#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wvt s ILE 36 N 0.00 3.31 0.23 6.31 1.01 -1.26 -5.01 121.20 125.79 2wvt s ILE 36 Ca 0.00 1.29 -0.30 0.00 0.00 0.00 0.00 60.65 61.64 2wvt s ILE 36 Cb 0.00 -3.82 -0.09 0.00 0.01 0.00 0.00 42.46 38.56 2wvt s ILE 36 CO 0.00 0.29 1.06 -2.84 0.00 0.00 0.00 174.94 173.45 2wvt s PRO 37 N -1.37 4.68 -0.13 2.79 0.02 -1.26 -4.87 135.00 134.87 2wvt s PRO 37 Ca 0.47 1.69 -0.10 0.00 0.02 0.00 0.00 61.00 63.08 2wvt s PRO 37 Cb -0.34 -3.24 0.04 0.00 0.02 0.00 0.00 34.50 30.98 2wvt s PRO 37 CO 0.43 0.24 0.33 -0.51 -0.33 0.00 0.00 177.00 177.16 2wvt s LEU 38 N -1.01 0.57 0.09 -5.54 1.43 -1.26 -5.04 118.68 107.92 2wvt s LEU 38 Ca 0.45 0.67 0.19 0.00 -1.03 0.00 0.00 54.13 54.42 2wvt s LEU 38 Cb -0.29 1.10 -0.11 0.00 0.03 0.00 0.00 46.19 46.91 2wvt s LEU 38 CO 0.37 -0.13 0.84 0.29 0.23 0.00 0.00 176.35 177.94 2wvt n LYS 39 N 3.33 0.62 -0.60 1.70 5.02 -1.26 -4.53 118.16 122.44 2wvt n LYS 39 Ca -0.17 0.14 0.06 0.00 -2.02 0.00 0.00 58.31 56.32 2wvt n LYS 39 Cb 0.57 -1.78 0.16 0.00 -0.02 0.00 0.00 35.03 33.96 2wvt n LYS 39 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2wvt n TYR 40 N -2.75 0.00 -0.84 2.13 4.01 -1.26 -5.03 117.16 113.43 2wvt n TYR 40 Ca -0.07 -1.18 0.00 0.00 -0.16 0.00 0.00 57.90 56.50 2wvt n TYR 40 Cb 0.72 -0.20 0.00 0.00 -0.31 0.00 0.00 39.34 39.55 2wvt n TYR 40 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wvt n GLY 41 N -0.91 0.91 3.75 2.72 0.00 -1.26 -4.40 105.19 106.00 2wvt n GLY 41 Ca 0.16 -1.79 -0.36 0.00 0.00 0.00 0.00 46.02 44.03 2wvt n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wvt s ALA 42 N -3.16 2.54 -0.06 4.61 0.00 -1.26 -4.95 121.76 119.46 2wvt s ALA 42 Ca 0.00 1.03 0.03 0.00 0.00 0.00 0.00 51.96 53.02 2wvt s ALA 42 Cb 0.00 -3.46 -0.06 0.00 0.00 0.00 0.00 23.12 19.60 2wvt s ALA 42 CO 0.00 -1.19 -0.02 -2.37 0.00 0.00 0.00 175.76 172.18 2wvt n THR 43 N -1.60 0.41 -2.91 0.00 5.66 -1.26 -5.01 114.28 109.56 2wvt n THR 43 Ca 0.14 -0.20 -0.40 0.00 -3.05 0.00 0.00 64.05 60.54 2wvt n THR 43 Cb 0.49 -0.80 -0.06 0.00 -1.55 0.00 0.00 70.33 68.41 2wvt n THR 43 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 2wvt s ASN 44 N -4.20 7.45 -0.62 1.09 0.01 -1.26 -5.02 114.94 112.39 2wvt s ASN 44 Ca -0.06 1.72 -0.19 0.00 -0.71 0.00 0.00 52.86 53.61 2wvt s ASN 44 Cb 0.02 -2.53 0.10 0.00 0.41 0.00 0.00 41.25 39.25 2wvt s ASN 44 CO 0.20 0.17 0.77 -1.83 -1.51 0.00 0.00 177.10 174.90 2wvt s GLU 45 N -1.04 3.09 2.22 -0.60 -1.05 -1.26 -4.93 118.70 115.13 2wvt s GLU 45 Ca 0.38 -1.28 0.00 0.00 -0.15 0.00 0.00 54.97 53.92 2wvt s GLU 45 Cb -0.24 -4.29 0.00 0.00 -0.44 0.00 0.00 34.13 29.16 2wvt s GLU 45 CO 0.28 -1.59 0.00 0.41 0.95 0.00 0.00 175.26 175.30 2wvt n GLY 46 N 5.27 -0.60 3.77 -3.83 0.00 -1.26 -4.81 105.19 103.73 2wvt n GLY 46 Ca -0.07 -1.10 -0.39 0.00 0.00 0.00 0.00 46.02 44.46 2wvt n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wvt s LYS 47 N 0.00 4.49 0.30 1.61 1.02 -1.26 -5.01 119.74 120.89 2wvt s LYS 47 Ca 0.00 1.69 -0.29 0.00 0.02 0.00 0.00 55.97 57.39 2wvt s LYS 47 Cb 0.00 -2.97 -0.10 0.00 -0.52 0.00 0.00 37.83 34.23 2wvt s LYS 47 CO 0.00 0.11 1.35 1.03 -0.92 0.00 0.00 175.35 176.92 2wvt s ARG 48 N -1.79 4.32 -0.01 1.68 0.52 -1.26 -4.94 118.95 117.48 2wvt s ARG 48 Ca 0.49 2.24 0.01 0.00 -0.52 0.00 0.00 55.73 57.96 2wvt s ARG 48 Cb -0.28 -3.08 0.02 0.00 0.52 0.00 0.00 34.95 32.13 2wvt s ARG 48 CO 0.36 -0.26 0.90 1.04 0.02 0.00 0.00 175.30 177.35 2wvt n GLN 49 N 1.27 2.11 -1.60 3.54 1.13 -1.26 -4.61 117.38 117.96 2wvt n GLN 49 Ca 0.02 -1.34 -0.35 0.00 -1.94 0.00 0.00 57.00 53.39 2wvt n GLN 49 Cb 0.41 -0.91 0.07 0.00 0.11 0.00 0.00 30.24 29.93 2wvt n GLN 49 CO 0.00 0.00 0.00 0.16 -1.44 0.00 0.00 177.06 175.78 2wvt s ASP 50 N -0.92 4.52 0.40 1.08 -4.77 -1.26 -4.73 116.67 110.99 2wvt s ASP 50 Ca 0.02 2.34 0.12 0.00 -3.30 0.00 0.00 52.55 51.73 2wvt s ASP 50 Cb 0.02 -2.59 0.95 0.00 -1.09 0.00 0.00 42.92 40.21 2wvt s ASP 50 CO 0.00 -2.04 1.92 1.55 0.70 0.00 0.00 175.17 177.30 2wvt h PRO 51 N 0.02 0.52 -0.45 2.11 0.13 -1.99 -1.32 132.00 131.03 2wvt h PRO 51 Ca -0.48 -0.03 -0.12 0.00 -0.87 0.00 0.00 66.00 64.50 2wvt h PRO 51 Cb 1.29 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 2wvt h PRO 51 CO 0.51 0.34 -0.18 0.00 -0.23 0.00 0.00 178.00 178.45 2wvt h ALA 52 N 1.63 0.84 -0.22 -0.56 0.00 -1.91 -1.09 119.26 117.95 2wvt h ALA 52 Ca 0.38 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 2wvt h ALA 52 Cb 0.71 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 2wvt h ALA 52 CO -0.14 0.65 -0.23 1.98 0.00 0.00 0.00 179.25 181.51 2wvt h MET 53 N 0.77 0.54 -0.97 0.00 -1.53 -1.53 -2.00 114.93 110.21 2wvt h MET 53 Ca 0.11 -0.29 0.13 0.00 -3.44 0.00 0.00 59.70 56.21 2wvt h MET 53 Cb 0.71 0.01 -0.09 0.00 -0.55 0.00 0.00 31.60 31.69 2wvt h MET 53 CO 0.05 0.87 0.59 1.96 0.14 0.00 0.00 176.91 180.53 2wvt h GLN 54 N 0.22 0.89 -0.03 0.39 4.20 -1.23 -0.73 115.11 118.82 2wvt h GLN 54 Ca 0.03 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.69 2wvt h GLN 54 Cb 0.78 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 28.36 2wvt h GLN 54 CO 0.06 0.59 0.01 -0.22 -0.67 0.00 0.00 178.83 178.59 2wvt h LYS 55 N 0.91 0.02 -0.56 1.46 1.63 -1.11 0.17 116.57 119.11 2wvt h LYS 55 Ca 0.49 -0.00 0.10 0.00 -0.85 0.00 0.00 60.65 60.39 2wvt h LYS 55 Cb 0.52 -0.01 -0.08 0.00 -0.60 0.00 0.00 32.23 32.07 2wvt h LYS 55 CO -0.28 0.02 0.11 0.35 -3.45 0.00 0.00 179.45 176.19 2wvt h PHE 56 N 0.02 0.17 0.15 1.91 3.57 -0.66 -1.51 116.94 120.60 2wvt h PHE 56 Ca 0.01 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 2wvt h PHE 56 Cb 0.00 0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.75 2wvt h PHE 56 CO -0.09 -0.02 -0.07 -0.09 -2.23 0.00 0.00 178.31 175.81 2wvt h ARG 57 N 0.24 -0.19 -0.06 1.11 2.43 -1.05 -3.27 114.38 113.59 2wvt h ARG 57 Ca 0.29 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.49 2wvt h ARG 57 Cb 0.41 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.00 2wvt h ARG 57 CO -0.37 0.21 0.05 -0.44 -1.51 0.00 0.00 179.97 177.91 2wvt h ASP 58 N -0.67 0.00 -0.36 -3.80 3.32 -0.49 -2.38 116.42 112.04 2wvt h ASP 58 Ca -0.02 0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.09 2wvt h ASP 58 Cb 0.49 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.99 2wvt h ASP 58 CO 0.03 0.00 0.06 0.78 -1.72 0.00 0.00 179.24 178.39 2wvt h ASN 59 N 0.00 -0.01 0.00 6.45 2.35 -1.33 -0.65 115.58 122.39 2wvt h ASN 59 Ca 0.03 0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2wvt h ASN 59 Cb 0.13 0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.59 2wvt h ASN 59 CO -0.00 0.03 0.00 0.54 -1.65 0.00 0.00 177.43 176.35 2wvt n ARG 60 N -5.11 0.00 -4.26 0.81 5.12 -0.90 -4.59 116.66 107.73 2wvt n ARG 60 Ca 0.02 0.00 -0.34 0.00 -1.93 0.00 0.00 57.85 55.59 2wvt n ARG 60 Cb 0.17 -0.17 -0.14 0.00 -1.16 0.00 0.00 32.46 31.16 2wvt n ARG 60 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 2wvt s LEU 61 N 0.00 2.91 0.28 0.55 2.96 -1.26 -1.78 118.68 122.33 2wvt s LEU 61 Ca 0.00 -0.32 0.06 0.00 -0.22 0.00 0.00 54.13 53.65 2wvt s LEU 61 Cb 0.00 -1.71 -0.06 0.00 0.50 0.00 0.00 46.19 44.92 2wvt s LEU 61 CO 0.00 0.07 -0.04 -0.83 -1.32 0.00 0.00 176.35 174.23 2wvt s GLY 62 N 0.93 1.83 0.01 7.98 0.00 -0.29 -0.88 107.32 116.90 2wvt s GLY 62 Ca -0.01 -1.91 0.05 0.00 0.00 0.00 0.00 44.72 42.85 2wvt s GLY 62 CO 0.00 -1.82 -0.14 0.00 0.00 0.00 0.00 173.10 171.14 2wvt s ALA 63 N -3.09 2.72 -0.10 3.20 0.00 -0.67 -1.20 121.76 122.62 2wvt s ALA 63 Ca 0.30 -1.10 -0.02 0.00 0.00 0.00 0.00 51.96 51.14 2wvt s ALA 63 Cb 0.05 -0.89 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 2wvt s ALA 63 CO 0.12 0.58 -0.03 0.12 0.00 0.00 0.00 175.76 176.55 2wvt s PHE 64 N -0.90 3.06 -0.23 0.00 5.99 0.09 -0.25 117.98 125.74 2wvt s PHE 64 Ca 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 56.93 57.08 2wvt s PHE 64 Cb -0.11 -1.83 0.03 0.00 0.00 0.00 0.00 43.02 41.12 2wvt s PHE 64 CO 0.05 0.27 -0.12 0.42 -0.00 0.00 0.00 175.22 175.84 2wvt s ILE 65 N -0.45 2.42 -0.44 3.12 -1.09 0.80 -0.37 121.20 125.19 2wvt s ILE 65 Ca 0.07 -1.16 -0.12 0.00 -2.23 0.00 0.00 60.65 57.21 2wvt s ILE 65 Cb -0.12 -2.22 0.07 0.00 -1.58 0.00 0.00 42.46 38.61 2wvt s ILE 65 CO 0.02 0.25 0.32 -1.00 -1.23 0.00 0.00 174.94 173.30 2wvt s HIS 66 N 1.25 3.29 -0.05 3.97 3.76 -0.51 -1.55 115.29 125.45 2wvt s HIS 66 Ca -0.01 -1.19 -0.01 0.00 -0.15 0.00 0.00 55.06 53.71 2wvt s HIS 66 Cb -0.16 -3.03 0.03 0.00 1.11 0.00 0.00 32.58 30.52 2wvt s HIS 66 CO -0.07 -0.81 0.00 -0.46 -0.85 0.00 0.00 174.74 172.55 2wvt s TRP 67 N 1.54 0.51 0.03 1.40 -0.00 -1.26 -3.88 118.94 117.28 2wvt s TRP 67 Ca 0.03 -0.08 -0.02 0.00 -0.00 0.00 0.00 56.10 56.03 2wvt s TRP 67 Cb -0.23 -0.64 0.01 0.00 -0.00 0.00 0.00 33.47 32.60 2wvt s TRP 67 CO 0.05 -0.24 0.11 0.41 -0.00 0.00 0.00 176.95 177.28 2wvt n GLY 68 N 4.74 1.48 0.26 5.86 0.00 -1.26 -4.86 105.19 111.41 2wvt n GLY 68 Ca -0.14 -0.98 0.10 0.00 0.00 0.00 0.00 46.02 45.00 2wvt n GLY 68 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wvt h LEU 69 N 0.00 0.00 -2.41 0.99 3.38 -1.97 -1.96 115.31 113.34 2wvt h LEU 69 Ca -0.04 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.96 2wvt h LEU 69 Cb 0.14 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 2wvt h LEU 69 CO 0.05 0.10 0.12 0.10 0.09 0.00 0.00 178.44 178.90 2wvt h TYR 70 N 0.00 0.00 0.00 1.13 -0.00 -1.93 -1.41 116.97 114.76 2wvt h TYR 70 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.72 2wvt h TYR 70 Cb 0.21 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 36.94 2wvt h TYR 70 CO 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 178.16 178.13 2wvt h ALA 71 N 1.83 1.49 0.32 0.10 0.00 -1.61 -0.74 119.26 120.65 2wvt h ALA 71 Ca 0.04 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2wvt h ALA 71 Cb 0.29 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2wvt h ALA 71 CO -0.00 0.04 -0.16 0.82 0.00 0.00 0.00 179.25 179.95 2wvt h ILE 72 N 0.00 0.26 -0.01 0.00 2.04 -1.47 -3.24 117.51 115.09 2wvt h ILE 72 Ca -0.00 -0.76 -0.12 0.00 1.00 0.00 0.00 64.86 64.98 2wvt h ILE 72 Cb 0.08 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 2wvt h ILE 72 CO 0.00 0.06 -0.55 1.55 0.00 0.00 0.00 178.15 179.22 2wvt h PRO 73 N -1.05 0.03 -6.20 2.37 0.13 -1.72 -3.48 132.00 122.09 2wvt h PRO 73 Ca -0.04 -0.02 -0.45 0.00 -0.87 0.00 0.00 66.00 64.62 2wvt h PRO 73 Cb 0.44 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.58 2wvt h PRO 73 CO 0.07 0.57 -0.80 0.41 -0.23 0.00 0.00 178.00 178.03 2wvt n GLY 74 N 0.05 -0.38 1.17 1.56 0.00 -0.29 -2.03 105.19 105.27 2wvt n GLY 74 Ca -0.01 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2wvt n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wvt n GLY 75 N -1.65 0.73 3.25 -0.02 0.00 -1.26 -1.07 105.19 105.16 2wvt n GLY 75 Ca -0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 2wvt n GLY 75 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wvt s GLU 76 N -0.61 3.14 -0.07 1.61 2.12 -0.86 -0.22 118.70 123.81 2wvt s GLU 76 Ca 0.00 -0.82 0.00 0.00 0.36 0.00 0.00 54.97 54.51 2wvt s GLU 76 Cb 0.00 -2.42 0.02 0.00 0.26 0.00 0.00 34.13 32.00 2wvt s GLU 76 CO 0.00 0.16 -0.05 -0.46 -0.54 0.00 0.00 175.26 174.37 2wvt s TRP 77 N 0.42 1.00 -1.39 5.30 -0.11 0.08 -4.70 118.94 119.54 2wvt s TRP 77 Ca -0.15 -0.37 -0.00 0.00 1.22 0.00 0.00 56.10 56.80 2wvt s TRP 77 Cb -0.17 -0.89 0.00 0.00 -1.50 0.00 0.00 33.47 30.92 2wvt s TRP 77 CO 0.07 -0.31 0.49 0.09 -4.62 0.00 0.00 176.95 172.67 2wvt n ASN 78 N 4.47 -0.58 0.00 5.86 5.03 -1.26 -1.91 115.26 126.88 2wvt n ASN 78 Ca -0.18 -0.96 0.00 0.00 0.87 0.00 0.00 54.58 54.31 2wvt n ASN 78 Cb 0.51 -3.29 0.00 0.00 -1.02 0.00 0.00 39.78 35.98 2wvt n ASN 78 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2wvt n GLY 79 N -1.88 0.82 3.21 7.41 0.00 -1.26 -5.02 105.19 108.46 2wvt n GLY 79 Ca -0.30 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.40 2wvt n GLY 79 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wvt s LYS 80 N -0.08 3.07 -0.16 1.61 2.20 -0.80 -5.10 119.74 120.47 2wvt s LYS 80 Ca 0.00 -0.85 -0.16 0.00 -0.36 0.00 0.00 55.97 54.60 2wvt s LYS 80 Cb 0.00 -2.40 -0.04 0.00 -1.51 0.00 0.00 37.83 33.88 2wvt s LYS 80 CO 0.00 0.08 0.40 0.08 -0.36 0.00 0.00 175.35 175.55 2wvt s VAL 81 N 0.59 5.22 -0.14 4.02 1.01 -1.26 -0.74 120.40 129.09 2wvt s VAL 81 Ca -0.12 0.75 -0.05 0.00 0.00 0.00 0.00 61.98 62.56 2wvt s VAL 81 Cb -0.17 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 2wvt s VAL 81 CO 0.03 0.31 0.04 -0.31 0.00 0.00 0.00 175.10 175.17 2wvt s TYR 82 N 0.88 3.25 0.05 5.22 2.02 0.70 -4.99 117.35 124.48 2wvt s TYR 82 Ca 0.21 0.14 0.19 0.00 -0.37 0.00 0.00 57.07 57.24 2wvt s TYR 82 Cb -0.14 -1.95 0.56 0.00 -0.40 0.00 0.00 41.96 40.04 2wvt s TYR 82 CO 0.08 0.33 1.67 0.78 -1.57 0.00 0.00 175.55 176.84 2wvt h GLY 83 N 5.92 0.00 -1.11 0.71 0.00 -1.97 -3.46 103.07 103.15 2wvt h GLY 83 Ca -0.44 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.44 2wvt h GLY 83 CO 0.62 0.00 0.09 -0.32 0.00 0.00 0.00 176.54 176.93 2wvt s GLY 84 N -4.36 1.58 0.14 4.60 0.00 -1.26 -4.90 107.32 103.10 2wvt s GLY 84 Ca 0.01 -0.02 -0.35 0.00 0.00 0.00 0.00 44.72 44.36 2wvt s GLY 84 CO 0.69 0.61 1.38 0.00 0.00 0.00 0.00 173.10 175.78 2wvt n ALA 85 N -4.65 -0.13 0.16 3.20 0.00 -1.25 -4.86 120.51 112.98 2wvt n ALA 85 Ca 0.05 0.48 0.05 0.00 0.00 0.00 0.00 53.44 54.02 2wvt n ALA 85 Cb 0.54 -2.16 0.51 0.00 0.00 0.00 0.00 19.45 18.34 2wvt n ALA 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wvt h ALA 86 N 4.67 1.77 0.00 0.00 0.00 -1.84 -1.46 119.26 122.40 2wvt h ALA 86 Ca -0.46 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2wvt h ALA 86 Cb 1.31 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2wvt h ALA 86 CO 0.79 0.18 0.00 -0.85 0.00 0.00 0.00 179.25 179.37 2wvt n GLU 87 N -4.43 0.25 -0.42 0.00 0.00 -1.26 -1.95 120.64 112.82 2wvt n GLU 87 Ca -0.01 0.07 0.08 0.00 0.00 0.00 0.00 57.16 57.30 2wvt n GLU 87 Cb 0.15 -1.50 0.27 0.00 0.00 0.00 0.00 31.44 30.35 2wvt n GLU 87 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.13 178.04 2wvt n TRP 88 N -1.35 1.00 -0.09 -1.84 7.02 -0.55 -4.69 117.44 116.94 2wvt n TRP 88 Ca 0.10 -0.62 0.10 0.00 -1.02 0.00 0.00 57.50 56.05 2wvt n TRP 88 Cb 0.22 -0.17 0.46 0.00 -2.42 0.00 0.00 31.31 29.39 2wvt n TRP 88 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 2wvt h LEU 89 N 2.96 0.45 -1.19 -0.99 5.85 -1.46 0.11 115.31 121.04 2wvt h LEU 89 Ca 0.00 0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.81 2wvt h LEU 89 Cb 1.18 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 42.05 2wvt h LEU 89 CO 0.13 0.28 0.58 0.50 -0.34 0.00 0.00 178.44 179.60 2wvt h LYS 90 N 0.51 0.89 -0.02 1.25 3.64 -1.85 0.75 116.57 121.74 2wvt h LYS 90 Ca 0.27 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.57 2wvt h LYS 90 Cb 0.39 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 2wvt h LYS 90 CO -0.08 0.59 -0.10 1.03 -2.27 0.00 0.00 179.45 178.62 2wvt h SER 91 N 0.92 0.12 -0.58 4.20 0.87 -1.14 -0.49 113.55 117.44 2wvt h SER 91 Ca 0.41 -0.67 -0.03 0.00 -1.23 0.00 0.00 61.79 60.26 2wvt h SER 91 Cb 0.35 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.25 