#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wvv s ILE 36 N 0.00 4.70 0.10 3.84 1.01 -1.26 -5.00 121.20 124.59 2wvv s ILE 36 Ca 0.00 2.00 -0.31 0.00 0.00 0.00 0.00 60.65 62.34 2wvv s ILE 36 Cb 0.00 -4.29 -0.09 0.00 0.01 0.00 0.00 42.46 38.09 2wvv s ILE 36 CO 0.00 -0.07 1.72 -2.84 0.00 0.00 0.00 174.94 173.74 2wvv s PRO 37 N 2.53 4.17 -0.00 2.79 0.02 -1.26 -4.85 135.00 138.41 2wvv s PRO 37 Ca 0.47 2.44 0.01 0.00 0.02 0.00 0.00 61.00 63.95 2wvv s PRO 37 Cb -0.17 -3.55 -0.01 0.00 0.02 0.00 0.00 34.50 30.79 2wvv s PRO 37 CO 0.13 -0.77 -0.05 -0.51 -0.33 0.00 0.00 177.00 175.48 2wvv s LEU 38 N 2.54 2.03 -0.07 -5.54 1.43 -1.26 -5.04 118.68 112.77 2wvv s LEU 38 Ca 0.76 -0.12 0.16 0.00 -1.03 0.00 0.00 54.13 53.90 2wvv s LEU 38 Cb -0.43 -0.23 -0.22 0.00 0.03 0.00 0.00 46.19 45.34 2wvv s LEU 38 CO 0.34 0.03 0.49 0.29 0.23 0.00 0.00 176.35 177.74 2wvv n LYS 39 N 2.85 0.65 -1.14 1.70 5.02 -1.26 -4.55 118.16 121.43 2wvv n LYS 39 Ca -0.13 0.16 -0.03 0.00 -2.02 0.00 0.00 58.31 56.29 2wvv n LYS 39 Cb 0.58 -1.70 0.14 0.00 -0.02 0.00 0.00 35.03 34.03 2wvv n LYS 39 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2wvv n TYR 40 N -2.88 0.83 -1.31 2.13 4.01 -1.26 -5.02 117.16 113.66 2wvv n TYR 40 Ca -0.20 -1.66 0.00 0.00 -0.16 0.00 0.00 57.90 55.88 2wvv n TYR 40 Cb 1.02 -0.27 0.00 0.00 -0.31 0.00 0.00 39.34 39.79 2wvv n TYR 40 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wvv n GLY 41 N -0.88 1.12 3.76 2.72 0.00 -1.26 -4.14 105.19 106.51 2wvv n GLY 41 Ca 0.25 -1.90 -0.39 0.00 0.00 0.00 0.00 46.02 43.98 2wvv n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wvv s ALA 42 N -2.69 3.01 -0.04 4.61 0.00 -1.26 -4.96 121.76 120.42 2wvv s ALA 42 Ca 0.00 1.40 0.02 0.00 0.00 0.00 0.00 51.96 53.39 2wvv s ALA 42 Cb 0.00 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.50 2wvv s ALA 42 CO 0.00 -1.31 -0.01 0.25 0.00 0.00 0.00 175.76 174.70 2wvv n THR 43 N -0.65 0.27 -2.52 0.00 -2.24 -1.26 -5.00 114.28 102.88 2wvv n THR 43 Ca 0.08 -0.14 -0.40 0.00 -2.27 0.00 0.00 64.05 61.31 2wvv n THR 43 Cb 0.43 -0.81 -0.05 0.00 -2.10 0.00 0.00 70.33 67.80 2wvv n THR 43 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2wvv s ASN 44 N -3.85 7.33 -0.13 3.42 0.01 -1.26 -5.01 114.94 115.44 2wvv s ASN 44 Ca -0.04 2.21 -0.08 0.00 -0.71 0.00 0.00 52.86 54.25 2wvv s ASN 44 Cb 0.01 -2.62 -0.03 0.00 0.41 0.00 0.00 41.25 39.02 2wvv s ASN 44 CO 0.14 -0.10 -0.15 -0.08 -1.51 0.00 0.00 177.10 175.40 2wvv h GLU 45 N 3.93 0.00 0.00 -0.60 4.57 -1.94 -3.47 114.58 117.06 2wvv h GLU 45 Ca -0.46 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 2wvv h GLU 45 Cb 1.21 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.80 2wvv h GLU 45 CO 0.67 0.00 0.00 0.41 -1.18 0.00 0.00 179.01 178.91 2wvv n GLY 46 N 1.64 5.15 3.76 1.92 0.00 -1.26 -5.04 105.19 111.36 2wvv n GLY 46 Ca -0.06 -1.66 -0.40 0.00 0.00 0.00 0.00 46.02 43.90 2wvv n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wvv s LYS 47 N 2.94 4.64 0.28 1.61 1.02 -1.26 -5.02 119.74 123.96 2wvv s LYS 47 Ca 0.00 1.78 -0.30 0.00 0.02 0.00 0.00 55.97 57.47 2wvv s LYS 47 Cb 0.00 -3.21 -0.11 0.00 -0.52 0.00 0.00 37.83 34.00 2wvv s LYS 47 CO 0.00 0.21 1.48 1.03 -0.92 0.00 0.00 175.35 177.15 2wvv s ARG 48 N -1.28 4.21 -0.07 1.68 0.52 -1.26 -4.93 118.95 117.82 2wvv s ARG 48 Ca 0.45 2.41 0.11 0.00 -0.52 0.00 0.00 55.73 58.17 2wvv s ARG 48 Cb -0.31 -3.06 0.16 0.00 0.52 0.00 0.00 34.95 32.26 2wvv s ARG 48 CO 0.40 -0.47 1.07 1.04 0.02 0.00 0.00 175.30 177.35 2wvv n GLN 49 N 1.92 1.74 -1.77 3.54 1.13 -1.26 -4.66 117.38 118.02 2wvv n GLN 49 Ca 0.06 -2.04 -0.33 0.00 -1.94 0.00 0.00 57.00 52.74 2wvv n GLN 49 Cb 0.39 -1.23 0.05 0.00 0.11 0.00 0.00 30.24 29.56 2wvv n GLN 49 CO 0.00 0.00 0.00 0.16 -1.44 0.00 0.00 177.06 175.78 2wvv s ASP 50 N -2.02 5.06 0.40 1.08 -4.77 -1.26 -4.77 116.67 110.39 2wvv s ASP 50 Ca 0.18 2.06 0.15 0.00 -3.30 0.00 0.00 52.55 51.64 2wvv s ASP 50 Cb 0.16 -2.56 1.00 0.00 -1.09 0.00 0.00 42.92 40.43 2wvv s ASP 50 CO 0.02 -1.67 1.88 -0.65 0.70 0.00 0.00 175.17 175.45 2wvv h PRO 51 N 0.11 0.47 -0.50 2.11 0.11 -1.98 -0.55 132.00 131.76 2wvv h PRO 51 Ca -0.47 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 2wvv h PRO 51 Cb 1.25 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 2wvv h PRO 51 CO 0.54 0.31 0.14 0.00 -0.21 0.00 0.00 178.00 178.78 2wvv h ALA 52 N 1.62 0.66 -0.15 -0.75 0.00 -1.92 -0.74 119.26 117.98 2wvv h ALA 52 Ca 0.44 -0.20 -0.17 0.00 0.00 0.00 0.00 54.91 54.98 2wvv h ALA 52 Cb 0.95 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2wvv h ALA 52 CO -0.17 0.34 -0.60 1.98 0.00 0.00 0.00 179.25 180.80 2wvv h MET 53 N 0.69 0.51 -0.36 0.00 1.85 -1.53 -1.86 114.93 114.23 2wvv h MET 53 Ca 0.16 -0.34 -0.02 0.00 -0.61 0.00 0.00 59.70 58.88 2wvv h MET 53 Cb 0.31 0.05 -0.02 0.00 0.43 0.00 0.00 31.60 32.37 2wvv h MET 53 CO -0.00 0.96 0.13 1.96 -0.40 0.00 0.00 176.91 179.55 2wvv h GLN 54 N 0.38 0.51 -0.16 0.39 4.20 -0.94 -0.88 115.11 118.62 2wvv h GLN 54 Ca -0.00 -0.07 -0.07 0.00 0.06 0.00 0.00 58.65 58.56 2wvv h GLN 54 Cb 1.14 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.83 2wvv h GLN 54 CO 0.11 0.44 -0.19 -0.22 -0.67 0.00 0.00 178.83 178.30 2wvv h LYS 55 N 0.51 0.41 -0.39 1.46 1.63 -0.94 0.12 116.57 119.38 2wvv h LYS 55 Ca 0.12 -0.23 0.08 0.00 -0.85 0.00 0.00 60.65 59.77 2wvv h LYS 55 Cb 0.14 0.01 -0.08 0.00 -0.60 0.00 0.00 32.23 31.71 2wvv h LYS 55 CO -0.01 0.80 -0.12 0.35 -3.45 0.00 0.00 179.45 177.02 2wvv h PHE 56 N 0.04 -0.27 0.02 1.91 3.57 -0.96 -1.20 116.94 120.05 2wvv h PHE 56 Ca 0.02 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 2wvv h PHE 56 Cb 0.74 0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.67 2wvv h PHE 56 CO 0.09 -0.20 -0.01 -0.09 -2.23 0.00 0.00 178.31 175.87 2wvv h ARG 57 N -0.03 -0.03 0.00 1.11 2.43 -1.14 -3.25 114.38 113.47 2wvv h ARG 57 Ca 0.19 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.33 2wvv h ARG 57 Cb 0.32 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.87 2wvv h ARG 57 CO -0.42 0.26 -0.13 -0.44 -1.51 0.00 0.00 179.97 177.73 2wvv h ASP 58 N -0.31 0.00 -0.56 -3.80 3.32 -0.52 -2.65 116.42 111.91 2wvv h ASP 58 Ca -0.00 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.13 2wvv h ASP 58 Cb 0.30 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.78 2wvv h ASP 58 CO 0.00 0.13 0.18 0.78 -1.72 0.00 0.00 179.24 178.62 2wvv h ASN 59 N 0.00 0.15 0.00 6.45 2.35 -1.26 -1.08 115.58 122.20 2wvv h ASN 59 Ca -0.00 0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2wvv h ASN 59 Cb 0.27 0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.71 2wvv h ASN 59 CO 0.02 0.10 0.00 0.54 -1.65 0.00 0.00 177.43 176.44 2wvv n ARG 60 N -5.03 0.00 -3.84 0.81 5.12 -1.00 -4.59 116.66 108.12 2wvv n ARG 60 Ca 0.07 0.00 -0.36 0.00 -1.93 0.00 0.00 57.85 55.63 2wvv n ARG 60 Cb 0.25 0.00 -0.13 0.00 -1.16 0.00 0.00 32.46 31.42 2wvv n ARG 60 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 2wvv s LEU 61 N 0.00 3.14 0.39 0.55 2.96 -1.26 -1.16 118.68 123.30 2wvv s LEU 61 Ca 0.00 -0.33 0.04 0.00 -0.22 0.00 0.00 54.13 53.62 2wvv s LEU 61 Cb 0.00 -1.81 -0.05 0.00 0.50 0.00 0.00 46.19 44.83 2wvv s LEU 61 CO 0.00 -0.03 0.06 -0.83 -1.32 0.00 0.00 176.35 174.23 2wvv s GLY 62 N 1.53 2.42 0.11 7.98 0.00 -0.33 -0.76 107.32 118.27 2wvv s GLY 62 Ca 0.06 -1.64 0.09 0.00 0.00 0.00 0.00 44.72 43.24 2wvv s GLY 62 CO -0.00 -1.92 -0.21 0.00 0.00 0.00 0.00 173.10 170.96 2wvv s ALA 63 N -3.12 2.56 -0.11 3.20 0.00 -0.44 -1.39 121.76 122.47 2wvv s ALA 63 Ca 0.28 -1.36 -0.01 0.00 0.00 0.00 0.00 51.96 50.87 2wvv s ALA 63 Cb 0.06 -0.58 -0.03 0.00 0.00 0.00 0.00 23.12 22.58 2wvv s ALA 63 CO 0.14 0.57 -0.05 0.12 0.00 0.00 0.00 175.76 176.54 2wvv s PHE 64 N -1.07 2.99 -0.24 0.00 5.99 -0.17 -0.23 117.98 125.25 2wvv s PHE 64 Ca 0.16 -0.12 -0.02 0.00 0.00 0.00 0.00 56.93 56.95 2wvv s PHE 64 Cb -0.10 -1.82 0.02 0.00 0.00 0.00 0.00 43.02 41.11 2wvv s PHE 64 CO 0.08 0.17 -0.06 0.42 -0.00 0.00 0.00 175.22 175.83 2wvv s ILE 65 N -0.31 2.98 -0.38 3.12 -1.09 0.66 -0.18 121.20 126.00 2wvv s ILE 65 Ca 0.05 -0.90 -0.09 0.00 -2.23 0.00 0.00 60.65 57.48 2wvv s ILE 65 Cb -0.13 -2.47 0.05 0.00 -1.58 0.00 0.00 42.46 38.33 2wvv s ILE 65 CO 0.02 0.26 0.20 -1.00 -1.23 0.00 0.00 174.94 173.19 2wvv s HIS 66 N 1.36 3.27 -0.03 3.97 3.76 -0.58 -1.49 115.29 125.55 2wvv s HIS 66 Ca 0.02 -1.24 -0.01 0.00 -0.15 0.00 0.00 55.06 53.68 2wvv s HIS 66 Cb -0.16 -2.56 0.03 0.00 1.11 0.00 0.00 32.58 31.00 2wvv s HIS 66 CO -0.04 -0.73 0.04 -0.46 -0.85 0.00 0.00 174.74 172.70 2wvv s TRP 67 N 1.48 0.05 0.00 1.40 -0.00 -1.26 -3.90 118.94 116.71 2wvv s TRP 67 Ca 0.01 0.18 0.00 0.00 -0.00 0.00 0.00 56.10 56.30 2wvv s TRP 67 Cb -0.20 -0.34 0.00 0.00 -0.00 0.00 0.00 33.47 32.92 2wvv s TRP 67 CO 0.04 -0.13 0.00 0.41 -0.00 0.00 0.00 176.95 177.27 2wvv n GLY 68 N 4.66 1.25 0.27 5.86 0.00 -1.26 -4.86 105.19 111.11 2wvv n GLY 68 Ca -0.17 -0.87 0.10 0.00 0.00 0.00 0.00 46.02 45.07 2wvv n GLY 68 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wvv h LEU 69 N 0.00 0.00 -2.05 0.99 3.38 -1.98 -1.89 115.31 113.77 2wvv h LEU 69 Ca 0.00 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.07 2wvv h LEU 69 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2wvv h LEU 69 CO 0.00 0.02 0.37 0.10 0.09 0.00 0.00 178.44 179.02 2wvv h TYR 70 N 0.00 0.00 0.00 1.13 -0.00 -1.93 -1.21 116.97 114.96 2wvv h TYR 70 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.71 2wvv h TYR 70 Cb 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 36.77 2wvv h TYR 70 CO 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 178.16 178.08 2wvv h ALA 71 N 1.57 1.16 0.38 0.10 0.00 -1.60 -1.10 119.26 119.78 2wvv h ALA 71 Ca 0.16 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2wvv h ALA 71 Cb 0.89 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2wvv h ALA 71 CO -0.00 0.09 -0.18 0.82 0.00 0.00 0.00 179.25 179.98 2wvv h ILE 72 N 0.00 0.00 -0.18 0.00 2.04 -1.43 -3.30 117.51 114.64 2wvv h ILE 72 Ca -0.00 -0.47 -0.10 0.00 1.00 0.00 0.00 64.86 65.30 2wvv h ILE 72 Cb 0.32 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.39 2wvv h ILE 72 CO 0.01 0.00 -0.31 1.55 0.00 0.00 0.00 178.15 179.40 2wvv h PRO 73 N -0.97 0.37 -5.74 2.37 0.13 -1.71 -3.48 132.00 122.96 2wvv h PRO 73 Ca -0.05 -0.15 -0.38 0.00 -0.87 0.00 0.00 66.00 64.55 2wvv h PRO 73 Cb 0.39 -0.02 0.15 0.00 0.13 0.00 0.00 31.00 31.65 2wvv h PRO 73 CO 0.09 0.64 -0.69 0.41 -0.23 0.00 0.00 178.00 178.21 2wvv n GLY 74 N -0.33 -0.49 0.47 1.56 0.00 -0.42 -2.74 105.19 103.24 2wvv n GLY 74 Ca -0.01 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2wvv n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wvv n GLY 75 N -1.78 0.53 3.27 -0.02 0.00 -1.26 -1.08 105.19 104.85 2wvv n GLY 75 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 2wvv n GLY 75 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wvv s GLU 76 N -0.84 2.74 -0.02 1.61 2.12 -1.11 -0.53 118.70 122.67 2wvv s GLU 76 Ca 0.00 -0.87 0.00 0.00 0.36 0.00 0.00 54.97 54.46 2wvv s GLU 76 Cb 0.00 -2.24 0.03 0.00 0.26 0.00 0.00 34.13 32.17 2wvv s GLU 76 CO 0.00 0.33 0.02 -0.46 -0.54 0.00 0.00 175.26 174.60 2wvv s TRP 77 N -0.02 0.17 -1.47 5.30 -0.11 -0.69 -4.70 118.94 117.43 2wvv s TRP 77 Ca -0.07 0.07 -0.11 0.00 1.22 0.00 0.00 56.10 57.20 2wvv s TRP 77 Cb -0.15 -0.33 0.06 0.00 -1.50 0.00 0.00 33.47 31.55 2wvv s TRP 77 CO 0.05 -0.11 0.98 0.09 -4.62 0.00 0.00 176.95 173.34 2wvv n ASN 78 N 4.17 -4.53 -0.82 5.86 4.13 -1.26 -1.56 115.26 121.25 2wvv n ASN 78 Ca -0.27 -0.74 -0.11 0.00 1.68 0.00 0.00 54.58 55.14 2wvv n ASN 78 Cb 0.50 -4.13 -0.05 0.00 -1.54 0.00 0.00 39.78 34.56 2wvv n ASN 78 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2wvv n GLY 79 N -1.72 1.15 3.22 7.41 0.00 -1.26 -5.01 105.19 108.98 2wvv n GLY 79 Ca -0.02 -0.28 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 2wvv n GLY 79 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wvv s LYS 80 N -2.75 3.16 -0.11 1.61 2.20 -0.60 -5.11 119.74 118.14 2wvv s LYS 80 Ca 0.00 -0.76 -0.27 0.00 -0.36 0.00 0.00 55.97 54.58 2wvv s LYS 80 Cb 0.00 -2.65 -0.02 0.00 -1.51 0.00 0.00 37.83 33.65 2wvv s LYS 80 CO 0.00 -0.09 0.89 0.08 -0.36 0.00 0.00 175.35 175.87 2wvv s VAL 81 N 1.07 4.87 -0.13 4.02 1.01 -1.26 -1.70 120.40 128.27 2wvv s VAL 81 Ca -0.01 1.80 -0.07 0.00 0.00 0.00 0.00 61.98 63.71 2wvv s VAL 81 Cb -0.14 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 2wvv s VAL 81 CO -0.05 0.07 0.12 -0.31 0.00 0.00 0.00 175.10 174.93 2wvv s TYR 82 N 1.78 3.50 -0.36 5.22 2.02 0.31 -5.00 117.35 124.82 2wvv s TYR 82 Ca 0.43 0.44 0.26 0.00 -0.37 0.00 0.00 57.07 57.83 2wvv s TYR 82 Cb -0.18 -1.96 0.63 0.00 -0.40 0.00 0.00 41.96 40.05 2wvv s TYR 82 CO 0.17 0.61 1.71 0.78 -1.57 0.00 0.00 175.55 177.25 2wvv h GLY 83 N 5.34 0.00 -1.05 0.71 0.00 -1.97 -3.46 103.07 102.63 2wvv h GLY 83 Ca -0.52 0.00 -0.44 0.00 0.00 0.00 0.00 47.33 46.37 2wvv h GLY 83 CO 0.61 0.00 0.05 -0.32 0.00 0.00 0.00 176.54 176.88 2wvv s GLY 84 N -4.11 1.55 0.09 4.60 0.00 -1.26 -4.89 107.32 103.30 2wvv s GLY 84 Ca 0.06 -0.18 -0.34 0.00 0.00 0.00 0.00 44.72 44.26 2wvv s GLY 84 CO 0.63 0.52 1.67 0.00 0.00 0.00 0.00 173.10 175.92 2wvv n ALA 85 N -4.78 1.26 0.07 3.20 0.00 -1.25 -4.87 120.51 114.14 2wvv n ALA 85 Ca 0.03 0.40 0.10 0.00 0.00 0.00 0.00 53.44 53.97 2wvv n ALA 85 Cb 0.55 -2.40 0.56 0.00 0.00 0.00 0.00 19.45 18.16 2wvv n ALA 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wvv h ALA 86 N 6.94 2.01 0.00 0.00 0.00 -1.84 -0.65 119.26 125.73 2wvv h ALA 86 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2wvv h ALA 86 Cb 1.26 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2wvv h ALA 86 CO 0.91 -0.07 0.00 -0.85 0.00 0.00 0.00 179.25 179.24 2wvv n GLU 87 N -4.48 0.11 -0.26 0.00 0.00 -1.26 -2.17 120.64 112.57 2wvv n GLU 87 Ca 0.04 0.32 0.12 0.00 0.00 0.00 0.00 57.16 57.63 2wvv n GLU 87 Cb 0.23 -1.69 0.26 0.00 0.00 0.00 0.00 31.44 30.24 2wvv n GLU 87 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.13 178.04 2wvv n TRP 88 N -1.89 0.68 -0.04 -1.84 7.02 -0.25 -4.68 117.44 116.44 2wvv n TRP 88 Ca 0.03 -0.34 0.16 0.00 -1.02 0.00 0.00 57.50 56.33 2wvv n TRP 88 Cb 0.22 0.00 0.59 0.00 -2.42 0.00 0.00 31.31 29.70 2wvv n TRP 88 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 2wvv h LEU 89 N 4.46 0.19 -0.90 -0.99 5.85 -1.46 0.53 115.31 122.99 2wvv h LEU 89 Ca 0.00 0.01 0.11 0.00 0.84 0.00 0.00 57.88 58.83 2wvv h LEU 89 Cb 1.00 -0.03 -0.08 0.00 0.37 0.00 0.00 40.66 41.91 2wvv h LEU 89 CO 0.00 0.11 0.54 0.50 -0.34 0.00 0.00 178.44 179.24 2wvv h LYS 90 N 0.21 0.84 0.12 1.25 3.64 -1.85 -0.20 116.57 120.58 2wvv h LYS 90 Ca 0.27 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 2wvv h LYS 90 Cb 0.77 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 2wvv h LYS 90 CO -0.05 0.56 -0.06 1.03 -2.27 0.00 0.00 179.45 178.66 2wvv h SER 91 N 0.87 -0.13 -0.83 4.20 0.87 -1.24 0.11 113.55 117.39 2wvv h SER 91 Ca 0.44 -0.42 0.05 0.00 -1.23 0.00 0.00 61.79 60.63 2wvv h SER 91 Cb 0.43 0.03 -0.06 0.00 -0.44 0.00 0.00 62.40 62.37 2wvv h SER 91 CO -0.26 0.42 0.52 -0.50 -0.53 0.00 0.00 176.83 176.47 2wvv h TRP 92 N -0.75 0.97 -0.06 2.24 -0.00 -1.24 -2.10 115.95 115.01 2wvv h TRP 92 Ca -0.02 0.03 0.00 0.00 -0.00 0.00 0.00 58.89 58.90 2wvv h TRP 92 Cb 0.55 -0.31 0.00 0.00 -0.00 0.00 0.00 29.16 29.39 2wvv h TRP 92 CO 0.10 0.51 0.00 0.00 -0.00 0.00 0.00 178.44 179.05 2wvv n ALA 93 N -2.35 2.57 -3.87 1.49 0.00 -0.10 -4.95 120.51 113.30 2wvv n ALA 93 Ca 0.11 -0.43 -0.24 0.00 0.00 0.00 0.00 53.44 52.88 2wvv n ALA 93 Cb 0.14 -1.18 -0.00 0.00 0.00 0.00 0.00 19.45 18.41 2wvv n ALA 93 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2wvv n LYS 94 N 0.07 -3.94 -3.07 0.00 4.76 -0.79 -4.95 118.16 110.24 2wvv n LYS 94 Ca 0.18 0.49 -0.40 0.00 -2.87 0.00 0.00 58.31 55.71 2wvv n LYS 94 Cb 0.31 -4.81 -0.05 0.00 -1.84 0.00 0.00 35.03 28.65 2wvv n LYS 94 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2wvv s VAL 95 N -3.82 5.06 0.56 -0.18 1.01 0.33 -5.03 120.40 118.32 2wvv s VAL 95 Ca 0.04 1.41 -0.20 0.00 0.00 0.00 0.00 61.98 63.22 2wvv s VAL 95 Cb -0.02 -4.02 -0.05 0.00 0.00 0.00 0.00 36.38 32.29 2wvv s VAL 95 CO 0.86 0.26 1.25 -2.84 0.00 0.00 0.00 175.10 174.63 2wvv s PRO 96 N 0.78 3.16 0.28 2.72 0.02 -1.26 -4.80 135.00 135.89 2wvv s PRO 96 Ca 0.37 1.95 0.00 0.00 0.02 0.00 0.00 61.00 63.34 2wvv s PRO 96 Cb -0.18 -2.12 0.50 0.00 0.02 0.00 0.00 34.50 32.73 2wvv s PRO 96 CO 0.18 -1.09 1.86 0.00 -0.33 0.00 0.00 177.00 177.61 2wvv h ALA 97 N 1.27 1.48 -0.12 -1.55 0.00 -1.96 -0.43 119.26 117.95 2wvv h ALA 97 Ca -0.50 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.44 2wvv h ALA 97 Cb 1.29 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 2wvv h ALA 97 CO 0.57 0.32 -0.08 -0.44 0.00 0.00 0.00 179.25 179.61 2wvv h ASP 98 N 1.06 -0.27 -0.00 0.00 5.19 -1.94 -1.66 116.42 118.81 2wvv h ASP 98 Ca 0.46 0.06 -0.19 0.00 -0.62 0.00 0.00 57.03 56.74 2wvv h ASP 98 Cb 0.34 0.14 -0.00 0.00 0.18 0.00 0.00 39.33 39.99 2wvv h ASP 98 CO -0.22 -0.11 -0.65 -0.08 -3.12 0.00 0.00 179.24 175.05 2wvv h GLU 99 N -0.09 0.62 -0.27 3.56 4.81 -1.71 -3.06 114.58 118.45 2wvv h GLU 99 Ca 0.07 -0.45 -0.01 0.00 -0.13 0.00 0.00 59.36 58.84 2wvv h GLU 99 Cb 0.20 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 2wvv h GLU 99 CO -0.17 1.07 0.13 2.35 -0.73 0.00 0.00 179.01 181.66 2wvv h TRP 100 N 0.45 0.38 0.00 0.92 2.91 -1.01 -2.98 115.95 116.63 2wvv h TRP 100 Ca -0.02 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 59.99 2wvv h TRP 100 Cb 1.24 -0.12 0.00 0.00 -0.51 0.00 0.00 29.16 29.77 2wvv h TRP 100 CO 0.06 0.35 0.00 1.28 -1.03 0.00 0.00 178.44 179.10 2wvv n LEU 101 N -4.81 0.47 0.16 0.65 4.77 -0.63 -1.71 117.00 115.89 2wvv n LEU 101 Ca -0.02 0.60 0.12 0.00 -0.03 0.00 0.00 56.01 56.68 2wvv n LEU 101 Cb 0.09 -0.52 0.58 0.00 -2.33 0.00 0.00 43.42 41.25 2wvv n LEU 101 CO 0.35 -0.40 0.87 0.11 -1.33 0.00 0.00 177.39 176.99 2wvv h LYS 102 N 0.00 0.00 -0.06 3.23 1.57 -1.42 -2.03 116.57 117.86 2wvv h LYS 102 Ca 0.00 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 2wvv h LYS 102 Cb 0.39 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.69 2wvv h LYS 102 CO 0.00 0.00 0.12 -0.07 -0.57 0.00 0.00 179.45 178.93 2wvv h LEU 103 N 0.00 0.00 -1.46 2.94 3.38 -1.48 -1.64 115.31 117.05 2wvv h LEU 103 Ca 0.00 0.00 0.19 0.00 0.09 0.00 0.00 57.88 58.16 2wvv h LEU 103 Cb 0.19 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.87 2wvv h LEU 103 CO 0.00 0.00 0.59 0.24 0.09 0.00 0.00 178.44 179.36 2wvv h MET 104 N 0.00 0.45 0.00 1.13 2.86 -1.60 0.17 114.93 117.94 2wvv h MET 104 Ca 0.03 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2wvv h MET 104 Cb 0.26 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.82 2wvv h MET 104 CO -0.00 0.30 0.00 -0.25 1.06 0.00 0.00 176.91 178.02 2wvv n ASP 105 N -4.53 0.59 -0.51 1.22 8.00 -0.62 -1.75 116.55 118.96 2wvv n ASP 105 Ca 0.19 0.74 0.06 0.00 0.71 0.00 0.00 54.79 56.50 2wvv n ASP 105 Cb 0.65 -0.83 0.05 0.00 -0.02 0.00 0.00 41.12 40.97 2wvv n ASP 105 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wvv n GLN 106 N -2.26 0.77 -2.38 -1.24 6.02 0.59 -4.74 117.38 114.15 2wvv n GLN 106 Ca -0.01 -1.26 -0.40 0.00 -0.01 0.00 0.00 57.00 55.32 2wvv n GLN 106 Cb 0.07 -1.24 -0.03 0.00 1.02 0.00 0.00 30.24 30.06 2wvv n GLN 106 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 2wvv s TRP 107 N -1.05 2.07 -0.45 1.08 -0.11 -0.72 -4.82 118.94 114.95 2wvv s TRP 107 Ca 0.15 0.23 0.07 0.00 1.22 0.00 0.00 56.10 57.76 2wvv s TRP 107 Cb 0.11 -4.45 0.26 0.00 -1.50 0.00 0.00 33.47 27.88 2wvv s TRP 107 CO 0.16 -2.15 0.78 -1.71 -4.62 0.00 0.00 176.95 169.40 2wvv n ASN 108 N 10.51 -1.60 -4.58 5.86 5.15 -1.26 -2.98 115.26 126.36 2wvv n ASN 108 Ca 0.09 -3.13 -0.35 0.00 -0.60 0.00 0.00 54.58 50.60 2wvv n ASN 108 Cb 0.50 0.88 -0.03 0.00 -0.53 0.00 0.00 39.78 40.59 2wvv n ASN 108 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2wvv s PRO 109 N -0.16 3.17 0.52 1.20 0.04 -1.26 -4.80 135.00 133.71 2wvv s PRO 109 Ca 0.33 -1.37 0.20 0.00 0.04 0.00 0.00 61.00 60.20 2wvv s PRO 109 Cb 0.22 -5.34 1.36 0.00 0.04 0.00 0.00 34.50 30.78 2wvv s PRO 109 CO -0.17 -3.09 2.12 0.00 0.04 0.00 0.00 177.00 175.90 2wvv h THR 110 N 6.15 0.86 -0.02 1.26 1.03 -1.81 -2.07 112.91 118.32 2wvv h THR 110 Ca 0.29 -0.24 0.00 0.00 -0.01 0.00 0.00 66.41 66.45 2wvv h THR 110 Cb 0.93 1.13 0.00 0.00 -1.07 0.00 0.00 68.15 69.14 2wvv h THR 110 CO 1.33 0.06 -0.05 0.29 -0.01 0.00 0.00 175.52 177.14 2wvv n LYS 111 N -4.20 1.70 -1.72 0.00 5.02 0.40 -4.94 118.16 114.43 2wvv n LYS 111 Ca -0.03 -1.13 -0.42 0.00 -2.02 0.00 0.00 58.31 54.71 2wvv n LYS 111 Cb 0.15 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.65 2wvv n LYS 111 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2wvv n PHE 112 N 0.34 2.75 -3.40 2.13 7.35 -0.78 -4.55 117.46 121.30 2wvv n PHE 112 Ca 0.17 0.11 -0.14 0.00 -0.76 0.00 0.00 57.45 56.83 2wvv n PHE 112 Cb 0.42 -2.65 -0.09 0.00 0.35 0.00 0.00 39.48 37.50 2wvv n PHE 112 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2wvv s ASP 113 N 0.98 0.97 0.38 -2.13 -1.08 -1.26 -5.04 116.67 109.49 2wvv s ASP 113 Ca 0.73 -0.25 0.06 0.00 -0.52 0.00 0.00 52.55 52.57 2wvv s ASP 113 Cb -0.51 0.75 0.77 0.00 -1.46 0.00 0.00 42.92 42.47 2wvv s ASP 113 CO 0.37 -0.34 2.00 0.00 0.52 0.00 0.00 175.17 177.72 2wvv h ALA 114 N 8.24 1.70 -0.78 3.66 0.00 -1.93 -1.52 119.26 128.61 2wvv h ALA 114 Ca -0.16 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 2wvv h ALA 114 Cb 1.13 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 2wvv h ALA 114 CO 0.29 0.23 0.39 0.87 0.00 0.00 0.00 179.25 181.03 2wvv h LYS 115 N 0.70 1.11 -0.51 0.00 1.57 -1.92 -1.01 116.57 116.51 2wvv h LYS 115 Ca 0.25 -0.15 -0.10 0.00 -1.87 0.00 0.00 60.65 58.77 2wvv h LYS 115 Cb 0.11 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 2wvv h LYS 115 CO -0.07 0.85 -0.10 0.87 -0.57 0.00 0.00 179.45 180.43 2wvv h LYS 116 N 1.11 0.94 -0.51 3.15 1.57 -1.73 -1.04 116.57 120.05 2wvv h LYS 116 Ca 0.27 -0.33 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 2wvv h LYS 116 Cb 0.09 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 2wvv h LYS 116 CO -0.04 0.99 0.26 -1.49 -0.57 0.00 0.00 179.45 178.60 2wvv h TRP 117 N 0.84 0.73 -0.45 -1.35 4.06 -1.05 -1.15 115.95 117.59 2wvv h TRP 117 Ca 0.14 -0.03 -0.12 0.00 2.06 0.00 0.00 58.89 60.94 2wvv h TRP 117 Cb 0.63 -0.23 -0.01 0.00 -1.00 0.00 0.00 29.16 28.55 2wvv h TRP 117 CO 0.04 0.56 -0.19 0.00 -3.56 0.00 0.00 178.44 175.29 2wvv h ALA 118 N 1.10 0.82 -0.73 1.49 0.00 -1.03 -1.89 119.26 119.02 2wvv h ALA 118 Ca 0.18 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2wvv h ALA 118 Cb 0.09 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2wvv h ALA 118 CO -0.02 0.65 0.27 0.87 0.00 0.00 0.00 179.25 181.01 2wvv h LYS 119 N 0.77 1.09 -0.22 0.00 1.79 -1.00 -0.48 116.57 118.52 2wvv h LYS 119 Ca 0.11 -0.20 -0.00 0.00 -2.18 0.00 0.00 60.65 58.37 2wvv h LYS 119 Cb 0.73 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 31.19 2wvv h LYS 119 CO 0.06 0.90 0.13 1.98 -1.08 0.00 0.00 179.45 181.44 2wvv h MET 120 N 1.06 0.31 -0.86 3.15 4.05 -0.95 -0.83 114.93 120.86 2wvv h MET 120 Ca 0.24 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.63 2wvv h MET 120 Cb 0.24 -0.06 -0.04 0.00 -0.80 0.00 0.00 31.60 30.93 2wvv h MET 120 CO -0.02 0.26 0.55 0.00 0.23 0.00 0.00 176.91 177.93 2wvv h ALA 121 N 1.03 1.09 -0.42 0.39 0.00 -1.16 -1.54 119.26 118.66 2wvv h ALA 121 Ca 0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2wvv h ALA 121 Cb 0.03 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 2wvv h ALA 121 CO -0.01 0.52 0.14 -0.22 0.00 0.00 0.00 179.25 179.67 2wvv h LYS 122 N 1.17 0.65 -0.09 0.00 3.64 -0.74 -2.66 116.57 118.54 2wvv h LYS 122 Ca 0.31 -0.14 -0.10 0.00 -1.27 0.00 0.00 60.65 59.46 2wvv h LYS 122 Cb -0.10 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 2wvv h LYS 122 CO -0.06 0.64 -0.38 0.93 -2.27 0.00 0.00 179.45 178.30 2wvv h GLU 123 N 0.54 0.19 0.00 1.90 5.08 -1.01 -2.28 114.58 118.99 2wvv h GLU 123 Ca 0.14 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 2wvv h GLU 123 Cb 0.25 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 2wvv h GLU 123 CO -0.01 0.55 -0.09 1.98 -1.00 0.00 0.00 179.01 180.44 2wvv h MET 124 N 0.16 0.00 0.00 2.33 4.05 -0.97 -3.38 114.93 117.12 2wvv h MET 124 Ca 0.02 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.44 2wvv h MET 124 Cb 0.75 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.55 2wvv h MET 124 CO 0.06 0.09 0.00 0.41 0.23 0.00 0.00 176.91 177.70 2wvv n GLY 125 N -0.43 0.77 3.77 1.39 0.00 -0.86 -3.20 105.19 106.63 2wvv n GLY 125 Ca -0.01 -0.18 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 2wvv n GLY 125 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wvv s THR 126 N -2.00 3.45 -0.74 2.61 -4.23 -1.03 -4.87 115.64 108.83 2wvv s THR 126 Ca 0.00 1.34 0.16 0.00 -1.18 0.00 0.00 61.69 62.01 2wvv s THR 126 Cb 0.00 -3.80 -0.18 0.00 1.34 0.00 0.00 72.50 69.85 2wvv s THR 126 CO 0.00 0.22 0.69 0.29 -0.54 0.00 0.00 174.62 175.28 2wvv n LYS 127 N 0.69 1.46 -3.61 3.99 4.76 0.06 -4.68 118.16 120.83 2wvv n LYS 127 Ca 0.01 -0.01 -0.11 0.00 -2.87 0.00 0.00 58.31 55.34 2wvv n LYS 127 Cb 0.46 -1.29 -0.04 0.00 -1.84 0.00 0.00 35.03 32.32 2wvv n LYS 127 CO 0.00 0.00 0.00 1.52 -1.37 0.00 0.00 177.40 177.55 2wvv s TYR 128 N -2.60 -0.24 -0.03 2.13 -0.85 -1.24 -2.20 117.35 112.32 2wvv s TYR 128 Ca 0.06 -0.04 0.02 0.00 -0.52 0.00 0.00 57.07 56.59 2wvv s TYR 128 Cb 0.12 0.29 0.00 0.00 0.38 0.00 0.00 41.96 42.76 2wvv s TYR 128 CO 0.68 -0.71 -0.09 0.08 -1.52 0.00 0.00 175.55 173.99 2wvv s VAL 129 N -3.71 0.82 -0.19 -3.49 1.01 -0.29 -1.32 120.40 113.21 2wvv s VAL 129 Ca 0.02 -0.37 -0.07 0.00 0.00 0.00 0.00 61.98 61.56 2wvv s VAL 129 Cb 0.01 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.62 2wvv s VAL 129 CO -0.11 0.26 0.06 -0.54 0.00 0.00 0.00 175.10 174.76 2wvv s LYS 130 N 0.27 3.90 -0.08 2.72 1.02 0.68 -0.39 119.74 127.86 2wvv s LYS 130 Ca -0.05 -0.38 0.05 0.00 0.02 0.00 0.00 55.97 55.61 2wvv s LYS 130 Cb -0.10 -3.23 -0.00 0.00 -0.52 0.00 0.00 37.83 33.98 2wvv s LYS 130 CO 0.01 0.18 -0.24 0.42 -0.92 0.00 0.00 175.35 174.80 2wvv s ILE 131 N 0.63 2.01 -0.46 2.17 1.01 -0.34 -0.25 121.20 125.96 2wvv s ILE 131 Ca 0.03 -1.01 -0.28 0.00 0.00 0.00 0.00 60.65 59.40 2wvv s ILE 131 Cb -0.13 -1.72 -0.02 0.00 0.01 0.00 0.00 42.46 40.60 2wvv s ILE 131 CO 0.02 0.55 1.82 0.42 0.00 0.00 0.00 174.94 177.74 2wvv s THR 132 N 0.15 3.44 0.14 2.92 -4.23 -0.56 -0.85 115.64 116.65 2wvv s THR 132 Ca -0.12 0.38 0.00 0.00 -1.18 0.00 0.00 61.69 60.76 2wvv s THR 132 Cb -0.16 -3.79 -0.18 0.00 1.34 0.00 0.00 72.50 69.71 2wvv s THR 132 CO 0.07 -0.64 1.32 0.71 -0.54 0.00 0.00 174.62 175.54 2wvv h THR 133 N 6.85 1.48 -1.87 3.99 1.35 -1.71 -3.44 112.91 119.56 2wvv h THR 133 Ca -0.30 -2.68 0.09 0.00 -0.55 0.00 0.00 66.41 62.97 2wvv h THR 133 Cb 1.16 2.54 -0.21 0.00 -1.73 0.00 0.00 68.15 69.92 2wvv h THR 133 CO 1.12 0.78 -0.06 -0.75 -0.25 0.00 0.00 175.52 176.36 2wvv s LYS 134 N -3.12 0.56 0.00 4.72 2.20 -1.26 -0.90 119.74 121.94 2wvv s LYS 134 Ca -0.04 1.33 0.00 0.00 -0.36 0.00 0.00 55.97 56.91 2wvv s LYS 134 Cb 0.09 0.73 0.00 0.00 -1.51 0.00 0.00 37.83 37.14 2wvv s LYS 134 CO 0.84 -0.18 0.00 1.58 -0.36 0.00 0.00 175.35 177.23 2wvv n HIS 135 N 5.24 -2.61 0.07 4.03 -0.00 -1.26 -2.03 115.22 118.66 2wvv n HIS 135 Ca -0.13 0.00 0.04 0.00 -0.00 0.00 0.00 57.72 57.63 2wvv n HIS 135 Cb 0.51 0.00 0.44 0.00 -0.00 0.00 0.00 29.99 30.94 2wvv n HIS 135 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2wvv h HIS 136 N -0.29 0.37 -0.16 1.57 -0.00 -1.91 -1.96 115.15 112.78 2wvv h HIS 136 Ca 0.00 -0.01 0.05 0.00 -0.00 0.00 0.00 60.37 60.41 2wvv h HIS 136 Cb 0.00 -0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 27.29 2wvv h HIS 136 CO 0.00 0.30 0.18 1.05 -0.00 0.00 0.00 177.93 179.46 2wvv h GLU 137 N 0.38 0.00 0.00 2.45 4.11 -1.89 0.16 114.58 119.79 2wvv h GLU 137 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.53 2wvv h GLU 137 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2wvv h GLU 137 CO -0.01 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.48 2wvv n GLY 138 N -1.38 0.78 3.69 1.06 0.00 -0.74 -3.75 105.19 104.86 2wvv n GLY 138 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2wvv n GLY 138 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2wvv s PHE 139 N -2.68 3.10 -0.16 1.61 5.36 -1.26 -4.85 117.98 119.09 2wvv s PHE 139 Ca 0.00 1.05 -0.12 0.00 -0.96 0.00 0.00 56.93 56.90 2wvv s PHE 139 Cb 0.00 -3.54 -0.05 0.00 -0.34 0.00 0.00 43.02 39.09 2wvv s PHE 139 CO 0.00 -1.84 0.22 0.00 -1.46 0.00 0.00 175.22 172.14 2wvv n LEU 141 N 3.22 0.26 -4.49 0.00 4.77 -0.08 -1.52 117.00 119.17 2wvv n LEU 141 Ca -0.15 0.07 -0.25 0.00 -0.03 0.00 0.00 56.01 55.65 2wvv n LEU 141 Cb 0.52 -0.16 -0.10 0.00 -2.33 0.00 0.00 43.42 41.35 2wvv n LEU 141 CO 0.37 0.05 -0.47 -1.66 -1.33 0.00 0.00 177.39 174.35 2wvv s TRP 142 N -2.36 2.38 -1.41 -1.77 -2.14 -1.26 -1.57 118.94 110.80 2wvv s TRP 142 Ca 0.34 -0.31 -0.15 0.00 2.66 0.00 0.00 56.10 58.64 2wvv s TRP 142 Cb 0.21 -1.09 0.03 0.00 -3.10 0.00 0.00 33.47 29.51 2wvv s TRP 142 CO 0.44 0.62 2.18 -0.35 -2.66 0.00 0.00 176.95 177.18 2wvv n PRO 143 N -0.32 2.80 -1.75 3.25 -0.04 -1.26 -4.35 135.00 133.33 2wvv n PRO 143 Ca -0.08 -2.61 -0.42 0.00 -0.04 0.00 0.00 63.50 60.36 2wvv n PRO 143 Cb 0.58 -3.29 -0.01 0.00 -0.04 0.00 0.00 33.50 30.74 2wvv n PRO 143 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2wvv n SER 144 N 6.36 3.83 -0.06 3.54 2.88 -1.26 -4.88 113.62 124.02 2wvv n SER 144 Ca 0.52 1.16 0.15 0.00 -1.33 0.00 0.00 58.87 59.37 2wvv n SER 144 Cb 0.40 -1.59 0.79 0.00 -0.75 0.00 0.00 64.21 63.06 2wvv n SER 144 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2wvv n LYS 145 N 1.90 0.84 0.00 -1.46 2.85 -1.26 -3.90 118.16 117.14 2wvv n LYS 145 Ca 0.08 -0.13 0.12 0.00 -1.05 0.00 0.00 58.31 57.33 2wvv n LYS 145 Cb 0.37 -1.50 0.12 0.00 -0.65 0.00 0.00 35.03 33.37 2wvv n LYS 145 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2wvv n TYR 146 N -0.97 0.00 -3.56 5.58 4.01 -1.26 -4.95 117.16 116.01 2wvv n TYR 146 Ca 0.19 