#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 5.00 -0.04 6.31 1.01 -1.26 -5.03 121.20 127.19 2wvt s ILE 36 Ca 0.00 1.39 -0.30 0.00 0.00 0.00 0.00 60.65 61.74 2wvt s ILE 36 Cb 0.00 -4.02 -0.04 0.00 0.01 0.00 0.00 42.46 38.41 2wvt s ILE 36 CO 0.00 0.15 1.24 -2.16 0.00 0.00 0.00 174.94 174.17 2wvt s PRO 37 N 1.49 4.34 0.06 2.79 0.04 -1.26 -4.83 135.00 137.61 2wvt s PRO 37 Ca 0.34 1.73 0.07 0.00 0.04 0.00 0.00 61.00 63.19 2wvt s PRO 37 Cb -0.17 -3.56 -0.03 0.00 0.04 0.00 0.00 34.50 30.79 2wvt s PRO 37 CO 0.14 -0.47 -0.20 -0.51 0.04 0.00 0.00 177.00 176.00 2wvt s LEU 38 N 2.24 2.19 -0.07 -3.56 1.43 -1.26 -5.02 118.68 114.64 2wvt s LEU 38 Ca 0.57 -0.55 0.16 0.00 -1.03 0.00 0.00 54.13 53.28 2wvt s LEU 38 Cb -0.26 -0.92 -0.22 0.00 0.03 0.00 0.00 46.19 44.82 2wvt s LEU 38 CO 0.23 0.13 0.51 0.29 0.23 0.00 0.00 176.35 177.74 2wvt n LYS 39 N 1.69 0.65 -1.10 1.70 5.02 -1.26 -4.59 118.16 120.27 2wvt n LYS 39 Ca -0.18 0.17 -0.02 0.00 -2.02 0.00 0.00 58.31 56.25 2wvt n LYS 39 Cb 0.53 -1.70 0.14 0.00 -0.02 0.00 0.00 35.03 33.98 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 -2.88 0.77 -1.02 2.13 4.01 -1.26 -5.03 117.16 113.87 2wvt n TYR 40 Ca -0.20 -1.64 0.00 0.00 -0.16 0.00 0.00 57.90 55.90 2wvt n TYR 40 Cb 1.01 -0.27 0.00 0.00 -0.31 0.00 0.00 39.34 39.78 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 -0.89 1.08 3.69 2.72 0.00 -1.26 -4.18 105.19 106.34 2wvt n GLY 41 Ca 0.24 -1.84 -0.40 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 n ALA 42 N -3.00 1.02 -0.04 4.61 0.00 -1.26 -4.93 120.51 116.92 2wvt n ALA 42 Ca 0.00 0.17 -0.03 0.00 0.00 0.00 0.00 53.44 53.58 2wvt n ALA 42 Cb 0.00 -2.24 -0.07 0.00 0.00 0.00 0.00 19.45 17.15 2wvt n ALA 42 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2wvt n THR 43 N -0.79 0.48 -3.34 0.00 -2.24 -1.26 -5.00 114.28 102.12 2wvt n THR 43 Ca 0.09 -0.33 -0.32 0.00 -2.27 0.00 0.00 64.05 61.23 2wvt n THR 43 Cb 0.43 -0.62 -0.05 0.00 -2.10 0.00 0.00 70.33 67.98 2wvt n THR 43 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2wvt s ASN 44 N -3.86 6.66 -0.29 3.42 0.01 -1.26 -5.08 114.94 114.54 2wvt s ASN 44 Ca -0.04 1.00 -0.07 0.00 -0.71 0.00 0.00 52.86 53.04 2wvt s ASN 44 Cb 0.03 -2.26 -0.00 0.00 0.41 0.00 0.00 41.25 39.43 2wvt s ASN 44 CO 0.34 -0.11 0.09 -0.70 -1.51 0.00 0.00 177.10 175.21 2wvt s GLU 45 N -2.88 3.24 3.06 -0.60 2.56 -1.26 -4.91 118.70 117.90 2wvt s GLU 45 Ca 0.49 -0.76 0.00 0.00 0.00 0.00 0.00 54.97 54.69 2wvt s GLU 45 Cb -0.11 -3.40 0.00 0.00 2.00 0.00 0.00 34.13 32.62 2wvt s GLU 45 CO 0.21 -0.39 0.00 0.41 -0.56 0.00 0.00 175.26 174.92 2wvt n GLY 46 N 4.90 0.50 3.72 -1.50 0.00 -1.26 -4.74 105.19 106.82 2wvt n GLY 46 Ca -0.15 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.59 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 4.64 0.44 1.61 1.02 -1.26 -4.97 119.74 121.21 2wvt s LYS 47 Ca 0.00 1.43 -0.25 0.00 0.02 0.00 0.00 55.97 57.17 2wvt s LYS 47 Cb 0.00 -3.41 -0.09 0.00 -0.52 0.00 0.00 37.83 33.81 2wvt s LYS 47 CO 0.00 0.11 1.26 0.54 -0.92 0.00 0.00 175.35 176.34 2wvt n