2wvt h SER 91 CO -0.17 0.77 0.25 -0.50 -0.53 0.00 0.00 176.83 176.65 2wvt h TRP 92 N -0.53 0.87 -0.42 2.24 -0.00 -0.78 -2.46 115.95 114.87 2wvt h TRP 92 Ca -0.01 -0.06 0.00 0.00 -0.00 0.00 0.00 58.89 58.83 2wvt h TRP 92 Cb 0.77 -0.26 0.00 0.00 -0.00 0.00 0.00 29.16 29.67 2wvt h TRP 92 CO 0.16 0.69 0.00 0.00 -0.00 0.00 0.00 178.44 179.28 2wvt n ALA 93 N -2.35 2.52 -4.07 1.49 0.00 0.20 -4.96 120.51 113.34 2wvt n ALA 93 Ca 0.03 -0.79 -0.33 0.00 0.00 0.00 0.00 53.44 52.36 2wvt n ALA 93 Cb 0.15 -0.98 -0.03 0.00 0.00 0.00 0.00 19.45 18.59 2wvt n ALA 93 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2wvt n LYS 94 N 0.71 -1.52 -3.22 0.00 4.76 -0.93 -4.93 118.16 113.04 2wvt n LYS 94 Ca 0.14 0.23 -0.39 0.00 -2.87 0.00 0.00 58.31 55.42 2wvt n LYS 94 Cb 0.41 -3.69 -0.06 0.00 -1.84 0.00 0.00 35.03 29.84 2wvt n LYS 94 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2wvt s VAL 95 N -3.95 5.09 0.72 -0.18 1.01 -0.22 -5.05 120.40 117.83 2wvt s VAL 95 Ca 0.18 1.03 -0.15 0.00 0.00 0.00 0.00 61.98 63.04 2wvt s VAL 95 Cb -0.08 -3.87 0.03 0.00 0.00 0.00 0.00 36.38 32.46 2wvt s VAL 95 CO 0.94 0.18 1.18 -2.84 0.00 0.00 0.00 175.10 174.57 2wvt s PRO 96 N 1.55 2.25 0.20 2.72 0.02 -1.26 -4.74 135.00 135.72 2wvt s PRO 96 Ca 0.26 1.68 -0.13 0.00 0.02 0.00 0.00 61.00 62.82 2wvt s PRO 96 Cb -0.16 -1.85 0.22 0.00 0.02 0.00 0.00 34.50 32.73 2wvt s PRO 96 CO 0.10 -1.73 1.66 0.00 -0.33 0.00 0.00 177.00 176.70 2wvt h ALA 97 N -0.27 0.47 -0.49 -1.55 0.00 -1.97 0.33 119.26 115.78 2wvt h ALA 97 Ca -0.47 0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.54 2wvt h ALA 97 Cb 1.28 0.34 -0.02 0.00 0.00 0.00 0.00 17.79 19.40 2wvt h ALA 97 CO 0.50 -0.41 -0.01 0.38 0.00 0.00 0.00 179.25 179.71 2wvt h ASP 98 N 0.07 0.86 0.15 0.00 3.04 -1.95 0.79 116.42 119.37 2wvt h ASP 98 Ca 0.28 -0.31 -0.01 0.00 -3.24 0.00 0.00 57.03 53.75 2wvt h ASP 98 Cb 0.44 -0.23 -0.00 0.00 -1.04 0.00 0.00 39.33 38.49 2wvt h ASP 98 CO -0.51 0.96 -0.08 -0.33 -2.04 0.00 0.00 179.24 177.24 2wvt h GLU 99 N 0.73 -0.20 0.02 4.15 5.08 -1.82 -1.15 114.58 121.38 2wvt h GLU 99 Ca 0.14 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.53 2wvt h GLU 99 Cb 0.53 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 2wvt h GLU 99 CO 0.03 -0.14 -0.15 2.35 -1.00 0.00 0.00 179.01 180.10 2wvt h TRP 100 N -0.21 -0.39 0.00 4.33 2.91 -0.67 -2.50 115.95 119.42 2wvt h TRP 100 Ca -0.02 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.01 2wvt h TRP 100 Cb 0.17 0.17 0.00 0.00 -0.51 0.00 0.00 29.16 28.99 2wvt h TRP 100 CO -0.07 -0.22 0.00 -0.07 -1.03 0.00 0.00 178.44 177.04 2wvt h LEU 101 N -0.26 0.00 -2.36 0.65 3.38 -0.77 -1.80 115.31 114.15 2wvt h LEU 101 Ca 0.04 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.02 2wvt h LEU 101 Cb 0.31 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 2wvt h LEU 101 CO -0.13 0.00 0.21 0.50 0.09 0.00 0.00 178.44 179.11 2wvt h LYS 102 N 0.00 0.00 -0.15 1.13 3.64 -0.73 -1.36 116.57 119.10 2wvt h LYS 102 Ca 0.00 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.42 2wvt h LYS 102 Cb 0.36 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 2wvt h LYS 102 CO 0.00 0.00 0.26 -0.07 -2.27 0.00 0.00 179.45 177.37 2wvt h LEU 103 N 0.00 0.00 -1.42 5.20 3.38 -1.45 -0.81 115.31 120.22 2wvt h LEU 103 Ca 0.01 0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.14 2wvt h LEU 103 Cb 0.43 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.11 2wvt h LEU 103 CO -0.00 0.00 0.57 0.24 0.09 0.00 0.00 178.44 179.34 2wvt h MET 104 N 0.00 0.52 0.00 1.13 2.86 -1.48 -0.16 114.93 117.80 2wvt h MET 104 Ca 0.07 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2wvt h MET 104 Cb 0.58 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.12 2wvt h MET 104 CO -0.00 0.35 0.00 -0.44 1.06 0.00 0.00 176.91 177.88 2wvt h ASP 105 N 0.54 0.00 -0.18 1.22 3.32 -1.38 -1.95 116.42 117.99 2wvt h ASP 105 Ca 0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.49 2wvt h ASP 105 Cb 0.90 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.45 2wvt h ASP 105 CO -0.18 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.34 2wvt n GLN 106 N -2.45 1.82 -2.70 3.56 6.02 -0.08 -4.69 117.38 118.85 2wvt n GLN 106 Ca -0.01 -1.78 -0.42 0.00 -0.01 0.00 0.00 57.00 54.79 2wvt n GLN 106 Cb 0.10 -1.35 -0.03 0.00 1.02 0.00 0.00 30.24 29.97 2wvt n GLN 106 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 2wvt s TRP 107 N -1.28 2.51 -0.43 1.08 -0.11 -0.73 -4.86 118.94 115.10 2wvt s TRP 107 Ca 0.25 -0.20 0.07 0.00 1.22 0.00 0.00 56.10 57.44 2wvt s TRP 107 Cb 0.15 -4.44 0.26 0.00 -1.50 0.00 0.00 33.47 27.95 2wvt s TRP 107 CO 0.22 -1.80 0.75 -1.71 -4.62 0.00 0.00 176.95 169.78 2wvt n ASN 108 N 8.48 -1.24 -3.90 5.86 5.15 -1.26 -2.89 115.26 125.46 2wvt n ASN 108 Ca 0.01 -3.07 -0.41 0.00 -0.60 0.00 0.00 54.58 50.51 2wvt n ASN 108 Cb 0.47 0.60 -0.03 0.00 -0.53 0.00 0.00 39.78 40.30 2wvt n ASN 108 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2wvt n PRO 109 N 1.29 2.23 0.32 1.20 -0.04 -1.26 -4.76 135.00 133.98 2wvt n PRO 109 Ca 0.15 -2.38 0.21 0.00 -0.04 0.00 0.00 63.50 61.44 2wvt n PRO 109 Cb 0.60 -3.23 1.07 0.00 -0.04 0.00 0.00 33.50 31.91 2wvt n PRO 109 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wvt h THR 110 N 4.64 0.06 -0.01 0.52 1.03 -1.81 -0.82 112.91 116.52 2wvt h THR 110 Ca 0.46 -0.13 0.00 0.00 -0.01 0.00 0.00 66.41 66.72 2wvt h THR 110 Cb 0.72 1.12 0.00 0.00 -1.07 0.00 0.00 68.15 68.92 2wvt h THR 110 CO 1.78 0.01 -0.11 0.29 -0.01 0.00 0.00 175.52 177.48 2wvt n LYS 111 N -3.16 1.40 -1.79 0.00 4.76 0.31 -4.92 118.16 114.75 2wvt n LYS 111 Ca -0.02 -0.86 -0.42 0.00 -2.87 0.00 0.00 58.31 54.14 2wvt n LYS 111 Cb 0.13 -1.48 -0.02 0.00 -1.84 0.00 0.00 35.03 31.81 2wvt n LYS 111 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 2wvt s PHE 112 N -2.20 2.84 -0.25 2.13 5.36 -0.31 -4.62 117.98 120.93 2wvt s PHE 112 Ca 0.32 0.65 -0.02 0.00 -0.96 0.00 0.00 56.93 56.92 2wvt s PHE 112 Cb 0.20 -4.06 0.12 0.00 -0.34 0.00 0.00 43.02 38.94 2wvt s PHE 112 CO 0.41 -3.73 0.30 0.34 -1.46 0.00 0.00 175.22 171.07 2wvt s ASP 113 N 0.74 1.16 0.29 6.13 -1.08 -1.26 -5.05 116.67 117.61 2wvt s ASP 113 Ca 0.67 -0.33 -0.01 0.00 -0.52 0.00 0.00 52.55 52.36 2wvt s ASP 113 Cb -0.48 0.65 0.47 0.00 -1.46 0.00 0.00 42.92 42.11 2wvt s ASP 113 CO 0.42 -0.35 1.93 0.00 0.52 0.00 0.00 175.17 177.69 2wvt h ALA 114 N 8.25 1.46 -0.91 3.66 0.00 -1.93 -1.33 119.26 128.46 2wvt h ALA 114 Ca -0.16 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.73 2wvt h ALA 114 Cb 1.12 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 2wvt h ALA 114 CO 0.30 0.44 0.60 0.87 0.00 0.00 0.00 179.25 181.46 2wvt h LYS 115 N 1.09 1.20 -0.38 0.00 1.57 -1.92 -0.79 116.57 117.33 2wvt h LYS 115 Ca 0.37 -0.07 -0.10 0.00 -1.87 0.00 0.00 60.65 58.98 2wvt h LYS 115 Cb 0.07 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 2wvt h LYS 115 CO -0.12 0.79 -0.14 -0.22 -0.57 0.00 0.00 179.45 179.19 2wvt h LYS 116 N 1.23 0.77 -0.56 3.15 3.64 -1.70 -0.55 116.57 122.55 2wvt h LYS 116 Ca 0.33 -0.32 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2wvt h LYS 116 Cb -0.14 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.62 2wvt h LYS 116 CO -0.07 0.94 0.34 -1.49 -2.27 0.00 0.00 179.45 176.90 2wvt h TRP 117 N 0.58 0.73 -0.38 1.91 4.06 -0.98 -0.10 115.95 121.76 2wvt h TRP 117 Ca 0.09 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 60.96 2wvt h TRP 117 Cb 0.68 -0.24 -0.02 0.00 -1.00 0.00 0.00 29.16 28.58 2wvt h TRP 117 CO 0.05 0.49 -0.11 0.00 -3.56 0.00 0.00 178.44 175.31 2wvt h ALA 118 N 1.17 1.09 -0.70 1.49 0.00 -1.04 -1.40 119.26 119.87 2wvt h ALA 118 Ca 0.20 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2wvt h ALA 118 Cb -0.03 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 2wvt h ALA 118 CO -0.04 0.56 0.38 0.87 0.00 0.00 0.00 179.25 181.03 2wvt h LYS 119 N 0.61 0.98 0.06 0.00 1.57 -0.79 -0.93 116.57 118.08 2wvt h LYS 119 Ca 0.11 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2wvt h LYS 119 Cb 0.55 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.67 2wvt h LYS 119 CO 0.03 0.74 -0.03 1.98 -0.57 0.00 0.00 179.45 181.60 2wvt h MET 120 N 0.97 -0.08 -0.23 3.15 4.05 -0.48 -1.26 114.93 121.06 2wvt h MET 120 Ca 0.25 0.01 0.04 0.00 -0.28 0.00 0.00 59.70 59.71 2wvt h MET 120 Cb 0.04 0.02 -0.04 0.00 -0.80 0.00 0.00 31.60 30.82 2wvt h MET 120 CO -0.04 -0.00 -0.01 0.00 0.23 0.00 0.00 176.91 177.09 2wvt h ALA 121 N 0.80 0.19 -0.59 0.39 0.00 -1.24 -0.88 119.26 117.94 2wvt h ALA 121 Ca -0.01 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2wvt h ALA 121 Cb 0.11 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2wvt h ALA 121 CO 0.01 -0.44 0.29 -0.22 0.00 0.00 0.00 179.25 178.89 2wvt h LYS 122 N 0.05 0.82 -0.02 0.00 3.64 -1.01 -2.61 116.57 117.45 2wvt h LYS 122 Ca 0.11 -0.10 -0.20 0.00 -1.27 0.00 0.00 60.65 59.19 2wvt h LYS 122 Cb 0.14 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.80 2wvt h LYS 122 CO -0.19 0.63 -0.85 0.93 -2.27 0.00 0.00 179.45 177.70 2wvt h GLU 123 N 0.82 0.32 0.00 1.90 5.08 -0.92 -2.83 114.58 118.96 2wvt h GLU 123 Ca 0.21 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 2wvt h GLU 123 Cb 0.08 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 2wvt h GLU 123 CO -0.03 1.00 -0.03 1.98 -1.00 0.00 0.00 179.01 180.93 2wvt h MET 124 N 0.20 0.00 0.00 2.33 4.05 -0.83 -3.38 114.93 117.29 2wvt h MET 124 Ca -0.05 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.37 2wvt h MET 124 Cb 1.46 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.26 2wvt h MET 124 CO 0.14 0.03 0.00 0.41 0.23 0.00 0.00 176.91 177.72 2wvt n GLY 125 N -1.02 0.70 3.76 1.39 0.00 -1.01 -3.01 105.19 106.00 2wvt n GLY 125 Ca -0.02 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 2wvt n GLY 125 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wvt s THR 126 N -2.00 3.06 -0.72 2.61 -4.23 -1.03 -4.88 115.64 108.46 2wvt s THR 126 Ca 0.00 1.05 0.22 0.00 -1.18 0.00 0.00 61.69 61.77 2wvt s THR 126 Cb 0.00 -3.67 -0.20 0.00 1.34 0.00 0.00 72.50 69.97 2wvt s THR 126 CO 0.00 0.24 0.89 0.29 -0.54 0.00 0.00 174.62 175.50 2wvt n LYS 127 N 1.17 0.20 -3.67 3.99 4.76 -0.06 -4.63 118.16 119.92 2wvt n LYS 127 Ca 0.00 -0.04 -0.11 0.00 -2.87 0.00 0.00 58.31 55.30 2wvt n LYS 127 Cb 0.43 -1.53 -0.05 0.00 -1.84 0.00 0.00 35.03 32.04 2wvt n LYS 127 CO 0.00 0.00 0.00 1.52 -1.37 0.00 0.00 177.40 177.55 2wvt s TYR 128 N -3.15 -0.18 -0.05 2.13 -0.85 -1.22 -2.11 117.35 111.92 2wvt s TYR 128 Ca 0.04 -0.07 0.01 0.00 -0.52 0.00 0.00 57.07 56.54 2wvt s TYR 128 Cb 0.15 0.21 0.02 0.00 0.38 0.00 0.00 41.96 42.72 2wvt s TYR 128 CO 0.85 -0.64 -0.07 0.08 -1.52 0.00 0.00 175.55 174.25 2wvt s VAL 129 N -3.40 0.71 -0.24 -3.49 1.01 -0.61 -1.67 120.40 112.71 2wvt s VAL 129 Ca 0.01 -0.23 -0.09 0.00 0.00 0.00 0.00 61.98 61.66 2wvt s VAL 129 Cb 0.01 -0.69 -0.04 0.00 0.00 0.00 0.00 36.38 35.66 2wvt s VAL 129 CO -0.09 0.26 0.12 -0.54 0.00 0.00 0.00 175.10 174.85 2wvt s LYS 130 N 0.79 3.91 -0.11 2.72 1.02 0.65 -0.99 119.74 127.73 2wvt s LYS 130 Ca -0.12 -0.36 0.01 0.00 0.02 0.00 0.00 55.97 55.52 2wvt s LYS 130 Cb -0.15 -3.43 -0.02 0.00 -0.52 0.00 0.00 37.83 33.72 2wvt s LYS 130 CO 0.01 -0.02 -0.14 0.42 -0.92 0.00 0.00 175.35 174.70 2wvt s ILE 131 N 1.22 2.94 -0.56 2.17 1.01 -0.43 -0.14 121.20 127.40 2wvt s ILE 131 Ca 0.06 -0.71 -0.26 0.00 0.00 0.00 0.00 60.65 59.73 2wvt s ILE 131 Cb -0.14 -2.21 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 2wvt s ILE 131 CO 0.05 0.54 2.08 0.42 0.00 0.00 0.00 174.94 178.03 2wvt s THR 132 N 0.17 3.22 0.24 2.92 -4.23 -0.60 -0.24 115.64 117.12 2wvt s THR 132 Ca -0.08 0.12 -0.01 0.00 -1.18 0.00 0.00 61.69 60.54 2wvt s THR 132 Cb -0.15 -3.57 0.04 0.00 1.34 0.00 0.00 72.50 70.16 2wvt s THR 132 CO 0.05 -0.55 1.66 0.71 -0.54 0.00 0.00 174.62 175.95 2wvt h THR 133 N 7.21 1.27 -1.90 3.99 1.35 -1.72 -3.44 112.91 119.67 2wvt h THR 133 Ca -0.25 -1.34 0.06 0.00 -0.55 0.00 0.00 66.41 64.32 2wvt h THR 133 Cb 1.20 1.32 -0.22 0.00 -1.73 0.00 0.00 68.15 68.73 2wvt h THR 133 CO 1.20 0.44 0.02 -0.75 -0.25 0.00 0.00 175.52 176.18 2wvt s LYS 134 N -4.51 0.61 0.27 4.72 2.20 -1.26 -0.91 119.74 120.87 2wvt s LYS 134 Ca -0.08 1.21 0.04 0.00 -0.36 0.00 0.00 55.97 56.78 2wvt s LYS 134 Cb 0.13 0.37 0.05 0.00 -1.51 0.00 0.00 37.83 36.86 2wvt s LYS 134 CO 0.81 -0.15 0.37 1.58 -0.36 0.00 0.00 175.35 177.60 2wvt n HIS 135 N 4.62 -2.73 -0.30 4.03 -0.00 -1.26 -1.72 115.22 117.87 2wvt n HIS 135 Ca -0.17 -0.95 0.16 0.00 -0.00 0.00 0.00 57.72 56.76 2wvt n HIS 135 Cb 0.56 -0.26 0.42 0.00 -0.00 0.00 0.00 29.99 30.70 2wvt n HIS 135 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2wvt h HIS 136 N -0.00 0.79 -0.47 1.57 -0.00 -1.90 -0.93 115.15 114.21 2wvt h HIS 136 Ca -0.13 0.02 0.11 0.00 -0.00 0.00 0.00 60.37 60.38 2wvt h HIS 136 Cb 0.57 -0.24 -0.02 0.00 -0.00 0.00 0.00 27.41 27.71 2wvt h HIS 136 CO 0.00 0.21 0.33 1.05 -0.00 0.00 0.00 177.93 179.51 2wvt h GLU 137 N 0.59 0.12 0.00 2.45 4.11 -1.88 0.40 114.58 120.38 2wvt h GLU 137 Ca 0.51 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.94 2wvt h GLU 137 Cb 1.01 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.24 2wvt h GLU 137 CO -0.26 0.08 0.00 0.41 0.07 0.00 0.00 179.01 179.31 2wvt n GLY 138 N -1.59 0.24 3.67 1.06 0.00 -0.35 -3.44 105.19 104.77 2wvt n GLY 138 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2wvt n GLY 138 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2wvt s PHE 139 N -2.07 2.45 -0.02 1.61 5.36 -1.26 -4.89 117.98 119.14 2wvt s PHE 139 Ca 0.00 0.57 -0.19 0.00 -0.96 0.00 0.00 56.93 56.35 2wvt s PHE 139 Cb 0.00 -3.74 -0.05 0.00 -0.34 0.00 0.00 43.02 38.89 2wvt s PHE 139 CO 0.00 -2.92 0.56 0.00 -1.46 0.00 0.00 175.22 171.40 2wvt n LEU 141 N 2.79 0.55 -4.37 0.00 4.77 -0.09 -1.69 117.00 118.96 2wvt n LEU 141 Ca -0.08 -0.20 -0.24 0.00 -0.03 0.00 0.00 56.01 55.46 2wvt n LEU 141 Cb 0.51 -0.01 -0.11 0.00 -2.33 0.00 0.00 43.42 41.48 2wvt n LEU 141 CO 0.43 0.10 -0.50 -1.66 -1.33 0.00 0.00 177.39 174.43 2wvt s TRP 142 N -1.97 2.02 -1.37 -1.77 -2.14 -1.26 -1.44 118.94 111.00 2wvt s TRP 142 Ca 0.39 -0.42 -0.16 0.00 2.66 0.00 0.00 56.10 58.57 2wvt s TRP 142 Cb 0.19 -1.00 0.05 0.00 -3.10 0.00 0.00 33.47 29.60 2wvt s TRP 142 CO 0.31 0.40 2.00 -0.35 -2.66 0.00 0.00 176.95 176.66 2wvt n PRO 143 N 0.29 2.94 -1.83 3.25 -0.04 -1.26 -4.31 135.00 134.05 2wvt n PRO 143 Ca -0.13 -2.88 -0.38 0.00 -0.04 0.00 0.00 63.50 60.07 2wvt n PRO 143 Cb 0.57 -3.38 0.03 0.00 -0.04 0.00 0.00 33.50 30.68 2wvt n PRO 143 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2wvt s SER 144 N 3.76 5.42 0.00 3.54 0.15 -1.26 -4.92 113.70 120.40 2wvt s SER 144 Ca 0.51 2.74 0.27 0.00 0.70 0.00 0.00 55.95 60.17 2wvt s SER 144 Cb 0.09 -2.63 0.89 0.00 -1.71 0.00 0.00 66.02 62.66 2wvt s SER 144 CO -0.01 -1.47 1.65 1.17 1.20 0.00 0.00 173.24 175.79 2wvt n LYS 145 N -0.88 0.92 0.00 5.44 4.81 -1.26 -4.17 118.16 123.02 2wvt n LYS 145 Ca 0.09 -0.51 0.08 0.00 -0.87 0.00 0.00 58.31 57.11 2wvt n LYS 145 Cb 0.45 -1.49 0.06 0.00 0.02 0.00 0.00 35.03 34.07 2wvt n LYS 145 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2wvt n TYR 146 N -0.60 0.00 -3.63 5.64 4.01 -1.26 -4.96 117.16 116.36 2wvt n TYR 146 Ca 0.14 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.74 2wvt n TYR 146 Cb 0.33 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.30 2wvt n TYR 146 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2wvt s THR 147 N -1.39 0.04 -0.97 -0.72 -1.32 -1.26 -5.03 115.64 105.00 2wvt s THR 147 Ca 0.18 -0.35 0.28 0.00 -1.21 0.00 0.00 61.69 60.59 2wvt s THR 147 Cb 0.13 -0.94 0.19 0.00 -1.51 0.00 0.00 72.50 70.37 2wvt s THR 147 CO 0.22 -0.20 1.80 2.29 -2.21 0.00 0.00 174.62 176.52 2wvt n LYS 148 N 0.55 0.03 -2.51 7.08 2.85 -1.26 -4.58 118.16 120.30 2wvt n LYS 148 Ca -0.19 0.02 -0.43 0.00 -1.05 0.00 0.00 58.31 56.66 2wvt n LYS 148 Cb 0.60 -1.53 0.00 0.00 -0.65 0.00 0.00 35.03 33.45 2wvt n LYS 148 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2wvt n TYR 149 N -1.57 3.53 -4.14 5.58 4.01 -1.26 -4.65 117.16 118.66 2wvt n TYR 149 Ca 0.06 -2.95 -0.11 0.00 -0.16 0.00 0.00 57.90 54.75 2wvt n TYR 149 Cb 0.35 -2.02 -0.09 0.00 -0.31 0.00 0.00 39.34 37.27 2wvt n TYR 149 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2wvt s THR 150 N 0.73 0.05 0.53 -0.72 -4.23 -1.26 -1.18 115.64 109.56 2wvt s THR 150 Ca 0.41 -1.85 0.32 0.00 -1.18 0.00 0.00 61.69 59.39 2wvt s THR 150 Cb 0.06 -2.22 0.49 0.00 1.34 0.00 0.00 72.50 72.17 2wvt s THR 150 CO 0.00 -0.21 1.87 -0.37 -0.54 0.00 0.00 174.62 175.37 2wvt h VAL 151 N 2.68 0.52 -0.31 2.29 -1.51 -1.51 -1.92 116.25 116.49 2wvt h VAL 151 Ca -0.34 -0.01 -0.01 0.00 -1.23 0.00 0.00 66.70 65.10 2wvt h VAL 151 Cb 1.23 0.50 -0.02 0.00 -2.13 0.00 0.00 31.29 30.87 2wvt h VAL 151 CO 0.53 0.00 0.13 0.00 -1.23 0.00 0.00 177.57 177.01 2wvt h ALA 152 N 1.52 1.66 -1.02 5.19 0.00 -1.83 -2.99 119.26 121.79 2wvt h ALA 152 Ca 0.46 -0.08 -0.73 0.00 0.00 0.00 0.00 54.91 54.56 2wvt h ALA 152 Cb 1.81 -0.13 -0.29 0.00 0.00 0.00 0.00 17.79 19.18 2wvt h ALA 152 CO -0.02 0.28 0.91 0.09 0.00 0.00 0.00 179.25 180.50 2wvt n ASN 153 N -4.42 7.43 -4.26 0.00 3.02 -0.72 -4.50 115.26 111.81 2wvt n ASN 153 Ca 0.01 -3.82 -0.14 0.00 -0.03 0.00 0.00 54.58 50.60 2wvt n ASN 153 Cb 0.13 -1.00 -0.10 0.00 -0.61 0.00 0.00 39.78 38.19 2wvt n ASN 153 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2wvt s THR 154 N -5.01 0.92 0.52 3.41 -4.23 -1.14 -4.72 115.64 105.39 2wvt s THR 154 Ca 0.56 -2.02 0.25 0.00 -1.18 0.00 0.00 61.69 59.31 2wvt s THR 154 Cb 0.46 -2.07 0.41 0.00 1.34 0.00 0.00 72.50 72.64 2wvt s THR 154 CO -0.28 -0.55 1.98 -0.65 -0.54 0.00 0.00 174.62 174.58 2wvt h PRO 155 N 2.68 0.03 -0.00 3.99 0.11 -1.76 -2.29 132.00 134.76 2wvt h PRO 155 Ca -0.37 -0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.54 2wvt h PRO 155 Cb 1.20 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2wvt h PRO 155 CO 0.64 0.02 -0.87 -0.92 -0.21 0.00 0.00 178.00 176.66 2wvt h TYR 156 N 0.03 0.33 0.00 0.65 3.20 -1.82 -3.47 116.97 115.89 2wvt h TYR 156 Ca 0.29 -0.18 0.00 0.00 3.14 0.00 0.00 58.73 61.98 2wvt h TYR 156 Cb 1.10 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.33 2wvt h TYR 156 CO -0.00 0.98 0.00 1.63 -1.64 0.00 0.00 178.16 179.13 2wvt n LYS 157 N -3.68 0.00 -1.62 1.82 5.02 -0.86 -4.95 118.16 113.89 2wvt n LYS 157 Ca -0.04 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.91 2wvt n LYS 157 Cb 0.80 -0.70 0.07 0.00 -0.02 0.00 0.00 35.03 35.18 2wvt n LYS 157 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2wvt s ARG 158 N 0.00 2.47 -1.08 1.97 0.52 -1.26 -3.94 118.95 117.63 2wvt s ARG 158 Ca 0.00 1.63 -0.22 0.00 -0.52 0.00 0.00 55.73 56.62 2wvt s ARG 158 Cb 0.00 -1.89 0.04 0.00 0.52 0.00 0.00 34.95 33.62 2wvt s ARG 158 CO 0.00 -1.55 1.58 0.34 0.02 0.00 0.00 175.30 175.69 2wvt s ASP 159 N -2.17 6.40 0.13 0.23 2.15 -1.26 -4.67 116.67 117.47 2wvt s ASP 159 Ca 0.72 -1.61 -0.23 0.00 0.43 0.00 0.00 52.55 51.86 2wvt s ASP 159 Cb -0.26 -2.57 -0.03 0.00 -0.30 0.00 0.00 42.92 39.76 2wvt s ASP 159 CO 0.42 -1.60 1.66 0.40 -0.17 0.00 0.00 175.17 175.88 2wvt h ILE 160 N 6.54 0.54 -0.25 4.11 1.08 -1.90 -1.29 117.51 126.34 2wvt h ILE 160 Ca 0.25 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.76 2wvt h ILE 160 Cb 0.97 0.54 -0.04 0.00 -3.07 0.00 0.00 36.82 35.23 2wvt h ILE 160 CO 1.41 0.00 -0.00 0.25 -0.69 0.00 0.00 178.15 179.12 2wvt h LEU 161 N -0.24 -0.11 -0.94 1.44 5.85 -1.58 -0.29 115.31 119.44 2wvt h LEU 161 Ca 0.09 0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.89 2wvt h LEU 161 Cb 0.37 0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.45 2wvt h LEU 161 CO -0.24 -0.02 0.62 1.23 -0.34 0.00 0.00 178.44 179.69 2wvt h GLY 162 N 0.07 1.35 1.06 3.75 0.00 -1.78 -0.29 103.07 107.23 2wvt h GLY 162 Ca 0.12 -0.48 -0.08 0.00 0.00 0.00 0.00 47.33 46.89 2wvt h GLY 162 CO -0.21 0.45 0.10 0.83 0.00 0.00 0.00 176.54 177.71 2wvt h GLU 163 N 1.24 1.07 -0.13 4.80 5.08 -0.42 -2.66 114.58 123.56 2wvt h GLU 163 Ca 0.36 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 2wvt h GLU 163 Cb -0.08 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 2wvt h GLU 163 CO -0.10 0.99 0.03 -0.07 -1.00 0.00 0.00 179.01 178.86 2wvt h LEU 164 N 0.99 0.20 -0.51 1.33 3.38 -0.82 -1.69 115.31 118.20 2wvt h LEU 164 Ca 0.20 -0.24 0.10 0.00 0.09 0.00 0.00 57.88 58.02 2wvt h LEU 164 Cb 0.44 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.06 2wvt h LEU 164 CO 0.01 0.39 0.04 0.58 0.09 0.00 0.00 178.44 179.56 2wvt h VAL 165 N 0.01 0.64 -0.26 1.22 2.07 -0.99 0.18 116.25 119.12 2wvt h VAL 165 Ca 0.04 -0.06 -0.10 0.00 0.82 0.00 0.00 66.70 67.41 2wvt h VAL 165 Cb 0.27 0.47 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 2wvt h VAL 165 CO 0.00 0.03 -0.23 0.50 0.02 0.00 0.00 177.57 177.89 2wvt h LYS 166 N 0.16 0.61 -0.20 1.57 1.63 -1.45 -0.99 116.57 117.90 2wvt h LYS 166 Ca 0.26 -0.31 -0.02 0.00 -0.85 0.00 0.00 60.65 59.72 2wvt h LYS 166 Cb 0.38 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.01 2wvt h LYS 166 CO -0.39 0.91 0.03 0.00 -3.45 0.00 0.00 179.45 176.55 2wvt h ALA 167 N 0.69 0.27 -0.19 5.00 0.00 -0.82 -0.27 119.26 123.94 2wvt h ALA 167 Ca 0.04 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 2wvt h ALA 167 Cb 0.79 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2wvt h ALA 167 CO 0.06 -0.06 0.12 1.88 0.00 0.00 0.00 179.25 181.24 2wvt h TYR 168 N 0.13 0.25 -0.40 0.00 0.05 -0.68 -2.94 116.97 113.37 2wvt h TYR 168 Ca 0.06 -0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.83 2wvt h TYR 168 Cb 0.31 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 37.95 2wvt h TYR 168 CO 0.02 0.20 0.19 -0.91 -1.05 0.00 0.00 178.16 176.61 2wvt h ASN 169 N 0.23 0.49 0.13 3.88 2.35 -0.99 -1.26 115.58 120.42 2wvt h ASN 169 Ca 0.07 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 2wvt h ASN 169 Cb 0.02 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.26 2wvt h ASN 169 CO -0.01 0.42 -0.06 0.44 -1.65 0.00 0.00 177.43 176.57 2wvt h ASP 170 N 0.56 0.00 -0.27 5.81 3.32 -0.88 -1.99 116.42 122.96 2wvt h ASP 170 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 2wvt h ASP 170 Cb 0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.61 2wvt h ASP 170 CO -0.02 0.06 0.00 -0.62 -1.72 0.00 0.00 179.24 176.94 2wvt n GLU 171 N -3.94 1.97 -1.12 3.56 -0.58 -0.53 -4.93 120.64 115.07 2wvt n GLU 171 Ca -0.03 -1.48 -0.01 0.00 -0.42 0.00 0.00 57.16 55.23 2wvt n GLU 171 Cb 0.15 -1.41 -0.00 0.00 -0.57 0.00 0.00 31.44 29.61 2wvt n GLU 171 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2wvt n GLY 172 N 1.23 0.44 3.55 0.62 0.00 -0.75 -5.01 105.19 105.27 2wvt n GLY 172 Ca 0.17 -1.04 -0.35 0.00 0.00 0.00 0.00 46.02 44.80 2wvt n GLY 172 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wvt s ILE 173 N -2.03 4.53 0.55 -0.61 1.01 -0.84 -4.97 121.20 118.83 2wvt s ILE 173 Ca 0.00 -0.11 -0.19 0.00 0.00 0.00 0.00 60.65 60.35 2wvt s ILE 173 Cb 0.00 -3.07 -0.05 0.00 0.01 0.00 0.00 42.46 39.35 2wvt s ILE 173 CO 0.00 0.41 1.12 -1.81 0.00 0.00 0.00 174.94 174.66 2wvt s ASP 174 N 0.85 5.71 -0.09 3.58 1.01 -0.90 -3.50 116.67 123.34 2wvt s ASP 174 Ca 0.03 2.14 0.04 0.00 0.71 0.00 0.00 52.55 55.47 2wvt s ASP 174 Cb -0.14 -2.58 -0.00 0.00 1.01 0.00 0.00 42.92 41.22 2wvt s ASP 174 CO 0.02 -1.22 -0.23 -0.69 0.21 0.00 0.00 175.17 173.26 2wvt s VAL 175 N -1.85 1.99 -0.03 -1.27 1.01 -1.26 -1.57 120.40 117.43 2wvt s VAL 175 Ca 0.72 -0.99 0.06 0.00 0.00 0.00 0.00 61.98 61.76 2wvt s VAL 175 Cb -0.23 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.41 2wvt s VAL 175 CO 0.28 0.55 -0.20 -1.00 0.00 0.00 0.00 175.10 174.73 2wvt s HIS 176 N 0.27 2.52 -0.27 5.22 3.76 -0.16 -1.55 115.29 125.08 2wvt s HIS 176 Ca -0.16 -0.29 -0.10 0.00 -0.15 0.00 0.00 55.06 54.36 2wvt s HIS 176 Cb -0.17 -1.56 -0.04 0.00 1.11 0.00 0.00 32.58 31.92 2wvt s HIS 176 CO 0.08 0.09 0.14 -0.06 -0.85 0.00 0.00 174.74 174.14 2wvt s PHE 177 N -0.69 3.17 0.34 1.40 0.08 0.05 -1.32 117.98 121.01 2wvt s PHE 177 Ca 0.11 -0.11 -0.27 0.00 0.12 0.00 0.00 56.93 56.78 2wvt s PHE 177 Cb -0.10 -2.33 -0.09 0.00 -0.57 0.00 0.00 43.02 39.93 2wvt s PHE 177 CO 0.00 -0.25 1.04 -0.47 -0.10 0.00 0.00 175.22 175.45 2wvt s TYR 178 N 1.70 3.49 -0.13 0.36 5.04 0.67 -0.12 117.35 128.36 2wvt s TYR 178 Ca 0.07 1.70 -0.05 0.00 -2.44 0.00 0.00 57.07 56.35 2wvt s TYR 178 Cb -0.16 -3.14 0.06 0.00 0.35 0.00 0.00 41.96 39.07 2wvt s TYR 178 CO 0.08 -0.40 0.27 0.12 -1.34 0.00 0.00 175.55 174.28 2wvt s PHE 179 N -1.45 -0.41 -0.19 4.97 5.36 -0.51 -1.85 117.98 123.89 2wvt s PHE 179 Ca 0.51 0.95 -0.20 0.00 -0.96 0.00 0.00 56.93 57.23 2wvt s PHE 179 Cb -0.25 -0.00 -0.03 0.00 -0.34 0.00 0.00 43.02 42.40 2wvt s PHE 179 CO 0.32 -0.33 0.60 0.45 -1.46 0.00 0.00 175.22 174.80 2wvt s SER 180 N 2.13 6.66 -0.07 6.13 0.15 -0.70 -1.63 113.70 126.37 2wvt s SER 180 Ca -0.02 0.80 -0.23 0.00 0.70 0.00 0.00 55.95 57.21 2wvt s SER 180 Cb -0.12 -2.34 -0.18 0.00 -1.71 0.00 0.00 66.02 61.67 2wvt s SER 180 CO -0.09 -0.25 0.88 0.58 1.20 0.00 0.00 173.24 175.57 2wvt h VAL 181 N 5.15 1.17 -1.94 4.45 2.07 -1.46 -3.43 116.25 122.26 2wvt h VAL 181 Ca -0.32 -1.44 -0.64 0.00 0.82 0.00 0.00 66.70 65.12 2wvt h VAL 181 Cb 1.15 2.02 0.05 0.00 -1.52 0.00 0.00 31.29 32.98 2wvt h VAL 181 CO 0.76 0.33 0.72 0.80 0.02 0.00 0.00 177.57 180.20 2wvt n MET 182 N -4.82 1.67 -3.64 1.57 0.00 -0.77 -4.95 117.12 106.18 2wvt n MET 182 Ca -0.08 0.61 -0.26 0.00 -0.00 0.00 0.00 57.70 57.96 2wvt n MET 182 Cb 0.30 -2.33 -0.17 0.00 0.00 0.00 0.00 33.22 31.02 2wvt n MET 182 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2wvt s ASP 183 N 1.44 2.51 0.00 6.12 -1.08 -1.26 -4.30 116.67 120.11 2wvt s ASP 183 Ca 0.85 -0.68 0.24 0.00 -0.52 0.00 0.00 52.55 52.44 2wvt s ASP 183 Cb -0.83 -0.34 1.21 0.00 -1.46 0.00 0.00 42.92 41.50 2wvt s ASP 183 CO 0.46 -0.34 1.79 0.79 0.52 0.00 0.00 175.17 178.39 2wvt n TRP 184 N 5.21 0.00 0.63 -5.34 8.01 0.14 -3.19 117.44 122.91 2wvt n TRP 184 Ca -0.08 0.00 0.11 0.00 -1.31 0.00 0.00 57.50 56.22 2wvt n TRP 184 Cb 0.48 -0.28 -0.03 0.00 -2.01 0.00 0.00 31.31 29.47 2wvt n TRP 184 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 2wvt n SER 185 N -1.28 0.63 -4.36 -0.99 3.41 -1.22 -4.81 113.62 104.99 2wvt n SER 185 Ca 0.11 -0.40 -0.39 0.00 -0.26 0.00 0.00 58.87 57.93 2wvt n SER 185 Cb 0.19 0.99 -0.12 0.00 -0.26 0.00 0.00 64.21 65.01 2wvt n SER 185 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2wvt s ASN 186 N -3.69 5.53 0.00 4.04 3.84 -1.19 -4.97 114.94 118.49 2wvt s ASN 186 Ca 0.04 -0.91 0.17 0.00 0.21 0.00 0.00 52.86 52.37 2wvt s ASN 186 Cb 0.15 -1.97 0.95 0.00 -0.55 0.00 0.00 41.25 39.83 2wvt s ASN 186 CO 0.83 -0.31 1.46 -0.81 -2.79 0.00 0.00 177.10 175.47 2wvt n PRO 187 N 4.94 0.40 0.00 0.43 -0.04 -1.26 -1.60 135.00 137.87 2wvt n PRO 187 Ca -0.13 0.06 0.13 0.00 -0.04 0.00 0.00 63.50 63.53 2wvt n PRO 187 Cb 0.47 -1.50 0.59 0.00 -0.04 0.00 0.00 33.50 33.01 2wvt n PRO 187 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2wvt n ASP 188 N -1.13 0.00 -4.77 3.54 8.00 -1.26 -4.83 116.55 116.10 2wvt n ASP 188 Ca 0.11 0.50 -0.40 0.00 0.71 0.00 0.00 54.79 55.70 2wvt n ASP 188 Cb 0.09 -0.50 0.01 0.00 -0.02 0.00 0.00 41.12 40.70 2wvt n ASP 188 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2wvt s TYR 189 N -3.00 2.56 0.03 1.24 5.04 -0.63 -3.69 117.35 118.90 2wvt s TYR 189 Ca 0.13 1.29 0.04 0.00 -2.44 0.00 0.00 57.07 56.09 2wvt s TYR 189 Cb 0.18 -3.87 -0.02 0.00 0.35 0.00 0.00 41.96 38.60 2wvt s TYR 189 CO 0.50 -2.73 -0.11 1.03 -1.34 0.00 0.00 175.55 172.89 2wvt s ARG 190 N -2.37 0.78 0.09 4.97 1.81 -1.26 -4.98 118.95 117.99 2wvt s ARG 190 Ca 0.59 -0.65 0.14 0.00 -1.72 0.00 0.00 55.73 54.10 2wvt s ARG 190 Cb -0.43 -0.73 -0.12 0.00 -0.45 0.00 0.00 34.95 33.22 2wvt s ARG 190 CO 0.55 0.18 0.98 1.88 -0.68 0.00 0.00 175.30 178.21 2wvt h TYR 191 N 5.08 0.00 -3.56 -0.53 -1.99 -1.98 -3.43 116.97 110.55 2wvt h TYR 191 Ca -0.36 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.32 2wvt h TYR 191 Cb 1.19 0.00 -0.11 0.00 2.00 0.00 0.00 36.73 39.81 2wvt h TYR 191 CO 0.53 0.70 -0.12 0.34 -0.00 0.00 0.00 178.16 179.61 2wvt s ASP 192 N -6.10 -0.12 -0.38 3.88 -1.08 -1.26 -2.03 116.67 109.58 2wvt s ASP 192 Ca -0.01 -0.69 -0.09 0.00 -0.52 0.00 0.00 52.55 51.23 2wvt s ASP 192 Cb 0.08 0.53 0.05 0.00 -1.46 0.00 0.00 42.92 42.12 2wvt s ASP 192 CO 0.80 -1.02 0.20 -0.63 0.52 0.00 0.00 175.17 175.05 2wvt s ILE 193 N -3.93 4.29 0.00 4.11 -1.09 -1.26 -4.85 121.20 118.47 2wvt s ILE 193 Ca 0.14 -1.09 0.00 0.00 -2.23 0.00 0.00 60.65 57.47 2wvt s ILE 193 Cb 0.00 -3.48 0.00 0.00 -1.58 0.00 0.00 42.46 37.41 2wvt s ILE 193 CO 0.00 -0.31 0.64 0.29 -1.23 0.00 0.00 174.94 174.33 2wvt n LYS 194 N 4.93 0.52 -3.89 2.79 5.02 -1.26 -5.04 118.16 121.23 2wvt n LYS 194 Ca -0.11 -0.81 -0.07 0.00 -2.02 0.00 0.00 58.31 55.29 2wvt n LYS 194 Cb 0.45 -0.94 -0.03 0.00 -0.02 0.00 0.00 35.03 34.49 2wvt n LYS 194 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2wvt s SER 195 N -0.35 -0.22 0.29 4.39 1.04 -1.26 -5.01 113.70 112.58 2wvt s SER 195 Ca 0.00 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 55.74 2wvt s SER 195 Cb 0.00 0.70 0.43 0.00 0.10 0.00 0.00 66.02 67.26 2wvt s SER 195 CO 0.00 -1.32 1.81 0.11 0.98 0.00 0.00 173.24 174.82 2wvt h LYS 196 N 2.05 0.71 -0.23 4.02 1.57 -2.01 -3.09 116.57 119.59 2wvt h LYS 196 Ca -0.21 -0.17 -0.15 0.00 -1.87 0.00 0.00 60.65 58.26 2wvt h LYS 196 Cb 1.25 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 2wvt h LYS 196 CO 0.26 0.71 -0.46 1.49 -0.57 0.00 0.00 179.45 180.88 2wvt h GLU 197 N 0.68 0.59 -0.98 3.15 4.22 -2.01 -2.81 114.58 117.43 2wvt h GLU 197 Ca 0.14 -0.33 0.08 0.00 0.08 0.00 0.00 59.36 59.33 2wvt h GLU 197 Cb 0.38 0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.58 2wvt h GLU 197 CO 0.01 0.93 0.63 -0.44 -2.18 0.00 0.00 179.01 177.96 2wvt h ASP 198 N 0.48 0.97 -0.17 1.04 3.32 -1.92 -1.82 116.42 118.32 2wvt h ASP 198 Ca 0.03 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 2wvt h ASP 198 Cb 0.98 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.34 2wvt h ASP 198 CO 0.09 0.59 0.07 -1.28 -1.72 0.00 0.00 179.24 177.00 2wvt h SER 199 N 1.09 0.23 -0.35 6.45 0.87 -1.49 -1.30 113.55 119.05 2wvt h SER 199 Ca 0.44 -0.15 -0.02 0.00 -1.23 0.00 0.00 61.79 60.83 2wvt h SER 199 Cb 0.27 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.15 