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.78 2wvv n TYR 146 Cb 0.20 -0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.17 2wvv n TYR 146 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2wvv s THR 147 N -2.06 0.02 -0.72 -0.72 -1.32 -1.25 -5.04 115.64 104.55 2wvv s THR 147 Ca 0.28 -0.18 0.25 0.00 -1.21 0.00 0.00 61.69 60.83 2wvv s THR 147 Cb 0.20 -0.95 0.17 0.00 -1.51 0.00 0.00 72.50 70.40 2wvv s THR 147 CO 0.34 -0.10 1.57 2.29 -2.21 0.00 0.00 174.62 176.51 2wvv n LYS 148 N 0.57 0.25 -2.25 7.08 2.85 -1.26 -4.55 118.16 120.84 2wvv n LYS 148 Ca -0.19 0.14 -0.43 0.00 -1.05 0.00 0.00 58.31 56.79 2wvv n LYS 148 Cb 0.59 -1.72 0.00 0.00 -0.65 0.00 0.00 35.03 33.25 2wvv n LYS 148 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2wvv n TYR 149 N -2.12 3.55 -4.24 5.58 4.01 -1.26 -4.63 117.16 118.04 2wvv n TYR 149 Ca 0.05 -2.93 -0.13 0.00 -0.16 0.00 0.00 57.90 54.73 2wvv n TYR 149 Cb 0.43 -2.23 -0.10 0.00 -0.31 0.00 0.00 39.34 37.13 2wvv n TYR 149 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2wvv s THR 150 N 1.75 0.38 0.55 -0.72 -4.23 -1.26 -1.11 115.64 111.00 2wvv s THR 150 Ca 0.44 -1.98 0.30 0.00 -1.18 0.00 0.00 61.69 59.27 2wvv s THR 150 Cb 0.09 -2.35 0.45 0.00 1.34 0.00 0.00 72.50 72.03 2wvv s THR 150 CO -0.02 -0.22 1.88 -0.37 -0.54 0.00 0.00 174.62 175.36 2wvv h VAL 151 N 2.61 0.49 -0.08 2.29 -1.51 -1.47 -2.00 116.25 116.59 2wvv h VAL 151 Ca -0.37 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.08 2wvv h VAL 151 Cb 1.23 0.57 -0.01 0.00 -2.13 0.00 0.00 31.29 30.95 2wvv h VAL 151 CO 0.59 0.00 -0.06 0.00 -1.23 0.00 0.00 177.57 176.87 2wvv h ALA 152 N 1.51 1.76 -0.93 5.19 0.00 -1.84 -3.06 119.26 121.89 2wvv h ALA 152 Ca 0.36 -0.10 -0.64 0.00 0.00 0.00 0.00 54.91 54.52 2wvv h ALA 152 Cb 1.55 -0.05 -0.32 0.00 0.00 0.00 0.00 17.79 18.97 2wvv h ALA 152 CO -0.00 0.18 0.48 0.09 0.00 0.00 0.00 179.25 179.99 2wvv n ASN 153 N -4.40 6.92 -4.33 0.00 3.02 -0.75 -4.55 115.26 111.17 2wvv n ASN 153 Ca -0.02 -3.78 -0.18 0.00 -0.03 0.00 0.00 54.58 50.58 2wvv n ASN 153 Cb 0.18 -0.83 -0.10 0.00 -0.61 0.00 0.00 39.78 38.42 2wvv n ASN 153 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2wvv s THR 154 N -4.72 1.63 0.58 3.41 -4.23 -1.18 -4.76 115.64 106.37 2wvv s THR 154 Ca 0.61 -2.17 0.29 0.00 -1.18 0.00 0.00 61.69 59.24 2wvv s THR 154 Cb 0.49 -1.99 0.39 0.00 1.34 0.00 0.00 72.50 72.72 2wvv s THR 154 CO 0.00 -0.62 1.93 -0.65 -0.54 0.00 0.00 174.62 174.75 2wvv h PRO 155 N 2.63 0.00 0.02 3.99 0.11 -1.74 -2.04 132.00 134.97 2wvv h PRO 155 Ca -0.38 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.50 2wvv h PRO 155 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2wvv h PRO 155 CO 0.62 0.00 -0.99 -0.92 -0.21 0.00 0.00 178.00 176.50 2wvv h TYR 156 N 0.00 0.62 0.00 0.65 3.20 -1.82 -3.47 116.97 116.14 2wvv h TYR 156 Ca 0.22 -0.35 0.00 0.00 3.14 0.00 0.00 58.73 61.74 2wvv h TYR 156 Cb 1.12 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 39.33 2wvv h TYR 156 CO 0.00 1.18 0.00 1.63 -1.64 0.00 0.00 178.16 179.33 2wvv n LYS 157 N -3.72 0.00 -2.30 1.82 5.02 -0.77 -4.95 118.16 113.26 2wvv n LYS 157 Ca -0.07 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.89 2wvv n LYS 157 Cb 0.86 -1.18 -0.01 0.00 -0.02 0.00 0.00 35.03 34.67 2wvv n LYS 157 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2wvv s ARG 158 N 0.00 3.58 -1.18 1.97 0.52 -1.26 -3.97 118.95 118.62 2wvv s ARG 158 Ca 0.00 1.26 -0.21 0.00 -0.52 0.00 0.00 55.73 56.27 2wvv s ARG 158 Cb 0.00 -2.07 0.02 0.00 0.52 0.00 0.00 34.95 33.42 2wvv s ARG 158 CO 0.00 -0.60 1.75 0.34 0.02 0.00 0.00 175.30 176.81 2wvv s ASP 159 N -2.42 6.15 0.20 0.23 2.15 -1.26 -4.69 116.67 117.03 2wvv s ASP 159 Ca 0.65 -1.88 -0.13 0.00 0.43 0.00 0.00 52.55 51.62 2wvv s ASP 159 Cb -0.16 -2.58 0.22 0.00 -0.30 0.00 0.00 42.92 40.10 2wvv s ASP 159 CO 0.29 -1.87 1.65 0.40 -0.17 0.00 0.00 175.17 175.46 2wvv h ILE 160 N 6.14 0.46 -0.29 4.11 1.08 -1.91 -1.92 117.51 125.19 2wvv h ILE 160 Ca 0.31 -0.01 0.01 0.00 -0.39 0.00 0.00 64.86 64.77 2wvv h ILE 160 Cb 0.93 0.42 -0.02 0.00 -3.07 0.00 0.00 36.82 35.08 2wvv h ILE 160 CO 1.37 0.01 0.17 0.25 -0.69 0.00 0.00 178.15 179.26 2wvv h LEU 161 N 0.04 0.29 -1.20 1.44 5.85 -1.61 -1.25 115.31 118.86 2wvv h LEU 161 Ca 0.28 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 59.01 2wvv h LEU 161 Cb 0.44 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.37 2wvv h LEU 161 CO -0.55 0.21 0.53 1.23 -0.34 0.00 0.00 178.44 179.52 2wvv h GLY 162 N 0.36 1.13 1.07 3.75 0.00 -1.74 0.23 103.07 107.86 2wvv h GLY 162 Ca 0.11 -0.43 -0.09 0.00 0.00 0.00 0.00 47.33 46.92 2wvv h GLY 162 CO -0.04 0.42 -0.01 0.83 0.00 0.00 0.00 176.54 177.74 2wvv h GLU 163 N 1.09 1.03 -0.24 4.80 5.08 -0.82 -1.84 114.58 123.69 2wvv h GLU 163 Ca 0.29 -0.33 -0.05 0.00 -1.00 0.00 0.00 59.36 58.27 2wvv h GLU 163 Cb -0.12 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 2wvv h GLU 163 CO -0.06 1.02 -0.03 -0.07 -1.00 0.00 0.00 179.01 178.86 2wvv h LEU 164 N 0.92 0.44 -0.34 1.33 3.38 -0.74 -1.15 115.31 119.15 2wvv h LEU 164 Ca 0.16 -0.34 0.07 0.00 0.09 0.00 0.00 57.88 57.86 2wvv h LEU 164 Cb 0.56 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.13 2wvv h LEU 164 CO 0.03 0.68 -0.06 0.58 0.09 0.00 0.00 178.44 179.76 2wvv h VAL 165 N 0.20 0.68 -0.30 1.22 2.07 -0.87 0.10 116.25 119.36 2wvv h VAL 165 Ca 0.06 -0.01 -0.02 0.00 0.82 0.00 0.00 66.70 67.56 2wvv h VAL 165 Cb 0.48 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 2wvv h VAL 165 CO 0.02 0.00 0.11 0.50 0.02 0.00 0.00 177.57 178.23 2wvv h LYS 166 N 0.02 0.45 -0.30 1.57 3.64 -1.24 -1.18 116.57 119.53 2wvv h LYS 166 Ca 0.17 -0.09 -0.04 0.00 -1.27 0.00 0.00 60.65 59.42 2wvv h LYS 166 Cb 0.25 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2wvv h LYS 166 CO -0.33 0.47 0.01 0.00 -2.27 0.00 0.00 179.45 177.33 2wvv h ALA 167 N 0.95 0.40 -0.33 5.00 0.00 -0.83 -0.15 119.26 124.31 2wvv h ALA 167 Ca 0.10 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 2wvv h ALA 167 Cb 0.20 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2wvv h ALA 167 CO -0.01 0.14 0.12 1.88 0.00 0.00 0.00 179.25 181.38 2wvv h TYR 168 N 0.32 0.52 -0.59 0.00 0.05 -0.81 -2.82 116.97 113.64 2wvv h TYR 168 Ca 0.09 -0.04 0.01 0.00 0.05 0.00 0.00 58.73 58.83 2wvv h TYR 168 Cb 0.41 -0.15 -0.03 0.00 1.01 0.00 0.00 36.73 37.97 2wvv h TYR 168 CO 0.03 0.50 0.39 -0.91 -1.05 0.00 0.00 178.16 177.12 2wvv h ASN 169 N 0.39 0.66 0.26 3.88 2.35 -1.01 -0.68 115.58 121.42 2wvv h ASN 169 Ca 0.11 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.81 2wvv h ASN 169 Cb 0.21 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.42 2wvv h ASN 169 CO -0.01 0.47 -0.14 0.44 -1.65 0.00 0.00 177.43 176.54 2wvv h ASP 170 N 0.77 0.00 -0.20 5.81 3.32 -0.79 -0.94 116.42 124.39 2wvv h ASP 170 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 2wvv h ASP 170 Cb -0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.50 2wvv h ASP 170 CO -0.05 0.14 0.00 -0.62 -1.72 0.00 0.00 179.24 176.99 2wvv n GLU 171 N -3.95 1.73 -1.89 3.56 -0.58 -0.35 -4.92 120.64 114.25 2wvv n GLU 171 Ca -0.02 -1.11 -0.06 0.00 -0.42 0.00 0.00 57.16 55.54 2wvv n GLU 171 Cb 0.23 -1.37 -0.01 0.00 -0.57 0.00 0.00 31.44 29.73 2wvv n GLU 171 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2wvv n GLY 172 N 1.11 0.29 3.58 0.62 0.00 -0.36 -5.02 105.19 105.42 2wvv n GLY 172 Ca 0.15 -0.66 -0.35 0.00 0.00 0.00 0.00 46.02 45.16 2wvv n GLY 172 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wvv s ILE 173 N -2.29 4.63 0.45 -0.61 1.01 -0.68 -4.97 121.20 118.75 2wvv s ILE 173 Ca 0.00 -0.08 -0.24 0.00 0.00 0.00 0.00 60.65 60.33 2wvv s ILE 173 Cb 0.00 -3.10 -0.07 0.00 0.01 0.00 0.00 42.46 39.29 2wvv s ILE 173 CO 0.00 0.43 1.22 -1.81 0.00 0.00 0.00 174.94 174.78 2wvv s ASP 174 N 0.68 6.13 -0.09 3.58 1.01 -0.93 -3.51 116.67 123.53 2wvv s ASP 174 Ca 0.03 2.44 0.03 0.00 0.71 0.00 0.00 52.55 55.75 2wvv s ASP 174 Cb -0.13 -2.62 -0.02 0.00 1.01 0.00 0.00 42.92 41.17 2wvv s ASP 174 CO 0.02 -0.96 -0.17 -0.69 0.21 0.00 0.00 175.17 173.58 2wvv s VAL 175 N -1.44 2.73 0.06 -1.27 1.01 -1.26 -1.14 120.40 119.09 2wvv s VAL 175 Ca 0.62 -0.81 0.09 0.00 0.00 0.00 0.00 61.98 61.89 2wvv s VAL 175 Cb -0.32 -2.08 -0.03 0.00 0.00 0.00 0.00 36.38 33.94 2wvv s VAL 175 CO 0.40 0.56 -0.26 -1.00 0.00 0.00 0.00 175.10 174.80 2wvv s HIS 176 N -0.09 2.35 -0.24 5.22 3.76 0.48 -1.71 115.29 125.05 2wvv s HIS 176 Ca -0.03 -0.39 -0.06 0.00 -0.15 0.00 0.00 55.06 54.43 2wvv s HIS 176 Cb -0.14 -1.37 -0.02 0.00 1.11 0.00 0.00 32.58 32.16 2wvv s HIS 176 CO 0.04 0.18 0.03 -0.06 -0.85 0.00 0.00 174.74 174.09 2wvv s PHE 177 N -0.87 3.04 0.18 1.40 0.08 0.08 -1.20 117.98 120.70 2wvv s PHE 177 Ca 0.13 -0.59 -0.30 0.00 0.12 0.00 0.00 56.93 56.28 2wvv s PHE 177 Cb -0.10 -2.20 -0.08 0.00 -0.57 0.00 0.00 43.02 40.07 2wvv s PHE 177 CO 0.03 -0.42 1.18 -0.47 -0.10 0.00 0.00 175.22 175.44 2wvv s TYR 178 N 1.57 3.45 -0.06 0.36 5.04 -0.03 -0.56 117.35 127.12 2wvv s TYR 178 Ca 0.06 1.45 -0.02 0.00 -2.44 0.00 0.00 57.07 56.12 2wvv s TYR 178 Cb -0.15 -3.41 0.04 0.00 0.35 0.00 0.00 41.96 38.79 2wvv s TYR 178 CO 0.01 -1.12 0.12 0.12 -1.34 0.00 0.00 175.55 173.35 2wvv s PHE 179 N -0.09 -0.11 -0.27 4.97 5.36 -0.19 -1.79 117.98 125.85 2wvv s PHE 179 Ca 0.52 0.44 -0.18 0.00 -0.96 0.00 0.00 56.93 56.75 2wvv s PHE 179 Cb -0.32 -0.22 -0.02 0.00 -0.34 0.00 0.00 43.02 42.12 2wvv s PHE 179 CO 0.36 -0.19 0.52 0.45 -1.46 0.00 0.00 175.22 174.90 2wvv s SER 180 N 1.66 6.42 -0.00 6.13 0.15 -0.86 -1.47 113.70 125.73 2wvv s SER 180 Ca -0.03 0.45 -0.24 0.00 0.70 0.00 0.00 55.95 56.82 2wvv s SER 180 Cb -0.12 -2.28 -0.16 0.00 -1.71 0.00 0.00 66.02 61.74 2wvv s SER 180 CO -0.05 -0.32 1.19 0.58 1.20 0.00 0.00 173.24 175.84 2wvv h VAL 181 N 5.43 0.74 -2.25 4.45 2.07 -1.42 -3.43 116.25 121.85 2wvv h VAL 181 Ca -0.29 -0.69 -0.60 0.00 0.82 0.00 0.00 66.70 65.94 2wvv h VAL 181 Cb 1.14 1.10 0.07 0.00 -1.52 0.00 0.00 31.29 32.07 2wvv h VAL 181 CO 0.73 0.13 0.65 0.80 0.02 0.00 0.00 177.57 179.90 2wvv n MET 182 N -5.09 1.87 -3.57 1.57 0.00 -0.63 -4.96 117.12 106.31 2wvv n MET 182 Ca -0.09 0.67 -0.25 0.00 -0.00 0.00 0.00 57.70 58.03 2wvv n MET 182 Cb 0.26 -2.37 -0.16 0.00 0.00 0.00 0.00 33.22 30.96 2wvv n MET 182 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2wvv s ASP 183 N 0.60 2.34 0.00 6.12 -1.08 -1.26 -4.41 116.67 118.98 2wvv s ASP 183 Ca 0.76 -0.66 0.21 0.00 -0.52 0.00 0.00 52.55 52.35 2wvv s ASP 183 Cb -0.73 -0.12 1.10 0.00 -1.46 0.00 0.00 42.92 41.72 2wvv s ASP 183 CO 0.44 -0.36 1.67 0.79 0.52 0.00 0.00 175.17 178.22 2wvv n TRP 184 N 5.28 0.00 0.23 -5.34 8.01 0.56 -3.11 117.44 123.07 2wvv n TRP 184 Ca -0.06 0.00 0.10 0.00 -1.31 0.00 0.00 57.50 56.23 2wvv n TRP 184 Cb 0.48 -0.22 -0.15 0.00 -2.01 0.00 0.00 31.31 29.41 2wvv n TRP 184 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 2wvv n SER 185 N -1.22 0.43 -4.46 -0.99 3.41 -1.25 -4.78 113.62 104.76 2wvv n SER 185 Ca 0.11 -0.25 -0.39 0.00 -0.26 0.00 0.00 58.87 58.09 2wvv n SER 185 Cb 0.15 1.71 -0.11 0.00 -0.26 0.00 0.00 64.21 65.69 2wvv n SER 185 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2wvv s ASN 186 N -4.01 5.66 0.27 4.04 3.84 -1.18 -4.97 114.94 118.58 2wvv s ASN 186 Ca -0.04 -0.50 0.22 0.00 0.21 0.00 0.00 52.86 52.74 2wvv s ASN 186 Cb 0.14 -2.03 1.02 0.00 -0.55 0.00 0.00 41.25 39.83 2wvv s ASN 186 CO 0.85 -0.20 1.66 -0.81 -2.79 0.00 0.00 177.10 175.81 2wvv n PRO 187 N 5.01 0.16 0.03 0.43 -0.04 -1.26 -2.10 135.00 137.23 2wvv n PRO 187 Ca -0.14 0.52 0.10 0.00 -0.04 0.00 0.00 63.50 63.95 2wvv n PRO 187 Cb 0.49 -1.89 0.44 0.00 -0.04 0.00 0.00 33.50 32.50 2wvv n PRO 187 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2wvv n ASP 188 N -2.20 0.17 -4.75 3.54 8.00 -1.26 -4.83 116.55 115.21 2wvv n ASP 188 Ca 0.00 0.53 -0.41 0.00 0.71 0.00 0.00 54.79 55.63 2wvv n ASP 188 Cb 0.13 -0.57 -0.03 0.00 -0.02 0.00 0.00 41.12 40.63 2wvv n ASP 188 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2wvv s TYR 189 N -3.05 3.33 0.03 1.24 5.04 -0.89 -3.45 117.35 119.59 2wvv s TYR 189 Ca 0.09 1.48 0.07 0.00 -2.44 0.00 0.00 57.07 56.27 2wvv s TYR 189 Cb 0.13 -3.49 -0.02 0.00 0.35 0.00 0.00 41.96 38.93 2wvv s TYR 189 CO 0.39 -1.30 -0.20 1.03 -1.34 0.00 0.00 175.55 174.14 2wvv s ARG 190 N -1.12 1.39 0.12 4.97 1.81 -1.26 -5.00 118.95 119.87 2wvv s ARG 190 Ca 0.49 -0.85 0.11 0.00 -1.72 0.00 0.00 55.73 53.77 2wvv s ARG 190 Cb -0.35 -1.44 -0.14 0.00 -0.45 0.00 0.00 34.95 32.56 2wvv s ARG 190 CO 0.44 0.38 1.17 1.88 -0.68 0.00 0.00 175.30 178.48 2wvv h TYR 191 N 5.11 0.00 -2.96 -0.53 -1.99 -1.98 -3.42 116.97 111.21 2wvv h TYR 191 Ca -0.41 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.22 2wvv h TYR 191 Cb 1.16 0.00 -0.19 0.00 2.00 0.00 0.00 36.73 39.70 2wvv h TYR 191 CO 0.47 0.84 -0.20 0.34 -0.00 0.00 0.00 178.16 179.62 2wvv s ASP 192 N -6.45 -0.25 -0.44 3.88 -1.08 -1.26 -1.43 116.67 109.65 2wvv s ASP 192 Ca 0.00 0.10 -0.12 0.00 -0.52 0.00 0.00 52.55 52.01 2wvv s ASP 192 Cb 0.09 0.36 0.07 0.00 -1.46 0.00 0.00 42.92 41.97 2wvv s ASP 192 CO 0.80 -0.52 0.32 -0.63 0.52 0.00 0.00 175.17 175.66 2wvv s ILE 193 N -1.64 4.76 -0.42 4.11 -1.09 -1.26 -4.84 121.20 120.82 2wvv s ILE 193 Ca -0.11 -1.16 0.09 0.00 -2.23 0.00 0.00 60.65 57.24 2wvv s ILE 193 Cb -0.03 -3.84 0.23 0.00 -1.58 0.00 0.00 42.46 37.24 2wvv s ILE 193 CO 0.03 -0.50 1.18 0.29 -1.23 0.00 0.00 174.94 174.71 2wvv n LYS 194 N 5.06 2.75 -3.57 2.79 5.02 -1.26 -5.01 118.16 123.95 2wvv n LYS 194 Ca -0.11 -2.03 -0.06 0.00 -2.02 0.00 0.00 58.31 54.08 2wvv n LYS 194 Cb 0.44 -1.28 -0.02 0.00 -0.02 0.00 0.00 35.03 34.15 2wvv n LYS 194 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2wvv s SER 195 N -1.33 -0.29 0.47 4.39 1.04 -1.26 -4.99 113.70 111.73 2wvv s SER 195 Ca 0.19 -0.09 0.13 0.00 0.48 0.00 0.00 55.95 56.66 2wvv s SER 195 Cb 0.13 0.37 1.09 0.00 0.10 0.00 0.00 66.02 67.70 2wvv s SER 195 CO 0.08 -0.62 2.09 0.50 0.98 0.00 0.00 173.24 176.27 2wvv h LYS 196 N 2.00 0.17 0.26 4.02 1.63 -1.98 -0.87 116.57 121.80 2wvv h LYS 196 Ca -0.22 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.57 2wvv h LYS 196 Cb 1.23 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 32.81 2wvv h LYS 196 CO 0.29 0.15 -0.23 1.49 -3.45 0.00 0.00 179.45 177.69 2wvv h GLU 197 N 0.17 -0.50 -0.32 1.90 4.22 -1.99 -1.32 114.58 116.74 2wvv h GLU 197 Ca 0.04 0.03 0.04 0.00 0.08 0.00 0.00 59.36 59.56 2wvv h GLU 197 Cb 0.05 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 2wvv h GLU 197 CO -0.00 -0.33 0.08 -0.44 -2.18 0.00 0.00 179.01 176.13 2wvv h ASP 198 N -0.52 0.05 -0.93 1.04 3.32 -1.82 0.22 116.42 117.78 2wvv h ASP 198 Ca -0.01 0.05 0.14 0.00 0.02 0.00 0.00 57.03 57.23 2wvv h ASP 198 Cb 0.47 0.05 -0.08 0.00 0.22 0.00 0.00 39.33 39.99 2wvv h ASP 198 CO -0.03 0.06 0.60 -1.28 -1.72 0.00 0.00 179.24 176.86 2wvv h SER 199 N 0.20 0.74 0.03 6.45 0.87 -1.02 0.50 113.55 121.31 2wvv h SER 199 Ca 0.15 0.05 -0.15 0.00 -1.23 0.00 0.00 61.79 60.60 2wvv h SER 199 Cb 0.15 -0.10 0.01 0.00 -0.44 0.00 0.00 62.40 62.02 2wvv h SER 199 CO -0.18 0.37 -0.62 0.40 -0.53 0.00 0.00 176.83 