58 120.40 124.22 2wad s VAL 540 Ca 0.00 -0.71 -0.28 0.00 0.00 0.00 0.00 61.98 60.99 2wad s VAL 540 Cb 0.00 -4.25 -0.02 0.00 0.00 0.00 0.00 36.38 32.11 2wad s VAL 540 CO 0.00 -0.74 0.95 -0.60 0.00 0.00 0.00 175.10 174.70 2wad s ARG 541 N 2.29 4.41 -0.02 2.72 3.52 -0.49 -4.74 118.95 126.65 2wad s ARG 541 Ca 0.11 1.29 0.02 0.00 -0.13 0.00 0.00 55.73 57.02 2wad s ARG 541 Cb -0.21 -3.53 -0.03 0.00 -1.56 0.00 0.00 34.95 29.61 2wad s ARG 541 CO 0.10 -0.26 -0.05 -0.51 -0.81 0.00 0.00 175.30 173.77 2wad s LEU 542 N 1.84 3.29 0.12 -0.88 1.43 -1.26 -0.63 118.68 122.59 2wad s LEU 542 Ca 0.46 -0.07 -0.31 0.00 -1.03 0.00 0.00 54.13 53.19 2wad s LEU 542 Cb -0.18 -1.84 -0.07 0.00 0.03 0.00 0.00 46.19 44.12 2wad s LEU 542 CO 0.18 0.30 1.26 0.00 0.23 0.00 0.00 176.35 178.32 2wad s ALA 543 N -0.98 3.47 0.28 4.21 0.00 -0.48 -4.90 121.76 123.36 2wad s ALA 543 Ca 0.17 0.98 -0.29 0.00 0.00 0.00 0.00 51.96 52.82 2wad s ALA 543 Cb -0.11 -3.46 -0.09 0.00 0.00 0.00 0.00 23.12 19.45 2wad s ALA 543 CO 0.07 -0.48 0.99 -1.25 0.00 0.00 0.00 175.76 175.09 2wad s PRO 544 N 0.58 4.69 -0.01 0.00 0.05 -1.26 -4.43 135.00 134.63 2wad s PRO 544 Ca 0.58 1.54 0.01 0.00 0.05 0.00 0.00 61.00 63.19 2wad s PRO 544 Cb -0.33 -3.11 0.01 0.00 0.05 0.00 0.00 34.50 31.12 2wad s PRO 544 CO 0.32 0.34 -0.04 -3.38 0.05 0.00 0.00 177.00 174.30 2wad s HIS 545 N -1.30 0.46 -0.08 0.56 -3.43 -0.04 -3.52 115.29 107.95 2wad s HIS 545 Ca 0.45 -0.09 0.14 0.00 -0.80 0.00 0.00 55.06 54.77 2wad s HIS 545 Cb -0.26 -0.37 -0.16 0.00 -1.43 0.00 0.00 32.58 30.37 2wad s HIS 545 CO 0.32 -0.06 0.87 0.82 -2.00 0.00 0.00 174.74 174.69 2wad h ILE 546 N 5.43 0.76 -3.36 -5.38 2.04 -1.90 -0.75 117.51 114.35 2wad h ILE 546 Ca -0.32 -2.39 -0.57 0.00 1.00 0.00 0.00 64.86 62.58 2wad h ILE 546 Cb 1.18 2.27 -0.07 0.00 -0.74 0.00 0.00 36.82 39.46 2wad h ILE 546 CO 0.49 0.43 0.04 -0.69 0.00 0.00 0.00 178.15 178.43 2wad s VAL 547 N -2.79 5.07 -0.04 1.67 1.01 -1.26 0.27 120.40 124.32 2wad s VAL 547 Ca -0.02 1.27 0.09 0.00 0.00 0.00 0.00 61.98 63.32 2wad s VAL 547 Cb 0.08 -3.97 -0.24 0.00 0.00 0.00 0.00 36.38 32.26 2wad s VAL 547 CO 0.81 0.24 0.67 -0.08 0.00 0.00 0.00 175.10 176.73 2wad h GLU 548 N 6.90 0.05 -1.57 2.72 4.22 -0.57 -3.44 114.58 122.90 2wad h GLU 548 Ca -0.39 -0.08 0.26 0.00 0.08 0.00 0.00 59.36 59.24 2wad h GLU 548 Cb 1.18 0.03 -0.16 0.00 0.50 0.00 0.00 28.75 30.30 2wad h GLU 548 CO 0.76 0.64 0.78 0.20 -2.18 0.00 0.00 179.01 179.21 2wad s GLY 549 N -5.14 -0.34 -0.16 1.92 0.00 -1.10 -2.11 107.32 100.39 2wad s GLY 549 Ca -0.07 1.19 -0.04 0.00 0.00 0.00 0.00 44.72 45.81 2wad s GLY 549 CO 0.82 0.36 -0.04 -0.42 0.00 0.00 0.00 173.10 173.82 2wad s ILE 550 N -2.51 3.83 -0.01 0.90 1.01 0.20 -2.10 121.20 122.52 2wad s ILE 550 Ca 0.11 -0.37 0.06 0.00 0.00 0.00 0.00 60.65 60.44 2wad s ILE 550 Cb 0.01 -2.69 -0.02 0.00 0.01 0.00 0.00 42.46 39.78 2wad s ILE 550 CO -0.04 0.48 -0.18 -0.31 0.00 0.00 0.00 174.94 174.89 2wad s TYR 551 N 0.49 1.63 1.09 3.97 2.02 0.84 -0.51 117.35 126.87 2wad s TYR 551 Ca -0.03 -0.31 -0.18 0.00 -0.37 0.00 0.00 57.07 56.17 2wad s TYR 551 Cb -0.14 -1.04 0.25 0.00 -0.40 0.00 0.00 41.96 40.63 2wad s TYR 551 CO 0.03 -0.01 1.26 0.34 -1.57 0.00 0.00 175.55 175.59 2wad s ASP 552 N -0.52 1.98 -0.14 2.29 -1.08 0.16 -0.67 116.67 118.69 2wad s ASP 552 Ca 0.07 0.31 -0.08 0.00 -0.52 0.00 0.00 52.55 52.33 2wad s ASP 552 Cb -0.07 -0.35 -0.04 0.00 -1.46 0.00 0.00 42.92 41.00 2wad s ASP 552 CO -0.00 -3.44 0.13 0.20 0.52 0.00 0.00 175.17 172.58 2wad s ASN 553 N -4.57 6.28 1.03 -0.34 -0.87 -1.26 -1.32 114.94 113.88 2wad s ASN 553 Ca 0.75 0.38 -0.07 0.00 -1.57 0.00 0.00 52.86 52.34 2wad s ASN 553 Cb -0.05 -2.05 0.10 0.00 -0.02 0.00 0.00 41.25 39.23 2wad s ASN 553 CO 0.54 0.33 0.49 -0.46 -2.57 0.00 0.00 177.10 175.44 2wad n ASN 554 N 2.48 -0.38 0.12 -1.22 0.23 -1.07 -4.74 115.26 110.68 2wad n ASN 554 Ca -0.19 -1.07 -0.01 0.00 -0.53 0.00 0.00 54.58 52.79 2wad n ASN 554 Cb 0.54 -0.40 0.25 0.00 -2.08 0.00 0.00 39.78 38.09 2wad n ASN 554 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2wad h ASP 555 N -0.97 0.18 0.31 0.53 3.32 -1.95 -2.08 116.42 115.76 2wad h ASP 555 Ca -0.17 -0.07 -0.05 0.00 0.02 0.00 0.00 57.03 56.76 2wad h ASP 555 Cb 0.47 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 2wad h ASP 555 CO 0.11 0.58 -0.23 0.11 -1.72 0.00 0.00 179.24 178.10 2wad h LYS 556 N 0.14 0.00 0.00 3.56 1.57 -1.98 -3.46 116.57 116.40 2wad h LYS 556 