2wvt h SER 199 CO -0.19 0.32 0.13 0.40 -0.53 0.00 0.00 176.83 176.96 2wvt h ILE 200 N 0.13 1.19 -0.62 2.23 1.08 -1.35 -2.33 117.51 117.84 2wvt h ILE 200 Ca 0.06 -0.60 -0.06 0.00 -0.39 0.00 0.00 64.86 63.86 2wvt h ILE 200 Cb 0.15 0.94 -0.03 0.00 -3.07 0.00 0.00 36.82 34.82 2wvt h ILE 200 CO -0.01 0.21 0.15 0.00 -0.69 0.00 0.00 178.15 177.81 2wvt h ALA 201 N 0.97 0.82 -0.41 1.87 0.00 -1.28 -2.65 119.26 118.57 2wvt h ALA 201 Ca 0.11 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 2wvt h ALA 201 Cb 0.20 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2wvt h ALA 201 CO -0.01 0.54 -0.00 0.35 0.00 0.00 0.00 179.25 180.13 2wvt h PHE 202 N 0.92 0.70 -0.84 0.00 3.57 -1.08 -0.31 116.94 119.90 2wvt h PHE 202 Ca 0.20 -0.09 0.01 0.00 3.53 0.00 0.00 57.97 61.61 2wvt h PHE 202 Cb 0.36 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 38.86 2wvt h PHE 202 CO 0.03 0.67 0.55 0.77 -2.23 0.00 0.00 178.31 178.09 2wvt h SER 203 N 0.63 0.98 -0.74 0.41 0.02 -1.20 -0.46 113.55 113.19 2wvt h SER 203 Ca 0.13 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 2wvt h SER 203 Cb 0.40 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 2wvt h SER 203 CO 0.02 0.72 0.40 0.03 -1.14 0.00 0.00 176.83 176.85 2wvt h ARG 204 N 1.14 1.03 -0.78 3.45 3.08 -0.90 -2.73 114.38 118.67 2wvt h ARG 204 Ca 0.31 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 60.24 2wvt h ARG 204 Cb -0.11 -0.20 -0.04 0.00 0.08 0.00 0.00 29.97 29.70 2wvt h ARG 204 CO -0.06 0.77 0.50 0.35 -1.07 0.00 0.00 179.97 180.45 2wvt h PHE 205 N 1.02 1.01 -0.44 3.04 3.57 -0.06 -1.61 116.94 123.46 2wvt h PHE 205 Ca 0.26 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.71 2wvt h PHE 205 Cb 0.04 -0.34 -0.02 0.00 2.79 0.00 0.00 35.95 38.42 2wvt h PHE 205 CO -0.00 0.65 0.04 -0.07 -2.23 0.00 0.00 178.31 176.70 2wvt h LEU 206 N 1.07 0.66 -0.26 0.59 3.38 -1.00 -1.00 115.31 118.75 2wvt h LEU 206 Ca 0.28 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 2wvt h LEU 206 Cb -0.09 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 2wvt h LEU 206 CO -0.06 0.71 -0.06 -0.08 0.09 0.00 0.00 178.44 179.04 2wvt h GLU 207 N 0.67 0.50 -0.48 1.13 4.81 -1.16 0.52 114.58 120.56 2wvt h GLU 207 Ca 0.14 -0.19 0.07 0.00 -0.13 0.00 0.00 59.36 59.25 2wvt h GLU 207 Cb 0.36 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.66 2wvt h GLU 207 CO 0.01 0.71 0.16 0.35 -0.73 0.00 0.00 179.01 179.52 2wvt h PHE 208 N 0.24 0.29 -0.15 0.92 3.57 -1.12 -0.28 116.94 120.42 2wvt h PHE 208 Ca 0.07 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.59 2wvt h PHE 208 Cb 0.53 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.21 2wvt h PHE 208 CO 0.05 0.09 0.09 1.15 -2.23 0.00 0.00 178.31 177.46 2wvt h THR 209 N 0.34 1.09 -0.61 4.41 2.02 -1.01 -1.66 112.91 117.49 2wvt h THR 209 Ca 0.23 -0.24 0.12 0.00 0.77 0.00 0.00 66.41 67.29 2wvt h THR 209 Cb 0.25 0.97 -0.10 0.00 -1.74 0.00 0.00 68.15 67.53 2wvt h THR 209 CO -0.24 0.08 0.05 0.44 0.37 0.00 0.00 175.52 176.22 2wvt h ASP 210 N 0.15 -0.16 -0.44 4.18 5.19 -0.61 -0.62 116.42 124.11 2wvt h ASP 210 Ca 0.05 0.14 0.03 0.00 -0.62 0.00 0.00 57.03 56.63 2wvt h ASP 210 Cb 0.06 0.22 -0.03 0.00 0.18 0.00 0.00 39.33 39.76 2wvt h ASP 210 CO -0.01 -0.07 0.25 0.78 -3.12 0.00 0.00 179.24 177.07 2wvt h ASN 211 N 0.17 0.39 -0.79 6.45 2.35 -0.30 -1.00 115.58 122.85 2wvt h ASN 211 Ca 0.32 0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 56.04 2wvt h ASN 211 Cb 0.51 -0.07 -0.04 0.00 0.05 0.00 0.00 38.32 38.77 2wvt h ASN 211 CO -0.48 0.28 0.32 1.56 -1.65 0.00 0.00 177.43 177.46 2wvt h GLN 212 N 0.50 1.19 -0.25 0.81 4.20 -0.82 -1.09 115.11 119.66 2wvt h GLN 212 Ca 0.18 -0.22 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 2wvt h GLN 212 Cb 0.04 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.62 2wvt h GLN 212 CO -0.10 0.96 0.02 -0.07 -0.67 0.00 0.00 178.83 178.97 2wvt h LEU 213 N 1.16 0.40 -0.96 1.46 3.38 -0.66 -0.17 115.31 119.92 2wvt h LEU 213 Ca 0.26 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 2wvt h LEU 213 Cb 0.22 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2wvt h LEU 213 CO -0.02 0.58 0.11 0.11 0.09 0.00 0.00 178.44 179.32 2wvt h LYS 214 N 0.21 0.87 -0.17 1.13 1.57 -1.11 -1.67 116.57 117.39 2wvt h LYS 214 Ca 0.07 -0.19 0.01 0.00 -1.87 0.00 0.00 60.65 58.67 2wvt h LYS 214 Cb 0.36 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 2wvt h LYS 214 CO 0.01 0.80 0.08 1.49 -0.57 0.00 0.00 179.45 181.25 2wvt h GLU 215 N 0.83 0.16 -0.62 3.15 4.81 -0.88 -1.71 114.58 120.32 2wvt h GLU 215 Ca 0.18 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.42 2wvt h GLU 215 Cb 0.34 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.64 2wvt h GLU 215 CO 0.00 0.11 0.39 -0.07 -0.73 0.00 0.00 179.01 178.71 2wvt h LEU 216 N 0.17 0.66 -1.41 1.64 3.38 -0.72 0.58 115.31 119.61 2wvt h LEU 216 Ca 0.07 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 2wvt h LEU 216 Cb 0.02 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2wvt h LEU 216 CO -0.06 0.47 -0.19 0.00 0.09 0.00 0.00 178.44 178.76 2wvt h ALA 217 N 1.25 1.51 0.09 1.53 0.00 -1.15 -2.29 119.26 120.21 2wvt h ALA 217 Ca 0.24 -0.22 -0.35 0.00 0.00 0.00 0.00 54.91 54.58 2wvt h ALA 217 Cb -0.03 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2wvt h ALA 217 CO -0.08 0.35 -1.96 0.25 0.00 0.00 0.00 179.25 177.81 2wvt n THR 218 N -4.25 1.73 -0.02 0.00 -2.24 -0.66 -3.76 114.28 105.09 2wvt n THR 218 Ca -0.01 -0.69 -0.05 0.00 -2.27 0.00 0.00 64.05 61.03 2wvt n THR 218 Cb 0.29 -1.56 0.17 0.00 -2.10 0.00 0.00 70.33 67.13 2wvt n THR 218 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2wvt h ARG 219 N 0.05 0.58 -2.42 -0.78 3.08 -0.93 -3.37 114.38 110.59 2wvt h ARG 219 Ca -0.40 -0.22 -0.60 0.00 0.07 0.00 0.00 59.98 58.84 2wvt h ARG 219 Cb 2.03 -0.04 -0.41 0.00 0.08 0.00 0.00 29.97 31.64 2wvt h ARG 219 CO 0.08 0.76 -0.75 0.66 -1.07 0.00 0.00 179.97 179.65 2wvt n TYR 220 N -4.13 2.02 1.78 3.04 4.01 -0.86 -4.97 117.16 118.06 2wvt n TYR 220 Ca -0.00 -3.95 0.14 0.00 -0.16 0.00 0.00 57.90 53.93 2wvt n TYR 220 Cb 0.40 -0.41 0.83 0.00 -0.31 0.00 0.00 39.34 39.86 2wvt n TYR 220 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2wvt n PRO 221 N 1.56 0.89 0.00 -0.72 -0.04 -1.25 -2.28 135.00 133.16 2wvt n PRO 221 Ca 0.25 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.87 2wvt n PRO 221 Cb 0.43 -1.49 0.77 0.00 -0.04 0.00 0.00 33.50 33.17 2wvt n PRO 221 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2wvt n THR 222 N -0.99 0.00 -1.73 0.52 -2.24 -1.26 -4.91 114.28 103.67 2wvt n THR 222 Ca 0.21 -0.08 -0.42 0.00 -2.27 0.00 0.00 64.05 61.48 2wvt n THR 222 Cb 0.10 -0.14 -0.02 0.00 -2.10 0.00 0.00 70.33 68.17 2wvt n THR 222 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2wvt n VAL 223 N -0.64 1.16 0.32 2.28 3.14 -0.97 -4.58 118.33 119.05 2wvt n VAL 223 Ca 0.21 -0.29 0.04 0.00 -2.96 0.00 0.00 64.34 61.34 2wvt n VAL 223 Cb 0.21 -1.85 -0.06 0.00 -1.06 0.00 0.00 33.84 31.08 2wvt n VAL 223 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 2wvt n LYS 224 N 1.87 3.11 -3.57 1.45 4.76 -0.60 -4.88 118.16 120.30 2wvt n LYS 224 Ca 0.08 -0.02 -0.16 0.00 -2.87 0.00 0.00 58.31 55.34 2wvt n LYS 224 Cb 0.36 -1.00 -0.07 0.00 -1.84 0.00 0.00 35.03 32.49 2wvt n LYS 224 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2wvt s ASP 225 N -2.15 -0.66 -0.19 4.39 2.15 -1.26 -1.24 116.67 117.72 2wvt s ASP 225 Ca 0.02 0.91 0.00 0.00 0.43 0.00 0.00 52.55 53.91 2wvt s ASP 225 Cb 0.07 0.82 0.02 0.00 -0.30 0.00 0.00 42.92 43.52 2wvt s ASP 225 CO 0.38 -0.48 -0.16 -0.36 -0.17 0.00 0.00 175.17 174.37 2wvt s PHE 226 N -0.68 2.84 -0.45 -5.34 0.40 -0.57 -0.77 117.98 113.41 2wvt s PHE 226 Ca -0.07 -1.54 -0.08 0.00 -0.60 0.00 0.00 56.93 54.64 2wvt s PHE 226 Cb -0.02 -1.96 0.11 0.00 0.51 0.00 0.00 43.02 41.66 2wvt s PHE 226 CO 0.07 -0.76 0.30 -0.46 0.70 0.00 0.00 175.22 175.06 2wvt s TRP 227 N 1.32 3.45 0.28 0.36 -0.00 0.83 -2.66 118.94 122.52 2wvt s TRP 227 Ca 0.04 -1.96 -0.20 0.00 -0.00 0.00 0.00 56.10 53.99 2wvt s TRP 227 Cb -0.14 -3.35 -0.09 0.00 -0.00 0.00 0.00 33.47 29.90 2wvt s TRP 227 CO -0.11 -0.97 0.79 -0.06 -0.00 0.00 0.00 176.95 176.60 2wvt s PHE 228 N 1.32 3.56 0.24 5.86 0.08 -1.26 -1.43 117.98 126.34 2wvt s PHE 228 Ca 0.06 1.44 -0.02 0.00 0.12 0.00 0.00 56.93 58.52 2wvt s PHE 228 Cb -0.25 -2.67 -0.03 0.00 -0.57 0.00 0.00 43.02 39.50 2wvt s PHE 228 CO -0.01 0.21 0.24 0.34 -0.10 0.00 0.00 175.22 175.90 2wvt s ASP 229 N -1.85 0.35 -1.18 1.36 2.15 -0.65 -4.35 116.67 112.52 2wvt s ASP 229 Ca 0.49 -1.36 -0.07 0.00 0.43 0.00 0.00 52.55 52.03 2wvt s ASP 229 Cb -0.15 0.46 0.01 0.00 -0.30 0.00 0.00 42.92 42.94 2wvt s ASP 229 CO 0.20 -0.95 0.95 0.61 -0.17 0.00 0.00 175.17 175.80 2wvt n GLY 230 N -0.36 -0.32 0.09 2.66 0.00 -1.26 -1.60 105.19 104.40 2wvt n GLY 230 Ca 0.02 0.10 0.08 0.00 0.00 0.00 0.00 46.02 46.23 2wvt n GLY 230 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wvt n THR 231 N -4.60 1.76 0.85 2.61 -2.24 -1.26 -1.85 114.28 109.55 2wvt n THR 231 Ca -0.00 -2.05 0.12 0.00 -2.27 0.00 0.00 64.05 59.84 2wvt n THR 231 Cb 0.56 -0.12 0.17 0.00 -2.10 0.00 0.00 70.33 68.84 2wvt n THR 231 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 2wvt n TRP 232 N -1.25 0.14 -1.92 4.78 2.14 -1.26 -4.57 117.44 115.50 2wvt n TRP 232 Ca 0.14 0.04 -0.33 0.00 2.07 0.00 0.00 57.50 59.42 2wvt n TRP 232 Cb 0.59 -0.34 0.03 0.00 -0.81 0.00 0.00 31.31 30.78 2wvt n TRP 232 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 2wvt s ASP 233 N -3.37 5.44 0.41 -0.67 1.01 -1.26 -4.84 116.67 113.38 2wvt s ASP 233 Ca 0.09 1.94 0.10 0.00 0.71 0.00 0.00 52.55 55.39 2wvt s ASP 233 Cb 0.16 -2.55 0.92 0.00 1.01 0.00 0.00 42.92 42.46 2wvt s ASP 233 CO 0.73 -1.40 2.01 0.00 0.21 0.00 0.00 175.17 176.72 2wvt h ALA 234 N 0.31 1.84 -0.65 5.23 0.00 -1.83 -1.98 119.26 122.18 2wvt h ALA 234 Ca -0.47 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.50 2wvt h ALA 234 Cb 1.24 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.83 2wvt h ALA 234 CO 0.56 0.08 0.31 0.66 0.00 0.00 0.00 179.25 180.85 2wvt h SER 235 N 0.52 0.39 -0.19 0.00 4.64 -1.68 0.18 113.55 117.41 2wvt h SER 235 Ca 0.23 0.06 -0.20 0.00 -0.47 0.00 0.00 61.79 61.40 2wvt h SER 235 Cb 0.24 -0.01 0.01 0.00 -0.31 0.00 0.00 62.40 62.33 2wvt h SER 235 CO -0.06 0.24 -0.68 0.58 -0.87 0.00 0.00 176.83 176.03 2wvt h VAL 236 N 0.54 1.28 -0.23 0.95 2.07 -1.68 -3.11 116.25 116.07 2wvt h VAL 236 Ca 0.31 -1.88 0.00 0.00 0.82 0.00 0.00 66.70 65.96 2wvt h VAL 236 Cb 0.31 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.97 2wvt h VAL 236 CO -0.25 0.60 0.15 0.11 0.02 0.00 0.00 177.57 178.20 2wvt h LYS 237 N 0.53 0.30 0.00 1.57 1.57 -0.79 0.26 116.57 120.01 2wvt h LYS 237 Ca -0.03 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2wvt h LYS 237 Cb 1.31 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.55 2wvt h LYS 237 CO 0.14 0.20 0.00 1.63 -0.57 0.00 0.00 179.45 180.85 2wvt n LYS 238 N -4.50 0.67 -2.43 3.15 5.02 -0.01 -3.72 118.16 116.33 2wvt n LYS 238 Ca 0.01 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.08 2wvt n LYS 238 Cb 0.08 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.60 2wvt n LYS 238 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2wvt n ASN 239 N -1.15 4.11 -0.28 4.39 4.13 0.92 -4.85 115.26 122.53 2wvt n ASN 239 Ca 0.18 -3.49 0.08 0.00 1.68 0.00 0.00 54.58 53.04 2wvt n ASN 239 Cb 0.18 -0.45 0.21 0.00 -1.54 0.00 0.00 39.78 38.18 2wvt n ASN 239 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 2wvt h GLY 240 N 2.56 1.04 0.30 7.41 0.00 -1.63 0.31 103.07 113.06 2wvt h GLY 240 Ca 0.23 0.07 0.16 0.00 0.00 0.00 0.00 47.33 47.79 2wvt h GLY 240 CO 0.74 -0.33 0.62 0.11 0.00 0.00 0.00 176.54 177.68 2wvt h TRP 241 N 0.13 1.07 -0.40 5.60 5.08 -1.85 -1.33 115.95 124.24 2wvt h TRP 241 Ca 0.47 0.03 -0.13 0.00 1.08 0.00 0.00 58.89 60.35 2wvt h TRP 241 Cb 0.89 -0.33 -0.01 0.00 -3.00 0.00 0.00 29.16 26.71 2wvt h TRP 241 CO -0.38 0.33 -0.25 2.35 -1.28 0.00 0.00 178.44 179.20 2wvt h TRP 242 N 0.84 0.96 -0.61 0.12 7.01 -1.31 -0.60 115.95 122.35 2wvt h TRP 242 Ca 0.53 -0.23 -0.08 0.00 2.11 0.00 0.00 58.89 61.22 2wvt h TRP 242 Cb 0.73 -0.22 -0.02 0.00 -2.10 0.00 0.00 29.16 27.54 2wvt h TRP 242 CO -0.00 0.99 0.06 1.79 -2.79 0.00 0.00 178.44 178.49 2wvt h THR 243 N 0.72 1.26 -0.63 2.65 1.35 -1.06 0.24 112.91 117.43 2wvt h THR 243 Ca 0.09 -1.05 -0.06 0.00 -0.55 0.00 0.00 66.41 64.84 2wvt h THR 243 Cb 0.79 0.72 -0.03 0.00 -1.73 0.00 0.00 68.15 67.91 2wvt h THR 243 CO 0.07 0.39 0.16 0.00 -0.25 0.00 0.00 175.52 175.88 2wvt h ALA 244 N 1.11 0.83 -0.69 6.62 0.00 -1.18 -2.19 119.26 123.75 2wvt h ALA 244 Ca 0.18 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 2wvt h ALA 244 Cb 0.47 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2wvt h ALA 244 CO 0.02 0.54 0.13 1.25 0.00 0.00 0.00 179.25 181.20 2wvt h HIS 245 N 0.93 1.20 -0.40 0.00 -0.00 -0.65 -1.99 115.15 114.24 2wvt h HIS 245 Ca 0.20 -0.16 -0.03 0.00 -0.00 0.00 0.00 60.37 60.38 2wvt h HIS 245 Cb 0.36 -0.33 -0.02 0.00 -0.00 0.00 0.00 27.41 27.42 2wvt h HIS 245 CO 0.03 0.98 0.12 0.00 -0.00 0.00 0.00 177.93 179.06 2wvt h ALA 246 N 1.07 0.53 -0.14 5.26 0.00 -0.33 0.43 119.26 126.08 2wvt h ALA 246 Ca 0.21 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.99 2wvt h ALA 246 Cb 0.42 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 2wvt h ALA 246 CO 0.01 0.19 -0.15 1.49 0.00 0.00 0.00 179.25 180.78 2wvt h GLU 247 N 0.51 -0.18 -0.24 0.00 4.81 -1.31 -2.27 114.58 115.90 2wvt h GLU 247 Ca 0.13 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 2wvt h GLU 247 Cb 0.28 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 2wvt h GLU 247 CO -0.00 -0.12 -0.01 0.37 -0.73 0.00 0.00 179.01 178.52 2wvt h GLN 248 N -0.18 0.43 -0.53 1.92 5.75 -0.98 -1.59 115.11 119.93 2wvt h GLN 248 Ca 0.10 -0.14 0.11 0.00 -0.15 0.00 0.00 58.65 58.56 2wvt h GLN 248 Cb 0.33 -0.04 -0.09 0.00 1.07 0.00 0.00 27.48 28.75 2wvt h GLN 248 CO -0.25 0.62 -0.04 1.98 -2.65 0.00 0.00 178.83 178.48 2wvt h MET 249 N 0.20 0.07 -0.21 1.69 4.05 -0.90 0.15 114.93 119.99 2wvt h MET 249 Ca 0.07 -0.00 -0.16 0.00 -0.28 0.00 0.00 59.70 59.32 2wvt h MET 249 Cb 0.43 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.20 2wvt h MET 249 CO 0.01 0.05 -0.53 -0.07 0.23 0.00 0.00 176.91 176.60 2wvt h LEU 250 N 0.08 0.67 -1.08 3.39 3.38 -1.25 -2.01 115.31 118.49 2wvt h LEU 250 Ca 0.27 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 2wvt h LEU 250 Cb 0.42 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 2wvt h LEU 250 CO -0.48 1.07 0.39 0.11 0.09 0.00 0.00 178.44 179.62 2wvt h LYS 251 N 0.47 1.04 -0.26 1.13 1.57 -0.67 0.13 116.57 119.97 2wvt h LYS 251 Ca 0.01 -0.12 -0.06 0.00 -1.87 0.00 0.00 60.65 58.61 2wvt h LYS 251 Cb 1.08 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 33.17 2wvt h LYS 251 CO 0.10 0.77 -0.08 0.93 -0.57 0.00 0.00 179.45 180.60 2wvt h GLU 252 N 1.04 0.43 0.11 3.15 5.08 -0.33 -3.17 114.58 120.88 2wvt h GLU 252 Ca 0.26 -0.10 -0.28 0.00 -1.00 0.00 0.00 59.36 58.24 2wvt h GLU 252 Cb 0.05 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2wvt h GLU 252 