176.27 2wvv h ILE 200 N 0.78 1.45 0.54 2.23 1.08 -0.71 -2.09 117.51 120.79 2wvv h ILE 200 Ca 0.47 -2.16 -0.02 0.00 -0.39 0.00 0.00 64.86 62.77 2wvv h ILE 200 Cb 0.68 2.73 -0.01 0.00 -3.07 0.00 0.00 36.82 37.15 2wvv h ILE 200 CO -0.24 0.62 -0.33 0.00 -0.69 0.00 0.00 178.15 177.51 2wvv h ALA 201 N 0.27 -0.84 -0.03 1.87 0.00 -0.36 -1.09 119.26 119.08 2wvv h ALA 201 Ca -0.08 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2wvv h ALA 201 Cb 1.35 0.41 -0.00 0.00 0.00 0.00 0.00 17.79 19.56 2wvv h ALA 201 CO 0.12 -0.99 0.01 0.35 0.00 0.00 0.00 179.25 178.75 2wvv h PHE 202 N -0.83 0.04 -0.68 0.00 3.57 -0.04 0.85 116.94 119.85 2wvv h PHE 202 Ca -0.06 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.42 2wvv h PHE 202 Cb 0.68 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.37 2wvv h PHE 202 CO -0.10 0.03 0.36 1.03 -2.23 0.00 0.00 178.31 177.40 2wvv h SER 203 N 0.04 0.86 -0.78 0.41 0.87 -0.95 -0.57 113.55 113.43 2wvv h SER 203 Ca 0.01 -0.10 -0.04 0.00 -1.23 0.00 0.00 61.79 60.42 2wvv h SER 203 Cb 0.00 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 61.71 2wvv h SER 203 CO -0.00 0.72 0.32 0.03 -0.53 0.00 0.00 176.83 177.37 2wvv h ARG 204 N 0.94 1.16 -0.65 2.24 3.08 0.41 -2.13 114.38 119.42 2wvv h ARG 204 Ca 0.24 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 2wvv h ARG 204 Cb 0.06 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 29.89 2wvv h ARG 204 CO -0.04 0.94 0.36 0.35 -1.07 0.00 0.00 179.97 180.51 2wvv h PHE 205 N 1.13 0.89 -0.13 3.04 3.57 -0.85 -1.60 116.94 122.99 2wvv h PHE 205 Ca 0.26 -0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.67 2wvv h PHE 205 Cb 0.20 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.64 2wvv h PHE 205 CO 0.02 0.63 -0.27 -0.07 -2.23 0.00 0.00 178.31 176.39 2wvv h LEU 206 N 0.89 0.24 -0.31 0.59 3.38 -0.94 0.45 115.31 119.61 2wvv h LEU 206 Ca 0.23 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 2wvv h LEU 206 Cb 0.03 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2wvv h LEU 206 CO -0.04 0.51 0.01 -0.08 0.09 0.00 0.00 178.44 178.94 2wvv h GLU 207 N 0.22 0.54 -0.55 1.13 4.81 -1.11 -1.26 114.58 118.35 2wvv h GLU 207 Ca 0.03 -0.17 0.03 0.00 -0.13 0.00 0.00 59.36 59.13 2wvv h GLU 207 Cb 0.59 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.88 2wvv h GLU 207 CO 0.04 0.67 0.33 0.35 -0.73 0.00 0.00 179.01 179.67 2wvv h PHE 208 N 0.34 0.62 -0.10 0.92 3.57 -0.93 0.06 116.94 121.42 2wvv h PHE 208 Ca 0.09 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 2wvv h PHE 208 Cb 0.42 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 38.96 2wvv h PHE 208 CO 0.03 0.35 0.06 1.15 -2.23 0.00 0.00 178.31 177.67 2wvv h THR 209 N 0.65 1.05 -0.69 4.41 2.02 -0.89 -1.01 112.91 118.45 2wvv h THR 209 Ca 0.23 -0.13 0.11 0.00 0.77 0.00 0.00 66.41 67.39 2wvv h THR 209 Cb 0.04 0.96 -0.08 0.00 -1.74 0.00 0.00 68.15 67.33 2wvv h THR 209 CO -0.11 0.05 0.29 0.44 0.37 0.00 0.00 175.52 176.56 2wvv h ASP 210 N 0.10 0.30 -0.58 4.18 3.32 -0.87 -0.55 116.42 122.31 2wvv h ASP 210 Ca 0.03 0.09 0.02 0.00 0.02 0.00 0.00 57.03 57.19 2wvv h ASP 210 Cb 0.02 0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.59 2wvv h ASP 210 CO -0.01 0.15 0.37 0.78 -1.72 0.00 0.00 179.24 178.81 2wvv h ASN 211 N 0.47 0.61 -0.23 6.45 2.35 -0.39 0.15 115.58 124.98 2wvv h ASN 211 Ca 0.36 -0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.98 2wvv h ASN 211 Cb 0.47 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.69 2wvv h ASN 211 CO -0.34 0.43 -0.28 1.56 -1.65 0.00 0.00 177.43 177.15 2wvv h GLN 212 N 0.73 0.72 -0.16 0.81 4.20 -0.56 -1.54 115.11 119.31 2wvv h GLN 212 Ca 0.23 -0.31 -0.04 0.00 0.06 0.00 0.00 58.65 58.59 2wvv h GLN 212 Cb -0.01 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.74 2wvv h GLN 212 CO -0.08 0.92 -0.04 -0.07 -0.67 0.00 0.00 178.83 178.89 2wvv h LEU 213 N 0.62 0.31 -1.42 1.46 3.38 -0.69 -0.25 115.31 118.71 2wvv h LEU 213 Ca 0.08 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2wvv h LEU 213 Cb 0.79 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 2wvv h LEU 213 CO 0.07 0.60 0.34 0.11 0.09 0.00 0.00 178.44 179.65 2wvv h LYS 214 N 0.00 0.73 -0.07 1.13 1.57 -0.99 -0.85 116.57 118.08 2wvv h LYS 214 Ca 0.04 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2wvv h LYS 214 Cb 0.47 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.62 2wvv h LYS 214 CO 0.02 0.50 0.02 1.49 -0.57 0.00 0.00 179.45 180.91 2wvv h GLU 215 N 0.75 0.11 -0.91 3.15 4.81 -1.02 -1.00 114.58 120.48 2wvv h GLU 215 Ca 0.20 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.39 2wvv h GLU 215 Cb -0.05 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.27 2wvv h GLU 215 CO -0.04 0.27 0.50 -0.07 -0.73 0.00 0.00 179.01 178.94 2wvv h LEU 216 N -0.07 1.13 -0.66 1.64 3.38 -0.68 -0.07 115.31 119.98 2wvv h LEU 216 Ca 0.02 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.76 2wvv h LEU 216 Cb 0.20 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2wvv h LEU 216 CO -0.00 0.90 -0.47 0.00 0.09 0.00 0.00 178.44 178.96 2wvv h ALA 217 N 1.28 0.84 0.13 1.53 0.00 -1.04 -2.00 119.26 120.00 2wvv h ALA 217 Ca 0.32 -0.47 -0.32 0.00 0.00 0.00 0.00 54.91 54.44 2wvv h ALA 217 Cb 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2wvv h ALA 217 CO -0.05 0.66 -1.65 1.79 0.00 0.00 0.00 179.25 180.00 2wvv h THR 218 N 0.39 1.02 -0.59 0.00 1.35 -1.04 -3.25 112.91 110.79 2wvv h THR 218 Ca 0.02 -2.66 -0.08 0.00 -0.55 0.00 0.00 66.41 63.14 2wvv h THR 218 Cb 0.97 2.71 -0.02 0.00 -1.73 0.00 0.00 68.15 70.08 2wvv h THR 218 CO 0.09 0.82 0.05 0.03 -0.25 0.00 0.00 175.52 176.25 2wvv h ARG 219 N 0.08 0.98 -2.13 4.72 3.08 -1.06 -3.38 114.38 116.67 2wvv h ARG 219 Ca -0.29 -0.27 -0.56 0.00 0.07 0.00 0.00 59.98 58.93 2wvv h ARG 219 Cb 2.04 -0.11 -0.41 0.00 0.08 0.00 0.00 29.97 31.57 2wvv h ARG 219 CO 0.15 0.94 -0.86 0.66 -1.07 0.00 0.00 179.97 179.79 2wvv n TYR 220 N -4.21 2.04 0.58 3.04 4.01 -0.75 -4.95 117.16 116.91 2wvv n TYR 220 Ca 0.03 -3.90 0.06 0.00 -0.16 0.00 0.00 57.90 53.93 2wvv n TYR 220 Cb 0.30 -0.46 0.30 0.00 -0.31 0.00 0.00 39.34 39.18 2wvv n TYR 220 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2wvv n PRO 221 N 0.57 0.19 0.00 -0.72 -0.04 -1.23 -1.46 135.00 132.31 2wvv n PRO 221 Ca 0.27 0.16 0.15 0.00 -0.04 0.00 0.00 63.50 64.04 2wvv n PRO 221 Cb 0.49 -1.50 0.74 0.00 -0.04 0.00 0.00 33.50 33.18 2wvv n PRO 221 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2wvv n THR 222 N -1.26 0.00 -1.61 0.52 -2.24 -1.26 -4.90 114.28 103.53 2wvv n THR 222 Ca 0.06 -0.03 -0.46 0.00 -2.27 0.00 0.00 64.05 61.35 2wvv n THR 222 Cb 0.09 -0.34 -0.03 0.00 -2.10 0.00 0.00 70.33 67.95 2wvv n THR 222 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2wvv n VAL 223 N -1.09 1.27 0.43 2.28 3.14 -0.54 -4.67 118.33 119.15 2wvv n VAL 223 Ca 0.16 -0.32 0.05 0.00 -2.96 0.00 0.00 64.34 61.27 2wvv n VAL 223 Cb 0.23 -1.08 -0.07 0.00 -1.06 0.00 0.00 33.84 31.87 2wvv n VAL 223 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 2wvv n LYS 224 N 1.48 2.95 -3.62 1.45 4.76 -0.69 -4.85 118.16 119.63 2wvv n LYS 224 Ca 0.12 -0.02 -0.14 0.00 -2.87 0.00 0.00 58.31 55.41 2wvv n LYS 224 Cb 0.29 -1.05 -0.07 0.00 -1.84 0.00 0.00 35.03 32.36 2wvv n LYS 224 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2wvv s ASP 225 N -2.22 -0.71 -0.20 4.39 2.15 -1.26 -1.41 116.67 117.42 2wvv s ASP 225 Ca 0.03 1.31 -0.02 0.00 0.43 0.00 0.00 52.55 54.30 2wvv s ASP 225 Cb 0.08 1.31 -0.01 0.00 -0.30 0.00 0.00 42.92 44.01 2wvv s ASP 225 CO 0.45 -0.28 -0.08 -0.36 -0.17 0.00 0.00 175.17 174.73 2wvv s PHE 226 N 0.20 2.90 -0.40 -5.34 0.40 -0.03 -0.74 117.98 114.97 2wvv s PHE 226 Ca -0.01 -0.98 -0.04 0.00 -0.60 0.00 0.00 56.93 55.31 2wvv s PHE 226 Cb -0.04 -2.02 0.10 0.00 0.51 0.00 0.00 43.02 41.56 2wvv s PHE 226 CO 0.01 -0.51 0.20 -0.46 0.70 0.00 0.00 175.22 175.15 2wvv s TRP 227 N 1.21 3.53 0.25 0.36 -0.00 0.28 -2.41 118.94 122.16 2wvv s TRP 227 Ca 0.02 -2.27 -0.21 0.00 -0.00 0.00 0.00 56.10 53.65 2wvv s TRP 227 Cb -0.14 -3.11 -0.09 0.00 -0.00 0.00 0.00 33.47 30.13 2wvv s TRP 227 CO -0.03 -0.95 0.77 -0.06 -0.00 0.00 0.00 176.95 176.69 2wvv s PHE 228 N 1.19 3.63 0.21 5.86 0.08 -1.26 -1.02 117.98 126.66 2wvv s PHE 228 Ca 0.06 1.46 0.01 0.00 0.12 0.00 0.00 56.93 58.58 2wvv s PHE 228 Cb -0.23 -2.68 -0.05 0.00 -0.57 0.00 0.00 43.02 39.50 2wvv s PHE 228 CO -0.03 0.28 0.06 0.34 -0.10 0.00 0.00 175.22 175.77 2wvv s ASP 229 N -1.70 1.00 -1.04 1.36 2.15 -0.54 -4.42 116.67 113.48 2wvv s ASP 229 Ca 0.46 -1.29 -0.04 0.00 0.43 0.00 0.00 52.55 52.11 2wvv s ASP 229 Cb -0.16 0.18 0.00 0.00 -0.30 0.00 0.00 42.92 42.64 2wvv s ASP 229 CO 0.21 -0.68 0.89 0.61 -0.17 0.00 0.00 175.17 176.03 2wvv n GLY 230 N -0.32 -0.23 0.05 2.66 0.00 -1.26 -1.47 105.19 104.61 2wvv n GLY 230 Ca -0.03 0.04 0.04 0.00 0.00 0.00 0.00 46.02 46.08 2wvv n GLY 230 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wvv n THR 231 N -4.10 1.33 0.96 2.61 -2.24 -1.26 -1.61 114.28 109.97 2wvv n THR 231 Ca -0.09 -1.50 0.12 0.00 -2.27 0.00 0.00 64.05 60.31 2wvv n THR 231 Cb 0.59 0.19 0.28 0.00 -2.10 0.00 0.00 70.33 69.29 2wvv n THR 231 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 2wvv n TRP 232 N -0.88 0.05 -1.99 4.78 2.14 -1.26 -4.56 117.44 115.72 2wvv n TRP 232 Ca 0.07 0.01 -0.34 0.00 2.07 0.00 0.00 57.50 59.32 2wvv n TRP 232 Cb 0.44 -0.31 0.02 0.00 -0.81 0.00 0.00 31.31 30.66 2wvv n TRP 232 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 2wvv s ASP 233 N -3.11 5.44 0.33 -0.67 1.01 -1.26 -4.81 116.67 113.61 2wvv s ASP 233 Ca 0.11 2.03 0.06 0.00 0.71 0.00 0.00 52.55 55.46 2wvv s ASP 233 Cb 0.17 -2.56 0.70 0.00 1.01 0.00 0.00 42.92 42.25 2wvv s ASP 233 CO 0.68 -1.40 1.88 0.00 0.21 0.00 0.00 175.17 176.54 2wvv h ALA 234 N 0.52 1.70 -0.51 5.23 0.00 -1.79 -0.24 119.26 124.16 2wvv h ALA 234 Ca -0.48 0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.51 2wvv h ALA 234 Cb 1.25 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.80 2wvv h ALA 234 CO 0.56 0.09 0.19 0.66 0.00 0.00 0.00 179.25 180.75 2wvv h SER 235 N 0.82 0.20 -0.23 0.00 4.64 -1.49 -0.09 113.55 117.40 2wvv h SER 235 Ca 0.43 0.06 -0.06 0.00 -0.47 0.00 0.00 61.79 61.76 2wvv h SER 235 Cb 0.53 0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.65 2wvv h SER 235 CO -0.20 0.14 -0.08 0.58 -0.87 0.00 0.00 176.83 176.40 2wvv h VAL 236 N 0.37 1.30 -1.01 0.95 2.07 -1.39 -3.00 116.25 115.54 2wvv h VAL 236 Ca 0.25 -1.12 0.10 0.00 0.82 0.00 0.00 66.70 66.75 2wvv h VAL 236 Cb 0.26 1.56 -0.08 0.00 -1.52 0.00 0.00 31.29 31.51 2wvv h VAL 236 CO -0.25 0.34 0.64 0.11 0.02 0.00 0.00 177.57 178.44 2wvv h LYS 237 N 0.18 1.02 0.00 1.57 1.57 -0.79 -0.19 116.57 119.93 2wvv h LYS 237 Ca 0.05 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2wvv h LYS 237 Cb 0.56 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.64 2wvv h LYS 237 CO 0.03 0.68 0.00 0.87 -0.57 0.00 0.00 179.45 180.45 2wvv h LYS 238 N 1.05 0.00 -1.75 3.15 1.57 -0.98 -3.23 116.57 116.39 2wvv h LYS 238 Ca 0.48 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 58.65 2wvv h LYS 238 Cb 0.39 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.30 2wvv h LYS 238 CO -0.24 0.00 -0.54 0.09 -0.57 0.00 0.00 179.45 178.19 2wvv n ASN 239 N -2.46 4.93 -0.32 0.86 4.13 -0.09 -4.82 115.26 117.49 2wvv n ASN 239 Ca 0.02 -3.72 0.02 0.00 1.68 0.00 0.00 54.58 52.58 2wvv n ASN 239 Cb 0.28 -0.54 0.16 0.00 -1.54 0.00 0.00 39.78 38.13 2wvv n ASN 239 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 2wvv h GLY 240 N 2.74 1.37 -0.46 7.41 0.00 -1.57 -1.92 103.07 110.65 2wvv h GLY 240 Ca 0.29 -0.40 0.31 0.00 0.00 0.00 0.00 47.33 47.53 2wvv h GLY 240 CO 0.89 0.25 0.58 0.11 0.00 0.00 0.00 176.54 178.38 2wvv h TRP 241 N 0.99 0.94 -0.34 5.60 5.08 -1.84 -0.76 115.95 125.61 2wvv h TRP 241 Ca 0.40 0.04 -0.13 0.00 1.08 0.00 0.00 58.89 60.27 2wvv h TRP 241 Cb 0.22 -0.25 -0.01 0.00 -3.00 0.00 0.00 29.16 26.12 2wvv h TRP 241 CO -0.03 -0.13 -0.31 2.35 -1.28 0.00 0.00 178.44 179.04 2wvv h TRP 242 N 0.37 0.97 -0.64 0.12 7.01 -1.71 -1.28 115.95 120.78 2wvv h TRP 242 Ca 0.72 -0.28 -0.02 0.00 2.11 0.00 0.00 58.89 61.42 2wvv h TRP 242 Cb 1.61 -0.21 -0.03 0.00 -2.10 0.00 0.00 29.16 28.43 2wvv h TRP 242 CO -0.01 1.07 0.33 1.79 -2.79 0.00 0.00 178.44 178.83 2wvv h THR 243 N 0.59 1.20 -0.33 2.65 1.35 -1.18 0.14 112.91 117.33 2wvv h THR 243 Ca 0.06 -0.53 -0.16 0.00 -0.55 0.00 0.00 66.41 65.23 2wvv h THR 243 Cb 0.89 0.35 -0.01 0.00 -1.73 0.00 0.00 68.15 67.66 2wvv h THR 243 CO 0.08 0.23 -0.43 0.00 -0.25 0.00 0.00 175.52 175.15 2wvv h ALA 244 N 1.47 0.61 -0.49 6.62 0.00 -1.19 -2.09 119.26 124.18 2wvv h ALA 244 Ca 0.23 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 2wvv h ALA 244 Cb 0.05 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2wvv h ALA 244 CO -0.03 0.68 0.19 1.25 0.00 0.00 0.00 179.25 181.33 2wvv h HIS 245 N 0.68 0.76 -0.60 0.00 -0.00 -0.66 -2.09 115.15 113.24 2wvv h HIS 245 Ca 0.05 -0.06 -0.05 0.00 -0.00 0.00 0.00 60.37 60.30 2wvv h HIS 245 Cb 1.01 -0.23 -0.03 0.00 -0.00 0.00 0.00 27.41 28.17 2wvv h HIS 245 CO 0.06 0.64 0.17 0.00 -0.00 0.00 0.00 177.93 178.80 2wvv h ALA 246 N 1.04 0.79 -0.07 5.26 0.00 -0.58 0.20 119.26 125.91 2wvv h ALA 246 Ca 0.16 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.88 2wvv h ALA 246 Cb 0.21 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2wvv h ALA 246 CO -0.01 0.48 -0.05 1.49 0.00 0.00 0.00 179.25 181.15 2wvv h GLU 247 N 0.87 -0.06 -0.37 0.00 4.81 -1.33 -2.04 114.58 116.46 2wvv h GLU 247 Ca 0.19 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 2wvv h GLU 247 Cb 0.31 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 2wvv h GLU 247 CO -0.00 -0.04 0.18 0.37 -0.73 0.00 0.00 179.01 178.78 2wvv h GLN 248 N -0.06 0.53 -0.51 1.92 5.75 -0.88 -2.02 115.11 119.83 2wvv h GLN 248 Ca 0.05 -0.08 0.04 0.00 -0.15 0.00 0.00 58.65 58.50 2wvv h GLN 248 Cb 0.13 -0.10 -0.04 0.00 1.07 0.00 0.00 27.48 28.54 2wvv h GLN 248 CO -0.11 0.48 0.28 1.98 -2.65 0.00 0.00 178.83 178.81 2wvv h MET 249 N 0.46 0.53 -0.21 1.69 4.05 -0.55 -1.34 114.93 119.56 2wvv h MET 249 Ca 0.13 -0.03 -0.15 0.00 -0.28 0.00 0.00 59.70 59.36 2wvv h MET 249 Cb 0.12 -0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 30.79 2wvv h MET 249 CO -0.02 0.35 -0.50 -0.07 0.23 0.00 0.00 176.91 176.91 2wvv h LEU 250 N 0.55 0.62 -1.23 3.39 3.38 -1.27 -2.22 115.31 118.52 2wvv h LEU 250 Ca 0.22 -0.31 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 2wvv h LEU 250 Cb 0.09 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2wvv h LEU 250 CO -0.13 1.01 -0.37 0.11 0.09 0.00 0.00 178.44 179.14 2wvv h LYS 251 N 0.44 0.00 -0.32 1.13 1.57 -1.01 0.61 116.57 118.99 2wvv h LYS 251 Ca 0.02 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.66 2wvv h LYS 251 Cb 1.03 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.34 2wvv h LYS 251 CO 0.10 0.37 -0.33 0.93 -0.57 0.00 0.00 179.45 179.95 2wvv h GLU 252 N 0.00 0.78 -0.07 3.15 5.08 -1.07 -3.32 114.58 119.14 2wvv h GLU 252 Ca -0.00 -0.42 -0.18 0.00 -1.00 0.00 0.00 59.36 57.76 2wvv h GLU 252 Cb 0.69 