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2wad h LYS 556 Cb 0.81 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.12 2wad h LYS 556 CO 0.06 0.23 0.00 0.41 -0.57 0.00 0.00 179.45 179.58 2wad n GLY 557 N -0.72 1.01 0.00 3.86 0.00 -0.78 -5.11 105.19 103.45 2wad n GLY 557 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2wad n GLY 557 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wad n GLY 558 N -1.68 1.58 3.68 -0.02 0.00 -1.26 -4.83 105.19 102.66 2wad n GLY 558 Ca 0.00 -2.02 -0.50 0.00 0.00 0.00 0.00 46.02 43.50 2wad n GLY 558 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2wad n LEU 559 N 0.00 3.17 0.00 0.99 0.00 -1.26 -2.60 117.00 117.29 2wad n LEU 559 Ca 0.00 0.95 0.00 0.00 0.00 0.00 0.00 56.01 56.96 2wad n LEU 559 Cb 0.00 -1.32 0.00 0.00 0.00 0.00 0.00 43.42 42.10 2wad n LEU 559 CO 0.00 -0.17 0.00 0.61 0.00 0.00 0.00 177.39 177.83 2wad n GLY 560 N 4.51 4.03 3.87 -3.96 0.00 -0.44 -4.36 105.19 108.84 2wad n GLY 560 Ca 0.25 -1.66 -0.34 0.00 0.00 0.00 0.00 46.02 44.26 2wad n GLY 560 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wad s GLU 561 N 4.89 3.75 0.33 1.61 2.12 -1.25 -4.65 118.70 125.49 2wad s GLU 561 Ca 0.00 0.15 -0.28 0.00 0.36 0.00 0.00 54.97 55.20 2wad s GLU 561 Cb 0.00 -2.95 -0.12 0.00 0.26 0.00 0.00 34.13 31.31 2wad s GLU 561 CO 0.00 0.53 1.32 -0.11 -0.54 0.00 0.00 175.26 176.46 2wad n LEU 562 N 0.73 3.57 -0.06 2.70 7.94 -1.26 -0.66 117.00 129.95 2wad n LEU 562 Ca -0.07 1.20 -0.11 0.00 -1.11 0.00 0.00 56.01 55.92 2wad n LEU 562 Cb 0.52 -1.49 -0.05 0.00 0.53 0.00 0.00 43.42 42.94 2wad n LEU 562 CO 0.43 -0.44 -0.90 -0.38 -1.11 0.00 0.00 177.39 174.99 2wad n ILE 563 N 0.59 0.66 -3.37 1.96 5.41 0.33 -4.79 119.36 120.15 2wad n ILE 563 Ca 0.05 -0.19 -0.04 0.00 1.00 0.00 0.00 62.75 63.57 2wad n ILE 563 Cb 0.36 -1.42 -0.06 0.00 -0.71 0.00 0.00 39.64 37.81 2wad n ILE 563 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 176.55 174.97 2wad s GLN 564 N -2.22 0.44 0.49 0.38 2.00 -0.81 -4.99 119.66 114.95 2wad s GLN 564 Ca -0.16 0.87 -0.23 0.00 -2.00 0.00 0.00 55.36 53.84 2wad s GLN 564 Cb 0.06 0.14 -0.06 0.00 0.80 0.00 0.00 33.01 33.94 2wad s GLN 564 CO 0.23 -0.52 1.27 0.00 -0.50 0.00 0.00 175.29 175.77 2wad s ALA 565 N 2.70 2.94 -0.24 1.58 0.00 -1.26 0.61 121.76 128.08 2wad s ALA 565 Ca 0.11 1.16 -0.29 0.00 0.00 0.00 0.00 51.96 52.94 2wad s ALA 565 Cb -0.14 -3.48 0.01 0.00 0.00 0.00 0.00 23.12 19.50 2wad s ALA 565 CO -0.17 -1.01 1.11 0.42 0.00 0.00 0.00 175.76 176.10 2wad s ILE 566 N -1.40 4.53 0.35 0.00 -1.09 -0.90 -4.87 121.20 117.83 2wad s ILE 566 Ca 0.66 1.83 -0.19 0.00 -2.23 0.00 0.00 60.65 60.72 2wad s ILE 566 Cb -0.35 -4.27 -0.10 0.00 -1.58 0.00 0.00 42.46 36.16 2wad s ILE 566 CO 0.42 -0.26 0.83 -1.81 -1.23 0.00 0.00 174.94 172.90 2wad s ASP 567 N 1.55 6.92 0.06 3.58 1.01 -1.26 -4.92 116.67 123.62 2wad s ASP 567 Ca 0.47 1.50 -0.35 0.00 0.71 0.00 0.00 52.55 54.88 2wad s ASP 567 Cb -0.16 -2.46 -0.14 0.00 1.01 0.00 0.00 42.92 41.17 2wad s ASP 567 CO 0.11 -0.22 1.60 0.41 0.21 0.00 0.00 175.17 177.27 2wad n THR 568 N -0.25 0.14 -3.78 -1.27 -1.04 -1.26 -4.98 114.28 101.83 2wad n THR 568 Ca 0.04 -0.02 -0.37 0.00 -2.04 0.00 0.00 64.05 61.65 2wad n THR 568 Cb 0.53 -1.42 -0.13 0.00 -1.82 0.00 0.00 70.33 67.50 2wad n THR 568 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 2wad s LYS 569 N 1.62 2.65 0.14 -2.82 2.47 -1.26 -5.06 119.74 117.48 2wad s LYS 569 Ca 0.84 -1.15 -0.27 0.00 -1.56 0.00 0.00 55.97 53.83 2wad s LYS 569 Cb -0.77 -3.40 -0.07 0.00 -1.46 0.00 0.00 37.83 32.13 2wad s LYS 569 CO 0.45 -0.63 0.85 -1.21 0.16 0.00 0.00 175.35 174.97 2wad s GLU 570 N 1.39 4.64 -0.18 4.03 8.01 -1.26 -1.38 118.70 133.94 2wad s GLU 570 Ca -0.02 1.27 0.06 0.00 0.01 0.00 0.00 54.97 56.30 2wad s GLU 570 Cb -0.19 -3.32 -0.16 0.00 -4.31 0.00 0.00 34.13 26.15 2wad s GLU 570 CO 0.02 0.41 -0.09 -0.89 0.01 0.00 0.00 175.26 174.72 2wad n ILE 571 N 2.14 1.13 -3.60 -1.63 5.41 0.20 -4.93 119.36 118.08 2wad n ILE 571 Ca -0.02 -0.53 -0.03 0.00 1.00 0.00 0.00 62.75 63.16 2wad n ILE 571 Cb 0.49 -0.97 -0.02 0.00 -0.71 0.00 0.00 39.64 38.43 2wad n ILE 571 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2wad s ASN 572 N -5.57 -0.12 -0.20 4.38 4.22 -1.25 -5.03 114.94 111.38 2wad s ASN 572 Ca -0.20 -0.03 -0.02 0.00 -2.14 0.00 0.00 52.86 50.47 2wad s ASN 572 Cb 0.06 0.15 -0.00 0.00 1.28 0.00 0.00 41.25 42.74 2wad s ASN 572 CO 0.54 -0.25 -0.09 -0.75 -2.04 0.00 0.00 177.10 174.51 2wad s LYS 573 N -2.43 3.30 0.07 3.55 2.20 -1.26 -1.40 119.74 123.77 2wad s LYS 573 Ca 0.10 -0.67 -0.36 0.00 -0.36 0.00 0.00 55.97 54.68 2wad s LYS 573 Cb 0.00 -2.87 -0.15 0.00 -1.51 0.00 0.00 37.83 33.29 2wad s LYS 573 CO -0.04 -0.16 1.49 0.28 -0.36 0.00 0.00 175.35 176.56 2wad n VAL 574 N 4.62 0.06 -1.30 4.02 0.31 0.26 -4.83 118.33 121.47 2wad n VAL 574 Ca -0.19 -0.01 -0.32 0.00 -0.01 0.00 0.00 64.34 63.81 2wad n VAL 574 Cb 0.51 -1.16 -0.06 0.00 -0.91 0.00 0.00 33.84 32.21 2wad n VAL 574 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2wad n ASN 575 N 3.34 7.74 -4.26 4.52 5.15 -1.26 -4.85 115.26 125.64 2wad n ASN 575 Ca 0.19 -2.62 -0.15 0.00 -0.60 0.00 0.00 54.58 51.40 2wad n ASN 575 Cb 0.22 -1.49 -0.10 0.00 -0.53 0.00 0.00 39.78 37.88 2wad n ASN 575 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2wad s ILE 576 N 1.42 1.24 0.90 -1.44 -4.36 -1.26 -4.70 121.20 112.99 2wad s ILE 576 Ca 0.67 -2.03 -0.12 0.00 -0.26 0.00 0.00 60.65 58.91 2wad s ILE 576 Cb 0.22 -1.82 0.13 0.00 1.25 0.00 0.00 42.46 42.24 2wad s ILE 576 CO -0.05 -0.70 1.10 -0.94 0.24 0.00 0.00 174.94 174.59 2wad s SER 577 N -3.10 3.52 0.27 4.36 1.04 -1.26 -4.82 113.70 113.72 2wad s SER 577 Ca 0.16 1.33 -0.03 0.00 0.48 0.00 0.00 55.95 57.89 2wad s SER 577 Cb 0.01 -2.01 0.36 0.00 0.10 0.00 0.00 66.02 64.48 2wad s SER 577 CO 0.01 -2.59 1.88 -0.33 0.98 0.00 0.00 173.24 173.19 2wad h GLU 578 N -1.51 1.03 -0.01 4.02 5.08 -1.98 -1.94 114.58 119.26 2wad h GLU 578 Ca -0.50 -0.14 -0.16 0.00 -1.00 0.00 0.00 59.36 57.56 2wad h GLU 578 Cb 1.29 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 2wad h GLU 578 CO 0.57 0.79 -0.73 0.66 -1.00 0.00 0.00 179.01 179.30 2wad h SER 579 N 1.03 0.11 -0.05 1.42 4.64 -1.98 -1.07 113.55 117.65 2wad h SER 579 Ca 0.25 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.49 2wad h SER 579 Cb 0.09 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.15 2wad h SER 579 CO -0.03 0.81 -0.00 0.44 -0.87 0.00 0.00 176.83 177.17 2wad h ASP 580 N 0.06 0.09 -1.01 4.97 3.45 -1.88 -1.90 116.42 120.20 2wad h ASP 580 Ca -0.02 -0.31 0.23 0.00 0.43 0.00 0.00 57.03 57.36 2wad h ASP 580 Cb 1.30 -0.02 -0.11 0.00 -0.56 0.00 0.00 39.33 39.93 2wad h ASP 580 CO 0.10 0.38 0.62 -0.03 -1.57 0.00 0.00 179.24 178.74 2wad h MET 581 N -0.21 0.59 0.00 3.56 4.05 -1.28 0.48 114.93 122.12 2wad h MET 581 Ca 0.01 -0.04 -0.08 0.00 -0.28 0.00 0.00 59.70 59.32 2wad h MET 581 Cb 0.33 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 30.99 2wad h MET 581 CO 0.00 0.39 -0.36 0.00 0.23 0.00 0.00 176.91 177.17 2wad h ALA 582 N 1.67 1.18 -0.37 0.39 0.00 -0.82 -1.11 119.26 120.20 2wad h ALA 582 Ca 0.60 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 2wad h ALA 582 Cb 1.15 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2wad h ALA 582 CO -0.39 0.45 -0.04 0.82 0.00 0.00 0.00 179.25 180.09 2wad h ILE 583 N 0.00 1.27 -0.79 0.00 2.04 -0.13 -1.87 117.51 118.03 2wad h ILE 583 Ca -0.00 -1.08 0.06 0.00 1.00 0.00 0.00 64.86 64.84 2wad h ILE 583 Cb 0.75 1.22 -0.06 0.00 -0.74 0.00 0.00 36.82 37.99 2wad h ILE 583 CO 0.05 0.36 0.48 -0.07 0.00 0.00 0.00 178.15 178.96 2wad h LEU 584 N 0.49 0.74 -0.99 1.44 3.38 -0.56 -1.79 115.31 118.01 2wad h LEU 584 Ca 0.10 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 2wad h LEU 584 Cb 0.53 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 2wad h LEU 584 CO 0.03 0.47 0.11 0.45 0.09 0.00 0.00 178.44 179.59 2wad h HIS 585 N 0.87 0.87 -0.05 1.13 3.86 -1.11 -2.12 115.15 118.61 2wad h HIS 585 Ca 0.35 -0.09 -0.16 0.00 -1.16 0.00 0.00 60.37 59.31 2wad h HIS 585 Cb 0.17 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.38 2wad h HIS 585 CO -0.05 0.74 -0.69 0.37 0.86 0.00 0.00 177.93 179.17 2wad h GLN 586 N 0.81 0.24 0.30 2.45 5.75 -1.01 -1.25 115.11 122.40 2wad h GLN 586 Ca 0.17 -0.19 -0.01 0.00 -0.15 0.00 0.00 58.65 58.47 2wad h GLN 586 Cb 0.33 0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.92 2wad h GLN 586 CO 0.00 0.83 -0.15 0.78 -2.65 0.00 0.00 178.83 177.65 2wad h GLY 587 N 1.57 -0.42 1.60 2.39 0.00 -1.17 -1.86 103.07 105.19 2wad h GLY 587 Ca -0.02 0.16 -0.07 0.00 0.00 0.00 0.00 47.33 47.40 2wad h GLY 587 CO 0.11 -0.15 -0.14 0.74 0.00 0.00 0.00 176.54 177.09 2wad h PHE 588 N -0.41 0.51 -0.39 5.60 -1.00 -1.31 -0.25 116.94 119.69 2wad h PHE 588 Ca -0.04 -0.08 -0.03 0.00 2.81 0.00 0.00 57.97 60.63 2wad h PHE 588 Cb 0.32 -0.14 -0.02 0.00 3.61 0.00 0.00 35.95 39.72 2wad h PHE 588 CO -0.05 0.60 0.13 -0.92 -1.61 0.00 0.00 178.31 176.46 2wad h TYR 589 N 0.44 0.62 0.00 -0.55 3.20 -1.22 -2.43 116.97 117.03 2wad h TYR 589 Ca 0.08 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 2wad h TYR 589 Cb 0.50 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 38.59 2wad h TYR 589 CO 0.02 0.58 -0.15 1.96 -1.64 0.00 0.00 178.16 178.92 2wad h GLN 590 N 0.48 0.00 -0.45 1.82 4.20 -1.02 -1.32 115.11 118.81 2wad h GLN 590 Ca 0.13 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.95 2wad h GLN 590 Cb 0.24 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.00 2wad h GLN 590 CO -0.01 0.15 0.32 0.28 -0.67 0.00 0.00 178.83 178.90 2wad h VAL 591 N 0.00 0.82 0.00 -0.54 2.07 -0.94 -1.40 116.25 116.26 2wad h VAL 591 Ca -0.00 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.48 2wad h VAL 591 Cb 0.95 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 2wad h VAL 591 CO 0.02 0.02 -0.72 -1.54 0.02 0.00 0.00 177.57 175.37 2wad n SER 592 N -4.43 1.02 0.00 0.57 3.41 -0.85 -0.74 113.62 112.60 2wad n SER 592 Ca 0.08 -0.55 0.00 0.00 -0.26 0.00 0.00 58.87 58.14 2wad n SER 592 Cb 0.46 1.12 0.00 0.00 -0.26 0.00 0.00 64.21 65.52 2wad n SER 592 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2wad n HIS 593 N -1.39 0.00 -0.89 7.33 -0.00 -0.56 -4.43 115.22 115.29 2wad n HIS 593 Ca 0.01 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.43 2wad n HIS 593 Cb 0.18 0.00 0.17 0.00 -0.00 0.00 0.00 29.99 30.34 2wad n HIS 593 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.34 176.54 2wad s GLY 594 N -0.38 1.62 -0.05 -1.41 0.00 -0.53 -4.98 107.32 101.59 2wad s GLY 594 Ca 0.00 0.12 0.08 0.00 0.00 0.00 0.00 44.72 44.92 2wad s GLY 594 CO 0.00 0.64 1.06 -1.30 0.00 0.00 0.00 173.10 173.50 2wad n THR 595 N -4.24 0.73 -2.82 0.90 -2.24 -1.26 -4.95 114.28 100.40 2wad n THR 595 Ca 0.07 -0.90 -0.31 0.00 -2.27 0.00 0.00 64.05 60.65 2wad n THR 595 Cb 0.54 0.23 -0.03 0.00 -2.10 0.00 0.00 70.33 68.96 2wad n THR 595 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2wad s SER 596 N -1.74 6.54 0.59 3.42 0.15 -1.26 -4.96 113.70 116.45 2wad s SER 596 Ca 0.13 1.18 0.39 0.00 0.70 0.00 0.00 55.95 58.35 2wad s SER 596 Cb 0.11 -2.34 1.96 0.00 -1.71 0.00 0.00 66.02 64.04 2wad s SER 596 CO 0.01 -0.41 2.18 -0.65 1.20 0.00 0.00 173.24 175.56 2wad h PRO 597 N 1.25 0.00 -0.01 5.44 0.11 -2.04 -2.52 132.00 134.24 2wad h PRO 597 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2wad h PRO 597 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2wad h PRO 597 CO 0.64 0.00 -0.31 1.28 -0.21 0.00 0.00 178.00 179.39 2wad n LEU 598 N -3.00 1.24 -4.72 2.35 4.77 -1.26 -4.92 117.00 111.46 2wad n LEU 598 Ca -0.02 -0.37 -0.42 0.00 -0.03 0.00 0.00 56.01 55.18 2wad n LEU 598 Cb 0.15 -0.10 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 2wad n LEU 598 CO 0.22 0.23 1.37 -0.89 -1.33 0.00 0.00 177.39 176.99 2wad s THR 599 N -2.50 2.00 -0.10 -5.08 2.01 -0.95 -4.19 115.64 106.83 2wad s THR 599 Ca 0.23 0.00 0.21 0.00 0.31 0.00 0.00 61.69 62.44 2wad s THR 599 Cb 0.19 -3.00 -0.25 0.00 0.01 0.00 0.00 72.50 69.44 2wad s THR 599 CO 0.53 0.00 0.52 0.35 -0.69 0.00 0.00 174.62 175.33 2wad n THR 600 N 3.89 0.47 -2.48 -0.82 -2.24 -1.01 -4.66 114.28 107.44 2wad n THR 600 Ca 0.16 -0.60 -0.12 0.00 -2.27 0.00 0.00 64.05 61.22 2wad n THR 600 Cb 0.35 -0.21 0.03 0.00 -2.10 0.00 0.00 70.33 68.40 2wad n THR 600 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wad n GLY 601 N 1.36 3.87 0.29 3.38 0.00 0.08 -4.77 105.19 109.40 2wad n GLY 601 Ca -0.10 -1.82 0.13 0.00 0.00 0.00 0.00 46.02 44.24 2wad n GLY 601 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2wad h ARG 602 N 2.46 0.00 -0.31 1.61 3.08 -1.78 -2.04 114.38 117.39 2wad h ARG 602 Ca 0.09 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.23 2wad h ARG 602 Cb 1.36 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.39 2wad h ARG 602 CO 0.47 0.00 0.24 0.00 -1.07 0.00 0.00 179.97 179.61 2wad h ALA 603 N 1.96 2.21 -0.92 0.04 0.00 -1.89 -1.42 119.26 119.23 2wad h ALA 603 Ca 0.02 -0.01 0.17 0.00 0.00 0.00 0.00 54.91 55.09 2wad h ALA 603 Cb 0.10 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.84 2wad h ALA 603 CO -0.00 -0.41 0.59 0.74 0.00 0.00 0.00 179.25 180.18 2wad h PHE 604 N 0.00 0.80 0.00 0.00 0.04 -1.60 -2.83 116.94 113.36 2wad h PHE 604 Ca 0.15 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.94 