CO -0.04 0.52 -1.36 -0.07 -1.00 0.00 0.00 179.01 177.06 2wvt h LEU 253 N 0.40 0.36 -7.50 1.33 3.38 -0.77 -3.43 115.31 109.08 2wvt h LEU 253 Ca 0.08 -0.43 -0.63 0.00 0.09 0.00 0.00 57.88 56.99 2wvt h LEU 253 Cb 0.40 -0.12 -0.40 0.00 0.09 0.00 0.00 40.66 40.64 2wvt h LEU 253 CO 0.02 1.35 -0.74 -0.69 0.09 0.00 0.00 178.44 178.47 2wvt s VAL 254 N -2.64 1.69 0.06 1.22 1.01 -0.02 -5.01 120.40 116.71 2wvt s VAL 254 Ca -0.06 -1.86 -0.36 0.00 0.00 0.00 0.00 61.98 59.70 2wvt s VAL 254 Cb 0.07 -2.21 -0.15 0.00 0.00 0.00 0.00 36.38 34.08 2wvt s VAL 254 CO 0.86 -0.56 1.48 -2.65 0.00 0.00 0.00 175.10 174.24 2wvt n PRO 255 N 4.52 1.50 -0.99 2.72 -0.02 -1.26 -2.15 135.00 139.31 2wvt n PRO 255 Ca -0.00 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 2wvt n PRO 255 Cb 0.42 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 2wvt n PRO 255 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wvt n GLY 256 N 3.06 0.43 3.76 -1.23 0.00 -1.26 -4.99 105.19 104.96 2wvt n GLY 256 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 2wvt n GLY 256 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wvt s VAL 257 N -1.90 2.45 0.08 1.61 0.11 -0.92 -4.61 120.40 117.22 2wvt s VAL 257 Ca 0.00 0.36 -0.08 0.00 -2.93 0.00 0.00 61.98 59.33 2wvt s VAL 257 Cb 0.00 -3.20 -0.06 0.00 -1.53 0.00 0.00 36.38 31.60 2wvt s VAL 257 CO 0.00 0.02 0.38 0.00 -3.33 0.00 0.00 175.10 172.17 2wvt s ALA 258 N -1.33 3.76 -0.04 1.54 0.00 -0.37 -4.94 121.76 120.37 2wvt s ALA 258 Ca 0.64 -0.45 0.02 0.00 0.00 0.00 0.00 51.96 52.17 2wvt s ALA 258 Cb -0.38 -2.21 0.01 0.00 0.00 0.00 0.00 23.12 20.55 2wvt s ALA 258 CO 0.46 0.60 -0.08 0.42 0.00 0.00 0.00 175.76 177.17 2wvt s ILE 259 N -1.45 0.76 0.54 0.00 -1.09 -1.26 -1.51 121.20 117.19 2wvt s ILE 259 Ca 0.34 -0.28 -0.10 0.00 -2.23 0.00 0.00 60.65 58.38 2wvt s ILE 259 Cb -0.13 -0.72 -0.05 0.00 -1.58 0.00 0.00 42.46 39.98 2wvt s ILE 259 CO 0.19 0.26 0.93 0.54 -1.23 0.00 0.00 174.94 175.63 2wvt s ASN 260 N 0.66 6.35 0.44 3.58 4.22 -1.09 -0.26 114.94 128.83 2wvt s ASN 260 Ca -0.11 1.28 0.21 0.00 -2.14 0.00 0.00 52.86 52.11 2wvt s ASN 260 Cb -0.13 -2.40 1.02 0.00 1.28 0.00 0.00 41.25 41.01 2wvt s ASN 260 CO 0.01 -0.68 1.91 0.77 -2.04 0.00 0.00 177.10 177.06 2wvt h SER 261 N 0.24 0.00 0.10 3.54 4.64 -1.32 -3.11 113.55 117.65 2wvt h SER 261 Ca -0.46 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.85 2wvt h SER 261 Cb 1.19 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2wvt h SER 261 CO 0.62 0.25 -0.06 -0.09 -0.87 0.00 0.00 176.83 176.68 2wvt h ARG 262 N 0.00 0.00 -0.94 4.77 2.43 -1.84 -0.99 114.38 117.81 2wvt h ARG 262 Ca -0.00 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.24 2wvt h ARG 262 Cb 0.58 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.07 2wvt h ARG 262 CO 0.03 0.06 0.61 1.25 -1.51 0.00 0.00 179.97 180.41 2wvt h LEU 263 N 0.00 0.94 -9.44 3.80 5.85 -1.74 -3.44 115.31 111.27 2wvt h LEU 263 Ca -0.00 0.01 -0.60 0.00 0.84 0.00 0.00 57.88 58.13 2wvt h LEU 263 Cb 0.13 -0.19 -0.08 0.00 0.37 0.00 0.00 40.66 40.89 2wvt h LEU 263 CO 0.01 0.59 -0.24 -0.13 -0.34 0.00 0.00 178.44 178.33 2wvt s ARG 264 N -5.93 4.13 0.05 1.25 1.81 -0.38 -4.85 118.95 115.02 2wvt s ARG 264 Ca -0.12 0.29 0.04 0.00 -1.72 0.00 0.00 55.73 54.23 2wvt s ARG 264 Cb 0.20 -3.35 -0.02 0.00 -0.45 0.00 0.00 34.95 31.33 2wvt s ARG 264 CO 0.80 0.39 -0.13 0.00 -0.68 0.00 0.00 175.30 175.68 2wvt s ALA 265 N -0.05 1.05 0.32 2.13 0.00 -1.26 -2.09 121.76 121.85 2wvt s ALA 265 Ca 0.21 -0.83 0.01 0.00 0.00 0.00 0.00 51.96 51.35 2wvt s ALA 265 Cb -0.15 -0.12 0.03 0.00 0.00 0.00 0.00 23.12 22.87 2wvt s ALA 265 CO 0.09 0.17 0.18 -0.40 0.00 0.00 0.00 175.76 175.80 2wvt n ASP 266 N 1.74 0.33 -0.31 0.00 5.75 -0.70 -4.40 116.55 118.96 2wvt n ASP 266 Ca -0.19 -1.26 0.24 0.00 -0.01 0.00 0.00 54.79 53.57 2wvt n ASP 266 Cb 0.55 -0.11 0.54 0.00 -1.03 0.00 0.00 41.12 41.06 2wvt n ASP 266 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 2wvt h ASP 267 N -0.06 0.38 0.13 -1.12 3.45 -1.91 0.11 116.42 117.40 2wvt h ASP 267 Ca -0.06 0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.47 2wvt h ASP 267 Cb 0.25 0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.02 2wvt h ASP 267 CO 0.07 0.08 -0.25 0.29 -1.57 0.00 0.00 179.24 177.86 2wvt n LYS 268 N -4.56 1.13 -1.12 3.56 4.01 -1.26 -4.94 118.16 114.99 2wvt n LYS 268 Ca 0.24 -0.76 0.00 0.00 -0.51 0.00 0.00 58.31 57.29 2wvt n LYS 268 Cb 0.90 -1.48 0.00 0.00 -0.51 0.00 0.00 35.03 33.93 2wvt n LYS 268 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2wvt n GLY 269 N 1.33 0.41 3.73 0.72 0.00 0.39 -5.02 105.19 106.75 2wvt n GLY 269 Ca 0.13 -1.02 -0.40 0.00 0.00 0.00 0.00 46.02 44.72 2wvt n GLY 269 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wvt s LYS 270 N -2.24 4.52 0.16 1.61 1.02 -1.26 -4.76 119.74 118.77 2wvt s LYS 270 Ca 0.00 1.13 0.02 0.00 0.02 0.00 0.00 55.97 57.13 2wvt s LYS 270 Cb 0.00 -3.40 -0.04 0.00 -0.52 0.00 0.00 37.83 33.87 2wvt s LYS 270 CO 0.00 0.17 0.30 1.03 -0.92 0.00 0.00 175.35 175.93 2wvt s ARG 271 N 0.33 3.45 0.00 1.68 0.52 -1.26 -1.72 118.95 121.95 2wvt s ARG 271 Ca 0.41 -0.55 0.00 0.00 -0.52 0.00 0.00 55.73 55.07 2wvt s ARG 271 Cb -0.20 -2.95 0.00 0.00 0.52 0.00 0.00 34.95 32.32 2wvt s ARG 271 CO 0.23 0.50 0.00 0.72 0.02 0.00 0.00 175.30 176.78 2wvt n HIS 272 N -0.56 0.00 -4.17 -0.53 8.25 -0.89 -4.71 115.22 112.62 2wvt n HIS 272 Ca -0.07 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.04 2wvt n HIS 272 Cb 0.54 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.57 2wvt n HIS 272 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2wvt s PHE 273 N 0.00 3.34 0.97 4.41 0.40 -1.26 -1.01 117.98 124.82 2wvt s PHE 273 Ca 0.00 0.33 -0.16 0.00 -0.60 0.00 0.00 56.93 56.49 2wvt s PHE 273 Cb 0.00 -1.86 0.23 0.00 0.51 0.00 0.00 43.02 41.91 2wvt s PHE 273 CO 0.00 0.57 1.02 -0.40 0.70 0.00 0.00 175.22 177.11 2wvt n ASP 274 N 2.11 -1.10 0.16 1.36 5.68 0.40 -4.82 116.55 120.35 2wvt n ASP 274 Ca -0.19 -1.21 0.13 0.00 -0.50 0.00 0.00 54.79 53.01 2wvt n ASP 274 Cb 0.54 -0.87 0.57 0.00 -1.14 0.00 0.00 41.12 40.22 2wvt n ASP 274 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 2wvt h SER 275 N -2.07 0.00 -0.33 -1.12 0.02 -1.89 -0.42 113.55 107.73 2wvt h SER 275 Ca -0.36 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 2wvt h SER 275 Cb 1.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.59 2wvt h SER 275 CO 0.24 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 176.52 2wvt n ASN 276 N -2.35 2.44 -0.02 3.07 3.02 -1.26 -4.88 115.26 115.28 2wvt n ASN 276 Ca 0.01 -1.88 -0.00 0.00 -0.03 0.00 0.00 54.58 52.67 2wvt n ASN 276 Cb 0.17 -0.21 -0.00 0.00 -0.61 0.00 0.00 39.78 39.13 2wvt n ASN 276 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wvt n GLY 277 N 1.27 0.42 3.77 7.41 0.00 -0.17 -5.03 105.19 112.86 2wvt n GLY 277 Ca 0.17 -0.89 -0.36 0.00 0.00 0.00 0.00 46.02 44.95 2wvt n GLY 277 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wvt s ARG 278 N -1.66 3.47 0.01 1.61 0.52 -1.26 -4.75 118.95 116.89 2wvt s ARG 278 Ca 0.00 -0.25 -0.30 0.00 -0.52 0.00 0.00 55.73 54.66 2wvt s ARG 278 Cb 0.00 -3.10 -0.07 0.00 0.52 0.00 0.00 34.95 32.30 2wvt s ARG 278 CO 0.00 0.63 1.69 -1.17 0.02 0.00 0.00 175.30 176.47 2wvt s LEU 279 N -0.62 4.35 0.26 2.53 2.96 -1.26 -0.45 118.68 126.45 2wvt s LEU 279 Ca 0.12 2.39 -0.09 0.00 -0.22 0.00 0.00 54.13 56.33 2wvt s LEU 279 Cb -0.12 -3.55 -0.07 0.00 0.50 0.00 0.00 46.19 42.96 2wvt s LEU 279 CO 0.02 -0.92 0.57 -0.04 -1.32 0.00 0.00 176.35 174.67 2wvt s MET 280 N 3.49 3.76 1.19 1.98 -1.94 -0.18 -4.46 119.30 123.14 2wvt s MET 280 Ca 0.75 0.23 0.00 0.00 -1.71 0.00 0.00 55.69 54.97 2wvt s MET 280 Cb -0.37 -2.62 0.00 0.00 2.01 0.00 0.00 34.83 33.85 2wvt s MET 280 CO 0.32 0.26 0.00 0.41 -0.01 0.00 0.00 175.02 176.00 2wvt n GLY 281 N -0.45 -1.89 0.01 -0.03 0.00 -1.26 -4.00 105.19 97.57 2wvt n GLY 281 Ca 0.00 -1.35 0.11 0.00 0.00 0.00 0.00 46.02 44.77 2wvt n GLY 281 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wvt n ASP 282 N 0.32 0.39 -3.56 1.61 8.00 0.63 -4.72 116.55 119.23 2wvt n ASP 282 Ca 0.00 -0.36 -0.15 0.00 0.71 0.00 0.00 54.79 54.99 2wvt n ASP 282 Cb 0.00 1.58 -0.06 0.00 -0.02 0.00 0.00 41.12 42.62 2wvt n ASP 282 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2wvt s TYR 283 N -3.32 -0.59 0.30 1.24 -0.85 -1.25 -4.61 117.35 108.26 2wvt s TYR 283 Ca -0.02 1.12 -0.27 0.00 -0.52 0.00 0.00 57.07 57.37 2wvt s TYR 283 Cb 0.15 0.40 -0.10 0.00 0.38 0.00 0.00 41.96 42.79 2wvt s TYR 283 CO 0.89 -0.49 0.96 -2.00 -1.52 0.00 0.00 175.55 173.39 2wvt s GLU 284 N -0.86 4.64 -0.14 -3.49 -6.30 -0.26 -1.28 118.70 111.01 2wvt s GLU 284 Ca -0.06 1.41 0.19 0.00 -2.50 0.00 0.00 54.97 54.01 2wvt s GLU 284 Cb -0.01 -2.95 0.39 0.00 0.00 0.00 0.00 34.13 31.57 2wvt s GLU 284 CO 0.06 0.32 1.18 -1.13 0.02 0.00 0.00 175.26 175.71 2wvt n SER 285 N 0.83 0.54 -0.00 -1.70 3.41 -1.26 -1.13 113.62 114.31 2wvt n SER 285 Ca 0.01 -2.04 0.09 0.00 -0.26 0.00 0.00 58.87 56.66 2wvt n SER 285 Cb 0.49 -0.13 -0.11 0.00 -0.26 0.00 0.00 64.21 64.20 2wvt n SER 285 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wvt n GLY 286 N -0.28 -0.73 3.55 5.00 0.00 -1.26 -4.75 105.19 106.72 2wvt n GLY 286 Ca -0.02 -0.48 -0.41 0.00 0.00 0.00 0.00 46.02 45.11 2wvt n GLY 286 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wvt s TYR 287 N -2.87 2.17 -0.20 1.61 1.51 -1.26 -4.94 117.35 113.36 2wvt s TYR 287 Ca 0.02 0.17 -0.01 0.00 -1.01 0.00 0.00 57.07 56.24 2wvt s TYR 287 Cb 0.13 -4.50 0.06 0.00 -0.11 0.00 0.00 41.96 37.53 2wvt s TYR 287 CO 0.74 -2.10 -0.00 -2.00 -1.11 0.00 0.00 175.55 171.08 2wvt s GLU 288 N 5.96 1.03 -2.06 -0.62 2.12 -1.26 -1.70 118.70 122.17 2wvt s GLU 288 Ca 0.43 -0.61 0.00 0.00 0.36 0.00 0.00 54.97 55.15 2wvt s GLU 288 Cb -0.09 -2.24 0.00 0.00 0.26 0.00 0.00 34.13 32.06 2wvt s GLU 288 CO 0.17 -0.60 0.00 0.54 -0.54 0.00 0.00 175.26 174.83 2wvt n ARG 289 N 4.91 -1.46 -3.68 4.30 1.74 -0.21 -4.96 116.66 117.30 2wvt n ARG 289 Ca -0.10 1.16 -0.10 0.00 -0.77 0.00 0.00 57.85 58.04 2wvt n ARG 289 Cb 0.46 -5.59 -0.03 0.00 -1.02 0.00 0.00 32.46 26.29 2wvt n ARG 289 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2wvt s ARG 290 N -4.02 1.45 0.04 5.56 1.70 -1.26 -5.05 118.95 117.37 2wvt s ARG 290 Ca 0.00 -0.78 0.00 0.00 -0.47 0.00 0.00 55.73 54.48 2wvt s ARG 290 Cb 0.00 0.56 -0.03 0.00 -0.57 0.00 0.00 34.95 34.91 2wvt s ARG 290 CO 0.00 -0.63 -0.04 -0.51 -1.08 0.00 0.00 175.30 173.03 2wvt s LEU 291 N -2.85 2.34 0.52 -1.89 1.43 -1.26 -4.72 118.68 112.25 2wvt s LEU 291 Ca 0.07 -0.70 -0.22 0.00 -1.03 0.00 0.00 54.13 52.25 2wvt s LEU 291 Cb -0.02 0.05 -0.06 0.00 0.03 0.00 0.00 46.19 46.19 2wvt s LEU 291 CO -0.03 -0.38 1.25 -2.16 0.23 0.00 0.00 176.35 175.26 2wvt s PRO 292 N -2.42 3.36 0.15 1.29 0.04 -1.26 -4.95 135.00 131.22 2wvt s PRO 292 Ca -0.05 1.96 -0.31 0.00 0.04 0.00 0.00 61.00 62.63 2wvt s PRO 292 Cb -0.03 -2.25 -0.10 0.00 0.04 0.00 0.00 34.50 32.16 2wvt s PRO 292 CO -0.04 -0.93 1.56 0.34 0.04 0.00 0.00 177.00 177.98 2wvt s ASP 293 N -1.25 6.61 0.22 6.66 2.15 -1.26 -4.91 116.67 124.89 2wvt s ASP 293 Ca 0.69 2.58 0.19 0.00 0.43 0.00 0.00 52.55 56.45 2wvt s ASP 293 Cb -0.33 -2.59 0.90 0.00 -0.30 0.00 0.00 42.92 40.59 2wvt s ASP 293 CO 0.39 -0.81 1.59 -2.65 -0.17 0.00 0.00 175.17 173.51 2wvt n PRO 294 N 4.09 0.13 -0.10 4.34 -0.02 -1.26 -2.07 135.00 140.11 2wvt n PRO 294 Ca 0.14 0.49 -0.17 0.00 -2.02 0.00 0.00 63.50 61.94 2wvt n PRO 294 Cb 0.39 -1.82 -0.08 0.00 -0.02 0.00 0.00 33.50 31.97 2wvt n PRO 294 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2wvt n VAL 295 N -2.08 1.11 0.49 -1.45 0.31 -1.26 -4.74 118.33 110.72 2wvt n VAL 295 Ca 0.01 -0.37 0.12 0.00 -0.01 0.00 0.00 64.34 64.08 2wvt n VAL 295 Cb 0.13 -1.40 0.13 0.00 -0.91 0.00 0.00 33.84 31.79 2wvt n VAL 295 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2wvt h LYS 296 N -0.27 0.00 -0.70 5.55 1.57 -1.96 -3.38 116.57 117.39 2wvt h LYS 296 Ca -0.46 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 57.81 2wvt h LYS 296 Cb 1.59 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 33.49 2wvt h LYS 296 CO -0.16 0.00 -0.82 -0.25 -0.57 0.00 0.00 179.45 177.65 2wvt n ASP 297 N -2.19 4.62 0.03 0.86 8.00 -0.88 -4.78 116.55 122.21 2wvt n ASP 297 Ca 0.03 -3.66 0.06 0.00 0.71 0.00 0.00 54.79 51.92 2wvt n ASP 297 Cb 0.46 -0.35 0.26 0.00 -0.02 0.00 0.00 41.12 41.46 2wvt n ASP 297 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2wvt n LEU 298 N -0.72 0.13 0.20 0.64 4.77 -1.26 -2.57 117.00 118.20 2wvt n LEU 298 Ca 0.41 0.54 0.17 0.00 -0.03 0.00 0.00 56.01 57.10 2wvt n LEU 298 Cb 0.95 -0.54 0.81 0.00 -2.33 0.00 0.00 43.42 42.32 2wvt n LEU 298 CO 0.36 -0.43 1.15 0.07 -1.33 0.00 0.00 177.39 177.21 2wvt h LYS 299 N 0.00 0.00 0.00 3.23 2.10 -1.95 -2.36 116.57 117.59 2wvt h LYS 299 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2wvt h LYS 299 Cb 0.16 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.49 2wvt h LYS 299 CO 0.00 0.00 0.00 -0.39 -2.00 0.00 0.00 179.45 177.06 2wvt h VAL 300 N 0.00 0.00 0.00 0.07 -1.51 -1.84 -2.25 116.25 110.72 2wvt h VAL 300 Ca 0.09 -0.17 0.00 0.00 -1.23 0.00 0.00 66.70 65.39 2wvt h VAL 300 Cb 0.49 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 30.82 2wvt h VAL 300 CO -0.00 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 176.69 2wvt n THR 301 N -3.07 0.63 0.99 7.19 -2.24 -0.89 -3.18 114.28 113.71 2wvt n THR 301 Ca -0.02 0.16 0.13 0.00 -2.27 0.00 0.00 64.05 62.05 2wvt n THR 301 Cb 0.15 -0.84 0.52 0.00 -2.10 0.00 0.00 70.33 68.06 2wvt n THR 301 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wvt n GLN 302 N -1.43 0.01 -3.98 -0.78 6.02 -0.85 -4.89 117.38 111.47 2wvt n GLN 302 Ca 0.06 0.01 -0.08 0.00 -0.01 0.00 0.00 57.00 56.98 2wvt n GLN 302 Cb 0.20 -1.51 -0.09 0.00 1.02 0.00 0.00 30.24 29.86 2wvt n GLN 302 CO 0.00 0.00 0.00 1.67 -1.01 0.00 0.00 177.06 177.72 2wvt s TRP 303 N -3.00 0.35 0.49 1.08 -2.14 -1.19 -4.61 118.94 109.93 2wvt s TRP 303 Ca 0.13 -0.85 -0.21 0.00 2.66 0.00 0.00 56.10 57.83 2wvt s TRP 303 Cb 0.18 -0.24 -0.07 0.00 -3.10 0.00 0.00 33.47 30.25 2wvt s TRP 303 CO 0.57 -0.45 1.14 -0.51 -2.66 0.00 0.00 176.95 175.04 2wvt s ASP 304 N -2.89 6.00 0.05 -2.66 1.01 -1.26 -4.93 116.67 111.99 2wvt s ASP 304 Ca 0.06 2.23 -0.25 0.00 0.71 0.00 0.00 52.55 55.29 2wvt s ASP 304 Cb 0.07 -2.59 0.06 0.00 1.01 0.00 0.00 42.92 41.47 2wvt s ASP 304 CO -0.10 -1.03 0.60 -1.66 0.21 0.00 0.00 175.17 173.19 2wvt s TRP 305 N -1.66 -0.54 -0.04 4.23 1.48 -1.26 -1.10 118.94 120.05 2wvt s TRP 305 Ca 0.67 0.64 -0.00 0.00 -1.06 0.00 0.00 56.10 56.35 2wvt s TRP 305 Cb -0.26 0.44 0.03 0.00 -1.16 0.00 0.00 33.47 32.52 2wvt s TRP 305 CO 0.31 -0.70 0.01 -2.00 -4.06 0.00 0.00 176.95 170.50 2wvt s GLU 306 N -2.47 0.35 0.14 3.25 2.12 -0.28 -1.50 118.70 120.30 2wvt s GLU 306 Ca -0.05 0.12 0.02 0.00 0.36 0.00 0.00 54.97 55.42 2wvt s GLU 306 Cb -0.01 -0.62 -0.04 0.00 0.26 0.00 0.00 34.13 33.73 2wvt s GLU 306 CO -0.02 -0.20 0.27 0.00 -0.54 0.00 0.00 175.26 174.78 2wvt s ALA 307 N 1.40 3.97 0.11 6.30 0.00 0.71 -4.45 121.76 129.79 2wvt s ALA 307 Ca -0.04 -1.01 0.06 0.00 0.00 0.00 0.00 51.96 50.96 2wvt s ALA 307 Cb -0.13 -1.78 -0.04 0.00 0.00 0.00 0.00 23.12 21.18 2wvt s ALA 307 CO -0.03 0.57 -0.14 0.00 0.00 0.00 0.00 175.76 176.16 2wvt s MET 309 N -2.41 0.88 0.25 0.00 0.23 -0.27 -1.05 119.30 116.93 2wvt s MET 309 Ca 0.06 -0.95 0.08 0.00 -1.03 0.00 0.00 55.69 53.85 2wvt s MET 309 Cb -0.06 0.36 -0.04 0.00 -1.53 0.00 0.00 34.83 33.55 2wvt s MET 309 CO 0.03 -0.29 0.08 0.95 -2.03 0.00 0.00 175.02 173.75 2wvt s THR 310 N -3.86 3.90 -0.13 3.16 -4.23 -1.26 -1.35 115.64 111.86 2wvt s THR 310 Ca 0.06 -1.63 -0.19 0.00 -1.18 0.00 0.00 61.69 58.74 2wvt s THR 310 Cb 0.05 -3.08 -0.17 0.00 1.34 0.00 0.00 72.50 70.64 2wvt s THR 310 CO -0.10 -0.32 0.46 0.40 -0.54 0.00 0.00 174.62 174.52 2wvt h ILE 311 N 1.81 1.13 -3.22 2.99 2.04 -1.82 -3.46 117.51 116.98 2wvt h ILE 311 Ca -0.46 -1.88 -0.35 0.00 1.00 0.00 0.00 64.86 63.17 2wvt h ILE 311 Cb 1.24 2.17 0.16 0.00 -0.74 0.00 0.00 36.82 39.65 2wvt h ILE 311 CO 0.60 0.38 0.17 -2.65 0.00 0.00 0.00 178.15 176.66 2wvt n PRO 312 N -4.65 -2.35 -0.12 2.37 -0.02 -1.26 -1.44 135.00 127.53 2wvt n PRO 312 Ca -0.08 -1.56 -0.10 0.00 -2.02 0.00 0.00 63.50 59.73 2wvt n PRO 312 Cb 0.34 -1.33 -0.02 0.00 -0.02 0.00 0.00 33.50 32.47 2wvt n PRO 312 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2wvt h GLU 313 N 0.00 0.59 -0.91 -0.52 4.81 -1.74 -3.40 114.58 113.41 2wvt h GLU 313 Ca -0.35 -0.17 -0.15 0.00 -0.13 0.00 0.00 59.36 58.56 2wvt h GLU 313 Cb 1.05 -0.06 -0.16 0.00 0.63 0.00 0.00 28.75 30.21 2wvt h GLU 313 CO 0.24 0.68 -0.48 -1.71 -0.73 0.00 0.00 179.01 177.00 2wvt n ASN 314 N -4.56 -3.38 -3.64 1.04 5.15 -1.26 -4.87 115.26 103.74 2wvt n ASN 314 Ca -0.02 -2.90 -0.19 0.00 -0.60 0.00 0.00 54.58 50.87 2wvt n ASN 314 Cb 0.24 1.74 -0.16 0.00 -0.53 0.00 0.00 39.78 41.06 2wvt n ASN 314 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2wvt s GLN 315 N 0.86 0.02 -0.20 1.20 -1.52 -1.26 -3.85 119.66 114.91 2wvt s GLN 315 Ca 0.30 0.36 -0.14 0.00 -1.95 0.00 0.00 55.36 53.94 2wvt s GLN 315 Cb 0.02 -0.70 -0.08 0.00 -0.22 0.00 0.00 33.01 32.03 2wvt s GLN 315 CO -0.07 -0.41 -0.31 0.91 -0.25 0.00 0.00 175.29 175.16 2wvt n TRP 316 N 5.31 0.00 -1.36 0.91 7.02 -1.26 -4.64 117.44 123.42 2wvt n TRP 316 Ca -0.05 0.00 -0.31 0.00 -1.02 0.00 0.00 57.50 56.12 2wvt n TRP 316 Cb 0.50 -0.68 0.08 0.00 -2.42 0.00 0.00 31.31 28.79 2wvt n TRP 316 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 2wvt s GLY 317 N -5.15 1.74 -0.08 6.99 0.00 -1.26 -3.67 107.32 105.88 2wvt s GLY 317 Ca -0.30 0.28 -0.36 0.00 0.00 0.00 0.00 44.72 44.35 2wvt s GLY 317 CO 0.41 0.63 1.78 2.98 0.00 0.00 0.00 173.10 178.89 2wvt n TYR 318 N -3.32 2.22 -5.09 1.90 9.36 -1.25 -4.53 117.16 116.44 2wvt n TYR 318 Ca 0.09 0.18 -0.32 0.00 3.32 0.00 0.00 57.90 61.17 2wvt n TYR 318 Cb 0.53 -2.59 -0.16 0.00 -0.63 0.00 0.00 39.34 36.50 2wvt n TYR 318 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 2wvt s HIS 319 N 3.33 2.58 0.36 2.98 5.65 -1.26 -4.30 115.29 124.64 2wvt s HIS 319 Ca 0.92 -0.68 0.18 0.00 0.25 0.00 0.00 55.06 55.73 2wvt s HIS 319 Cb -0.78 -1.68 0.94 0.00 -1.18 0.00 0.00 32.58 29.88 2wvt s HIS 319 CO 0.52 -0.19 1.90 1.57 -0.65 0.00 0.00 174.74 177.89 2wvt h LYS 320 N 6.21 0.00 -3.34 2.88 2.10 -1.43 -3.39 116.57 119.61 2wvt h LYS 320 Ca -0.30 0.00 -0.64 0.00 -2.00 0.00 0.00 60.65 57.71 2wvt h LYS 320 Cb 1.19 0.00 -0.41 0.00 -0.90 0.00 0.00 32.23 32.11 2wvt h LYS 320 CO 0.49 0.28 -0.64 0.34 -2.00 0.00 0.00 179.45 177.92 2wvt s ASP 321 N -6.65 4.24 0.00 7.07 -1.08 -1.26 -4.94 116.67 114.05 2wvt s ASP 321 Ca -0.02 -2.98 0.28 0.00 -0.52 0.00 0.00 52.55 49.31 2wvt s ASP 321 Cb 0.14 -1.57 1.60 0.00 -1.46 0.00 0.00 42.92 41.62 2wvt s ASP 321 CO 0.68 -0.23 1.99 0.79 0.52 0.00 0.00 175.17 178.91 2wvt n TRP 322 N 3.15 0.00 1.08 -5.34 7.02 -1.26 -3.11 117.44 118.98 2wvt n TRP 322 Ca 0.05 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.65 2wvt n TRP 322 Cb 0.32 -0.06 0.59 0.00 -2.42 0.00 0.00 31.31 29.74 2wvt n TRP 322 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 2wvt n SER 323 N -1.06 0.00 0.24 -0.99 3.41 -1.26 -3.74 113.62 110.22 2wvt n SER 323 Ca 0.19 0.04 0.14 0.00 -0.26 0.00 0.00 58.87 58.98 2wvt n SER 323 Cb 0.12 -0.32 0.42 0.00 -0.26 0.00 0.00 64.21 64.17 2wvt n SER 323 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2wvt h LEU 324 N 0.00 0.00 -8.47 1.04 3.38 -1.98 -3.46 115.31 105.82 2wvt h LEU 324 Ca 0.00 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 2wvt h LEU 324 Cb 0.26 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.91 2wvt h LEU 324 CO 0.00 0.00 -0.28 -0.94 0.09 0.00 0.00 178.44 177.31 2wvt s SER 325 N -5.88 0.46 0.26 -0.43 1.04 -1.25 -5.12 113.70 102.78 2wvt s SER 325 Ca 0.04 -1.30 -0.30 0.00 0.48 0.00 0.00 55.95 54.88 2wvt s SER 325 Cb 0.07 0.57 -0.09 0.00 0.10 0.00 0.00 66.02 66.67 2wvt s SER 325 CO 0.60 -1.13 1.29 -0.47 0.98 0.00 0.00 173.24 174.51 2wvt s TYR 326 N -3.63 3.21 -0.20 5.02 5.04 -1.26 -4.82 117.35 120.70 2wvt s TYR 326 Ca 0.30 1.33 -0.03 0.00 -2.44 0.00 0.00 57.07 56.23 2wvt s TYR 326 Cb 0.01 -3.61 -0.01 0.00 0.35 0.00 0.00 41.96 38.71 2wvt s TYR 326 CO 0.15 -1.77 -0.06 0.08 -1.34 0.00 0.00 175.55 172.61 2wvt s VAL 327 N -0.50 3.34 0.36 3.14 1.01 -1.26 -2.07 120.40 124.42 2wvt s VAL 327 Ca 0.53 -0.52 -0.27 0.00 0.00 0.00 0.00 61.98 61.72 2wvt s VAL 327 Cb -0.37 -2.49 -0.09 0.00 0.00 0.00 0.00 36.38 33.42 2wvt s VAL 327 CO 0.44 0.45 1.14 -0.54 0.00 0.00 0.00 175.10 176.59 2wvt s LYS 328 N 1.18 4.28 0.58 2.72 1.02 -0.52 -4.98 119.74 124.01 2wvt s LYS 328 Ca 0.02 1.81 -0.08 0.00 0.02 0.00 0.00 55.97 57.74 2wvt s LYS 328 Cb -0.14 -2.84 -0.02 0.00 -0.52 0.00 0.00 37.83 34.30 2wvt s LYS 328 CO -0.01 -0.12 0.93 0.95 -0.92 0.00 0.00 175.35 176.18 2wvt s THR 329 N -1.35 4.36 0.23 2.17 -4.23 -1.26 -4.93 115.64 110.63 2wvt s THR 329 Ca 0.53 0.41 -0.07 0.00 -1.18 0.00 0.00 61.69 61.38 2wvt s THR 329 Cb -0.30 -3.72 0.19 0.00 1.34 0.00 0.00 72.50 70.01 2wvt s THR 329 CO 0.39 -0.83 1.72 -0.65 -0.54 0.00 0.00 174.62 174.71 2wvt h PRO 330 N -0.16 0.36 -0.48 3.99 0.11 -1.96 -1.99 132.00 131.87 2wvt h PRO 330 Ca -0.45 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 2wvt h PRO 330 Cb 1.22 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 2wvt h PRO 330 CO 0.62 0.24 0.03 0.82 -0.21 0.00 0.00 178.00 179.49 2wvt h ILE 331 N 0.37 1.24 -0.08 4.15 2.04 -1.98 0.12 117.51 123.36 2wvt h ILE 331 Ca 0.37 -0.95 -0.04 0.00 1.00 0.00 0.00 64.86 65.23 2wvt h ILE 331 Cb 0.54 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 2wvt h ILE 331 CO -0.40 0.34 -0.15 -0.33 0.00 0.00 0.00 178.15 177.61 2wvt h GLU 332 N 0.74 0.13 0.06 2.37 5.08 -1.79 0.82 114.58 121.99 2wvt h GLU 332 Ca 0.15 -0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 58.33 2wvt h GLU 332 Cb 0.41 -0.02 0.02 0.00 0.50 0.00 0.00 28.75 29.66 2wvt h GLU 332 CO 0.01 0.29 -0.64 0.28 -1.00 0.00 0.00 179.01 177.95 2wvt h VAL 333 N 0.12 1.48 -0.51 3.13 2.07 -0.65 -3.13 116.25 118.76 2wvt h VAL 333 Ca 0.03 -2.26 -0.03 0.00 0.82 0.00 0.00 66.70 65.26 2wvt h VAL 333 Cb 0.35 2.87 -0.02 0.00 -1.52 0.00 0.00 31.29 32.96 2wvt h VAL 333 CO 0.02 0.64 0.19 0.40 0.02 0.00 0.00 177.57 178.84 2wvt h ILE 334 N -0.26 1.19 -0.24 4.57 2.04 -0.53 -1.39 117.51 122.89 2wvt h ILE 334 Ca -0.10 -0.62 0.04 0.00 1.00 0.00 0.00 64.86 65.18 2wvt h ILE 334 Cb 1.41 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 38.06 2wvt h ILE 334 CO 0.12 0.24 0.03 -0.78 0.00 0.00 0.00 178.15 177.76 2wvt h ASP 335 N 0.73 -0.03 -0.81 1.72 3.58 -0.90 -1.04 116.42 119.67 2wvt h ASP 335 Ca 0.17 0.04 -0.04 0.00 0.42 0.00 0.00 57.03 57.63 2wvt h ASP 335 Cb 0.17 0.07 -0.04 0.00 1.72 0.00 0.00 39.33 41.25 2wvt h ASP 335 CO -0.01 0.02 0.37 0.03 -2.88 0.00 0.00 179.24 176.76 2wvt h ARG 336 N 0.11 1.18 -0.38 0.28 3.08 -1.35 -0.34 114.38 116.97 2wvt h ARG 336 Ca 0.11 -0.19 0.03 0.00 0.07 0.00 0.00 59.98 60.01 2wvt h ARG 336 Cb 0.13 -0.21 -0.04 0.00 0.08 0.00 0.00 29.97 29.94 2wvt h ARG 336 CO -0.17 0.93 0.17 0.82 -1.07 0.00 0.00 179.97 180.65 2wvt h ILE 337 N 1.16 0.95 -0.14 2.04 2.04 -0.93 -1.49 117.51 121.15 2wvt h ILE 337 Ca 0.28 -0.12 -0.16 0.00 1.00 0.00 0.00 64.86 65.86 2wvt h ILE 337 Cb 0.15 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 2wvt h ILE 337 CO -0.03 0.07 -0.58 0.58 0.00 0.00 0.00 178.15 178.19 2wvt h VAL 338 N 0.36 1.35 -0.32 1.67 2.07 -0.98 -2.56 116.25 117.83 2wvt h VAL 338 Ca 0.17 -1.87 0.01 0.00 0.82 0.00 0.00 66.70 65.83 2wvt h VAL 338 Cb 0.10 1.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 2wvt h VAL 338 CO -0.13 0.57 0.18 -0.74 0.02 0.00 0.00 177.57 177.47 2wvt h HIS 339 N 0.33 0.35 0.14 1.57 6.17 -0.88 0.20 115.15 123.01 2wvt h HIS 339 Ca -0.00 0.01 0.01 0.00 0.71 0.00 0.00 60.37 61.10 2wvt h HIS 339 Cb 1.11 -0.11 -0.02 0.00 2.52 0.00 0.00 27.41 30.91 2wvt h HIS 339 CO 0.04 0.21 -0.16 0.00 0.71 0.00 0.00 177.93 178.72 2wvt h ALA 340 N 1.14 -0.30 -0.67 5.26 0.00 -1.13 -2.72 119.26 120.83 2wvt h ALA 340 Ca 0.12 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2wvt h ALA 340 Cb -0.00 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2wvt h ALA 340 CO -0.06 -0.70 0.25 0.28 0.00 0.00 0.00 179.25 179.03 2wvt h VAL 341 N -0.34 1.24 0.00 0.00 2.07 -1.15 -0.03 116.25 118.04 2wvt h VAL 341 Ca 0.01 -0.77 -0.00 0.00 0.82 0.00 0.00 66.70 66.76 2wvt h VAL 341 Cb 0.34 0.45 -0.00 0.00 -1.52 0.00 0.00 31.29 30.56 2wvt h VAL 341 CO -0.06 0.31 -0.02 0.77 0.02 0.00 0.00 177.57 178.59 2wvt h SER 342 N 0.98 0.00 -0.30 0.57 4.64 -0.77 -1.28 113.55 117.38 2wvt h SER 342 Ca 0.22 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.43 2wvt h SER 342 Cb 0.22 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.24 2wvt h SER 342 CO -0.02 0.02 -0.04 0.23 -0.87 0.00 0.00 176.83 176.15 2wvt n MET 343 N -3.55 2.18 -0.68 4.77 2.81 -0.52 -4.09 117.12 118.04 2wvt n MET 343 Ca -0.03 -3.03 0.00 0.00 -1.81 0.00 0.00 57.70 52.83 2wvt n MET 343 Cb 0.11 -1.81 0.00 0.00 -0.71 0.00 0.00 33.22 30.81 2wvt n MET 343 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wvt n GLY 344 N -0.93 0.64 3.65 3.03 0.00 -0.48 -4.20 105.19 106.89 2wvt n GLY 344 Ca 0.28 -0.18 -0.23 0.00 0.00 0.00 0.00 46.02 45.90 2wvt n GLY 344 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wvt s GLY 345 N -2.16 1.64 0.36 -0.02 0.00 -0.14 -4.34 107.32 102.66 2wvt s GLY 345 Ca 0.00 -1.64 -0.02 0.00 0.00 0.00 0.00 44.72 43.06 2wvt s GLY 345 CO 0.00 -1.71 0.60 -1.31 0.00 0.00 0.00 173.10 170.68 2wvt s ASN 346 N -3.68 6.33 -0.02 1.64 -0.87 -0.56 -2.73 114.94 115.05 2wvt s ASN 346 Ca 0.31 0.62 0.04 0.00 -1.57 0.00 0.00 52.86 52.27 2wvt s ASN 346 Cb -0.06 -2.11 -0.01 0.00 -0.02 0.00 0.00 41.25 39.05 2wvt s ASN 346 CO 0.20 -0.33 -0.15 -0.32 -2.57 0.00 0.00 177.10 173.94 2wvt s MET 347 N -4.20 1.27 -0.15 -0.60 -2.45 -0.73 -0.21 119.30 112.23 2wvt s MET 347 Ca 0.43 -0.52 0.02 0.00 -1.25 0.00 0.00 55.69 54.36 2wvt s MET 347 Cb -0.10 -1.20 0.01 0.00 1.25 0.00 0.00 34.83 34.80 2wvt s MET 347 CO 0.36 0.29 -0.19 0.08 1.05 0.00 0.00 175.02 176.61 2wvt s VAL 348 N -0.25 1.92 -0.24 10.11 1.01 0.07 -1.14 120.40 131.88 2wvt s VAL 348 Ca 0.04 -0.88 -0.11 0.00 0.00 0.00 0.00 61.98 61.03 2wvt s VAL 348 Cb -0.07 -1.72 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 2wvt s VAL 348 CO -0.00 0.52 0.17 -0.69 0.00 0.00 0.00 175.10 175.10 2wvt s VAL 349 N 1.06 5.35 0.17 2.92 1.01 -0.34 -1.11 120.40 129.45 2wvt s VAL 349 Ca -0.02 0.20 -0.20 0.00 0.00 0.00 0.00 61.98 61.96 2wvt s VAL 349 Cb -0.14 -3.51 -0.08 0.00 0.00 0.00 0.00 36.38 32.65 2wvt s VAL 349 CO -0.06 0.34 0.68 0.21 0.00 0.00 0.00 175.10 176.26 2wvt s ASN 350 N 1.11 7.10 0.01 3.32 2.47 -0.46 -0.73 114.94 127.75 2wvt s ASN 350 Ca 0.08 1.39 0.06 0.00 0.42 0.00 0.00 52.86 54.80 2wvt s ASN 350 Cb -0.14 -2.40 -0.02 0.00 -1.45 0.00 0.00 41.25 37.24 2wvt s ASN 350 CO 0.05 0.13 -0.19 -0.36 -3.72 0.00 0.00 177.10 173.01 2wvt s PHE 351 N -1.34 1.68 -0.60 0.43 0.08 0.50 -4.46 117.98 114.28 2wvt s PHE 351 Ca 0.38 -0.33 0.03 0.00 0.12 0.00 0.00 56.93 57.12 2wvt s PHE 351 Cb -0.18 -1.05 0.15 0.00 -0.57 0.00 0.00 43.02 41.36 2wvt s PHE 351 CO 0.21 0.01 0.36 0.20 -0.10 0.00 0.00 175.22 175.91 2wvt s GLY 352 N -0.70 2.62 0.65 4.36 0.00 -1.24 -1.42 107.32 111.59 2wvt s GLY 352 Ca 0.07 -3.46 -0.18 0.00 0.00 0.00 0.00 44.72 41.15 2wvt s GLY 352 CO 0.00 1.05 1.25 -1.05 0.00 0.00 0.00 173.10 174.34 2wvt n PRO 353 N 2.80 1.04 -1.15 2.90 -0.02 -1.25 -3.97 135.00 135.34 2wvt n PRO 353 Ca 0.10 0.41 -0.31 0.00 -2.02 0.00 0.00 63.50 61.68 2wvt n PRO 353 Cb 0.34 -2.48 0.11 0.00 -0.02 0.00 0.00 33.50 31.44 2wvt n PRO 353 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2wvt s GLN 354 N -3.33 1.97 0.51 -0.52 -0.21 -0.30 -4.41 119.66 113.37 2wvt s GLN 354 Ca 0.82 1.21 0.19 0.00 0.02 0.00 0.00 55.36 57.60 2wvt s GLN 354 Cb -0.38 -1.86 1.28 0.00 1.00 0.00 0.00 33.01 33.05 2wvt s GLN 354 CO 0.41 -1.86 2.07 0.00 -2.12 0.00 0.00 175.29 173.79 2wvt h ALA 355 N -1.29 2.19 -0.00 6.09 0.00 -1.87 -2.31 119.26 122.07 2wvt h ALA 355 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2wvt h ALA 355 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2wvt h ALA 355 CO 0.50 -0.27 -0.16 -0.40 0.00 0.00 0.00 179.25 178.92 2wvt n ASP 356 N -4.47 0.27 0.00 0.00 5.68 -1.26 -3.99 116.55 112.78 2wvt n ASP 356 Ca 0.04 -0.06 0.00 0.00 -0.50 0.00 0.00 54.79 54.26 2wvt n ASP 356 Cb 0.32 -0.17 0.00 0.00 -1.14 0.00 0.00 41.12 40.13 2wvt n ASP 356 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wvt n GLY 357 N 1.42 0.87 3.86 6.12 0.00 -0.87 -0.53 105.19 116.06 2wvt n GLY 357 Ca 0.09 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.90 2wvt n GLY 357 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wvt s ASP 358 N -2.22 5.02 -0.13 1.61 -1.08 -1.26 -3.83 116.67 114.78 2wvt s ASP 358 Ca 0.00 -0.75 -0.07 0.00 -0.52 0.00 0.00 52.55 51.21 2wvt s ASP 358 Cb 0.00 -0.60 -0.04 0.00 -1.46 0.00 0.00 42.92 40.82 2wvt s ASP 358 CO 0.00 -0.62 0.12 -0.36 0.52 0.00 0.00 175.17 174.83 2wvt s PHE 359 N -2.47 3.49 0.65 -5.34 0.08 -1.26 -1.15 117.98 111.98 2wvt s PHE 359 Ca 0.47 0.43 -0.18 0.00 0.12 0.00 0.00 56.93 57.77 2wvt s PHE 359 Cb -0.03 -1.96 -0.02 0.00 -0.57 0.00 0.00 43.02 40.44 2wvt s PHE 359 CO 0.27 0.60 1.15 2.89 -0.10 0.00 0.00 175.22 180.03 2wvt n ARG 360 N 2.34 0.94 -0.34 0.44 1.85 -1.26 -4.71 116.66 115.92 2wvt n ARG 360 Ca -0.19 0.38 0.11 0.00 -1.00 0.00 0.00 57.85 57.15 2wvt n ARG 360 Cb 0.54 -2.38 0.29 0.00 -1.05 0.00 0.00 32.46 29.86 2wvt n ARG 360 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 2wvt h PRO 361 N 0.37 0.72 -0.31 2.89 0.13 -1.99 -1.30 132.00 132.51 2wvt h PRO 361 Ca -0.50 -0.04 -0.05 0.00 -0.87 0.00 0.00 66.00 64.54 2wvt h PRO 361 Cb 1.35 -0.16 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 2wvt h PRO 361 CO 0.51 0.48 -0.01 0.93 -0.23 0.00 0.00 178.00 179.68 2wvt h GLU 362 N 0.74 0.47 0.16 0.86 3.07 -1.99 0.83 114.58 118.72 2wvt h GLU 362 Ca 0.55 -0.10 -0.30 0.00 -0.50 0.00 0.00 59.36 59.01 2wvt h GLU 362 Cb 0.83 -0.07 0.02 0.00 -0.84 0.00 0.00 28.75 28.69 2wvt h GLU 362 CO -0.38 0.51 -1.30 0.93 -1.40 0.00 0.00 179.01 177.37 2wvt h GLU 363 N 0.46 0.48 -0.92 2.33 5.08 -1.62 -1.54 114.58 118.85 2wvt h GLU 363 Ca 0.10 -0.73 0.04 0.00 -1.00 0.00 0.00 59.36 57.77 2wvt h GLU 363 Cb 0.31 0.26 -0.06 0.00 0.50 0.00 0.00 28.75 29.76 2wvt h GLU 363 CO 0.01 1.33 0.59 0.87 -1.00 0.00 0.00 179.01 180.81 2wvt h LYS 364 N 0.17 1.10 -0.41 2.33 1.57 -0.88 -1.63 116.57 118.83 2wvt h LYS 364 Ca -0.19 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.52 2wvt h LYS 364 Cb 1.99 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 34.03 2wvt h LYS 364 CO 0.24 0.73 0.21 0.00 -0.57 0.00 0.00 179.45 180.06 2wvt h ALA 365 N 1.39 0.53 -0.05 3.86 0.00 -0.80 -2.30 119.26 121.88 2wvt h ALA 365 Ca 0.37 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2wvt h ALA 365 Cb 0.04 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2wvt h ALA 365 CO -0.13 0.07 0.03 1.98 0.00 0.00 0.00 179.25 181.20 2wvt h MET 366 N 0.53 0.07 -0.57 0.00 1.85 -0.96 -1.66 114.93 114.19 2wvt h MET 366 Ca 0.14 -0.01 -0.09 0.00 -0.61 0.00 0.00 59.70 59.14 2wvt h MET 366 Cb 0.08 -0.02 -0.02 0.00 0.43 0.00 0.00 31.60 32.08 2wvt h MET 366 CO -0.02 0.07 0.01 0.00 -0.40 0.00 0.00 176.91 176.57 2wvt h ALA 367 N 1.00 0.77 -0.30 0.39 0.00 -1.25 -0.13 119.26 119.74 2wvt h ALA 367 Ca 0.02 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.65 2wvt h ALA 367 Cb 0.01 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2wvt h ALA 367 CO -0.00 0.59 0.15 1.15 0.00 0.00 0.00 179.25 181.14 2wvt h THR 368 N 0.89 1.00 -0.29 0.00 2.02 -1.28 -0.95 112.91 114.29 2wvt h THR 368 Ca 0.16 -0.11 -0.07 0.00 0.77 0.00 0.00 66.41 67.16 2wvt h THR 368 Cb 0.53 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 2wvt h THR 368 CO 0.03 0.06 -0.09 0.00 0.37 0.00 0.00 175.52 175.89 2wvt h ALA 369 N 1.15 0.41 -0.77 6.16 0.00 -1.05 -0.56 119.26 124.60 2wvt h ALA 369 Ca 0.12 -0.29 0.05 0.00 0.00 0.00 0.00 54.91 54.79 2wvt h ALA 369 Cb 0.03 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 2wvt h ALA 369 CO -0.08 0.24 0.47 0.82 0.00 0.00 0.00 179.25 180.70 2wvt h ILE 370 N 0.34 1.04 -0.52 0.00 2.04 -0.99 -2.31 117.51 117.10 2wvt h ILE 370 Ca 0.07 -0.30 -0.09 0.00 1.00 0.00 0.00 64.86 65.54 2wvt h ILE 370 Cb 0.58 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 2wvt h ILE 370 CO 0.03 0.16 -0.05 1.23 0.00 0.00 0.00 178.15 179.53 2wvt h GLY 371 N 0.88 1.00 1.01 5.37 0.00 -0.75 0.11 103.07 110.68 2wvt h GLY 371 Ca 0.33 -0.74 -0.00 0.00 0.00 0.00 0.00 47.33 46.92 2wvt h GLY 371 CO -0.16 0.68 0.48 0.50 0.00 0.00 0.00 176.54 178.04 2wvt h LYS 372 N 0.85 1.03 -0.00 4.80 1.57 -0.70 -0.39 116.57 123.72 2wvt h LYS 372 Ca 0.15 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2wvt h LYS 372 Cb 0.56 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.65 2wvt h LYS 372 CO 0.03 0.72 -0.01 2.35 -0.57 0.00 0.00 179.45 181.97 2wvt h TRP 373 N 1.05 0.02 -0.60 -1.35 7.01 -1.06 -3.04 115.95 117.98 2wvt h TRP 373 Ca 0.28 -0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.34 2wvt h TRP 373 Cb -0.07 -0.00 -0.04 0.00 -2.10 0.00 0.00 29.16 26.95 2wvt h TRP 373 CO -0.01 0.58 0.40 0.52 -2.79 0.00 0.00 178.44 177.14 2wvt h MET 374 N -0.55 0.53 -0.47 2.65 2.86 -0.74 0.21 114.93 119.43 2wvt h MET 374 Ca 0.00 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.59 2wvt h MET 374 Cb 0.58 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.10 2wvt h MET 374 CO 0.00 0.35 0.21 -0.97 1.06 0.00 0.00 176.91 177.56 2wvt h ASN 375 N 0.55 0.59 0.07 1.22 -1.24 -1.01 0.57 115.58 116.33 2wvt h ASN 375 Ca 0.26 -0.06 -0.11 0.00 0.71 0.00 0.00 56.30 57.10 2wvt h ASN 375 Cb 0.33 -0.15 0.01 0.00 0.73 0.00 0.00 38.32 39.23 2wvt h ASN 375 CO -0.08 0.52 -0.51 -0.09 -1.29 0.00 0.00 177.43 175.98 2wvt h ARG 376 N 0.66 0.15 -0.01 6.67 2.43 -1.10 -3.41 114.38 119.76 2wvt h ARG 376 Ca 0.16 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 2wvt h ARG 376 Cb 0.10 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 2wvt h ARG 376 CO -0.02 1.12 -0.01 0.66 -1.51 0.00 0.00 179.97 180.21 2wvt n TYR 377 N -4.34 0.00 0.19 2.20 4.01 0.63 -4.73 117.16 115.12 2wvt n TYR 377 Ca -0.14 0.00 0.18 0.00 -0.16 0.00 0.00 57.90 57.79 2wvt n TYR 377 Cb 0.67 0.00 0.79 0.00 -0.31 0.00 0.00 39.34 40.49 2wvt n TYR 377 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2wvt h GLY 378 N 1.49 0.00 1.60 2.72 0.00 -1.04 -1.98 103.07 105.87 2wvt h GLY 378 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.38 2wvt h GLY 378 CO 0.00 0.00 0.15 1.70 0.00 0.00 0.00 176.54 178.39 2wvt h LYS 379 N 0.00 0.00 -0.19 4.80 3.64 -1.85 0.10 116.57 123.08 2wvt h LYS 379 Ca 0.11 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 2wvt h LYS 379 Cb 0.83 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.65 2wvt h LYS 379 CO -0.00 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.18 2wvt n ALA 380 N -2.40 2.50 0.02 5.00 0.00 -0.74 -4.45 120.51 120.44 2wvt n ALA 380 Ca 0.01 -0.59 -0.01 0.00 0.00 0.00 0.00 53.44 52.85 2wvt n ALA 380 Cb 0.28 -1.05 -0.00 0.00 0.00 0.00 0.00 19.45 18.67 2wvt n ALA 380 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wvt n VAL 381 N 0.52 0.74 -1.71 0.00 0.31 0.15 -4.78 118.33 113.56 2wvt n VAL 381 Ca 0.17 0.24 -0.43 0.00 -0.01 0.00 0.00 64.34 64.31 2wvt n VAL 381 Cb 0.38 -1.44 -0.03 0.00 -0.91 0.00 0.00 33.84 31.83 2wvt n VAL 381 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 2wvt n TYR 382 N -3.16 2.68 -1.38 3.52 4.01 -0.04 -2.09 117.16 120.70 2wvt n TYR 382 Ca -0.01 0.04 -0.13 0.00 -0.16 0.00 0.00 57.90 57.64 2wvt n TYR 382 Cb 0.05 -2.67 -0.06 0.00 -0.31 0.00 0.00 39.34 36.36 2wvt n TYR 382 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2wvt n ALA 383 N 4.10 -0.20 -2.14 -0.72 0.00 -0.25 -4.86 120.51 116.44 2wvt n ALA 383 Ca 0.16 0.21 -0.20 0.00 0.00 0.00 0.00 53.44 53.62 2wvt n ALA 383 Cb 0.34 -1.50 0.00 0.00 0.00 0.00 0.00 19.45 18.30 2wvt n ALA 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wvt s ASP 385 N -4.33 0.03 0.19 0.00 -1.08 -0.03 -4.91 116.67 106.54 2wvt s ASP 385 Ca 0.51 -1.16 -0.33 0.00 -0.52 0.00 0.00 52.55 51.06 2wvt s ASP 385 Cb -0.06 0.83 -0.13 0.00 -1.46 0.00 0.00 42.92 42.11 2wvt s ASP 385 CO 0.31 -1.66 1.65 0.00 0.52 0.00 0.00 175.17 175.99 2wvt n TYR 386 N -0.56 2.52 0.06 -5.34 9.36 -1.24 -0.10 117.16 121.87 2wvt n TYR 386 Ca -0.08 0.16 0.11 0.00 3.32 0.00 0.00 57.90 61.41 2wvt n TYR 386 Cb 0.60 -2.61 -0.07 0.00 -0.63 0.00 0.00 39.34 36.63 2wvt n TYR 386 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2wvt n ALA 387 N 3.64 2.63 -0.64 2.98 0.00 -1.26 -4.59 120.51 123.27 2wvt n ALA 387 Ca 0.16 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2wvt n ALA 387 Cb 0.32 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2wvt n ALA 387 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wvt n GLY 388 N 1.21 0.67 3.79 0.00 0.00 -1.26 -4.97 105.19 104.64 2wvt n GLY 388 Ca -0.02 -0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 2wvt n GLY 388 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wvt s PHE 389 N -2.00 3.25 0.30 1.61 0.40 -1.26 -4.73 117.98 115.54 2wvt s PHE 389 Ca 0.00 0.13 -0.29 0.00 -0.60 0.00 0.00 56.93 56.17 2wvt s PHE 389 Cb 0.00 -1.66 -0.10 0.00 0.51 0.00 0.00 43.02 41.77 2wvt s PHE 389 CO 0.00 0.54 1.32 -1.21 0.70 0.00 0.00 175.22 176.57 2wvt s GLU 390 N -2.25 4.36 0.35 0.44 2.02 -1.26 -4.93 118.70 117.42 2wvt s GLU 390 Ca 0.28 2.19 -0.29 0.00 0.02 0.00 0.00 54.97 57.18 2wvt s GLU 390 Cb -0.12 -3.10 -0.11 0.00 0.10 0.00 0.00 34.13 30.90 2wvt s GLU 390 CO 0.21 -0.22 1.44 0.21 0.02 0.00 0.00 175.26 176.92 2wvt s LYS 391 N -1.33 4.19 0.32 1.61 2.47 -1.26 -4.84 119.74 120.90 2wvt s LYS 391 Ca 0.51 2.45 0.10 0.00 -1.56 0.00 0.00 55.97 57.47 2wvt s LYS 391 Cb -0.39 -3.01 -0.05 0.00 -1.46 0.00 0.00 37.83 32.91 2wvt s LYS 391 CO 0.49 -0.43 -0.07 -0.65 0.16 0.00 0.00 175.35 174.84 2wvt s GLN 392 N -1.72 1.93 0.48 4.03 -1.52 -1.26 -5.06 119.66 116.54 2wvt s GLN 392 Ca 0.53 -1.77 0.26 0.00 -1.95 0.00 0.00 55.36 52.42 2wvt s GLN 392 Cb -0.44 -1.85 1.19 0.00 -0.22 0.00 0.00 33.01 31.69 2wvt s GLN 392 CO 0.57 0.21 1.95 -0.44 -0.25 0.00 0.00 175.29 177.34 2wvt h ASP 393 N 2.00 0.00 1.01 5.90 3.32 -1.96 -3.10 116.42 123.59 2wvt h ASP 393 Ca -0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.63 2wvt h ASP 393 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 2wvt h ASP 393 CO 0.65 0.18 0.00 -2.67 -1.72 0.00 0.00 179.24 175.68 2wvt n TRP 394 N -3.53 0.79 0.00 4.55 4.27 -1.26 -4.66 117.44 117.59 2wvt n TRP 394 Ca -0.01 0.27 0.00 0.00 -3.89 0.00 0.00 57.50 53.87 2wvt n TRP 394 Cb 0.33 -0.94 0.00 0.00 -1.36 0.00 0.00 31.31 29.34 2wvt n TRP 394 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 2wvt n GLY 395 N 0.56 -0.16 3.05 -1.67 0.00 -1.17 -0.31 105.19 105.49 2wvt n GLY 395 Ca 0.04 -0.70 -0.16 0.00 0.00 0.00 0.00 46.02 45.20 2wvt n GLY 395 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wvt s TYR 396 N -3.70 0.76 0.04 1.61 2.02 -0.70 -4.38 117.35 113.00 2wvt s TYR 396 Ca 0.00 -0.34 -0.06 0.00 -0.37 0.00 0.00 57.07 56.30 2wvt s TYR 396 Cb 0.00 -0.46 -0.05 0.00 -0.40 0.00 0.00 41.96 41.05 2wvt s TYR 396 CO 0.00 -0.03 0.29 0.71 -1.57 0.00 0.00 175.55 174.95 2wvt s TYR 397 N -0.86 3.56 0.11 2.71 2.02 -1.26 -0.27 117.35 123.36 2wvt s TYR 397 Ca -0.03 0.56 0.04 0.00 -0.37 0.00 0.00 57.07 57.27 2wvt s TYR 397 Cb -0.07 -1.99 -0.04 0.00 -0.40 0.00 0.00 41.96 39.47 2wvt s TYR 397 CO 0.00 0.57 -0.11 0.95 -1.57 0.00 0.00 175.55 175.40 2wvt s THR 398 N -1.39 1.06 -0.11 -0.71 -4.23 -0.14 -4.46 115.64 105.66 2wvt s THR 398 Ca 0.31 -1.72 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 2wvt s THR 398 Cb -0.13 -1.47 -0.02 0.00 1.34 0.00 0.00 72.50 72.22 2wvt s THR 398 CO 0.19 -0.56 -0.12 -0.60 -0.54 0.00 0.00 174.62 172.99 2wvt s ARG 399 N -2.91 3.22 0.84 3.99 3.52 0.86 -0.51 118.95 127.96 2wvt s ARG 399 Ca 0.08 -0.67 -0.07 0.00 -0.13 0.00 0.00 55.73 54.94 2wvt s ARG 399 Cb -0.02 -2.61 0.17 0.00 -1.56 0.00 0.00 34.95 30.93 2wvt s ARG 399 CO 0.01 0.31 1.15 0.20 -0.81 0.00 0.00 175.30 176.16 2wvt s GLY 400 N 0.10 1.77 0.52 8.12 0.00 -0.03 -0.85 107.32 116.95 2wvt s GLY 400 Ca -0.05 -1.57 0.30 0.00 0.00 0.00 0.00 44.72 43.39 2wvt s GLY 400 CO 0.04 -0.89 2.00 0.50 0.00 0.00 0.00 173.10 174.76 2wvt h LYS 401 N -1.05 0.00 -0.71 2.90 1.79 -1.89 -3.08 116.57 114.54 2wvt h LYS 401 Ca -0.39 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 57.57 2wvt h LYS 401 Cb 1.25 0.00 -0.38 0.00 -1.58 0.00 0.00 32.23 31.51 2wvt h LYS 401 CO 0.37 0.11 -0.67 0.09 -1.08 0.00 0.00 179.45 178.27 2wvt n ASN 402 N -3.37 4.84 -0.45 0.86 4.13 -1.26 -4.94 115.26 115.06 2wvt n ASN 402 Ca -0.01 -3.76 -0.06 0.00 1.68 0.00 0.00 54.58 52.43 2wvt n ASN 402 Cb 0.30 -0.40 -0.03 0.00 -1.54 0.00 0.00 39.78 38.11 2wvt n ASN 402 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 2wvt n ASP 403 N -0.76 -4.36 -4.77 6.41 8.00 -1.16 -4.99 116.55 114.92 2wvt n ASP 403 Ca 0.43 0.15 -0.41 0.00 0.71 0.00 0.00 54.79 55.67 2wvt n ASP 403 Cb 0.93 -2.38 -0.01 0.00 -0.02 0.00 0.00 41.12 39.64 2wvt n ASP 403 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2wvt s GLU 404 N -2.07 4.13 -0.20 -1.24 8.01 -1.26 -4.56 118.70 121.50 2wvt s GLU 404 Ca 0.00 2.55 -0.02 0.00 0.01 0.00 0.00 54.97 57.51 2wvt s GLU 404 Cb 0.00 -3.00 -0.00 0.00 -4.31 0.00 0.00 34.13 26.82 2wvt s GLU 404 CO 0.00 -0.56 -0.09 0.08 0.01 0.00 0.00 175.26 174.70 2wvt s VAL 405 N -0.63 2.97 -0.18 2.63 1.01 -1.07 -0.85 120.40 124.28 2wvt s VAL 405 Ca 0.57 -0.63 -0.08 0.00 0.00 0.00 0.00 61.98 61.83 2wvt s VAL 405 Cb -0.47 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 2wvt s VAL 405 CO 0.56 0.46 0.10 -0.31 0.00 0.00 0.00 175.10 175.91 2wvt s TYR 406 N 1.34 3.36 -0.25 5.22 2.02 0.33 0.41 117.35 129.78 2wvt s TYR 406 Ca 0.04 0.24 -0.15 0.00 -0.37 0.00 0.00 57.07 56.84 2wvt s TYR 406 Cb -0.14 -2.09 -0.04 0.00 -0.40 0.00 0.00 41.96 39.30 2wvt s TYR 406 CO -0.05 0.30 0.37 -1.64 -1.57 0.00 0.00 175.55 172.96 2wvt s MET 407 N 0.14 4.06 -0.39 -0.62 -1.94 0.66 -0.97 119.30 120.25 2wvt s MET 407 Ca 0.07 0.07 -0.08 0.00 -1.71 0.00 0.00 55.69 54.05 2wvt s MET 407 Cb -0.12 -3.62 0.07 0.00 2.01 0.00 0.00 34.83 33.17 2wvt s MET 407 CO -0.00 -0.20 0.20 0.08 -0.01 0.00 0.00 175.02 175.09 2wvt s VAL 408 N 1.83 4.00 -0.28 -6.03 1.01 0.63 -1.13 120.40 120.43 2wvt s VAL 408 Ca 0.16 -1.37 -0.15 0.00 0.00 0.00 0.00 61.98 60.62 2wvt s VAL 408 Cb -0.15 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.78 2wvt s VAL 408 CO 0.09 -0.41 0.40 -0.69 0.00 0.00 0.00 175.10 174.48 2wvt s VAL 409 N 1.39 5.15 -0.05 2.92 1.01 0.71 -1.72 120.40 129.81 2wvt s VAL 409 Ca 0.02 0.55 0.11 0.00 0.00 0.00 0.00 61.98 62.67 2wvt s VAL 409 Cb -0.22 -3.74 -0.17 0.00 0.00 0.00 0.00 36.38 32.26 2wvt s VAL 409 CO 0.02 0.11 0.18 0.49 0.00 0.00 0.00 175.10 175.90 2wvt n PHE 410 N 5.38 0.00 -3.91 5.22 3.72 0.58 -2.28 117.46 126.17 2wvt n PHE 410 Ca -0.08 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.02 2wvt n PHE 410 Cb 0.50 -0.38 -0.16 0.00 -0.94 0.00 0.00 39.48 38.51 2wvt n PHE 410 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 2wvt s ASN 411 N -3.77 3.82 -0.32 4.37 0.01 -0.46 -4.90 114.94 113.69 2wvt s ASN 411 Ca -0.05 -1.22 -0.28 0.00 -0.71 0.00 0.00 52.86 50.60 2wvt s ASN 411 Cb 0.06 -1.13 0.02 0.00 0.41 0.00 0.00 41.25 40.61 2wvt s ASN 411 CO 0.48 -0.26 1.05 -1.58 -1.51 0.00 0.00 177.10 175.28 2wvt s GLN 412 N 1.43 4.04 0.13 -0.60 2.00 -1.26 -4.49 119.66 120.91 2wvt s GLN 412 Ca -0.04 1.01 -0.31 0.00 -2.00 0.00 0.00 55.36 54.02 2wvt s GLN 412 Cb -0.19 -3.74 -0.07 0.00 0.80 0.00 0.00 33.01 29.81 2wvt s GLN 412 CO -0.07 -0.90 1.28 -1.25 -0.50 0.00 0.00 175.29 173.85 2wvt s PRO 413 N 3.61 4.40 0.60 1.67 0.04 -1.26 -4.91 135.00 139.14 2wvt s PRO 413 Ca 0.44 1.95 0.40 0.00 0.04 0.00 0.00 61.00 63.83 2wvt s PRO 413 Cb -0.12 -3.26 2.04 0.00 0.04 0.00 0.00 34.50 33.19 2wvt s PRO 413 CO 0.16 -0.28 2.21 1.88 0.04 0.00 0.00 177.00 181.00 2wvt h TYR 414 N 6.21 0.00 0.00 0.56 0.05 -1.94 -1.73 116.97 120.12 2wvt h TYR 414 Ca -0.43 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.35 2wvt h TYR 414 Cb 1.21 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.95 2wvt h TYR 414 CO 0.65 0.00 0.00 -1.13 -1.05 0.00 0.00 178.16 176.63 2wvt n SER 415 N -2.99 0.54 -0.50 3.88 3.41 -1.26 -4.88 113.62 111.83 2wvt n SER 415 Ca -0.02 0.61 -0.06 0.00 -0.26 0.00 0.00 58.87 59.14 2wvt n SER 415 Cb 0.13 -0.73 -0.03 0.00 -0.26 0.00 0.00 64.21 63.32 2wvt n SER 415 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2wvt n GLU 416 N -2.07 -0.81 -4.19 4.33 1.02 -0.65 -4.97 120.64 113.29 2wvt n GLU 416 Ca 0.03 0.63 -0.19 0.00 -0.02 0.00 0.00 57.16 57.61 2wvt n GLU 416 Cb 0.26 -4.49 -0.16 0.00 -0.02 0.00 0.00 31.44 27.03 2wvt n GLU 416 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2wvt s ARG 417 N -2.17 0.79 -0.32 3.49 0.52 -1.26 -1.98 118.95 118.02 2wvt s ARG 417 Ca 0.00 -0.13 -0.09 0.00 -0.52 0.00 0.00 55.73 54.99 2wvt s ARG 417 Cb 0.00 -0.79 0.00 0.00 0.52 0.00 0.00 34.95 34.68 2wvt s ARG 417 CO 0.00 -0.04 0.14 -0.51 0.02 0.00 0.00 175.30 174.91 2wvt s LEU 418 N 0.72 4.13 -0.01 2.53 1.43 0.19 -4.80 118.68 122.87 2wvt s LEU 418 Ca -0.10 -0.64 -0.30 0.00 -1.03 0.00 0.00 54.13 52.06 2wvt s LEU 418 Cb -0.13 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 