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 2wvv h GLU 252 CO 0.05 1.05 -0.74 -0.07 -1.00 0.00 0.00 179.01 178.30 2wvv h LEU 253 N 0.55 0.45 -7.22 1.33 3.38 -0.99 -3.42 115.31 109.39 2wvv h LEU 253 Ca 0.05 -0.30 -0.60 0.00 0.09 0.00 0.00 57.88 57.12 2wvv h LEU 253 Cb 0.91 -0.13 -0.40 0.00 0.09 0.00 0.00 40.66 41.12 2wvv h LEU 253 CO 0.08 1.03 -0.75 -0.69 0.09 0.00 0.00 178.44 178.21 2wvv s VAL 254 N -3.59 1.23 0.10 1.22 1.01 0.17 -4.96 120.40 115.59 2wvv s VAL 254 Ca -0.05 -1.78 -0.35 0.00 0.00 0.00 0.00 61.98 59.80 2wvv s VAL 254 Cb 0.10 -1.92 -0.14 0.00 0.00 0.00 0.00 36.38 34.43 2wvv s VAL 254 CO 0.84 -0.70 1.58 -2.65 0.00 0.00 0.00 175.10 174.16 2wvv n PRO 255 N 4.50 1.95 -0.96 2.72 -0.02 -1.26 -1.97 135.00 139.96 2wvv n PRO 255 Ca 0.01 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 2wvv n PRO 255 Cb 0.41 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 2wvv n PRO 255 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wvv n GLY 256 N 3.41 0.89 3.69 -1.23 0.00 -1.26 -5.00 105.19 105.69 2wvv n GLY 256 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2wvv n GLY 256 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2wvv n VAL 257 N -2.05 2.56 -3.82 1.61 3.14 -0.83 -4.60 118.33 114.33 2wvv n VAL 257 Ca 0.00 -0.50 -0.33 0.00 -2.96 0.00 0.00 64.34 60.55 2wvv n VAL 257 Cb 0.00 -1.51 -0.05 0.00 -1.06 0.00 0.00 33.84 31.23 2wvv n VAL 257 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2wvv s ALA 258 N -1.21 3.91 -0.04 1.55 0.00 -0.50 -4.91 121.76 120.55 2wvv s ALA 258 Ca 0.61 -0.69 0.01 0.00 0.00 0.00 0.00 51.96 51.90 2wvv s ALA 258 Cb -0.52 -1.97 0.02 0.00 0.00 0.00 0.00 23.12 20.65 2wvv s ALA 258 CO 0.58 0.73 -0.05 0.42 0.00 0.00 0.00 175.76 177.43 2wvv s ILE 259 N -1.45 0.60 0.61 0.00 -1.09 -1.26 -0.85 121.20 117.76 2wvv s ILE 259 Ca 0.33 -0.17 -0.13 0.00 -2.23 0.00 0.00 60.65 58.45 2wvv s ILE 259 Cb -0.13 -0.61 -0.04 0.00 -1.58 0.00 0.00 42.46 40.11 2wvv s ILE 259 CO 0.22 0.23 1.03 0.54 -1.23 0.00 0.00 174.94 175.74 2wvv s ASN 260 N 0.84 6.06 0.48 3.58 4.22 -1.01 -0.13 114.94 128.98 2wvv s ASN 260 Ca -0.12 1.57 0.24 0.00 -2.14 0.00 0.00 52.86 52.41 2wvv s ASN 260 Cb -0.14 -2.50 1.22 0.00 1.28 0.00 0.00 41.25 41.11 2wvv s ASN 260 CO 0.01 -0.98 1.98 0.77 -2.04 0.00 0.00 177.10 176.84 2wvv h SER 261 N 0.02 0.00 0.27 3.54 4.64 -1.38 -3.12 113.55 117.52 2wvv h SER 261 Ca -0.45 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.86 2wvv h SER 261 Cb 1.20 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2wvv h SER 261 CO 0.60 0.18 -0.06 -0.09 -0.87 0.00 0.00 176.83 176.59 2wvv h ARG 262 N 0.00 0.00 -0.72 4.77 2.43 -1.85 -1.60 114.38 117.42 2wvv h ARG 262 Ca -0.00 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 2wvv h ARG 262 Cb 0.47 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.99 2wvv h ARG 262 CO 0.02 0.06 0.30 1.25 -1.51 0.00 0.00 179.97 180.09 2wvv h LEU 263 N 0.00 0.97 -9.63 3.80 5.85 -1.75 -3.44 115.31 111.11 2wvv h LEU 263 Ca -0.00 -0.16 -0.57 0.00 0.84 0.00 0.00 57.88 57.98 2wvv h LEU 263 Cb 0.21 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 40.94 2wvv h LEU 263 CO 0.01 0.87 -0.04 -0.13 -0.34 0.00 0.00 178.44 178.81 2wvv s ARG 264 N -5.59 4.23 0.01 1.25 1.81 -0.60 -4.84 118.95 115.22 2wvv s ARG 264 Ca -0.13 0.72 0.03 0.00 -1.72 0.00 0.00 55.73 54.63 2wvv s ARG 264 Cb 0.14 -3.28 -0.01 0.00 -0.45 0.00 0.00 34.95 31.35 2wvv s ARG 264 CO 0.82 0.54 -0.09 0.00 -0.68 0.00 0.00 175.30 175.88 2wvv s ALA 265 N -0.76 0.77 0.40 2.13 0.00 -1.26 -2.09 121.76 120.95 2wvv s ALA 265 Ca 0.29 -0.53 -0.00 0.00 0.00 0.00 0.00 51.96 51.72 2wvv s ALA 265 Cb -0.19 -0.14 0.01 0.00 0.00 0.00 0.00 23.12 22.80 2wvv s ALA 265 CO 0.18 0.15 0.05 -0.40 0.00 0.00 0.00 175.76 175.73 2wvv n ASP 266 N 2.40 0.06 -0.11 0.00 5.75 -0.36 -4.44 116.55 119.85 2wvv n ASP 266 Ca -0.16 -1.05 0.24 0.00 -0.01 0.00 0.00 54.79 53.80 2wvv n ASP 266 Cb 0.56 -0.03 0.69 0.00 -1.03 0.00 0.00 41.12 41.31 2wvv n ASP 266 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 2wvv h ASP 267 N -0.03 0.05 -0.28 -1.12 3.45 -1.91 -2.25 116.42 114.33 2wvv h ASP 267 Ca -0.02 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.45 2wvv h ASP 267 Cb 0.06 -0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.82 2wvv h ASP 267 CO 0.02 0.02 0.00 0.29 -1.57 0.00 0.00 179.24 178.00 2wvv n LYS 268 N -4.34 2.36 -0.78 3.56 4.76 -1.26 -4.92 118.16 117.54 2wvv n LYS 268 Ca 0.15 -2.03 0.00 0.00 -2.87 0.00 0.00 58.31 53.55 2wvv n LYS 268 Cb 0.78 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 32.48 2wvv n LYS 268 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wvv n GLY 269 N 1.42 0.70 3.70 0.72 0.00 -0.85 -5.02 105.19 105.87 2wvv n GLY 269 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2wvv n GLY 269 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wvv s LYS 270 N -0.22 4.38 0.16 1.61 3.01 -1.26 -4.77 119.74 122.65 2wvv s LYS 270 Ca 0.00 1.73 0.05 0.00 -1.01 0.00 0.00 55.97 56.75 2wvv s LYS 270 Cb 0.00 -3.47 -0.04 0.00 -1.01 0.00 0.00 37.83 33.31 2wvv s LYS 270 CO 0.00 -0.37 0.10 1.03 0.51 0.00 0.00 175.35 176.62 2wvv s ARG 271 N 1.73 2.79 0.00 1.68 0.52 -1.26 -1.22 118.95 123.18 2wvv s ARG 271 Ca 0.58 -0.91 0.00 0.00 -0.52 0.00 0.00 55.73 54.88 2wvv s ARG 271 Cb -0.27 -2.59 0.00 0.00 0.52 0.00 0.00 34.95 32.61 2wvv s ARG 271 CO 0.25 0.48 0.00 0.72 0.02 0.00 0.00 175.30 176.78 2wvv n HIS 272 N -0.23 0.00 -4.77 -0.53 8.25 -0.89 -4.69 115.22 112.35 2wvv n HIS 272 Ca -0.09 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.04 2wvv n HIS 272 Cb 0.55 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.53 2wvv n HIS 272 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2wvv s PHE 273 N 0.00 2.80 0.73 4.41 0.40 -1.26 -0.70 117.98 124.35 2wvv s PHE 273 Ca 0.00 -0.08 -0.12 0.00 -0.60 0.00 0.00 56.93 56.12 2wvv s PHE 273 Cb 0.00 -1.66 0.17 0.00 0.51 0.00 0.00 43.02 42.04 2wvv s PHE 273 CO 0.00 0.25 0.92 -0.40 0.70 0.00 0.00 175.22 176.69 2wvv n ASP 274 N 2.25 -0.21 0.20 1.36 5.68 0.41 -4.81 116.55 121.42 2wvv n ASP 274 Ca -0.17 -1.29 0.14 0.00 -0.50 0.00 0.00 54.79 52.97 2wvv n ASP 274 Cb 0.52 -0.73 0.64 0.00 -1.14 0.00 0.00 41.12 40.42 2wvv n ASP 274 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 2wvv h SER 275 N -1.40 0.00 -0.56 -1.12 0.02 -1.89 0.92 113.55 109.52 2wvv h SER 275 Ca -0.31 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 2wvv h SER 275 Cb 0.85 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.39 2wvv h SER 275 CO 0.21 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 176.49 2wvv n ASN 276 N -2.55 3.32 -0.16 3.07 3.02 -1.26 -4.90 115.26 115.80 2wvv n ASN 276 Ca 0.00 -2.11 -0.02 0.00 -0.03 0.00 0.00 54.58 52.42 2wvv n ASN 276 Cb 0.19 -0.42 -0.01 0.00 -0.61 0.00 0.00 39.78 38.93 2wvv n ASN 276 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wvv n GLY 277 N 1.27 0.55 3.80 7.41 0.00 0.32 -5.02 105.19 113.52 2wvv n GLY 277 Ca 0.20 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 2wvv n GLY 277 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wvv s ARG 278 N -1.34 3.95 0.14 1.61 0.52 -1.26 -4.77 118.95 117.81 2wvv s ARG 278 Ca 0.00 0.14 -0.31 0.00 -0.52 0.00 0.00 55.73 55.03 2wvv s ARG 278 Cb 0.00 -3.30 -0.10 0.00 0.52 0.00 0.00 34.95 32.07 2wvv s ARG 278 CO 0.00 0.51 1.64 -1.17 0.02 0.00 0.00 175.30 176.31 2wvv s LEU 279 N -0.38 4.37 0.21 2.53 2.96 -1.26 -0.44 118.68 126.66 2wvv s LEU 279 Ca 0.18 2.63 0.03 0.00 -0.22 0.00 0.00 54.13 56.75 2wvv s LEU 279 Cb -0.14 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 42.93 2wvv s LEU 279 CO 0.07 -0.88 0.35 -0.04 -1.32 0.00 0.00 176.35 174.53 2wvv s MET 280 N 1.72 3.46 1.47 1.98 -1.94 0.12 -4.63 119.30 121.48 2wvv s MET 280 Ca 0.73 -0.58 0.00 0.00 -1.71 0.00 0.00 55.69 54.13 2wvv s MET 280 Cb -0.44 -2.89 0.00 0.00 2.01 0.00 0.00 34.83 33.51 2wvv s MET 280 CO 0.32 0.44 0.00 0.41 -0.01 0.00 0.00 175.02 176.18 2wvv n GLY 281 N -0.96 -1.57 0.01 -0.03 0.00 -1.26 -4.14 105.19 97.23 2wvv n GLY 281 Ca -0.07 -1.26 0.10 0.00 0.00 0.00 0.00 46.02 44.79 2wvv n GLY 281 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wvv n ASP 282 N -0.43 0.43 -3.53 1.61 8.00 0.81 -4.78 116.55 118.67 2wvv n ASP 282 Ca 0.00 -0.27 -0.16 0.00 0.71 0.00 0.00 54.79 55.07 2wvv n ASP 282 Cb 0.00 1.69 -0.05 0.00 -0.02 0.00 0.00 41.12 42.74 2wvv n ASP 282 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2wvv s TYR 283 N -3.30 -0.57 0.08 1.24 -0.85 -1.25 -4.55 117.35 108.15 2wvv s TYR 283 Ca -0.03 0.82 -0.28 0.00 -0.52 0.00 0.00 57.07 57.06 2wvv s TYR 283 Cb 0.14 0.41 -0.06 0.00 0.38 0.00 0.00 41.96 42.83 2wvv s TYR 283 CO 0.86 -0.65 0.87 -2.00 -1.52 0.00 0.00 175.55 173.11 2wvv s GLU 284 N -1.88 4.60 -0.31 -3.49 2.12 -0.26 -1.38 118.70 118.10 2wvv s GLU 284 Ca -0.08 1.27 0.14 0.00 0.36 0.00 0.00 54.97 56.67 2wvv s GLU 284 Cb -0.01 -3.37 0.47 0.00 0.26 0.00 0.00 34.13 31.48 2wvv s GLU 284 CO 0.03 0.25 1.10 -1.13 -0.54 0.00 0.00 175.26 174.97 2wvv n SER 285 N 2.78 3.01 -0.00 -1.70 3.41 -1.26 -1.24 113.62 118.61 2wvv n SER 285 Ca 0.00 -2.94 0.09 0.00 -0.26 0.00 0.00 58.87 55.76 2wvv n SER 285 Cb 0.50 -0.45 -0.12 0.00 -0.26 0.00 0.00 64.21 63.88 2wvv n SER 285 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wvv n GLY 286 N -0.49 -0.81 3.49 5.00 0.00 -1.26 -4.75 105.19 106.36 2wvv n GLY 286 Ca 0.23 -0.52 -0.43 0.00 0.00 0.00 0.00 46.02 45.30 2wvv n GLY 286 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wvv s TYR 287 N -2.90 2.76 -0.24 1.61 1.51 -1.26 -4.94 117.35 113.89 2wvv s TYR 287 Ca 0.04 -0.89 0.02 0.00 -1.01 0.00 0.00 57.07 55.24 2wvv s TYR 287 Cb 0.14 -4.43 0.05 0.00 -0.11 0.00 0.00 41.96 37.61 2wvv s TYR 287 CO 0.79 -1.71 -0.11 -2.00 -1.11 0.00 0.00 175.55 171.41 2wvv s GLU 288 N 3.95 2.19 -1.62 -0.62 2.12 -1.26 -2.29 118.70 121.17 2wvv s GLU 288 Ca 0.33 -1.14 0.00 0.00 0.36 0.00 0.00 54.97 54.53 2wvv s GLU 288 Cb -0.07 -2.72 0.00 0.00 0.26 0.00 0.00 34.13 31.60 2wvv s GLU 288 CO -0.02 -0.51 0.00 0.54 -0.54 0.00 0.00 175.26 174.74 2wvv n ARG 289 N 4.54 -1.34 -3.50 4.30 1.74 -0.77 -4.96 116.66 116.67 2wvv n ARG 289 Ca -0.15 0.94 -0.12 0.00 -0.77 0.00 0.00 57.85 57.75 2wvv n ARG 289 Cb 0.44 -5.34 -0.04 0.00 -1.02 0.00 0.00 32.46 26.50 2wvv n ARG 289 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2wvv s ARG 290 N -4.41 0.96 0.11 5.56 1.70 -1.26 -5.07 118.95 116.54 2wvv s ARG 290 Ca 0.00 -0.10 0.06 0.00 -0.47 0.00 0.00 55.73 55.21 2wvv s ARG 290 Cb 0.00 0.45 -0.04 0.00 -0.57 0.00 0.00 34.95 34.79 2wvv s ARG 290 CO 0.00 -0.37 -0.14 -0.51 -1.08 0.00 0.00 175.30 173.20 2wvv s LEU 291 N -1.93 2.37 0.57 -1.89 1.43 -1.26 -4.73 118.68 113.23 2wvv s LEU 291 Ca -0.02 -0.75 -0.21 0.00 -1.03 0.00 0.00 54.13 52.12 2wvv s LEU 291 Cb -0.01 -0.55 -0.04 0.00 0.03 0.00 0.00 46.19 45.62 2wvv s LEU 291 CO -0.03 -0.12 1.36 -2.16 0.23 0.00 0.00 176.35 175.63 2wvv s PRO 292 N -2.39 3.02 0.09 1.29 0.04 -1.26 -4.94 135.00 130.85 2wvv s PRO 292 Ca 0.06 2.22 -0.31 0.00 0.04 0.00 0.00 61.00 63.01 2wvv s PRO 292 Cb -0.06 -2.18 -0.07 0.00 0.04 0.00 0.00 34.50 32.22 2wvv s PRO 292 CO 0.03 -1.28 1.30 0.34 0.04 0.00 0.00 177.00 177.42 2wvv s ASP 293 N -1.01 6.95 0.00 6.66 2.15 -1.26 -4.91 116.67 125.25 2wvv s ASP 293 Ca 0.74 2.18 0.14 0.00 0.43 0.00 0.00 52.55 56.03 2wvv s ASP 293 Cb -0.40 -2.58 0.63 0.00 -0.30 0.00 0.00 42.92 40.26 2wvv s ASP 293 CO 0.47 -0.57 1.44 -2.65 -0.17 0.00 0.00 175.17 173.69 2wvv n PRO 294 N 3.94 0.05 -0.08 4.34 -0.02 -1.26 -1.43 135.00 140.53 2wvv n PRO 294 Ca 0.10 0.23 -0.11 0.00 -2.02 0.00 0.00 63.50 61.70 2wvv n PRO 294 Cb 0.44 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 32.35 2wvv n PRO 294 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2wvv n VAL 295 N -1.45 0.88 0.24 -1.45 0.31 -1.26 -4.68 118.33 110.92 2wvv n VAL 295 Ca 0.04 -0.32 0.11 0.00 -0.01 0.00 0.00 64.34 64.16 2wvv n VAL 295 Cb 0.15 -1.12 -0.11 0.00 -0.91 0.00 0.00 33.84 31.85 2wvv n VAL 295 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2wvv n LYS 296 N -3.04 0.50 -1.15 5.55 5.02 -1.19 -4.49 118.16 119.35 2wvv n LYS 296 Ca -0.28 -0.10 -0.10 0.00 -2.02 0.00 0.00 58.31 55.81 2wvv n LYS 296 Cb 0.78 -1.56 0.14 0.00 -0.02 0.00 0.00 35.03 34.37 2wvv n LYS 296 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2wvv n ASP 297 N -2.15 3.39 0.16 4.39 8.00 -0.52 -4.74 116.55 125.08 2wvv n ASP 297 Ca -0.01 -3.81 0.12 0.00 0.71 0.00 0.00 54.79 51.79 2wvv n ASP 297 Cb 0.51 -0.55 0.57 0.00 -0.02 0.00 0.00 41.12 41.62 2wvv n ASP 297 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2wvv n LEU 298 N -0.99 0.63 -0.39 0.64 4.77 -1.26 -2.39 117.00 118.00 2wvv n LEU 298 Ca 0.35 0.74 0.32 0.00 -0.03 0.00 0.00 56.01 57.38 2wvv n LEU 298 Cb 0.90 -0.75 0.61 0.00 -2.33 0.00 0.00 43.42 41.86 2wvv n LEU 298 CO 0.24 -0.82 1.25 0.07 -1.33 0.00 0.00 177.39 176.80 2wvv h LYS 299 N 0.00 0.19 0.00 3.23 2.10 -1.96 -1.73 116.57 118.41 2wvv h LYS 299 Ca 0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 2wvv h LYS 299 Cb 0.14 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 31.43 2wvv h LYS 299 CO 0.00 0.13 0.00 -0.39 -2.00 0.00 0.00 179.45 177.19 2wvv h VAL 300 N 0.20 0.00 0.00 0.07 -1.51 -1.82 -1.91 116.25 111.27 2wvv h VAL 300 Ca 0.70 -0.30 0.00 0.00 -1.23 0.00 0.00 66.70 65.87 2wvv h VAL 300 Cb 2.15 1.19 0.00 0.00 -2.13 0.00 0.00 31.29 32.50 2wvv h VAL 300 CO -0.29 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 176.40 2wvv n THR 301 N -2.83 1.04 0.62 7.19 -2.24 -0.65 -2.82 114.28 114.59 2wvv n THR 301 Ca -0.00 0.30 0.13 0.00 -2.27 0.00 0.00 64.05 62.21 2wvv n THR 301 Cb 0.22 -1.15 0.39 0.00 -2.10 0.00 0.00 70.33 67.69 2wvv n THR 301 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wvv n GLN 302 N -1.79 0.27 -4.18 -0.78 6.02 -0.72 -4.89 117.38 111.31 2wvv n GLN 302 Ca 0.02 0.21 -0.11 0.00 -0.01 0.00 0.00 57.00 57.12 2wvv n GLN 302 Cb 0.16 -1.80 -0.10 0.00 1.02 0.00 0.00 30.24 29.52 2wvv n GLN 302 CO 0.00 0.00 0.00 1.67 -1.01 0.00 0.00 177.06 177.72 2wvv s TRP 303 N -3.10 0.93 0.38 1.08 -2.14 -1.13 -4.59 118.94 110.37 2wvv s TRP 303 Ca 0.10 -1.00 -0.26 0.00 2.66 0.00 0.00 56.10 57.61 2wvv s TRP 303 Cb 0.12 -0.54 -0.09 0.00 -3.10 0.00 0.00 33.47 29.86 2wvv s TRP 303 CO 0.60 -0.24 1.13 -0.51 -2.66 0.00 0.00 176.95 175.28 2wvv s ASP 304 N -3.07 6.68 0.13 -2.66 1.01 -1.26 -4.93 116.67 112.58 2wvv s ASP 304 Ca 0.16 2.27 -0.18 0.00 0.71 0.00 0.00 52.55 55.51 2wvv s ASP 304 Cb 0.06 -2.61 0.05 0.00 1.01 0.00 0.00 42.92 41.43 2wvv s ASP 304 CO -0.02 -0.56 0.46 -1.66 0.21 0.00 0.00 175.17 173.60 2wvv s TRP 305 N -1.43 -0.31 -0.06 4.23 1.48 -1.26 -1.10 118.94 120.49 2wvv s TRP 305 Ca 0.55 0.04 -0.02 0.00 -1.06 0.00 0.00 56.10 55.61 2wvv s TRP 305 Cb -0.29 0.35 0.04 0.00 -1.16 0.00 0.00 33.47 32.40 2wvv s TRP 305 CO 0.37 -0.74 0.11 -2.00 -4.06 0.00 0.00 176.95 170.63 2wvv s GLU 306 N -3.71 0.02 0.11 3.25 2.12 -0.37 -1.11 118.70 119.01 2wvv s GLU 306 Ca 0.02 0.38 -0.03 0.00 0.36 0.00 0.00 54.97 55.70 2wvv s GLU 306 Cb 0.01 -0.27 -0.05 0.00 0.26 0.00 0.00 34.13 34.08 2wvv s GLU 306 CO -0.12 -0.23 0.31 0.00 -0.54 0.00 0.00 175.26 174.69 2wvv s