2wad h PHE 604 Cb 0.64 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 38.54 2wad h PHE 604 CO 0.00 0.25 -1.47 0.43 -0.60 0.00 0.00 178.31 176.92 2wad n SER 605 N -4.59 0.42 -4.56 2.17 7.64 -0.55 -4.50 113.62 109.65 2wad n SER 605 Ca 0.19 0.05 -0.27 0.00 1.01 0.00 0.00 58.87 59.85 2wad n SER 605 Cb 0.55 1.24 -0.05 0.00 -1.01 0.00 0.00 64.21 64.94 2wad n SER 605 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2wad s ASP 606 N -4.68 4.89 0.00 6.43 2.15 -1.07 -1.35 116.67 123.04 2wad s ASP 606 Ca -0.03 -0.22 0.00 0.00 0.43 0.00 0.00 52.55 52.73 2wad s ASP 606 Cb 0.13 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.20 2wad s ASP 606 CO 0.85 -2.88 0.00 0.61 -0.17 0.00 0.00 175.17 173.57 2wad n GLY 607 N 6.55 0.74 3.74 2.66 0.00 -1.26 -5.03 105.19 112.59 2wad n GLY 607 Ca 0.37 -0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 2wad n GLY 607 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wad s ALA 608 N -2.00 3.39 -2.00 4.61 0.00 -0.46 -4.94 121.76 120.36 2wad s ALA 608 Ca 0.00 0.86 0.25 0.00 0.00 0.00 0.00 51.96 53.06 2wad s ALA 608 Cb 0.00 -3.37 0.39 0.00 0.00 0.00 0.00 23.12 20.15 2wad s ALA 608 CO 0.00 -0.25 1.34 0.25 0.00 0.00 0.00 175.76 177.10 2wad n THR 609 N 2.32 0.00 -4.10 0.00 -2.24 -1.26 -4.87 114.28 104.13 2wad n THR 609 Ca 0.03 -0.22 -0.10 0.00 -2.27 0.00 0.00 64.05 61.49 2wad n THR 609 Cb 0.46 0.86 -0.09 0.00 -2.10 0.00 0.00 70.33 69.45 2wad n THR 609 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2wad s VAL 610 N -2.43 0.07 0.04 2.28 -7.23 -1.26 -4.96 120.40 106.91 2wad s VAL 610 Ca 0.23 -1.77 -0.30 0.00 -1.81 0.00 0.00 61.98 58.32 2wad s VAL 610 Cb 0.19 -2.08 -0.07 0.00 0.56 0.00 0.00 36.38 34.97 2wad s VAL 610 CO 0.52 -0.31 1.52 -0.55 -0.31 0.00 0.00 175.10 175.97 2wad s SER 611 N -3.05 6.73 -0.14 4.85 0.15 -1.26 -4.98 113.70 116.01 2wad s SER 611 Ca 0.25 2.30 -0.02 0.00 0.70 0.00 0.00 55.95 59.18 2wad s SER 611 Cb 0.06 -2.56 -0.02 0.00 -1.71 0.00 0.00 66.02 61.79 2wad s SER 611 CO 0.04 -0.79 -0.09 -0.63 1.20 0.00 0.00 173.24 172.96 2wad s ILE 612 N 2.42 3.41 0.06 6.45 1.01 -1.26 -1.36 121.20 131.93 2wad s ILE 612 Ca 0.68 -0.53 0.07 0.00 0.00 0.00 0.00 60.65 60.87 2wad s ILE 612 Cb -0.36 -2.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.62 2wad s ILE 612 CO 0.29 0.51 -0.14 -0.44 0.00 0.00 0.00 174.94 175.17 2wad s SER 613 N 0.35 4.15 0.03 3.58 0.01 -0.65 -4.78 113.70 116.39 2wad s SER 613 Ca -0.08 -0.38 -0.09 0.00 1.31 0.00 0.00 55.95 56.71 2wad s SER 613 Cb -0.15 -0.76 0.03 0.00 0.21 0.00 0.00 66.02 65.35 2wad s SER 613 CO 0.05 0.23 0.43 0.61 0.41 0.00 0.00 173.24 174.96 2wad n GLY 614 N 1.20 0.78 3.29 3.44 0.00 -0.92 -0.32 105.19 112.65 2wad n GLY 614 Ca -0.15 -0.96 -0.12 0.00 0.00 0.00 0.00 46.02 44.79 2wad n GLY 614 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wad s LYS 615 N -2.01 0.44 0.39 1.61 2.47 0.06 -4.43 119.74 118.25 2wad s LYS 615 Ca 0.10 0.66 0.03 0.00 -1.56 0.00 0.00 55.97 55.20 2wad s LYS 615 Cb -0.01 0.12 -0.01 0.00 -1.46 0.00 0.00 37.83 36.48 2wad s LYS 615 CO 0.01 -0.10 0.56 0.95 0.16 0.00 0.00 175.35 176.93 2wad s THR 616 N 0.72 4.12 0.00 3.43 -4.23 -1.26 -1.56 115.64 116.85 2wad s THR 616 Ca -0.04 -0.74 0.00 0.00 -1.18 0.00 0.00 61.69 59.73 2wad s THR 616 Cb -0.05 -3.48 0.00 0.00 1.34 0.00 0.00 72.50 70.31 2wad s THR 616 CO -0.05 -0.26 0.00 0.61 -0.54 0.00 0.00 174.62 174.38 2wad n GLY 617 N -1.85 1.58 0.91 3.99 0.00 0.18 -3.20 105.19 106.80 2wad n GLY 617 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 2wad n GLY 617 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wad n THR 630 N 0.00 -0.46 -2.93 2.61 -2.24 -1.14 -4.61 114.28 105.51 2wad n THR 630 Ca 0.00 0.39 -0.41 0.00 -2.27 0.00 0.00 64.05 61.76 2wad n THR 630 Cb 0.00 -0.59 -0.04 0.00 -2.10 0.00 0.00 70.33 67.60 2wad n THR 630 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2wad s ASN 631 N -5.68 7.00 -0.75 3.42 -0.87 -1.26 -1.04 114.94 115.76 2wad s ASN 631 Ca 0.00 1.22 -0.00 0.00 -1.57 0.00 0.00 52.86 52.51 2wad s ASN 631 Cb 0.00 -2.45 0.37 0.00 -0.02 0.00 0.00 41.25 39.15 2wad s ASN 631 CO 0.00 -0.29 1.79 0.35 -2.57 0.00 0.00 177.10 176.38 2wad n THR 632 N 4.34 3.33 -1.80 1.60 -2.24 -1.07 -4.96 114.28 113.48 2wad n THR 632 Ca 0.03 -4.50 -0.31 0.00 -2.27 0.00 0.00 64.05 56.99 2wad n THR 632 Cb 0.50 -1.25 0.03 0.00 -2.10 0.00 0.00 70.33 67.50 2wad n THR 632 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2wad