2wvt s LEU 418 CO 0.00 -0.22 1.20 -0.63 0.23 0.00 0.00 176.35 176.93 2wvt s ILE 419 N 1.57 4.18 -0.25 -0.59 1.01 -1.26 -0.36 121.20 125.50 2wvt s ILE 419 Ca 0.04 1.53 0.02 0.00 0.00 0.00 0.00 60.65 62.24 2wvt s ILE 419 Cb -0.17 -3.99 0.06 0.00 0.01 0.00 0.00 42.46 38.37 2wvt s ILE 419 CO 0.05 0.05 -0.07 -0.69 0.00 0.00 0.00 174.94 174.28 2wvt s VAL 420 N 1.73 1.79 -0.22 2.92 1.01 0.17 -4.91 120.40 122.89 2wvt s VAL 420 Ca 0.57 -1.40 -0.14 0.00 0.00 0.00 0.00 61.98 61.01 2wvt s VAL 420 Cb -0.27 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 2wvt s VAL 420 CO 0.25 -0.08 0.34 -0.75 0.00 0.00 0.00 175.10 174.86 2wvt s LYS 421 N 1.27 4.12 0.09 2.72 2.20 -1.26 -0.36 119.74 128.53 2wvt s LYS 421 Ca -0.07 0.07 -0.02 0.00 -0.36 0.00 0.00 55.97 55.59 2wvt s LYS 421 Cb -0.19 -3.56 -0.05 0.00 -1.51 0.00 0.00 37.83 32.52 2wvt s LYS 421 CO -0.06 -0.05 0.28 0.95 -0.36 0.00 0.00 175.35 176.11 2wvt s THR 422 N 1.37 5.30 0.89 3.43 -4.23 -0.19 -4.36 115.64 117.85 2wvt s THR 422 Ca 0.16 -0.22 -0.11 0.00 -1.18 0.00 0.00 61.69 60.33 2wvt s THR 422 Cb -0.15 -3.63 0.12 0.00 1.34 0.00 0.00 72.50 70.19 2wvt s THR 422 CO 0.07 0.10 1.09 -2.84 -0.54 0.00 0.00 174.62 172.50 2wvt s PRO 423 N -2.57 1.33 0.03 3.99 0.02 -1.26 -4.87 135.00 131.67 2wvt s PRO 423 Ca 0.37 0.86 -0.39 0.00 0.02 0.00 0.00 61.00 61.87 2wvt s PRO 423 Cb -0.13 -1.81 -0.19 0.00 0.02 0.00 0.00 34.50 32.39 2wvt s PRO 423 CO 0.27 -2.20 1.17 0.36 -0.33 0.00 0.00 177.00 176.27 2wvt n LYS 424 N -3.86 0.40 -0.92 5.54 0.00 -1.26 -1.48 118.16 116.58 2wvt n LYS 424 Ca 0.07 0.15 0.00 0.00 -0.00 0.00 0.00 58.31 58.53 2wvt n LYS 424 Cb 0.55 -1.70 0.00 0.00 -0.00 0.00 0.00 35.03 33.88 2wvt n LYS 424 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2wvt n GLY 425 N 1.88 0.76 3.56 2.58 0.00 -1.26 -4.93 105.19 107.77 2wvt n GLY 425 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 2wvt n GLY 425 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wvt s ILE 426 N -3.23 4.44 0.07 -0.61 -1.09 -0.55 -1.18 121.20 119.06 2wvt s ILE 426 Ca 0.00 -0.15 0.07 0.00 -2.23 0.00 0.00 60.65 58.33 2wvt s ILE 426 Cb 0.00 -3.00 -0.04 0.00 -1.58 0.00 0.00 42.46 37.84 2wvt s ILE 426 CO 0.00 0.44 -0.13 0.42 -1.23 0.00 0.00 174.94 174.44 2wvt s THR 427 N 0.64 3.15 -0.30 2.92 -4.23 -0.60 -4.65 115.64 112.58 2wvt s THR 427 Ca 0.02 -1.19 -0.16 0.00 -1.18 0.00 0.00 61.69 59.18 2wvt s THR 427 Cb -0.13 -2.41 -0.02 0.00 1.34 0.00 0.00 72.50 71.27 2wvt s THR 427 CO 0.02 0.23 0.43 -0.69 -0.54 0.00 0.00 174.62 174.07 2wvt s VAL 428 N -1.07 5.12 -0.10 2.29 1.01 -1.26 -0.97 120.40 125.41 2wvt s VAL 428 Ca 0.18 0.51 0.08 0.00 0.00 0.00 0.00 61.98 62.75 2wvt s VAL 428 Cb -0.11 -3.80 -0.24 0.00 0.00 0.00 0.00 36.38 32.24 2wvt s VAL 428 CO 0.09 0.03 0.42 -0.62 0.00 0.00 0.00 175.10 175.03 2wvt n GLU 429 N 5.47 0.67 -3.56 2.72 1.02 -0.14 -5.01 120.64 121.81 2wvt n GLU 429 Ca -0.07 0.23 -0.13 0.00 -0.02 0.00 0.00 57.16 57.17 2wvt n GLU 429 Cb 0.50 -1.71 -0.05 0.00 -0.02 0.00 0.00 31.44 30.16 2wvt n GLU 429 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2wvt s LYS 430 N -2.56 1.07 -0.00 3.49 2.20 -1.20 -4.99 119.74 117.75 2wvt s LYS 430 Ca -0.12 -0.32 0.03 0.00 -0.36 0.00 0.00 55.97 55.20 2wvt s LYS 430 Cb 0.07 0.49 -0.01 0.00 -1.51 0.00 0.00 37.83 36.87 2wvt s LYS 430 CO 0.80 -0.40 -0.10 0.00 -0.36 0.00 0.00 175.35 175.29 2wvt s ALA 431 N -2.77 0.82 -0.02 3.13 0.00 -1.26 -1.56 121.76 120.10 2wvt s ALA 431 Ca -0.03 -0.47 0.01 0.00 0.00 0.00 0.00 51.96 51.47 2wvt s ALA 431 Cb -0.00 -0.19 0.01 0.00 0.00 0.00 0.00 23.12 22.94 2wvt s ALA 431 CO -0.04 0.19 -0.04 0.99 0.00 0.00 0.00 175.76 176.85 2wvt s THR 432 N -0.34 0.40 -0.09 0.00 2.01 -0.31 -1.08 115.64 116.23 2wvt s THR 432 Ca 0.03 -0.14 -0.30 0.00 0.31 0.00 0.00 61.69 61.59 2wvt s THR 432 Cb -0.04 -0.39 -0.04 0.00 0.01 0.00 0.00 72.50 72.05 2wvt s THR 432 CO -0.00 0.15 1.39 -0.22 -0.69 0.00 0.00 174.62 175.24 2wvt s LEU 433 N 0.34 4.26 0.17 4.42 2.96 0.01 -0.48 118.68 130.36 2wvt s LEU 433 Ca -0.04 1.94 -0.14 0.00 -0.22 0.00 0.00 54.13 55.67 2wvt s LEU 433 Cb -0.07 -3.54 0.06 0.00 0.50 0.00 0.00 46.19 43.13 2wvt s LEU 433 CO -0.00 -0.78 1.82 0.25 -1.32 0.00 0.00 176.35 176.33 2wvt h LEU 434 N 9.38 0.61 -0.52 -0.68 5.85 -1.78 0.70 115.31 128.86 2wvt h LEU 434 Ca -0.33 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.36 2wvt h LEU 434 Cb 1.15 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.02 2wvt h LEU 434 CO 0.94 0.46 0.00 0.71 -0.34 0.00 0.00 178.44 180.21 2wvt h THR 435 N 0.70 0.00 0.00 1.05 1.35 -1.89 -3.33 112.91 110.79 2wvt h THR 435 Ca 0.19 -0.82 0.00 0.00 -0.55 0.00 0.00 66.41 65.23 2wvt h THR 435 Cb -0.06 1.82 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 2wvt h THR 435 CO -0.04 0.00 -0.68 0.35 -0.25 0.00 0.00 175.52 174.90 2wvt n THR 436 N -3.09 0.00 -0.99 6.82 -2.24 -1.16 -5.02 114.28 108.61 2wvt n THR 436 Ca 0.03 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 2wvt n THR 436 Cb 0.45 0.67 0.00 0.00 -2.10 0.00 0.00 70.33 69.35 2wvt n THR 436 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wvt n GLY 437 N 1.93 0.96 3.74 3.38 0.00 0.23 -5.01 105.19 110.42 2wvt n GLY 437 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2wvt n GLY 437 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wvt s GLU 438 N -0.02 4.49 0.32 1.61 -1.05 -1.25 -4.68 118.70 118.12 2wvt s GLU 438 Ca 0.00 1.88 -0.28 0.00 -0.15 0.00 0.00 54.97 56.42 2wvt s GLU 438 Cb 0.00 -3.23 -0.09 0.00 -0.44 0.00 0.00 34.13 30.36 2wvt s GLU 438 CO 0.00 -0.08 1.15 0.34 0.95 0.00 0.00 175.26 177.62 2wvt s ASP 439 N 0.06 7.01 -0.12 0.83 2.15 -1.26 -0.81 116.67 124.54 2wvt s ASP 439 Ca 0.52 2.35 0.02 0.00 0.43 0.00 0.00 52.55 55.87 2wvt s ASP 439 Cb -0.33 -2.63 -0.01 0.00 -0.30 0.00 0.00 42.92 39.66 2wvt s ASP 439 CO 0.37 -0.33 -0.18 -0.63 -0.17 0.00 0.00 175.17 174.23 2wvt s ILE 440 N -1.24 2.57 0.21 4.11 -1.09 -0.24 -4.88 121.20 120.64 2wvt s ILE 440 Ca 0.48 -0.83 -0.32 0.00 -2.23 0.00 0.00 60.65 57.75 2wvt s ILE 440 Cb -0.33 -2.04 -0.11 0.00 -1.58 0.00 0.00 42.46 38.40 2wvt s ILE 440 CO 0.42 0.54 1.67 -0.89 -1.23 0.00 0.00 174.94 175.45 2wvt s THR 441 N 0.38 2.17 -0.16 2.92 2.01 -1.26 -4.16 115.64 117.54 2wvt s THR 441 Ca -0.14 0.13 0.01 0.00 0.31 0.00 0.00 61.69 61.99 2wvt s THR 441 Cb -0.17 -3.08 0.02 0.00 0.01 0.00 0.00 72.50 69.28 2wvt s THR 441 CO 0.07 0.01 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.15 2wvt s VAL 442 N 1.03 1.82 -0.12 3.82 1.01 -1.26 -1.18 120.40 125.52 2wvt s VAL 442 Ca 0.72 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.94 2wvt s VAL 442 Cb -0.48 -1.67 0.00 0.00 0.00 0.00 0.00 36.38 34.23 2wvt s VAL 442 CO 0.34 0.50 -0.22 -0.69 0.00 0.00 0.00 175.10 175.02 2wvt s VAL 443 N 1.37 2.11 -0.00 2.92 1.01 -0.38 -5.00 120.40 122.43 2wvt s VAL 443 Ca 0.05 -0.98 -0.30 0.00 0.00 0.00 0.00 61.98 60.74 2wvt s VAL 443 Cb -0.13 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 2wvt s VAL 443 CO -0.11 0.55 1.20 -0.70 0.00 0.00 0.00 175.10 176.04 2wvt s GLU 444 N 0.56 4.39 -0.19 2.72 2.12 -1.26 -0.56 118.70 126.48 2wvt s GLU 444 Ca -0.13 1.72 0.05 0.00 0.36 0.00 0.00 54.97 56.97 2wvt s GLU 444 Cb -0.17 -3.47 -0.15 0.00 0.26 0.00 0.00 34.13 30.60 2wvt s GLU 444 CO 0.04 -0.36 -0.11 0.25 -0.54 0.00 0.00 175.26 174.54 2wvt n THR 445 N 4.30 1.15 -3.67 -1.70 -2.24 -0.31 -4.90 114.28 106.91 2wvt n THR 445 Ca 0.10 -0.52 -0.05 0.00 -2.27 0.00 0.00 64.05 61.31 2wvt n THR 445 Cb 0.46 -1.02 -0.01 0.00 -2.10 0.00 0.00 70.33 67.66 2wvt n THR 445 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2wvt n THR 446 N -2.94 0.00 -2.13 4.28 5.66 -1.18 -5.03 114.28 112.94 2wvt n THR 446 Ca -0.33 -0.60 -0.41 0.00 -3.05 0.00 0.00 64.05 59.67 2wvt n THR 446 Cb 0.93 0.39 -0.02 0.00 -1.55 0.00 0.00 70.33 70.07 2wvt n THR 446 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2wvt s ARG 447 N -2.25 4.36 -1.80 1.09 1.70 -1.26 -2.49 118.95 118.30 2wvt s ARG 447 Ca 0.10 2.19 0.00 0.00 -0.47 0.00 0.00 55.73 57.55 2wvt s ARG 447 Cb -0.01 -3.09 0.00 0.00 -0.57 0.00 0.00 34.95 31.28 2wvt s ARG 447 CO 0.07 -0.20 0.00 0.09 -1.08 0.00 0.00 175.30 174.18 2wvt n ASN 448 N 1.18 -5.55 -3.85 -2.89 5.03 -1.26 -4.97 115.26 102.95 2wvt n ASN 448 Ca 0.01 0.42 -0.14 0.00 0.87 0.00 0.00 54.58 55.74 2wvt n ASN 448 Cb 0.42 -4.58 -0.15 0.00 -1.02 0.00 0.00 39.78 34.45 2wvt n ASN 448 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 2wvt s GLU 449 N -3.43 0.09 0.14 3.52 2.12 -1.04 -1.02 118.70 119.08 2wvt s GLU 449 Ca 0.00 0.04 0.07 0.00 0.36 0.00 0.00 54.97 55.44 2wvt s GLU 449 Cb 0.00 -0.19 -0.04 0.00 0.26 0.00 0.00 34.13 34.16 2wvt s GLU 449 CO 0.00 -0.05 -0.17 0.71 -0.54 0.00 0.00 175.26 175.21 2wvt s TYR 450 N 0.43 1.63 -0.23 5.30 2.02 0.51 -1.16 117.35 125.85 2wvt s TYR 450 Ca -0.04 -0.50 -0.12 0.00 -0.37 0.00 0.00 57.07 56.05 2wvt s TYR 450 Cb -0.06 -0.84 -0.05 0.00 -0.40 0.00 0.00 41.96 40.61 2wvt s TYR 450 CO -0.01 0.23 0.22 -0.80 -1.57 0.00 0.00 175.55 173.62 2wvt s ASN 451 N -2.46 6.19 -0.23 2.29 0.01 0.27 -0.66 114.94 120.35 2wvt s ASN 451 Ca 0.11 0.20 -0.07 0.00 -0.71 0.00 0.00 52.86 52.39 2wvt s ASN 451 Cb -0.06 -2.14 -0.03 0.00 0.41 0.00 0.00 41.25 39.43 2wvt s ASN 451 CO 0.05 0.02 0.07 -0.69 -1.51 0.00 0.00 177.10 175.05 2wvt s VAL 452 N 1.16 4.48 0.44 1.60 1.01 0.51 -1.25 120.40 128.35 2wvt s VAL 452 Ca 0.10 -0.12 -0.25 0.00 0.00 0.00 0.00 61.98 61.71 2wvt s VAL 452 Cb -0.14 -3.08 -0.08 0.00 0.00 0.00 0.00 36.38 33.09 2wvt s VAL 452 CO 0.06 0.36 1.30 -0.44 0.00 0.00 0.00 175.10 176.38 2wvt s SER 453 N 1.31 6.08 0.75 3.32 0.01 -0.33 0.54 113.70 125.38 2wvt s SER 453 Ca 0.05 2.65 -0.12 0.00 1.31 0.00 0.00 55.95 59.84 2wvt s SER 453 Cb -0.15 -2.63 0.04 0.00 0.21 0.00 0.00 66.02 63.49 2wvt s SER 453 CO 0.04 -1.01 1.10 0.68 0.41 0.00 0.00 173.24 174.46 2wvt s VAL 454 N -1.30 3.24 0.74 3.43 -7.23 -0.84 -4.76 120.40 113.68 2wvt s VAL 454 Ca 0.61 0.45 -0.15 0.00 -1.81 0.00 0.00 61.98 61.08 2wvt s VAL 454 Cb -0.38 -2.93 0.04 0.00 0.56 0.00 0.00 36.38 33.68 2wvt s VAL 454 CO 0.47 -0.48 1.21 -2.84 -0.31 0.00 0.00 175.10 173.16 2wvt s PRO 455 N -4.65 2.07 0.42 4.82 0.02 -1.26 -4.93 135.00 131.49 2wvt s PRO 455 Ca 0.63 1.77 0.17 0.00 0.02 0.00 0.00 61.00 63.59 2wvt s PRO 455 Cb -0.18 -1.82 0.91 0.00 0.02 0.00 0.00 34.50 33.42 2wvt s PRO 455 CO 0.52 -1.89 1.89 0.87 -0.33 0.00 0.00 177.00 178.06 2wvt h LYS 456 N -0.36 0.00 -5.14 5.54 1.57 -1.97 -3.37 116.57 112.84 2wvt h LYS 456 Ca -0.48 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 57.65 2wvt h LYS 456 Cb 1.30 0.00 -0.25 0.00 0.08 0.00 0.00 32.23 33.35 2wvt h LYS 456 CO 0.49 0.29 -0.71 0.15 -0.57 0.00 0.00 179.45 179.11 2wvt s LYS 457 N -4.19 3.49 -0.26 3.15 -0.14 -1.26 -5.07 119.74 115.45 2wvt s LYS 457 Ca -0.03 -0.59 -0.36 0.00 -1.36 0.00 0.00 55.97 53.64 2wvt s LYS 457 Cb 0.14 -2.94 -0.12 0.00 -1.68 0.00 0.00 37.83 33.23 2wvt s LYS 457 CO 0.69 0.00 2.01 -1.71 -0.76 0.00 0.00 175.35 175.58 2wvt n ASN 458 N 4.21 2.60 0.18 2.83 2.85 -1.26 -4.83 115.26 121.83 2wvt n ASN 458 Ca -0.18 0.70 0.18 0.00 -0.11 0.00 0.00 54.58 55.18 2wvt n ASN 458 Cb 0.52 -1.28 0.76 0.00 1.24 0.00 0.00 39.78 41.02 2wvt n ASN 458 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2wvt h PRO 459 N 10.49 0.00 -0.00 1.20 0.11 -1.98 -3.46 132.00 138.37 2wvt h PRO 459 Ca -0.38 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.73 2wvt h PRO 459 Cb 1.30 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.41 2wvt h PRO 459 CO 0.98 0.00 -0.00 0.41 -0.21 0.00 0.00 178.00 179.18 2wvt n GLY 460 N -1.40 0.42 3.61 -0.55 0.00 -1.26 -4.98 105.19 101.03 2wvt n GLY 460 Ca 0.04 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.96 2wvt n GLY 460 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wvt s GLU 461 N -0.36 1.50 0.28 1.61 -1.05 -1.26 -5.12 118.70 114.30 2wvt s GLU 461 Ca 0.00 -0.93 -0.30 0.00 -0.15 0.00 0.00 54.97 53.59 2wvt s GLU 461 Cb 0.00 0.54 -0.13 0.00 -0.44 0.00 0.00 34.13 34.10 2wvt s GLU 461 CO 0.00 -0.65 1.35 -2.30 0.95 0.00 0.00 175.26 174.61 2wvt n PRO 462 N -0.38 2.06 -4.27 -4.83 -0.02 -1.26 -4.95 135.00 121.34 2wvt n PRO 462 Ca -0.08 0.73 -0.15 0.00 -2.02 0.00 0.00 63.50 61.98 2wvt n PRO 462 Cb 0.62 -2.35 -0.10 0.00 -0.02 0.00 0.00 33.50 31.65 2wvt n PRO 462 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 2wvt s TYR 463 N -0.48 1.41 -0.08 6.00 1.13 -0.96 -4.93 117.35 119.43 2wvt s TYR 463 Ca 0.63 -1.31 0.05 0.00 -1.41 0.00 0.00 57.07 55.02 2wvt s TYR 463 Cb -0.62 -0.75 -0.00 0.00 -1.10 0.00 0.00 41.96 39.49 2wvt s TYR 463 CO 0.55 -0.51 -0.23 0.08 -2.51 0.00 0.00 175.55 172.93 2wvt s VAL 464 N -3.88 1.96 -0.10 -3.49 1.01 -1.26 -0.21 120.40 114.44 2wvt s VAL 464 Ca 0.38 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.39 2wvt s VAL 464 Cb 0.07 -1.68 -0.02 0.00 0.00 0.00 0.00 36.38 34.74 2wvt s VAL 464 CO 0.14 0.54 -0.12 -0.63 0.00 0.00 0.00 175.10 175.03 2wvt s ILE 465 N 0.18 3.18 -0.21 2.22 1.01 -0.28 -2.18 121.20 125.12 2wvt s ILE 465 Ca -0.13 -0.65 -0.09 0.00 0.00 0.00 0.00 60.65 59.79 2wvt s ILE 465 Cb -0.16 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.96 2wvt s ILE 465 CO 0.07 0.55 0.10 -1.58 0.00 0.00 0.00 174.94 174.08 2wvt s GLN 466 N -0.16 4.01 -0.13 2.79 0.74 0.37 -0.24 119.66 127.03 2wvt s GLN 466 Ca -0.00 -0.31 -0.07 0.00 0.05 0.00 0.00 55.36 55.02 2wvt s GLN 466 Cb -0.13 -3.36 -0.04 0.00 1.10 0.00 0.00 33.01 30.58 2wvt s GLN 466 CO 0.03 0.17 0.13 -0.51 -0.55 0.00 0.00 175.29 174.57 2wvt s LEU 467 N 0.68 4.32 -0.22 3.68 1.43 0.17 -1.16 118.68 127.57 2wvt s LEU 467 Ca 0.05 0.41 -0.15 0.00 -1.03 0.00 0.00 54.13 53.41 2wvt s LEU 467 Cb -0.13 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 2wvt s LEU 467 CO 0.01 0.36 0.39 -0.75 0.23 0.00 0.00 176.35 176.59 2wvt s LYS 468 N -0.75 4.12 0.31 1.70 2.20 -0.60 -2.60 119.74 124.12 2wvt s LYS 468 Ca 0.13 0.14 0.10 0.00 -0.36 0.00 0.00 55.97 55.98 2wvt s LYS 468 Cb -0.12 -3.57 -0.06 0.00 -1.51 0.00 0.00 37.83 32.57 2wvt s LYS 468 CO 0.03 -0.11 -0.12 0.14 -0.36 0.00 0.00 175.35 174.93 2wvt s VAL 469 N 1.54 2.18 -0.03 4.02 -7.23 -1.26 -0.96 120.40 118.66 2wvt s VAL 469 Ca 0.17 -2.25 0.01 0.00 -1.81 0.00 0.00 61.98 58.11 2wvt s VAL 469 Cb -0.15 -2.48 0.01 0.00 0.56 0.00 0.00 36.38 34.32 2wvt s VAL 469 CO 0.08 -0.30 -0.05 -0.60 -0.31 0.00 0.00 175.10 173.92 2wvt s ARG 470 N -3.60 0.74 -0.10 4.82 6.06 -0.15 -4.90 118.95 121.82 2wvt s ARG 470 Ca 0.31 -0.16 -0.04 0.00 -2.50 0.00 0.00 55.73 53.33 2wvt s ARG 470 Cb 0.00 -0.73 -0.04 0.00 0.06 0.00 0.00 34.95 34.25 2wvt s ARG 470 CO 0.15 0.01 0.08 0.00 -2.50 0.00 0.00 175.30 173.03 2wvt s ALA 471 N 0.51 3.61 1.00 6.12 0.00 -1.26 -1.55 121.76 130.19 2wvt s ALA 471 Ca -0.07 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.17 2wvt s ALA 471 Cb -0.10 -1.74 0.00 0.00 0.00 0.00 0.00 23.12 21.28 2wvt s ALA 471 CO 0.00 0.61 0.00 0.00 0.00 0.00 0.00 175.76 176.37 2wvt n ALA 472 N 1.99 0.00 -0.40 0.00 0.00 -0.32 -5.01 120.51 116.77 2wvt n ALA 472 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2wvt n ALA 472 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 2wvt n ALA 472 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13