ALA 307 N 1.60 3.87 0.13 6.30 0.00 -0.11 -4.50 121.76 129.05 2wvv s ALA 307 Ca -0.04 -0.66 0.09 0.00 0.00 0.00 0.00 51.96 51.35 2wvv s ALA 307 Cb -0.12 -2.02 -0.04 0.00 0.00 0.00 0.00 23.12 20.94 2wvv s ALA 307 CO -0.05 0.73 -0.22 0.00 0.00 0.00 0.00 175.76 176.22 2wvv s MET 309 N -2.14 0.69 0.23 0.00 0.23 -0.20 -1.84 119.30 116.28 2wvv s MET 309 Ca 0.11 -0.72 0.06 0.00 -1.03 0.00 0.00 55.69 54.11 2wvv s MET 309 Cb -0.09 0.28 -0.04 0.00 -1.53 0.00 0.00 34.83 33.46 2wvv s MET 309 CO 0.05 -0.20 0.19 0.95 -2.03 0.00 0.00 175.02 173.99 2wvv s THR 310 N -2.82 4.53 -0.13 3.16 -4.23 -1.26 -0.75 115.64 114.14 2wvv s THR 310 Ca -0.03 -1.28 -0.21 0.00 -1.18 0.00 0.00 61.69 58.99 2wvv s THR 310 Cb 0.00 -3.41 -0.19 0.00 1.34 0.00 0.00 72.50 70.24 2wvv s THR 310 CO -0.05 -0.28 0.57 0.40 -0.54 0.00 0.00 174.62 174.71 2wvv h ILE 311 N 1.61 1.28 -2.81 2.99 2.04 -1.82 -3.46 117.51 117.34 2wvv h ILE 311 Ca -0.49 -1.94 -0.24 0.00 1.00 0.00 0.00 64.86 63.20 2wvv h ILE 311 Cb 1.23 2.41 0.11 0.00 -0.74 0.00 0.00 36.82 39.82 2wvv h ILE 311 CO 0.61 0.43 0.16 -2.65 0.00 0.00 0.00 178.15 176.70 2wvv n PRO 312 N -4.67 -1.47 -0.13 2.37 -0.02 -1.26 -1.57 135.00 128.26 2wvv n PRO 312 Ca -0.07 -1.09 -0.09 0.00 -2.02 0.00 0.00 63.50 60.23 2wvv n PRO 312 Cb 0.34 -0.86 -0.01 0.00 -0.02 0.00 0.00 33.50 32.96 2wvv n PRO 312 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2wvv h GLU 313 N 0.00 0.60 -0.39 -0.52 4.81 -1.80 -3.40 114.58 113.88 2wvv h GLU 313 Ca -0.24 -0.12 -0.18 0.00 -0.13 0.00 0.00 59.36 58.69 2wvv h GLU 313 Cb 0.70 -0.09 -0.15 0.00 0.63 0.00 0.00 28.75 29.84 2wvv h GLU 313 CO 0.16 0.59 -0.47 -1.71 -0.73 0.00 0.00 179.01 176.85 2wvv n ASN 314 N -4.63 -3.04 -3.67 1.04 5.15 -1.26 -4.87 115.26 103.98 2wvv n ASN 314 Ca -0.00 -3.06 -0.22 0.00 -0.60 0.00 0.00 54.58 50.69 2wvv n ASN 314 Cb 0.16 1.75 -0.18 0.00 -0.53 0.00 0.00 39.78 40.99 2wvv n ASN 314 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2wvv s GLN 315 N 0.75 0.03 -0.17 1.20 -1.52 -1.26 -3.95 119.66 114.74 2wvv s GLN 315 Ca 0.31 0.22 -0.13 0.00 -1.95 0.00 0.00 55.36 53.81 2wvv s GLN 315 Cb 0.14 -0.92 -0.07 0.00 -0.22 0.00 0.00 33.01 31.93 2wvv s GLN 315 CO -0.17 -0.42 -0.28 0.91 -0.25 0.00 0.00 175.29 175.08 2wvv n TRP 316 N 5.28 0.00 -1.49 0.91 7.02 -1.26 -4.63 117.44 123.26 2wvv n TRP 316 Ca -0.05 0.00 -0.30 0.00 -1.02 0.00 0.00 57.50 56.14 2wvv n TRP 316 Cb 0.50 -0.59 0.10 0.00 -2.42 0.00 0.00 31.31 28.89 2wvv n TRP 316 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 2wvv s GLY 317 N -5.07 1.63 -0.04 6.99 0.00 -1.26 -3.83 107.32 105.73 2wvv s GLY 317 Ca -0.27 -0.15 -0.35 0.00 0.00 0.00 0.00 44.72 43.95 2wvv s GLY 317 CO 0.36 0.27 1.77 2.98 0.00 0.00 0.00 173.10 178.48 2wvv n TYR 318 N -3.49 2.24 -5.13 1.90 9.36 -1.25 -4.59 117.16 116.21 2wvv n TYR 318 Ca 0.07 0.15 -0.32 0.00 3.32 0.00 0.00 57.90 61.12 2wvv n TYR 318 Cb 0.56 -2.60 -0.16 0.00 -0.63 0.00 0.00 39.34 36.51 2wvv n TYR 318 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 2wvv s HIS 319 N 3.08 2.59 -0.16 2.98 5.65 -1.26 -4.31 115.29 123.85 2wvv s HIS 319 Ca 0.90 -0.85 0.29 0.00 0.25 0.00 0.00 55.06 55.65 2wvv s HIS 319 Cb -0.74 -1.71 1.19 0.00 -1.18 0.00 0.00 32.58 30.14 2wvv s HIS 319 CO 0.50 -0.30 1.87 1.57 -0.65 0.00 0.00 174.74 177.72 2wvv h LYS 320 N 6.48 0.00 -3.38 2.88 2.10 -1.43 -3.39 116.57 119.83 2wvv h LYS 320 Ca -0.25 0.00 -0.60 0.00 -2.00 0.00 0.00 60.65 57.80 2wvv h LYS 320 Cb 1.21 0.00 -0.40 0.00 -0.90 0.00 0.00 32.23 32.14 2wvv h LYS 320 CO 0.49 0.00 -0.75 0.34 -2.00 0.00 0.00 179.45 177.53 2wvv s ASP 321 N -5.08 3.91 0.00 7.07 2.15 -1.26 -4.96 116.67 118.50 2wvv s ASP 321 Ca 0.03 -2.12 0.29 0.00 0.43 0.00 0.00 52.55 51.17 2wvv s ASP 321 Cb 0.09 -0.99 1.53 0.00 -0.30 0.00 0.00 42.92 43.24 2wvv s ASP 321 CO 0.48 -0.35 2.01 0.79 -0.17 0.00 0.00 175.17 177.93 2wvv n TRP 322 N 4.21 0.01 1.25 -5.34 7.02 -1.26 -3.44 117.44 119.89 2wvv n TRP 322 Ca 0.03 -0.01 0.14 0.00 -1.02 0.00 0.00 57.50 56.65 2wvv n TRP 322 Cb 0.39 0.00 0.67 0.00 -2.42 0.00 0.00 31.31 29.94 2wvv n TRP 322 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 2wvv n SER 323 N -0.58 0.09 0.23 -0.99 3.41 -1.26 -3.89 113.62 110.62 2wvv n SER 323 Ca 0.21 0.02 0.12 0.00 -0.26 0.00 0.00 58.87 58.96 2wvv n SER 323 Cb 0.18 -0.30 0.43 0.00 -0.26 0.00 0.00 64.21 64.26 2wvv n SER 323 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2wvv h LEU 324 N 0.07 0.00 -8.69 1.04 3.38 -2.00 -3.46 115.31 105.65 2wvv h LEU 324 Ca 0.00 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.63 2wvv h LEU 324 Cb 0.38 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.01 2wvv h LEU 324 CO 0.00 0.13 -0.43 -0.94 0.09 0.00 0.00 178.44 177.29 2wvv s SER 325 N -6.06 0.98 0.21 -0.43 1.04 -1.25 -5.11 113.70 103.08 2wvv s SER 325 Ca 0.02 -1.55 -0.30 0.00 0.48 0.00 0.00 55.95 54.61 2wvv s SER 325 Cb 0.08 0.54 -0.09 0.00 0.10 0.00 0.00 66.02 66.65 2wvv s SER 325 CO 0.62 -1.06 1.28 -0.47 0.98 0.00 0.00 173.24 174.59 2wvv s TYR 326 N -3.58 3.29 -0.22 5.02 5.04 -1.26 -4.83 117.35 120.81 2wvv s TYR 326 Ca 0.37 1.30 -0.05 0.00 -2.44 0.00 0.00 57.07 56.25 2wvv s TYR 326 Cb 0.03 -3.56 -0.02 0.00 0.35 0.00 0.00 41.96 38.76 2wvv s TYR 326 CO 0.21 -1.68 -0.02 0.08 -1.34 0.00 0.00 175.55 172.80 2wvv s VAL 327 N -0.08 3.65 0.51 3.14 1.01 -1.26 -2.45 120.40 124.93 2wvv s VAL 327 Ca 0.55 -0.40 -0.22 0.00 0.00 0.00 0.00 61.98 61.90 2wvv s VAL 327 Cb -0.36 -2.66 -0.06 0.00 0.00 0.00 0.00 36.38 33.30 2wvv s VAL 327 CO 0.39 0.41 1.27 -0.54 0.00 0.00 0.00 175.10 176.64 2wvv s LYS 328 N 1.35 3.37 0.56 2.72 1.02 -0.61 -4.99 119.74 123.17 2wvv s LYS 328 Ca 0.04 2.03 -0.06 0.00 0.02 0.00 0.00 55.97 58.00 2wvv s LYS 328 Cb -0.14 -2.30 -0.01 0.00 -0.52 0.00 0.00 37.83 34.86 2wvv s LYS 328 CO -0.01 -0.94 0.88 0.95 -0.92 0.00 0.00 175.35 175.32 2wvv s THR 329 N -1.41 4.11 0.27 2.17 -4.23 -1.26 -4.94 115.64 110.35 2wvv s THR 329 Ca 0.69 0.15 -0.01 0.00 -1.18 0.00 0.00 61.69 61.33 2wvv s THR 329 Cb -0.35 -3.61 0.27 0.00 1.34 0.00 0.00 72.50 70.14 2wvv s THR 329 CO 0.42 -0.64 1.85 -0.65 -0.54 0.00 0.00 174.62 175.06 2wvv h PRO 330 N -0.08 1.02 -0.51 3.99 0.11 -1.96 -1.59 132.00 132.98 2wvv h PRO 330 Ca -0.46 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 65.52 2wvv h PRO 330 Cb 1.24 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 2wvv h PRO 330 CO 0.61 0.67 0.03 0.82 -0.21 0.00 0.00 178.00 179.93 2wvv h ILE 331 N 1.05 1.24 -0.59 4.15 2.04 -1.98 0.16 117.51 123.58 2wvv h ILE 331 Ca 0.45 -0.98 -0.03 0.00 1.00 0.00 0.00 64.86 65.31 2wvv h ILE 331 Cb 0.32 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 2wvv h ILE 331 CO -0.22 0.35 0.26 -0.33 0.00 0.00 0.00 178.15 178.21 2wvv h GLU 332 N 0.78 0.85 -0.13 2.37 5.08 -1.78 0.20 114.58 121.95 2wvv h GLU 332 Ca 0.16 -0.12 -0.12 0.00 -1.00 0.00 0.00 59.36 58.28 2wvv h GLU 332 Cb 0.43 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2wvv h GLU 332 CO 0.02 0.68 -0.37 0.28 -1.00 0.00 0.00 179.01 178.61 2wvv h VAL 333 N 0.84 1.37 -0.87 3.13 2.07 -0.64 -2.99 116.25 119.15 2wvv h VAL 333 Ca 0.21 -1.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.05 2wvv h VAL 333 Cb 0.13 2.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.94 2wvv h VAL 333 CO -0.02 0.50 0.51 0.40 0.02 0.00 0.00 177.57 178.97 2wvv h ILE 334 N 0.09 1.25 -0.51 4.57 2.04 -0.33 -1.36 117.51 123.26 2wvv h ILE 334 Ca -0.01 -0.56 0.08 0.00 1.00 0.00 0.00 64.86 65.37 2wvv h ILE 334 Cb 0.99 0.03 -0.06 0.00 -0.74 0.00 0.00 36.82 37.04 2wvv h ILE 334 CO 0.08 0.26 0.15 -0.78 0.00 0.00 0.00 178.15 177.86 2wvv h ASP 335 N 1.21 0.10 -0.41 1.72 3.58 -0.62 -1.45 116.42 120.55 2wvv h ASP 335 Ca 0.31 0.08 -0.09 0.00 0.42 0.00 0.00 57.03 57.74 2wvv h ASP 335 Cb -0.02 0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.09 2wvv h ASP 335 CO -0.06 0.08 -0.08 0.03 -2.88 0.00 0.00 179.24 176.34 2wvv h ARG 336 N 0.30 0.85 -0.02 0.28 3.08 -1.18 -0.56 114.38 117.14 2wvv h ARG 336 Ca 0.25 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 2wvv h ARG 336 Cb 0.31 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.28 2wvv h ARG 336 CO -0.29 0.90 0.01 0.82 -1.07 0.00 0.00 179.97 180.34 2wvv h ILE 337 N 0.78 1.13 -0.55 2.04 2.04 -0.95 -1.84 117.51 120.15 2wvv h ILE 337 Ca 0.13 -0.38 -0.09 0.00 1.00 0.00 0.00 64.86 65.53 2wvv h ILE 337 Cb 0.58 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 2wvv h ILE 337 CO 0.04 0.10 0.01 0.58 0.00 0.00 0.00 178.15 178.87 2wvv h VAL 338 N -0.12 1.26 -0.45 1.67 2.07 -1.13 -2.52 116.25 117.04 2wvv h VAL 338 Ca 0.01 -1.11 0.09 0.00 0.82 0.00 0.00 66.70 66.51 2wvv h VAL 338 Cb 0.16 0.88 -0.09 0.00 -1.52 0.00 0.00 31.29 30.71 2wvv h VAL 338 CO -0.00 0.40 -0.21 -0.74 0.02 0.00 0.00 177.57 177.03 2wvv h HIS 339 N 0.86 -0.54 0.02 1.57 6.17 -1.04 0.81 115.15 122.98 2wvv h HIS 339 Ca 0.16 0.05 0.02 0.00 0.71 0.00 0.00 60.37 61.31 2wvv h HIS 339 Cb 0.53 0.31 -0.02 0.00 2.52 0.00 0.00 27.41 30.75 2wvv h HIS 339 CO 0.04 -0.30 -0.12 0.00 0.71 0.00 0.00 177.93 178.26 2wvv h ALA 340 N 1.17 -0.15 -0.90 5.26 0.00 -1.05 -2.74 119.26 120.85 2wvv h ALA 340 Ca 0.21 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.13 2wvv h ALA 340 Cb 0.46 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 2wvv h ALA 340 CO -0.53 -0.61 0.59 0.28 0.00 0.00 0.00 179.25 178.98 2wvv h VAL 341 N -0.21 1.24 0.00 0.00 2.07 -1.10 0.96 116.25 119.20 2wvv h VAL 341 Ca 0.04 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 2wvv h VAL 341 Cb 0.25 -0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 29.93 2wvv h VAL 341 CO -0.11 0.23 -0.04 0.77 0.02 0.00 0.00 177.57 178.45 2wvv h SER 342 N 1.23 0.00 -0.27 0.57 4.64 -0.60 -0.95 113.55 118.18 2wvv h SER 342 Ca 0.33 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.63 2wvv h SER 342 Cb -0.13 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 61.95 2wvv h SER 342 CO -0.07 0.04 0.00 0.23 -0.87 0.00 0.00 176.83 176.16 2wvv n MET 343 N -3.39 2.77 -0.92 4.77 2.81 -0.61 -4.03 117.12 118.53 2wvv n MET 343 Ca -0.02 -2.87 0.00 0.00 -1.81 0.00 0.00 57.70 53.00 2wvv n MET 343 Cb 0.16 -1.84 0.00 0.00 -0.71 0.00 0.00 33.22 30.83 2wvv n MET 343 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wvv n GLY 344 N -0.60 0.44 3.56 3.03 0.00 -0.36 -4.23 105.19 107.03 2wvv n GLY 344 Ca 0.23 -0.91 -0.24 0.00 0.00 0.00 0.00 46.02 45.09 2wvv n GLY 344 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wvv s GLY 345 N -2.83 1.91 0.47 -0.02 0.00 0.23 -4.38 107.32 102.70 2wvv s GLY 345 Ca 0.00 -1.87 -0.07 0.00 0.00 0.00 0.00 44.72 42.78 2wvv s GLY 345 CO 0.00 -1.90 0.80 -1.31 0.00 0.00 0.00 173.10 170.69 2wvv s ASN 346 N -3.61 6.32 -0.02 1.64 -0.87 -0.27 -2.86 114.94 115.27 2wvv s ASN 346 Ca 0.32 1.01 0.03 0.00 -1.57 0.00 0.00 52.86 52.65 2wvv s ASN 346 Cb -0.03 -2.28 -0.00 0.00 -0.02 0.00 0.00 41.25 38.91 2wvv s ASN 346 CO 0.17 -0.56 -0.11 -0.32 -2.57 0.00 0.00 177.10 173.71 2wvv s MET 347 N -4.57 1.07 -0.12 -0.60 -2.45 -0.31 -0.93 119.30 111.38 2wvv s MET 347 Ca 0.49 -0.37 0.01 0.00 -1.25 0.00 0.00 55.69 54.57 2wvv s MET 347 Cb -0.10 -0.99 0.02 0.00 1.25 0.00 0.00 34.83 35.00 2wvv s MET 347 CO 0.43 0.17 -0.15 0.08 1.05 0.00 0.00 175.02 176.59 2wvv s VAL 348 N 0.05 1.52 -0.24 10.11 1.01 -0.26 -1.18 120.40 131.40 2wvv s VAL 348 Ca -0.01 -0.64 -0.12 0.00 0.00 0.00 0.00 61.98 61.20 2wvv s VAL 348 Cb -0.08 -1.40 -0.05 0.00 0.00 0.00 0.00 36.38 34.85 2wvv s VAL 348 CO 0.00 0.45 0.25 -0.69 0.00 0.00 0.00 175.10 175.11 2wvv s VAL 349 N 1.14 5.29 0.34 2.92 1.01 -0.49 -1.03 120.40 129.58 2wvv s VAL 349 Ca -0.03 0.36 -0.25 0.00 0.00 0.00 0.00 61.98 62.06 2wvv s VAL 349 Cb -0.14 -3.59 -0.10 0.00 0.00 0.00 0.00 36.38 32.55 2wvv s VAL 349 CO -0.04 0.28 0.95 0.21 0.00 0.00 0.00 175.10 176.49 2wvv s ASN 350 N 1.25 7.27 0.01 3.32 2.47 0.07 -1.00 114.94 128.33 2wvv s ASN 350 Ca 0.11 1.82 0.04 0.00 0.42 0.00 0.00 52.86 55.25 2wvv s ASN 350 Cb -0.15 -2.57 -0.01 0.00 -1.45 0.00 0.00 41.25 37.07 2wvv s ASN 350 CO 0.07 -0.12 -0.12 -0.36 -3.72 0.00 0.00 177.10 172.85 2wvv s PHE 351 N -1.71 1.06 -0.59 0.43 0.08 0.75 -4.51 117.98 113.48 2wvv s PHE 351 Ca 0.52 -0.26 0.04 0.00 0.12 0.00 0.00 56.93 57.35 2wvv s PHE 351 Cb -0.17 -0.66 0.16 0.00 -0.57 0.00 0.00 43.02 41.78 2wvv s PHE 351 CO 0.22 -0.00 0.39 0.20 -0.10 0.00 0.00 175.22 175.93 2wvv s GLY 352 N -0.63 2.43 0.62 4.36 0.00 -1.25 -1.53 107.32 111.32 2wvv s GLY 352 Ca 0.03 -3.37 -0.18 0.00 0.00 0.00 0.00 44.72 41.19 2wvv s GLY 352 CO 0.00 1.28 1.14 -1.05 0.00 0.00 0.00 173.10 174.47 2wvv n PRO 353 N 2.52 1.05 -0.68 2.90 -0.02 -1.25 -3.89 135.00 135.62 2wvv n PRO 353 Ca 0.17 0.41 -0.31 0.00 -2.02 0.00 0.00 63.50 61.75 2wvv n PRO 353 Cb 0.36 -2.36 0.17 0.00 -0.02 0.00 0.00 33.50 31.66 2wvv n PRO 353 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2wvv s GLN 354 N -3.04 0.93 0.45 -0.52 -0.21 0.14 -4.49 119.66 112.92 2wvv s GLN 354 Ca 0.79 1.54 0.14 0.00 0.02 0.00 0.00 55.36 57.84 2wvv s GLN 354 Cb -0.40 -1.72 1.05 0.00 1.00 0.00 0.00 33.01 32.94 2wvv s GLN 354 CO 0.44 -2.69 2.02 0.00 -2.12 0.00 0.00 175.29 172.95 2wvv h ALA 355 N -1.91 1.98 0.00 6.09 0.00 -1.87 -2.15 119.26 121.40 2wvv h ALA 355 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2wvv h ALA 355 Cb 1.27 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2wvv h ALA 355 CO 0.42 -0.07 0.00 -0.40 0.00 0.00 0.00 179.25 179.19 2wvv n ASP 356 N -4.47 0.00 0.00 0.00 5.68 -1.26 -4.06 116.55 112.44 2wvv n ASP 356 Ca 0.06 -0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.35 2wvv n ASP 356 Cb 0.28 -0.32 0.00 0.00 -1.14 0.00 0.00 41.12 39.94 2wvv n ASP 356 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wvv n GLY 357 N 0.96 0.69 3.99 6.12 0.00 -0.81 -0.46 105.19 115.68 2wvv n GLY 357 Ca 0.11 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.95 2wvv n GLY 357 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wvv s ASP 358 N -2.81 5.43 -0.02 1.61 -1.08 -1.26 -3.96 116.67 114.58 2wvv s ASP 358 Ca 0.00 -0.57 -0.02 0.00 -0.52 0.00 0.00 52.55 51.44 2wvv s ASP 358 Cb 0.00 -0.46 -0.04 0.00 -1.46 0.00 0.00 42.92 40.96 2wvv s ASP 358 CO 0.00 -0.84 0.13 -0.36 0.52 0.00 0.00 175.17 174.62 2wvv s PHE 359 N -2.44 3.44 0.77 -5.34 0.08 -1.26 -0.68 117.98 112.55 2wvv s PHE 359 Ca 0.54 0.31 -0.13 0.00 0.12 0.00 0.00 56.93 57.78 2wvv s PHE 359 Cb -0.08 -1.81 0.06 0.00 -0.57 0.00 0.00 43.02 40.63 2wvv s PHE 359 CO 0.33 0.62 1.15 -0.98 -0.10 0.00 0.00 175.22 176.23 2wvv s ARG 360 N -1.71 2.02 0.36 0.44 1.70 -1.26 -4.80 118.95 115.70 2wvv s ARG 360 Ca 0.23 1.50 0.04 0.00 -0.47 0.00 0.00 55.73 57.03 2wvv s ARG 360 Cb -0.12 -1.84 0.67 0.00 -0.57 0.00 0.00 34.95 33.09 2wvv s ARG 360 CO 0.14 -1.87 1.97 -1.35 -1.08 0.00 0.00 175.30 173.11 2wvv h PRO 361 N -0.81 0.66 -0.71 3.89 0.11 -1.99 -2.03 132.00 131.11 2wvv h PRO 361 Ca -0.45 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 65.54 2wvv h PRO 361 Cb 1.26 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 2wvv h PRO 361 CO 0.49 0.51 0.27 0.93 -0.21 0.00 0.00 178.00 179.99 2wvv h GLU 362 N 0.66 1.05 -0.18 1.05 3.07 -1.99 -1.06 114.58 117.17 2wvv h