s ASN 633 N -1.72 5.72 -0.04 3.42 0.01 -1.26 -3.69 114.94 117.38 2wad s ASN 633 Ca 0.51 1.63 -0.20 0.00 -0.71 0.00 0.00 52.86 54.08 2wad s ASN 633 Cb 0.42 -2.50 0.04 0.00 0.41 0.00 0.00 41.25 39.62 2wad s ASN 633 CO -0.35 -1.21 0.45 0.00 -1.51 0.00 0.00 177.10 174.47 2wad s ALA 634 N -2.89 -1.14 0.14 0.60 0.00 -0.32 -0.65 121.76 117.49 2wad s ALA 634 Ca 0.59 0.73 0.09 0.00 0.00 0.00 0.00 51.96 53.37 2wad s ALA 634 Cb -0.14 -0.01 -0.04 0.00 0.00 0.00 0.00 23.12 22.93 2wad s ALA 634 CO 0.49 -0.29 -0.20 0.14 0.00 0.00 0.00 175.76 175.89 2wad s VAL 635 N -1.16 1.81 0.15 0.00 -7.23 -0.60 -0.28 120.40 113.08 2wad s VAL 635 Ca -0.12 -1.76 -0.20 0.00 -1.81 0.00 0.00 61.98 58.10 2wad s VAL 635 Cb -0.03 -1.74 0.05 0.00 0.56 0.00 0.00 36.38 35.22 2wad s VAL 635 CO 0.06 -0.19 0.52 0.00 -0.31 0.00 0.00 175.10 175.18 2wad s ALA 636 N -1.62 -1.31 0.08 1.32 0.00 -0.30 -0.76 121.76 119.16 2wad s ALA 636 Ca 0.12 0.25 -0.09 0.00 0.00 0.00 0.00 51.96 52.24 2wad s ALA 636 Cb -0.08 0.81 -0.00 0.00 0.00 0.00 0.00 23.12 23.85 2wad s ALA 636 CO 0.06 -0.72 0.19 1.52 0.00 0.00 0.00 175.76 176.80 2wad s TYR 637 N -3.78 0.14 -0.01 0.00 -0.85 0.57 -0.55 117.35 112.87 2wad s TYR 637 Ca 0.02 -0.55 -0.28 0.00 -0.52 0.00 0.00 57.07 55.74 2wad s TYR 637 Cb 0.00 -0.06 0.10 0.00 0.38 0.00 0.00 41.96 42.38 2wad s TYR 637 CO -0.12 -0.53 0.86 0.00 -1.52 0.00 0.00 175.55 174.24 2wad s ALA 638 N -3.70 -1.81 0.55 9.51 0.00 -0.50 -1.64 121.76 124.17 2wad s ALA 638 Ca 0.04 1.06 -0.18 0.00 0.00 0.00 0.00 51.96 52.87 2wad s ALA 638 Cb 0.04 0.28 -0.05 0.00 0.00 0.00 0.00 23.12 23.39 2wad s ALA 638 CO -0.10 -0.62 1.10 -1.25 0.00 0.00 0.00 175.76 174.88 2wad s PRO 639 N -2.79 3.37 0.27 0.00 0.04 -1.26 -1.01 135.00 133.62 2wad s PRO 639 Ca 0.03 1.47 -0.03 0.00 0.04 0.00 0.00 61.00 62.51 2wad s PRO 639 Cb -0.01 -2.02 0.56 0.00 0.04 0.00 0.00 34.50 33.07 2wad s PRO 639 CO -0.07 -0.81 1.63 1.15 0.04 0.00 0.00 177.00 178.94 2wad h THR 640 N 1.01 0.28 0.00 1.26 2.02 -1.44 -2.05 112.91 113.99 2wad h THR 640 Ca -0.49 -0.04 -0.11 0.00 0.77 0.00 0.00 66.41 66.54 2wad h THR 640 Cb 1.24 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 2wad h THR 640 CO 0.57 0.02 -0.58 -0.33 0.37 0.00 0.00 175.52 175.57 2wad h GLU 641 N 0.12 0.00 -1.39 6.66 5.08 -1.97 -3.40 114.58 119.68 2wad h GLU 641 Ca 0.48 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.58 2wad h GLU 641 Cb 0.91 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 29.94 2wad h GLU 641 CO -0.71 0.45 -0.61 1.21 -1.00 0.00 0.00 179.01 178.35 2wad s ASN 642 N -6.36 -0.60 0.16 1.42 2.47 -0.80 -5.14 114.94 106.09 2wad s ASN 642 Ca 0.03 -1.94 -0.31 0.00 0.42 0.00 0.00 52.86 51.06 2wad s ASN 642 Cb 0.08 1.26 -0.09 0.00 -1.45 0.00 0.00 41.25 41.05 2wad s ASN 642 CO 0.75 -0.11 1.42 -2.84 -3.72 0.00 0.00 177.10 172.61 2wad s PRO 643 N 0.82 4.30 0.00 0.43 0.02 -1.04 -4.02 135.00 135.52 2wad s PRO 643 Ca 0.28 2.17 0.00 0.00 0.02 0.00 0.00 61.00 63.47 2wad s PRO 643 Cb -0.01 -3.20 0.00 0.00 0.02 0.00 0.00 34.50 31.32 2wad s PRO 643 CO -0.08 -0.44 0.00 1.04 -0.33 0.00 0.00 177.00 177.18 2wad n GLN 644 N 3.49 3.73 -4.07 5.54 6.02 -0.18 -4.65 117.38 127.25 2wad n GLN 644 Ca 0.10 0.00 -0.16 0.00 -0.01 0.00 0.00 57.00 56.94 2wad n GLN 644 Cb 0.41 -0.49 -0.15 0.00 1.02 0.00 0.00 30.24 31.03 2wad n GLN 644 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.06 174.55 2wad s ILE 645 N -0.87 0.31 -0.02 5.09 2.07 -0.69 -4.33 121.20 122.75 2wad s ILE 645 Ca 0.00 -0.12 0.05 0.00 -1.41 0.00 0.00 60.65 59.16 2wad s ILE 645 Cb 0.00 -0.30 -0.01 0.00 0.13 0.00 0.00 42.46 42.28 2wad s ILE 645 CO 0.00 0.11 -0.16 0.00 -1.91 0.00 0.00 174.94 172.98 2wad s ALA 646 N 0.19 1.41 -0.01 1.50 0.00 -0.00 -1.41 121.76 123.44 2wad s ALA 646 Ca -0.02 -0.69 0.01 0.00 0.00 0.00 0.00 51.96 51.27 2wad s ALA 646 Cb -0.05 -0.41 0.00 0.00 0.00 0.00 0.00 23.12 22.67 2wad s ALA 646 CO -0.00 0.31 -0.03 0.54 0.00 0.00 0.00 175.76 176.57 2wad s VAL 647 N -0.20 0.30 -0.05 0.00 0.11 0.29 -0.59 120.40 120.25 2wad s VAL 647 Ca 0.02 -0.13 0.04 0.00 -2.93 0.00 0.00 61.98 58.98 2wad s VAL 647 Cb -0.08 -0.28 -0.02 0.00 -1.53 0.00 0.00 36.38 34.47 2wad s VAL 647 CO 0.00 0.10 -0.16 0.00 -3.33 0.00 0.00 175.10 171.71 2wad s ALA 648 N 0.10 2.58 -0.09 1.54 0.00 -0.67 -1.16 121.76 124.07 2wad s ALA 648 Ca -0.01 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 50.98 2wad s ALA 648 Cb -0.04 -0.92 0.01 0.00 0.00 0.00 0.00 23.12 22.17 2wad s ALA 648 CO -0.00 0.53 -0.16 0.08 0.00 0.00 0.00 175.76 176.21 2wad s VAL 649 N -0.62 1.45 -0.14 0.00 1.01 0.62 -2.20 120.40 120.53 2wad s VAL 649 Ca 0.09 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.44 2wad s VAL 649 Cb -0.11 -1.31 0.02 0.00 0.00 0.00 0.00 36.38 34.98 2wad s VAL 649 CO 0.01 0.43 -0.17 -0.69 0.00 0.00 0.00 175.10 174.68 2wad s VAL 650 N 0.72 1.72 -0.39 2.92 1.01 -0.09 -1.18 120.40 125.11 2wad s VAL 650 Ca -0.12 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.13 2wad s VAL 650 Cb -0.16 -1.57 0.16 0.00 0.00 0.00 0.00 36.38 34.81 2wad s VAL 650 CO 0.03 0.48 0.29 0.12 0.00 0.00 0.00 175.10 176.02 2wad s PHE 651 N 1.16 1.00 0.41 5.22 2.19 -1.26 -0.87 117.98 125.84 2wad s PHE 651 Ca -0.01 -2.07 -0.22 0.00 0.33 0.00 0.00 56.93 54.96 2wad s PHE 651 Cb -0.14 -0.96 -0.10 0.00 -1.31 0.00 0.00 43.02 40.51 2wad s PHE 651 CO -0.06 -0.82 0.98 -1.25 1.83 0.00 0.00 175.22 175.89 2wad s PRO 652 N 0.44 4.22 -1.43 10.12 0.04 -1.26 -2.61 135.00 144.52 2wad s PRO 652 Ca 0.27 1.26 -0.06 0.00 0.04 0.00 0.00 61.00 62.50 2wad s PRO 652 Cb -0.08 -2.34 0.04 0.00 0.04 0.00 0.00 34.50 32.16 2wad s PRO 652 CO -0.11 -0.05 0.76 0.72 0.04 0.00 0.00 177.00 178.36 2wad n HIS 653 N -0.37 -2.00 -3.68 0.56 8.25 -1.21 -4.32 115.22 112.45 2wad n HIS 653 Ca 0.06 0.85 -0.37 0.00 -0.26 0.00 0.00 57.72 58.00 2wad n HIS 653 Cb 0.52 -4.05 -0.11 0.00 1.12 0.00 0.00 29.99 27.47 2wad n HIS 653 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 2wad s ASN 654 N -3.92 5.84 -0.22 0.41 3.84 -0.21 -3.59 114.94 117.09 2wad s ASN 654 Ca 0.29 -0.01 0.15 0.00 0.21 0.00 0.00 52.86 53.50 2wad s ASN 654 Cb -0.14 -2.06 0.75 0.00 -0.55 0.00 0.00 41.25 39.25 2wad s ASN 654 CO 0.84 0.01 1.67 0.35 -2.79 0.00 0.00 177.10 177.18 2wad n THR 655 N 4.67 2.62 -2.37 -5.21 -2.24 -0.72 -2.90 114.28 108.14 2wad n THR 655 Ca -0.15 -1.51 -0.43 0.00 -2.27 0.00 0.00 64.05 59.70 2wad n THR 655 Cb 0.52 -0.25 -0.02 0.00 -2.10 0.00 0.00 70.33 68.47 2wad n THR 655 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2wad s ASN 656 N -1.05 6.49 0.00 3.42 -0.87 -1.26 -4.88 114.94 116.79 2wad s ASN 656 Ca 0.52 1.04 0.23 0.00 -1.57 0.00 0.00 52.86 53.08 2wad s ASN 656 Cb 0.40 -2.54 0.08 0.00 -0.02 0.00 0.00 41.25 39.16 2wad s ASN 656 CO 0.15 -1.27 1.15 0.00 -2.57 0.00 0.00 177.10 174.57 2wad n LEU 657 N 8.26 2.45 -0.04 0.60 -0.00 -1.26 -4.55 117.00 122.46 2wad n LEU 657 Ca 0.16 -0.87 -0.02 0.00 -0.00 0.00 0.00 56.01 55.28 2wad n LEU 657 Cb 0.47 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.89 2wad n LEU 657 CO 0.67 0.43 -0.15 0.71 -0.00 0.00 0.00 177.39 179.05 2wad h THR 658 N 3.41 0.00 -3.63 1.47 1.35 -2.02 -3.48 112.91 110.01 2wad h THR 658 Ca 0.00 -0.69 -0.68 0.00 -0.55 0.00 0.00 66.41 64.50 2wad h THR 658 Cb 0.85 0.00 -0.18 0.00 -1.73 0.00 0.00 68.15 67.10 2wad h THR 658 CO 0.00 0.00 -0.71 -1.59 -0.25 0.00 0.00 175.52 172.97 2wad s LYS 659 N -1.68 2.55 -0.36 4.72 -2.85 -1.26 -5.10 119.74 115.77 2wad s LYS 659 Ca -0.06 -0.72 -0.02 0.00 -1.00 0.00 0.00 55.97 54.17 2wad s LYS 659 Cb 0.01 -2.50 0.08 0.00 -2.06 0.00 0.00 37.83 33.36 2wad s LYS 659 CO 0.09 0.61 0.11 1.21 0.10 0.00 0.00 175.35 177.47 2wad s ASN 660 N -1.35 5.10 0.00 0.03 2.47 -1.26 -4.81 114.94 115.11 2wad s ASN 660 Ca 0.16 -1.66 0.29 0.00 0.42 0.00 0.00 52.86 52.08 2wad s ASN 660 Cb -0.11 -1.78 1.42 0.00 -1.45 0.00 0.00 41.25 39.33 2wad s ASN 660 CO 0.07 -0.41 2.00 1.33 -3.72 0.00 0.00 177.10 176.37 2wad n VAL 661 N 4.61 0.02 0.07 -5.21 0.24 -1.26 -4.02 118.33 112.78 2wad n VAL 661 Ca -0.07 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.10 2wad n VAL 661 Cb 0.42 -0.51 -0.07 0.00 -1.47 0.00 0.00 33.84 32.21 2wad n VAL 661 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2wad h GLY 662 N 4.93 -0.82 2.00 7.63 0.00 -1.90 -0.80 103.07 114.11 2wad h GLY 662 Ca 0.00 0.52 -0.05 0.00 0.00 0.00 0.00 47.33 47.81 2wad h GLY 662 CO 0.00 -0.25 -0.21 -2.55 0.00 0.00 0.00 176.54 173.52 2wad h PRO 663 N -0.60 0.00 -0.13 4.80 0.11 -1.84 -2.40 132.00 131.94 2wad h PRO 663 Ca 0.04 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.97 2wad h PRO 663 Cb 0.67 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.77 2wad h PRO 663 CO -0.30 0.21 -0.65 0.00 -0.21 0.00 0.00 178.00 177.05 2wad h ALA 664 N 1.79 0.63 -0.23 -0.75 0.00 -1.68 -1.17 119.26 117.85 2wad h ALA 664 Ca -0.00 -0.56 -0.02 0.00 0.00 0.00 