GLU 362 Ca 0.17 -0.18 -0.18 0.00 -0.50 0.00 0.00 59.36 58.66 2wvv h GLU 362 Cb 0.07 -0.17 -0.00 0.00 -0.84 0.00 0.00 28.75 27.80 2wvv h GLU 362 CO -0.02 0.86 -0.61 0.93 -1.40 0.00 0.00 179.01 178.77 2wvv h GLU 363 N 1.03 0.62 -0.56 2.33 5.08 -1.79 -1.39 114.58 119.90 2wvv h GLU 363 Ca 0.24 -0.43 -0.05 0.00 -1.00 0.00 0.00 59.36 58.12 2wvv h GLU 363 Cb 0.21 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 2wvv h GLU 363 CO -0.02 1.05 0.16 0.87 -1.00 0.00 0.00 179.01 180.07 2wvv h LYS 364 N 0.46 0.89 -0.58 2.33 1.57 -1.09 -1.43 116.57 118.71 2wvv h LYS 364 Ca -0.01 -0.20 -0.03 0.00 -1.87 0.00 0.00 60.65 58.55 2wvv h LYS 364 Cb 1.19 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 33.35 2wvv h LYS 364 CO 0.12 0.81 0.26 0.00 -0.57 0.00 0.00 179.45 180.06 2wvv h ALA 365 N 1.04 0.75 -0.03 3.86 0.00 -1.14 -2.17 119.26 121.57 2wvv h ALA 365 Ca 0.18 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2wvv h ALA 365 Cb 0.30 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2wvv h ALA 365 CO -0.00 0.34 0.02 1.98 0.00 0.00 0.00 179.25 181.58 2wvv h MET 366 N 0.79 0.04 -0.69 0.00 1.85 -1.08 -0.75 114.93 115.09 2wvv h MET 366 Ca 0.20 -0.00 0.02 0.00 -0.61 0.00 0.00 59.70 59.30 2wvv h MET 366 Cb 0.16 -0.01 -0.04 0.00 0.43 0.00 0.00 31.60 32.15 2wvv h MET 366 CO -0.02 0.06 0.45 0.00 -0.40 0.00 0.00 176.91 177.00 2wvv h ALA 367 N 0.97 0.89 -0.37 0.39 0.00 -1.16 0.29 119.26 120.27 2wvv h ALA 367 Ca 0.01 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2wvv h ALA 367 Cb 0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2wvv h ALA 367 CO -0.00 0.25 0.06 1.15 0.00 0.00 0.00 179.25 180.71 2wvv h THR 368 N 0.89 1.24 -0.28 0.00 2.02 -1.27 -0.51 112.91 115.00 2wvv h THR 368 Ca 0.26 -0.86 -0.02 0.00 0.77 0.00 0.00 66.41 66.57 2wvv h THR 368 Cb -0.05 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 2wvv h THR 368 CO -0.08 0.29 0.11 0.00 0.37 0.00 0.00 175.52 176.21 2wvv h ALA 369 N 0.91 0.37 -0.73 6.16 0.00 -0.64 -1.15 119.26 124.19 2wvv h ALA 369 Ca 0.11 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2wvv h ALA 369 Cb 0.37 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2wvv h ALA 369 CO 0.01 -0.03 0.41 0.82 0.00 0.00 0.00 179.25 180.46 2wvv h ILE 370 N 0.31 1.22 -0.83 0.00 2.04 -0.90 -2.83 117.51 116.51 2wvv h ILE 370 Ca 0.09 -0.52 0.02 0.00 1.00 0.00 0.00 64.86 65.45 2wvv h ILE 370 Cb 0.18 0.24 -0.04 0.00 -0.74 0.00 0.00 36.82 36.45 2wvv h ILE 370 CO -0.01 0.23 0.54 1.23 0.00 0.00 0.00 178.15 180.15 2wvv h GLY 371 N 1.00 1.18 1.01 5.37 0.00 -0.59 -0.18 103.07 110.87 2wvv h GLY 371 Ca 0.26 -0.42 -0.05 0.00 0.00 0.00 0.00 47.33 47.11 2wvv h GLY 371 CO -0.04 0.39 0.16 0.50 0.00 0.00 0.00 176.54 177.55 2wvv h LYS 372 N 1.09 0.93 -0.21 4.80 1.57 -1.06 -0.84 116.57 122.85 2wvv h LYS 372 Ca 0.31 -0.22 -0.14 0.00 -1.87 0.00 0.00 60.65 58.74 2wvv h LYS 372 Cb -0.08 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.11 2wvv h LYS 372 CO -0.09 0.85 -0.41 2.35 -0.57 0.00 0.00 179.45 181.58 2wvv h TRP 373 N 0.85 0.83 -0.46 -1.35 7.01 -1.22 -3.11 115.95 118.49 2wvv h TRP 373 Ca 0.19 -0.30 -0.01 0.00 2.11 0.00 0.00 58.89 60.87 2wvv h TRP 373 Cb 0.33 -0.16 -0.02 0.00 -2.10 0.00 0.00 29.16 27.21 2wvv h TRP 373 CO 0.02 1.07 0.23 0.52 -2.79 0.00 0.00 178.44 177.49 2wvv h MET 374 N 0.36 0.63 -0.30 2.65 2.86 -0.92 0.22 114.93 120.43 2wvv h MET 374 Ca 0.01 -0.07 -0.06 0.00 -2.06 0.00 0.00 59.70 57.52 2wvv h MET 374 Cb 1.02 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.53 2wvv h MET 374 CO 0.09 0.48 -0.08 -0.97 1.06 0.00 0.00 176.91 177.50 2wvv h ASN 375 N 0.64 0.46 0.19 1.22 -1.24 -1.11 0.20 115.58 115.93 2wvv h ASN 375 Ca 0.16 -0.10 -0.34 0.00 0.71 0.00 0.00 56.30 56.72 2wvv h ASN 375 Cb 0.05 -0.12 0.01 0.00 0.73 0.00 0.00 38.32 38.99 2wvv h ASN 375 CO -0.02 0.59 -1.69 -0.09 -1.29 0.00 0.00 177.43 174.92 2wvv h ARG 376 N 0.45 0.40 -0.01 6.67 2.43 -1.26 -3.41 114.38 119.65 2wvv h ARG 376 Ca 0.09 -0.69 0.00 0.00 -0.81 0.00 0.00 59.98 58.57 2wvv h ARG 376 Cb 0.42 0.26 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2wvv h ARG 376 CO 0.02 1.33 0.00 0.66 -1.51 0.00 0.00 179.97 180.47 2wvv n TYR 377 N -3.64 0.01 0.33 2.20 4.01 0.69 -4.76 117.16 116.00 2wvv n TYR 377 Ca -0.24 -0.10 0.22 0.00 -0.16 0.00 0.00 57.90 57.62 2wvv n TYR 377 Cb 1.06 -0.01 1.16 0.00 -0.31 0.00 0.00 39.34 41.24 2wvv n TYR 377 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2wvv h GLY 378 N 0.33 0.00 1.79 2.72 0.00 -0.75 -1.20 103.07 105.97 2wvv h GLY 378 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.35 2wvv h GLY 378 CO 0.00 0.00 0.08 1.70 0.00 0.00 0.00 176.54 178.32 2wvv h LYS 379 N 0.00 0.00 -0.01 4.80 3.64 -1.86 0.26 116.57 123.41 2wvv h LYS 379 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2wvv h LYS 379 Cb 0.06 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2wvv h LYS 379 CO 0.00 0.00 -0.05 0.00 -2.27 0.00 0.00 179.45 177.13 2wvv n ALA 380 N -2.41 2.69 0.01 5.00 0.00 -0.45 -4.47 120.51 120.89 2wvv n ALA 380 Ca -0.01 -0.32 -0.02 0.00 0.00 0.00 0.00 53.44 53.09 2wvv n ALA 380 Cb 0.18 -1.31 -0.01 0.00 0.00 0.00 0.00 19.45 18.32 2wvv n ALA 380 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wvv n VAL 381 N -0.53 1.09 -1.86 0.00 0.31 -0.10 -4.78 118.33 112.47 2wvv n VAL 381 Ca 0.19 0.31 -0.42 0.00 -0.01 0.00 0.00 64.34 64.41 2wvv n VAL 381 Cb 0.26 -1.67 -0.02 0.00 -0.91 0.00 0.00 33.84 31.50 2wvv n VAL 381 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 2wvv s TYR 382 N -2.03 2.88 -1.92 3.52 2.02 -0.18 -1.95 117.35 119.71 2wvv s TYR 382 Ca -0.06 0.78 0.00 0.00 -0.37 0.00 0.00 57.07 57.42 2wvv s TYR 382 Cb 0.01 -3.99 0.00 0.00 -0.40 0.00 0.00 41.96 37.58 2wvv s TYR 382 CO 0.09 -3.40 0.00 0.00 -1.57 0.00 0.00 175.55 170.67 2wvv n ALA 383 N 2.66 -0.47 -2.27 3.71 0.00 -0.41 -4.86 120.51 118.87 2wvv n ALA 383 Ca 0.09 0.24 -0.20 0.00 0.00 0.00 0.00 53.44 53.58 2wvv n ALA 383 Cb 0.38 -2.05 -0.02 0.00 0.00 0.00 0.00 19.45 17.76 2wvv n ALA 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wvv s ASP 385 N -4.14 0.47 0.23 0.00 -1.08 -0.16 -4.91 116.67 107.08 2wvv s ASP 385 Ca 0.47 -1.35 -0.32 0.00 -0.52 0.00 0.00 52.55 50.83 2wvv s ASP 385 Cb -0.06 0.79 -0.12 0.00 -1.46 0.00 0.00 42.92 42.07 2wvv s ASP 385 CO 0.29 -1.56 1.62 0.00 0.52 0.00 0.00 175.17 176.03 2wvv n TYR 386 N -0.56 2.60 0.48 -5.34 9.36 -1.23 -0.32 117.16 122.15 2wvv n TYR 386 Ca -0.05 0.20 0.11 0.00 3.32 0.00 0.00 57.90 61.49 2wvv n TYR 386 Cb 0.61 -2.60 0.04 0.00 -0.63 0.00 0.00 39.34 36.76 2wvv n TYR 386 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2wvv n ALA 387 N 3.06 3.15 -1.53 2.98 0.00 -1.26 -4.59 120.51 122.32 2wvv n ALA 387 Ca 0.13 -0.35 -0.08 0.00 0.00 0.00 0.00 53.44 53.14 2wvv n ALA 387 Cb 0.34 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.74 2wvv n ALA 387 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wvv n GLY 388 N 1.33 0.70 3.80 0.00 0.00 -1.26 -4.98 105.19 104.77 2wvv n GLY 388 Ca 0.02 -0.64 -0.31 0.00 0.00 0.00 0.00 46.02 45.09 2wvv n GLY 388 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wvv s PHE 389 N -2.33 3.26 0.22 1.61 0.40 -1.26 -4.70 117.98 115.16 2wvv s PHE 389 Ca 0.00 0.13 -0.32 0.00 -0.60 0.00 0.00 56.93 56.14 2wvv s PHE 389 Cb 0.00 -1.67 -0.12 0.00 0.51 0.00 0.00 43.02 41.75 2wvv s PHE 389 CO 0.00 0.54 1.70 -2.00 0.70 0.00 0.00 175.22 176.15 2wvv s GLU 390 N -2.25 4.13 0.29 0.44 2.12 -1.26 -4.92 118.70 117.25 2wvv s GLU 390 Ca 0.28 2.59 -0.30 0.00 0.36 0.00 0.00 54.97 57.90 2wvv s GLU 390 Cb -0.12 -3.07 -0.12 0.00 0.26 0.00 0.00 34.13 31.07 2wvv s GLU 390 CO 0.21 -0.73 1.52 1.17 -0.54 0.00 0.00 175.26 176.89 2wvv n LYS 391 N 3.77 2.49 -4.49 4.30 3.00 -1.26 -4.81 118.16 121.16 2wvv n LYS 391 Ca 0.15 0.89 -0.25 0.00 -0.00 0.00 0.00 58.31 59.10 2wvv n LYS 391 Cb 0.36 -2.62 -0.10 0.00 0.00 0.00 0.00 35.03 32.66 2wvv n LYS 391 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 2wvv s GLN 392 N -0.67 1.76 0.51 1.64 -1.52 -1.26 -5.07 119.66 115.05 2wvv s GLN 392 Ca 0.64 -1.83 0.30 0.00 -1.95 0.00 0.00 55.36 52.52 2wvv s GLN 392 Cb -0.54 -1.76 1.04 0.00 -0.22 0.00 0.00 33.01 31.54 2wvv s GLN 392 CO 0.51 0.25 1.87 -0.44 -0.25 0.00 0.00 175.29 177.22 2wvv h ASP 393 N 2.15 0.00 1.11 5.90 3.32 -1.95 -3.17 116.42 123.78 2wvv h ASP 393 Ca -0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.64 2wvv h ASP 393 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 2wvv h ASP 393 CO 0.64 0.03 0.00 4.11 -1.72 0.00 0.00 179.24 182.30 2wvv h TRP 394 N 0.00 0.00 0.00 4.55 5.08 -1.95 -3.42 115.95 120.21 2wvv h TRP 394 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2wvv h TRP 394 Cb 0.67 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.83 2wvv h TRP 394 CO 0.00 0.00 0.00 0.41 -1.28 0.00 0.00 178.44 177.57 2wvv n GLY 395 N 0.40 -0.25 3.18 11.11 0.00 -1.20 -0.14 105.19 118.30 2wvv n GLY 395 Ca 0.03 -0.61 -0.20 0.00 0.00 0.00 0.00 46.02 45.23 2wvv n GLY 395 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wvv s TYR 396 N -3.47 1.35 0.08 1.61 2.02 -0.42 -4.42 117.35 114.09 2wvv s TYR 396 Ca 0.00 -0.41 -0.10 0.00 -0.37 0.00 0.00 57.07 56.20 2wvv s TYR 396 Cb 0.00 -0.77 -0.06 0.00 -0.40 0.00 0.00 41.96 40.73 2wvv s TYR 396 CO 0.00 0.07 0.39 0.71 -1.57 0.00 0.00 175.55 175.16 2wvv s TYR 397 N -1.06 3.58 0.12 2.71 2.02 -1.26 -0.37 117.35 123.09 2wvv s TYR 397 Ca 0.01 0.78 0.05 0.00 -0.37 0.00 0.00 57.07 57.54 2wvv s TYR 397 Cb -0.09 -2.15 -0.04 0.00 -0.40 0.00 0.00 41.96 39.28 2wvv s TYR 397 CO 0.02 0.52 -0.12 0.95 -1.57 0.00 0.00 175.55 175.35 2wvv s THR 398 N -1.40 1.22 -0.13 -0.71 -4.23 -0.52 -4.41 115.64 105.46 2wvv s THR 398 Ca 0.33 -1.77 0.00 0.00 -1.18 0.00 0.00 61.69 59.07 2wvv s THR 398 Cb -0.14 -1.56 -0.01 0.00 1.34 0.00 0.00 72.50 72.13 2wvv s THR 398 CO 0.18 -0.51 -0.14 -0.60 -0.54 0.00 0.00 174.62 173.00 2wvv s ARG 399 N -2.91 3.31 0.87 3.99 3.52 0.57 -0.55 118.95 127.75 2wvv s ARG 399 Ca 0.10 -0.72 -0.11 0.00 -0.13 0.00 0.00 55.73 54.87 2wvv s ARG 399 Cb -0.03 -2.61 0.16 0.00 -1.56 0.00 0.00 34.95 30.92 2wvv s ARG 399 CO 0.02 0.15 1.20 0.20 -0.81 0.00 0.00 175.30 176.06 2wvv s GLY 400 N 0.48 1.76 0.04 8.12 0.00 0.04 -0.99 107.32 116.76 2wvv s GLY 400 Ca -0.10 -1.29 0.23 0.00 0.00 0.00 0.00 44.72 43.55 2wvv s GLY 400 CO 0.05 -0.63 1.72 0.28 0.00 0.00 0.00 173.10 174.52 2wvv n LYS 401 N -3.42 0.04 -0.63 2.90 5.02 -1.26 -2.56 118.16 118.26 2wvv n LYS 401 Ca 0.14 0.15 0.02 0.00 -2.02 0.00 0.00 58.31 56.60 2wvv n LYS 401 Cb 0.60 -1.55 0.20 0.00 -0.02 0.00 0.00 35.03 34.26 2wvv n LYS 401 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2wvv n ASN 402 N -1.62 2.28 -0.43 4.39 4.13 -1.26 -4.95 115.26 117.80 2wvv n ASN 402 Ca 0.05 -3.70 -0.06 0.00 1.68 0.00 0.00 54.58 52.56 2wvv n ASN 402 Cb 0.27 -0.57 -0.02 0.00 -1.54 0.00 0.00 39.78 37.92 2wvv n ASN 402 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 2wvv n ASP 403 N -1.11 -4.18 -4.75 6.41 8.00 -1.06 -5.01 116.55 114.85 2wvv n ASP 403 Ca 0.25 0.14 -0.41 0.00 0.71 0.00 0.00 54.79 55.48 2wvv n ASP 403 Cb 0.85 -2.17 -0.02 0.00 -0.02 0.00 0.00 41.12 39.77 2wvv n ASP 403 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2wvv s GLU 404 N -2.04 4.17 -0.24 -1.24 8.01 -1.26 -4.60 118.70 121.49 2wvv s GLU 404 Ca 0.00 2.48 -0.04 0.00 0.01 0.00 0.00 54.97 57.42 2wvv s GLU 404 Cb 0.00 -3.04 0.00 0.00 -4.31 0.00 0.00 34.13 26.78 2wvv s GLU 404 CO 0.00 -0.54 -0.02 0.08 0.01 0.00 0.00 175.26 174.79 2wvv s VAL 405 N -0.24 3.35 -0.12 2.63 1.01 -1.10 -0.78 120.40 125.16 2wvv s VAL 405 Ca 0.60 -0.67 -0.07 0.00 0.00 0.00 0.00 61.98 61.84 2wvv s VAL 405 Cb -0.46 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.27 2wvv s VAL 405 CO 0.49 0.30 0.12 -0.31 0.00 0.00 0.00 175.10 175.70 2wvv s TYR 406 N 1.44 3.53 -0.24 5.22 2.02 0.29 -0.04 117.35 129.57 2wvv s TYR 406 Ca 0.04 0.47 -0.07 0.00 -0.37 0.00 0.00 57.07 57.14 2wvv s TYR 406 Cb -0.15 -1.94 -0.03 0.00 -0.40 0.00 0.00 41.96 39.44 2wvv s TYR 406 CO -0.03 0.67 0.05 -1.64 -1.57 0.00 0.00 175.55 173.03 2wvv s MET 407 N -0.90 3.62 -0.32 -0.62 -1.94 0.44 -1.44 119.30 118.14 2wvv s MET 407 Ca 0.14 -0.50 -0.06 0.00 -1.71 0.00 0.00 55.69 53.57 2wvv s MET 407 Cb -0.12 -3.27 0.03 0.00 2.01 0.00 0.00 34.83 33.49 2wvv s MET 407 CO 0.03 -0.17 0.08 0.08 -0.01 0.00 0.00 175.02 175.03 2wvv s VAL 408 N 1.54 3.69 -0.31 -6.03 1.01 0.50 -1.05 120.40 119.76 2wvv s VAL 408 Ca 0.06 -1.05 -0.13 0.00 0.00 0.00 0.00 61.98 60.86 2wvv s VAL 408 Cb -0.15 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 2wvv s VAL 408 CO 0.03 -0.09 0.25 -0.69 0.00 0.00 0.00 175.10 174.60 2wvv s VAL 409 N 1.40 5.27 -0.05 2.92 1.01 0.32 -1.30 120.40 129.98 2wvv s VAL 409 Ca -0.01 0.06 0.15 0.00 0.00 0.00 0.00 61.98 62.18 2wvv s VAL 409 Cb -0.19 -3.66 -0.23 0.00 0.00 0.00 0.00 36.38 32.31 2wvv s VAL 409 CO 0.02 0.10 0.27 0.49 0.00 0.00 0.00 175.10 175.98 2wvv n PHE 410 N 5.15 0.00 -3.83 5.22 3.72 0.80 -2.30 117.46 126.23 2wvv n PHE 410 Ca -0.12 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 56.99 2wvv n PHE 410 Cb 0.51 -0.46 -0.16 0.00 -0.94 0.00 0.00 39.48 38.43 2wvv n PHE 410 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 2wvv s ASN 411 N -4.08 3.58 -0.32 4.37 0.01 -0.33 -4.90 114.94 113.27 2wvv s ASN 411 Ca -0.06 -1.18 -0.28 0.00 -0.71 0.00 0.00 52.86 50.63 2wvv s ASN 411 Cb 0.09 -0.92 0.02 0.00 0.41 0.00 0.00 41.25 40.84 2wvv s ASN 411 CO 0.65 -0.30 1.04 -1.58 -1.51 0.00 0.00 177.10 175.39 2wvv s GLN 412 N 1.59 4.05 0.17 -0.60 2.00 -1.26 -4.39 119.66 121.22 2wvv s GLN 412 Ca -0.00 1.00 -0.30 0.00 -2.00 0.00 0.00 55.36 54.06 2wvv s GLN 412 Cb -0.18 -3.74 -0.08 0.00 0.80 0.00 0.00 33.01 29.81 2wvv s GLN 412 CO -0.11 -0.87 1.29 -1.25 -0.50 0.00 0.00 175.29 173.85 2wvv s PRO 413 N 3.56 4.40 0.56 1.67 0.04 -1.26 -4.91 135.00 139.07 2wvv s PRO 413 Ca 0.44 2.00 0.28 0.00 0.04 0.00 0.00 61.00 63.76 2wvv s PRO 413 Cb -0.12 -3.22 1.67 0.00 0.04 0.00 0.00 34.50 32.87 2wvv s PRO 413 CO 0.15 -0.25 2.20 1.88 0.04 0.00 0.00 177.00 181.02 2wvv h TYR 414 N 5.64 0.00 0.00 0.56 0.05 -1.95 -1.52 116.97 119.75 2wvv h TYR 414 Ca -0.44 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.34 2wvv h TYR 414 Cb 1.21 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.95 2wvv h TYR 414 CO 0.63 0.04 0.00 -1.13 -1.05 0.00 0.00 178.16 176.65 2wvv n SER 415 N -3.85 0.14 -1.33 3.88 3.41 -1.26 -4.85 113.62 109.76 2wvv n SER 415 Ca -0.03 0.54 -0.17 0.00 -0.26 0.00 0.00 58.87 58.96 2wvv n SER 415 Cb 0.13 -0.57 -0.07 0.00 -0.26 0.00 0.00 64.21 63.43 2wvv n SER 415 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2wvv n GLU 416 N -1.67 -1.55 -4.29 4.33 1.02 -0.57 -4.96 120.64 112.95 2wvv n GLU 416 Ca 0.02 1.11 -0.21 0.00 -0.02 0.00 0.00 57.16 58.05 2wvv n GLU 416 Cb 0.12 -5.51 -0.16 0.00 -0.02 0.00 0.00 31.44 25.86 2wvv n GLU 416 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2wvv s ARG 417 N -3.46 1.11 -0.31 3.49 0.52 -1.26 -2.16 118.95 116.88 2wvv s ARG 417 Ca 0.00 -0.20 -0.10 0.00 -0.52 0.00 0.00 55.73 54.91 2wvv s ARG 417 Cb 0.00 -1.02 -0.01 0.00 0.52 0.00 0.00 34.95 34.44 2wvv s ARG 417 CO 0.00 -0.05 0.15 -0.51 0.02 0.00 0.00 175.30 174.91 2wvv s LEU 418 N 0.84 4.07 0.06 2.53 1.43 0.17 -4.82 118.68 122.97 2wvv s LEU 418 Ca -0.12 -0.49 -0.31 0.00 -1.03 0.00 0.00 54.13 52.18 2wvv s LEU 418 Cb -0.15 -2.00 -0.06 0.00 0.03 0.00 0.00 46.19 44.01 2wvv s LEU 418 CO 0.01 -0.18 1.19 -0.63 0.23 0.00 0.00 176.35 176.97 2wvv s ILE 419 N 1.62 4.07 -0.23 -0.59 1.01 -1.26 -1.10 121.20 124.72 2wvv s ILE 419 Ca 0.05 1.49 0.01 0.00 0.00 0.00 0.00 60.65 62.19 2wvv s ILE 419 Cb -0.17 -3.95 0.05 0.00 0.01 0.00 0.00 42.46 38.40 2wvv s ILE 419 CO 0.06 0.12 -0.08 -0.69 0.00 0.00 0.00 174.94 174.35 2wvv s VAL 420 N 1.04 1.68 -0.27 2.92 1.01 0.33 -4.90 120.40 122.21 2wvv s VAL 420 Ca 0.58 -1.22 -0.10 0.00 0.00 0.00 0.00 61.98 61.25 2wvv s VAL 420 Cb -0.29 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 2wvv s VAL 420 CO 0.29 0.01 0.15 -0.75 0.00 0.00 0.00 175.10 174.80 2wvv s LYS 421 N 1.34 3.87 0.27 2.72 2.47 -1.26 -0.43 119.74 128.72 2wvv s LYS 421 Ca -0.05 -0.36 -0.04 0.00 -1.56 0.00 0.00 55.97 53.96 2wvv s LYS 421 Cb -0.18 -3.55 -0.05 0.00 -1.46 0.00 0.00 37.83 32.59 2wvv s LYS 421 CO -0.07 -0.16 0.51 0.95 0.16 0.00 0.00 175.35 176.74 2wvv s THR 422 N 1.65 5.08 0.90 3.43 -4.23 0.05 -4.20 115.64 118.32 2wvv s THR 422 Ca 0.07 -0.08 -0.11 0.00 -1.18 0.00 0.00 61.69 60.38 2wvv s THR 422 Cb -0.16 -3.74 0.13 0.00 1.34 0.00 0.00 72.50 70.08 2wvv s THR 422 CO 0.08 -0.29 1.09 -2.84 -0.54 0.00 0.00 174.62 172.13 2wvv s PRO 423 N -3.51 1.25 0.24 3.99 0.02 -1.26 -4.90 135.00 130.83 2wvv s PRO 423 Ca 0.42 0.84 -0.31 0.00 0.02 0.00 0.00 61.00 61.97 2wvv s PRO 423 Cb -0.11 -1.81 -0.13 0.00 0.02 0.00 0.00 34.50 32.48 2wvv s PRO 423 CO 0.30 -2.25 1.46 0.36 -0.33 0.00 0.00 177.00 176.54 2wvv n LYS 424 N -3.89 2.19 -0.99 5.54 0.00 -1.26 -2.10 118.16 117.64 2wvv n LYS 424 Ca 0.07 0.78 0.00 0.00 -0.00 0.00 0.00 58.31 59.16 2wvv n LYS 424 Cb 0.55 -2.47 0.00 0.00 -0.00 0.00 0.00 35.03 33.11 2wvv n LYS 424 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2wvv n GLY 425 N 2.27 0.77 3.45 2.58 0.00 -1.26 -4.97 105.19 108.03 2wvv n GLY 425 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 2wvv n GLY 425 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wvv s ILE 426 N -3.09 3.38 0.18 -0.61 -1.09 -0.89 -0.21 121.20 118.86 2wvv s ILE 426 Ca 0.00 -0.56 0.11 0.00 -2.23 0.00 0.00 60.65 57.97 2wvv s ILE 426 Cb 0.00 -2.42 -0.04 0.00 -1.58 0.00 0.00 42.46 38.41 2wvv s ILE 426 CO 0.00 0.53 -0.23 0.42 -1.23 0.00 0.00 174.94 174.43 2wvv s THR 427 N 0.07 2.24 -0.39 2.92 -4.23 -0.28 -4.70 115.64 111.27 2wvv s THR 427 Ca -0.03 -1.97 -0.15 0.00 -1.18 0.00 0.00 61.69 58.35 2wvv s THR 427 Cb -0.14 -2.05 0.01 0.00 1.34 0.00 0.00 72.50 71.66 2wvv s THR 427 CO 0.04 -0.12 0.35 -0.69 -0.54 0.00 0.00 174.62 173.66 2wvv s VAL 428 N -1.64 5.19 -0.06 2.29 1.01 -1.26 -1.30 120.40 124.63 2wvv s VAL 428 Ca 0.19 -0.33 -0.03 0.00 0.00 0.00 0.00 61.98 61.81 2wvv s VAL 428 Cb -0.08 -3.91 -0.27 0.00 0.00 0.00 0.00 36.38 32.12 2wvv s VAL 428 CO 0.09 -0.25 0.61 -0.33 0.00 0.00 0.00 175.10 175.22 2wvv h GLU 429 N 8.60 0.24 -2.94 2.72 4.39 -1.19 -3.49 114.58 122.92 2wvv h GLU 429 Ca -0.28 -0.41 -0.07 0.00 0.34 0.00 0.00 59.36 58.93 2wvv h GLU 429 Cb 1.13 0.15 -0.17 0.00 -0.10 0.00 0.00 28.75 29.77 2wvv h GLU 429 CO 0.73 1.09 -0.06 0.21 -1.16 0.00 0.00 179.01 179.81 2wvv s LYS 430 N -2.59 0.95 -0.01 2.33 2.20 -1.15 -4.98 119.74 116.49 2wvv s LYS 430 Ca -0.14 -0.31 0.03 0.00 -0.36 0.00 0.00 55.97 55.18 2wvv s LYS 430 Cb 0.07 0.43 -0.01 0.00 -1.51 0.00 0.00 37.83 36.81 2wvv s LYS 430 CO 0.82 -0.33 -0.08 0.00 -0.36 0.00 0.00 175.35 175.40 2wvv s ALA 431 N -2.42 0.69 -0.03 3.13 0.00 -1.26 -1.18 121.76 120.69 2wvv s ALA 431 Ca -0.06 -0.35 -0.01 0.00 0.00 0.00 0.00 51.96 51.54 2wvv s ALA 431 Cb -0.01 -0.18 0.03 0.00 0.00 0.00 0.00 23.12 22.96 2wvv s ALA 431 CO -0.02 0.17 0.06 0.99 0.00 0.00 0.00 175.76 176.96 2wvv s THR 432 N -0.18 -0.04 -0.13 0.00 2.01 -0.48 -0.96 115.64 115.85 2wvv s THR 432 Ca 0.03 0.16 -0.29 0.00 0.31 0.00 0.00 61.69 61.90 2wvv s THR 432 Cb -0.03 -0.11 -0.03 0.00 0.01 0.00 0.00 72.50 72.33 2wvv s THR 432 CO -0.00 0.07 1.51 -0.22 -0.69 0.00 0.00 174.62 175.29 2wvv s LEU 433 N 0.88 4.17 0.20 4.42 2.96 -0.30 0.22 118.68 131.23 2wvv s LEU 433 Ca -0.07 1.89 -0.11 0.00 -0.22 0.00 0.00 54.13 55.62 2wvv s LEU 433 Cb -0.10 -3.53 0.25 0.00 0.50 0.00 0.00 46.19 43.31 2wvv s LEU 433 CO -0.03 -0.96 1.70 0.25 -1.32 0.00 0.00 176.35 175.99 2wvv h LEU 434 N 10.43 -0.05 -0.69 -0.68 5.85 -1.71 0.18 115.31 128.64 2wvv h LEU 434 Ca -0.34 0.11 -0.13 0.00 0.84 0.00 0.00 57.88 58.37 2wvv h LEU 434 Cb 1.15 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.33 2wvv h LEU 434 CO 0.97 -0.01 -0.35 0.71 -0.34 0.00 0.00 178.44 179.42 2wvv h THR 435 N 0.22 1.29 0.00 1.05 1.35 -1.89 -3.34 112.91 111.59 2wvv h THR 435 Ca 0.29 -1.49 0.00 0.00 -0.55 0.00 0.00 66.41 64.66 2wvv h THR 435 Cb 0.43 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 68.30 2wvv h THR 435 CO -0.40 0.48 -0.76 0.35 -0.25 0.00 0.00 175.52 174.94 2wvv n THR 436 N -4.06 0.00 -0.94 6.82 -2.24 -1.09 -5.00 114.28 107.78 2wvv n THR 436 Ca -0.01 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 2wvv n THR 436 Cb 0.49 0.75 0.00 0.00 -2.10 0.00 0.00 70.33 69.47 2wvv n THR 436 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wvv n GLY 437 N 1.49 0.46 3.67 3.38 0.00 0.61 -5.00 105.19 109.79 2wvv n GLY 437 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.57 2wvv n GLY 437 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2wvv n GLU 438 N -1.83 2.05 -2.44 1.61 2.13 -1.25 -4.71 120.64 116.20 2wvv n GLU 438 Ca 0.00 0.73 -0.40 0.00 0.66 0.00 0.00 57.16 58.15 2wvv n GLU 438 Cb 0.10 -2.44 -0.04 0.00 0.27 0.00 0.00 31.44 29.33 2wvv n GLU 438 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2wvv s ASP 439 N 0.59 7.21 -0.10 4.31 2.15 -1.26 -1.15 116.67 128.42 2wvv s ASP 439 Ca 0.74 2.30 0.04 0.00 0.43 0.00 0.00 52.55 56.06 2wvv s ASP 439 Cb -0.68 -2.63 -0.00 0.00 -0.30 0.00 0.00 42.92 39.31 2wvv s ASP 439 CO 0.44 -0.19 -0.23 -0.63 -0.17 0.00 0.00 175.17 174.39 2wvv s ILE 440 N -1.07 2.15 0.19 4.11 -1.09 -0.14 -4.89 121.20 120.45 2wvv s ILE 440 Ca 0.45 -1.00 -0.31 0.00 -2.23 0.00 0.00 60.65 57.57 2wvv s ILE 440 Cb -0.33 -1.82 -0.10 0.00 -1.58 0.00 0.00 42.46 38.64 2wvv s ILE 440 CO 0.42 0.56 1.46 -0.89 -1.23 0.00 0.00 174.94 175.26 2wvv s THR 441 N 0.26 2.82 -0.12 2.92 2.01 -1.26 -4.14 115.64 118.13 2wvv s THR 441 Ca -0.16 0.63 0.02 0.00 0.31 0.00 0.00 61.69 62.49 2wvv s THR 441 Cb -0.17 -3.40 -0.00 0.00 0.01 0.00 0.00 72.50 68.93 2wvv s THR 441 CO 0.08 0.07 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.20 2wvv s VAL 442 N 0.62 2.41 -0.11 3.82 1.01 -1.26 -1.06 120.40 125.83 2wvv s VAL 442 Ca 0.64 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.76 2wvv s VAL 442 Cb -0.41 -1.97 0.01 0.00 0.00 0.00 0.00 36.38 34.01 2wvv s VAL 442 CO 0.36 0.54 -0.17 -0.69 0.00 0.00 0.00 175.10 175.14 2wvv s VAL 443 N 0.48 1.61 -0.09 2.92 1.01 -0.20 -4.99 120.40 121.13 2wvv s VAL 443 Ca -0.13 -0.72 -0.30 0.00 0.00 0.00 0.00 61.98 60.84 2wvv s VAL 443 Cb -0.17 -1.46 -0.02 0.00 0.00 0.00 0.00 36.38 34.73 2wvv s VAL 443 CO 0.05 0.46 1.08 -0.70 0.00 0.00 0.00 175.10 175.99 2wvv s GLU 444 N 0.92 4.39 -0.19 2.72 2.12 -1.26 -0.18 118.70 127.22 2wvv s GLU 444 Ca -0.07 1.49 0.09 0.00 0.36 0.00 0.00 54.97 56.83 2wvv s GLU 444 Cb -0.15 -3.55 -0.17 0.00 0.26 0.00 0.00 34.13 30.51 2wvv s GLU 444 CO -0.01 -0.38 -0.06 0.25 -0.54 0.00 0.00 175.26 174.53 2wvv n THR 445 N 4.61 1.17 -3.00 -1.70 -2.24 0.24 -4.93 114.28 108.43 2wvv n THR 445 Ca 0.10 -0.59 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 2wvv n THR 445 Cb 0.48 -0.88 0.00 0.00 -2.10 0.00 0.00 70.33 67.83 2wvv n THR 445 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2wvv n THR 446 N -2.85 0.00 -1.66 4.28 5.66 -1.16 -5.04 114.28 113.52 2wvv n THR 446 Ca -0.32 0.00 -0.45 0.00 -3.05 0.00 0.00 64.05 60.23 2wvv n THR 446 Cb 0.97 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.72 2wvv n THR 446 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 2wvv n ARG 447 N 0.00 2.47 -2.64 1.09 0.63 -1.26 -1.99 116.66 114.96 2wvv n ARG 447 Ca 0.00 0.89 -0.21 0.00 -0.92 0.00 0.00 57.85 57.61 2wvv n ARG 447 Cb 0.00 -2.87 0.01 0.00 0.45 0.00 0.00 32.46 30.04 2wvv n ARG 447 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 2wvv n ASN 448 N 7.65 -5.79 -3.81 6.15 4.13 -1.26 -4.96 115.26 117.36 2wvv n ASN 448 Ca 0.23 -0.10 -0.13 0.00 1.68 0.00 0.00 54.58 56.25 2wvv n ASN 448 Cb 0.36 -4.78 -0.14 0.00 -1.54 0.00 0.00 39.78 33.69 2wvv n ASN 448 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 2wvv s GLU 449 N -5.30 0.09 0.06 3.52 2.12 -0.84 -0.77 118.70 117.58 2wvv s GLU 449 Ca 0.11 0.21 0.03 0.00 0.36 0.00 0.00 54.97 55.69 2wvv s GLU 449 Cb -0.05 -0.04 -0.03 0.00 0.26 0.00 0.00 34.13 34.27 2wvv s GLU 449 CO 0.14 -0.07 -0.11 0.71 -0.54 0.00 0.00 175.26 175.39 2wvv s TYR 450 N 0.47 0.91 -0.27 5.30 2.02 0.43 -0.59 117.35 125.62 2wvv s TYR 450 Ca -0.03 -0.49 -0.11 0.00 -0.37 0.00 0.00 57.07 56.07 2wvv s TYR 450 Cb -0.05 -0.53 -0.05 0.00 -0.40 0.00 0.00 41.96 40.94 2wvv s TYR 450 CO -0.02 -0.02 0.20 -0.80 -1.57 0.00 0.00 175.55 173.34 2wvv s ASN 451 N -1.67 6.07 -0.26 2.29 0.01 0.75 -0.52 114.94 121.61 2wvv s ASN 451 Ca -0.06 0.05 -0.11 0.00 -0.71 0.00 0.00 52.86 52.03 2wvv s ASN 451 Cb -0.10 -2.13 -0.05 0.00 0.41 0.00 0.00 41.25 39.39 2wvv s ASN 451 CO 0.01 -0.04 0.19 -0.69 -1.51 0.00 0.00 177.10 175.06 2wvv s VAL 452 N 1.63 5.32 0.54 1.60 1.01 -0.26 -1.04 120.40 129.21 2wvv s VAL 452 Ca 0.08 0.21 -0.21 0.00 0.00 0.00 0.00 61.98 62.06 2wvv s VAL 452 Cb -0.15 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 2wvv s VAL 452 CO 0.09 0.29 1.24 -0.44 0.00 0.00 0.00 175.10 176.28 2wvv s SER 453 N 1.41 5.51 0.71 3.32 0.01 -0.22 0.45 113.70 124.89 2wvv s SER 453 Ca 0.08 2.47 -0.13 0.00 1.31 0.00 0.00 55.95 59.68 2wvv s SER 453 Cb -0.15 -2.61 0.02 0.00 0.21 0.00 0.00 66.02 63.50 2wvv s SER 453 CO 0.08 -1.38 1.10 0.68 0.41 0.00 0.00 173.24 174.13 2wvv s VAL 454 N -1.50 3.32 0.67 3.43 -7.23 -0.92 -4.77 120.40 113.40 2wvv s VAL 454 Ca 0.72 0.52 -0.17 0.00 -1.81 0.00 0.00 61.98 61.24 2wvv s VAL 454 Cb -0.33 -3.03 -0.01 0.00 0.56 0.00 0.00 36.38 33.57 2wvv s VAL 454 CO 0.37 -0.47 1.13 -2.65 -0.31 0.00 0.00 175.10 173.18 2wvv n PRO 455 N -2.92 0.85 -0.29 4.82 -0.02 -1.26 -4.90 135.00 131.28 2wvv n PRO 455 Ca 0.10 0.34 0.05 0.00 -2.02 0.00 0.00 63.50 61.97 2wvv n PRO 455 Cb 0.52 -2.36 0.20 0.00 -0.02 0.00 0.00 33.50 31.84 2wvv n PRO 455 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2wvv h LYS 456 N 0.23 0.65 -5.13 -0.52 3.64 -1.96 -3.38 116.57 110.11 2wvv h LYS 456 Ca -0.49 -0.04 -0.64 0.00 -1.27 0.00 0.00 60.65 58.21 2wvv h LYS 456 Cb 1.34 -0.15 -0.23 0.00 -0.41 0.00 0.00 32.23 32.79 2wvv h LYS 456 CO 0.50 0.43 -0.66 0.15 -2.27 0.00 0.00 179.45 177.61 2wvv s LYS 457 N -6.00 3.63 -0.03 1.90 1.02 -1.26 -5.07 119.74 113.93 2wvv s LYS 457 Ca -0.12 -0.51 -0.32 0.00 0.02 0.00 0.00 55.97 55.03 2wvv s LYS 457 Cb 0.21 -3.08 -0.10 0.00 -0.52 0.00 0.00 37.83 34.33 2wvv s LYS 457 CO 0.78 0.02 1.94 -1.71 -0.92 0.00 0.00 175.35 175.46 2wvv n ASN 458 N 4.22 3.79 0.32 2.83 2.85 -1.26 -4.84 115.26 123.17 2wvv n ASN 458 Ca -0.17 0.92 0.22 0.00 -0.11 0.00 0.00 54.58 55.44 2wvv n ASN 458 Cb 0.52 -1.45 1.14 0.00 1.24 0.00 0.00 39.78 41.23 2wvv n ASN 458 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2wvv h PRO 459 N 10.02 0.00 -0.39 1.20 0.11 -1.97 -3.46 132.00 137.51 2wvv h PRO 459 Ca -0.49 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.45 2wvv h PRO 459 Cb 1.26 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.30 2wvv h PRO 459 CO 0.95 0.00 -0.15 0.41 -0.21 0.00 0.00 178.00 179.00 2wvv n GLY 460 N -0.96 0.95 3.54 -0.55 0.00 -1.26 -4.95 105.19 101.95 2wvv n GLY 460 Ca -0.02 -0.30 -0.10 0.00 0.00 0.00 0.00 46.02 45.60 2wvv n GLY 460 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wvv s GLU 461 N -2.40 1.27 0.20 1.61 -1.05 -1.26 -5.13 118.70 111.94 2wvv s GLU 461 Ca 0.00 -0.54 -0.33 0.00 -0.15 0.00 0.00 54.97 53.95 2wvv s GLU 461 Cb 0.00 0.54 -0.14 0.00 -0.44 0.00 0.00 34.13 34.09 2wvv s GLU 461 CO 0.00 -0.57 1.48 -2.30 0.95 0.00 0.00 175.26 174.82 2wvv n PRO 462 N -0.37 2.05 -4.28 -4.83 -0.02 -1.26 -4.96 135.00 121.33 2wvv n PRO 462 Ca -0.12 0.74 -0.16 0.00 -2.02 0.00 0.00 63.50 61.94 2wvv n PRO 462 Cb 0.63 -2.44 -0.10 0.00 -0.02 0.00 0.00 33.50 31.57 2wvv n PRO 462 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 2wvv s TYR 463 N 0.38 1.44 -0.07 6.00 1.13 -0.97 -4.92 117.35 120.33 2wvv s TYR 463 Ca 0.73 -1.31 0.04 0.00 -1.41 0.00 0.00 57.07 55.12 2wvv s TYR 463 Cb -0.67 -0.77 0.00 0.00 -1.10 0.00 0.00 41.96 39.42 2wvv s TYR 463 CO 0.44 -0.50 -0.19 0.08 -2.51 0.00 0.00 175.55 172.87 2wvv s VAL 464 N -3.84 1.61 -0.16 -3.49 1.01 -1.26 -0.52 120.40 113.75 2wvv s VAL 464 Ca 0.38 -0.78 -0.03 0.00 0.00 0.00 0.00 61.98 61.55 2wvv s VAL 464 Cb 0.07 -1.40 -0.02 0.00 0.00 0.00 0.00 36.38 35.02 2wvv s VAL 464 CO 0.15 0.46 -0.06 -0.63 0.00 0.00 0.00 175.10 175.02 2wvv s ILE 465 N 0.29 3.65 -0.21 2.22 1.01 -0.21 -1.83 121.20 126.12 2wvv s ILE 465 Ca -0.12 -0.44 -0.15 0.00 0.00 0.00 0.00 60.65 59.94 2wvv s ILE 465 Cb -0.15 -2.60 -0.04 0.00 0.01 0.00 0.00 42.46 39.68 2wvv s ILE 465 CO 0.05 0.49 0.37 -1.58 0.00 0.00 0.00 174.94 174.27 2wvv s GLN 466 N 0.54 4.15 -0.05 2.79 0.74 0.13 -0.42 119.66 127.55 2wvv s GLN 466 Ca -0.04 0.14 -0.07 0.00 0.05 0.00 0.00 55.36 55.44 2wvv s GLN 466 Cb -0.15 -3.54 -0.04 0.00 1.10 0.00 0.00 33.01 30.38 2wvv s GLN 466 CO 0.03 -0.04 0.21 -0.51 -0.55 0.00 0.00 175.29 174.43 2wvv s LEU 467 N 1.32 4.39 -0.25 3.68 1.43 0.94 -1.38 118.68 128.81 2wvv s LEU 467 Ca 0.18 0.53 -0.14 0.00 -1.03 0.00 0.00 54.13 53.66 2wvv s LEU 467 Cb -0.15 -2.39 -0.04 0.00 0.03 0.00 0.00 46.19 43.64 2wvv s LEU 467 CO 0.08 0.33 0.34 -0.75 0.23 0.00 0.00 176.35 176.57 2wvv s LYS 468 N -1.40 4.05 0.25 1.70 2.20 -0.32 -2.69 119.74 123.53 2wvv s LYS 468 Ca 0.22 0.01 0.10 0.00 -0.36 0.00 0.00 55.97 55.93 2wvv s LYS 468 Cb -0.13 -3.62 -0.04 0.00 -1.51 0.00 0.00 37.83 32.53 2wvv s LYS 468 CO 0.11 -0.18 -0.06 0.14 -0.36 0.00 0.00 175.35 175.01 2wvv s VAL 469 N 1.75 3.24 -0.04 4.02 -7.23 -1.26 -0.57 120.40 120.31 2wvv s VAL 469 Ca 0.14 -1.94 0.03 0.00 -1.81 0.00 0.00 61.98 58.40 2wvv s VAL 469 Cb -0.15 -2.70 0.00 0.00 0.56 0.00 0.00 36.38 34.09 2wvv s VAL 469 CO 0.09 -0.32 -0.11 -0.60 -0.31 0.00 0.00 175.10 173.85 2wvv s ARG 470 N -3.47 1.24 -0.20 4.82 3.52 -0.42 -4.90 118.95 119.53 2wvv s ARG 470 Ca 0.30 -0.37 -0.12 0.00 -0.13 0.00 0.00 55.73 55.41 2wvv s ARG 470 Cb -0.07 -1.11 -0.05 0.00 -1.56 0.00 0.00 34.95 32.17 2wvv s ARG 470 CO 0.18 0.12 0.20 0.00 -0.81 0.00 0.00 175.30 174.99 2wvv s ALA 471 N 0.27 3.63 -2.00 6.12 0.00 -1.26 -1.13 121.76 127.39 2wvv s ALA 471 Ca -0.05 -0.67 0.01 0.00 0.00 0.00 0.00 51.96 51.24 2wvv s ALA 471 Cb -0.11 -2.31 0.06 0.00 0.00 0.00 0.00 23.12 20.76 2wvv s ALA 471 CO 0.01 0.00 0.55 0.00 0.00 0.00 0.00 175.76 176.33