0.00 54.91 54.32 2wad h ALA 664 Cb 0.39 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2wad h ALA 664 CO 0.03 0.72 0.05 0.82 0.00 0.00 0.00 179.25 180.87 2wad h ILE 665 N 0.36 1.21 -0.22 0.00 2.04 -0.72 -1.82 117.51 118.37 2wad h ILE 665 Ca -0.01 -0.70 0.04 0.00 1.00 0.00 0.00 64.86 65.18 2wad h ILE 665 Cb 1.21 1.24 -0.03 0.00 -0.74 0.00 0.00 36.82 38.50 2wad h ILE 665 CO 0.12 0.22 0.01 0.00 0.00 0.00 0.00 178.15 178.50 2wad h ALA 666 N 0.86 0.20 -0.57 1.87 0.00 -1.39 -0.20 119.26 120.03 2wad h ALA 666 Ca 0.07 0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.11 2wad h ALA 666 Cb 0.29 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 2wad h ALA 666 CO 0.00 -0.42 0.25 -0.09 0.00 0.00 0.00 179.25 178.99 2wad h ARG 667 N 0.08 0.45 -0.08 0.00 2.43 -1.18 -0.72 114.38 115.36 2wad h ARG 667 Ca 0.10 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.13 2wad h ARG 667 Cb 0.13 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 2wad h ARG 667 CO -0.17 0.30 -0.50 -0.44 -1.51 0.00 0.00 179.97 177.65 2wad h ASP 668 N 0.47 0.22 -0.55 -3.80 3.45 -1.11 0.13 116.42 115.23 2wad h ASP 668 Ca 0.27 -0.11 -0.11 0.00 0.43 0.00 0.00 57.03 57.52 2wad h ASP 668 Cb 0.26 -0.06 -0.02 0.00 -0.56 0.00 0.00 39.33 38.95 2wad h ASP 668 CO -0.23 0.69 -0.07 0.40 -1.57 0.00 0.00 179.24 178.45 2wad h ILE 669 N 0.17 1.27 -0.17 0.35 2.04 -0.39 -0.87 117.51 119.90 2wad h ILE 669 Ca 0.01 -1.22 -0.02 0.00 1.00 0.00 0.00 64.86 64.62 2wad h ILE 669 Cb 0.94 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.94 2wad h ILE 669 CO 0.08 0.43 0.01 0.40 0.00 0.00 0.00 178.15 179.07 2wad h ILE 670 N 0.91 1.24 -0.51 -0.67 2.04 -0.78 -2.26 117.51 117.48 2wad h ILE 670 Ca 0.15 -0.80 0.10 0.00 1.00 0.00 0.00 64.86 65.31 2wad h ILE 670 Cb 0.63 1.43 -0.10 0.00 -0.74 0.00 0.00 36.82 38.05 2wad h ILE 670 CO 0.04 0.24 -0.17 0.78 0.00 0.00 0.00 178.15 179.05 2wad h ASN 671 N 0.06 -0.59 -0.82 1.72 2.35 -0.69 -1.11 115.58 116.50 2wad h ASN 671 Ca 0.05 0.17 0.08 0.00 -0.55 0.00 0.00 56.30 56.05 2wad h ASN 671 Cb 0.35 0.36 -0.06 0.00 0.05 0.00 0.00 38.32 39.03 2wad h ASN 671 CO 0.01 -0.20 0.53 -0.07 -1.65 0.00 0.00 177.43 176.05 2wad h LEU 672 N -0.04 0.73 -0.22 1.61 3.38 -1.09 -1.99 115.31 117.69 2wad h LEU 672 Ca 0.24 0.01 -0.22 0.00 0.09 0.00 0.00 57.88 58.01 2wad h LEU 672 Cb 0.42 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2wad h LEU 672 CO -0.55 0.45 -0.88 0.22 0.09 0.00 0.00 178.44 177.77 2wad h TYR 673 N 0.82 0.68 -0.40 1.13 3.20 -0.86 -2.46 116.97 119.07 2wad h TYR 673 Ca 0.37 -0.34 -0.09 0.00 3.14 0.00 0.00 58.73 61.80 2wad h TYR 673 Cb 0.35 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 2wad h TYR 673 CO -0.00 1.15 -0.13 -0.97 -1.64 0.00 0.00 178.16 176.56 2wad h ASN 674 N 0.29 0.71 0.54 -2.11 -1.24 -0.80 0.97 115.58 113.94 2wad h ASN 674 Ca -0.07 -0.22 -0.12 0.00 0.71 0.00 0.00 56.30 56.60 2wad h ASN 674 Cb 1.50 -0.19 -0.02 0.00 0.73 0.00 0.00 38.32 40.34 2wad h ASN 674 CO 0.16 0.86 -0.58 -0.61 -1.29 0.00 0.00 177.43 175.98 2wad h GLN 675 N 0.65 0.04 0.00 6.67 4.15 -1.37 -2.38 115.11 122.87 2wad h GLN 675 Ca 0.11 -0.03 -0.14 0.00 0.77 0.00 0.00 58.65 59.37 2wad h GLN 675 Cb 0.60 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.27 2wad h GLN 675 CO 0.04 0.61 -0.78 1.25 -1.93 0.00 0.00 178.83 178.02 2wad h HIS 676 N 0.03 0.00 -1.32 3.99 2.76 -0.95 -3.42 115.15 116.23 2wad h HIS 676 Ca -0.01 0.00 -0.25 0.00 -2.20 0.00 0.00 60.37 57.92 2wad h HIS 676 Cb 1.03 0.00 -0.21 0.00 1.55 0.00 0.00 27.41 29.77 2wad h HIS 676 CO 0.00 0.60 -0.60 -1.58 -1.30 0.00 0.00 177.93 175.05 2wad s HIS 677 N -2.91 -1.00 0.28 5.26 5.65 0.29 -5.09 115.29 117.78 2wad s HIS 677 Ca 0.02 -0.94 -0.29 0.00 0.25 0.00 0.00 55.06 54.10 2wad s HIS 677 Cb 0.08 0.03 -0.14 0.00 -1.18 0.00 0.00 32.58 31.38 2wad s HIS 677 CO 0.77 -1.17 1.16 -2.30 -0.65 0.00 0.00 174.74 172.55 2wad n PRO 678 N 2.99 1.65 -0.05 2.88 -0.02 -0.90 -4.43 135.00 137.12 2wad n PRO 678 Ca 0.20 0.58 -0.07 0.00 -2.02 0.00 0.00 63.50 62.20 2wad n PRO 678 Cb 0.54 -2.06 -0.04 0.00 -0.02 0.00 0.00 33.50 31.91 2wad n PRO 678 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 2wad n MET 679 N 0.97 0.24 -0.81 -0.52 2.81 -1.26 -5.05 117.12 113.50 2wad n MET 679 Ca 0.09 0.06 0.00 0.00 -1.81 0.00 0.00 57.70 56.04 2wad n MET 679 Cb 0.32 -1.19 0.00 0.00 -0.71 0.00 0.00 33.22 31.64 2wad n MET 679 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57