ARG 48 N 3.24 1.86 -0.01 1.68 1.74 -1.26 -4.92 116.66 118.98 2wvt n ARG 48 Ca 0.04 0.66 0.00 0.00 -0.77 0.00 0.00 57.85 57.78 2wvt n ARG 48 Cb 0.50 -2.39 0.00 0.00 -1.02 0.00 0.00 32.46 29.55 2wvt n ARG 48 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2wvt n GLN 49 N -0.11 1.30 -1.36 5.56 1.13 -1.26 -4.69 117.38 117.95 2wvt n GLN 49 Ca 0.07 -0.97 -0.34 0.00 -1.94 0.00 0.00 57.00 53.82 2wvt n GLN 49 Cb 0.40 -0.73 0.10 0.00 0.11 0.00 0.00 30.24 30.13 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 -0.49 4.02 0.51 1.08 -4.77 -1.26 -4.73 116.67 111.03 2wvt s ASP 50 Ca 0.00 2.41 0.23 0.00 -3.30 0.00 0.00 52.55 51.90 2wvt s ASP 50 Cb 0.00 -2.59 1.33 0.00 -1.09 0.00 0.00 42.92 40.57 2wvt s ASP 50 CO 0.00 -2.38 1.98 -0.65 0.70 0.00 0.00 175.17 174.82 2wvt h PRO 51 N -0.39 0.08 -0.38 2.11 0.11 -1.98 -1.39 132.00 130.16 2wvt h PRO 51 Ca -0.48 -0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.56 2wvt h PRO 51 Cb 1.30 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 2wvt h PRO 51 CO 0.49 0.05 -0.05 0.00 -0.21 0.00 0.00 178.00 178.28 2wvt h ALA 52 N 1.72 0.51 -0.11 -0.75 0.00 -1.91 -1.17 119.26 117.55 2wvt h ALA 52 Ca 0.27 -0.28 -0.22 0.00 0.00 0.00 0.00 54.91 54.68 2wvt h ALA 52 Cb 0.98 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.65 2wvt h ALA 52 CO -0.02 0.33 -0.81 1.98 0.00 0.00 0.00 179.25 180.72 2wvt h MET 53 N 0.51 0.70 -0.71 0.00 -1.53 -1.59 -1.39 114.93 110.92 2wvt h MET 53 Ca 0.10 -0.60 0.08 0.00 -3.44 0.00 0.00 59.70 55.84 2wvt h MET 53 Cb 0.54 0.13 -0.05 0.00 -0.55 0.00 0.00 31.60 31.68 2wvt h MET 53 CO 0.03 1.21 0.47 1.96 0.14 0.00 0.00 176.91 180.72 2wvt h GLN 54 N 0.47 0.64 -0.12 0.39 4.20 -1.25 -0.44 115.11 119.00 2wvt h GLN 54 Ca -0.06 -0.04 -0.09 0.00 0.06 0.00 0.00 58.65 58.52 2wvt h GLN 54 Cb 1.44 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 29.08 2wvt h GLN 54 CO 0.16 0.42 -0.29 -0.22 -0.67 0.00 0.00 178.83 178.24 2wvt h LYS 55 N 0.66 0.41 -0.45 1.46 1.63 -0.98 0.32 116.57 119.62 2wvt h LYS 55 Ca 0.32 -0.28 0.09 0.00 -0.85 0.00 0.00 60.65 59.93 2wvt h LYS 55 Cb 0.37 0.04 -0.09 0.00 -0.60 0.00 0.00 32.23 31.95 2wvt h LYS 55 CO -0.11 0.89 -0.18 0.35 -3.45 0.00 0.00 179.45 176.95 2wvt h PHE 56 N -0.02 -0.44 -0.11 1.91 3.57 -0.73 -0.87 116.94 120.25 2wvt h PHE 56 Ca -0.00 0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 2wvt h PHE 56 Cb 0.89 0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.89 2wvt h PHE 56 CO 0.11 -0.26 -0.04 -0.09 -2.23 0.00 0.00 178.31 175.80 2wvt h ARG 57 N -0.08 0.22 0.00 1.11 2.43 -1.09 -3.20 114.38 113.77 2wvt h ARG 57 Ca 0.22 -0.09 -0.04 0.00 -0.81 0.00 0.00 59.98 59.26 2wvt h ARG 57 Cb 0.42 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 2wvt h ARG 57 CO -0.51 0.54 -0.20 -0.44 -1.51 0.00 0.00 179.97 177.86 2wvt h ASP 58 N -0.12 0.00 -0.76 -3.80 3.32 -0.72 -2.71 116.42 111.63 2wvt h ASP 58 Ca 0.03 0.00 0.12 0.00 0.02 0.00 0.00 57.03 57.20 2wvt h ASP 58 Cb 0.47 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.94 2wvt h ASP 58 CO 0.01 0.20 0.36 0.78 -1.72 0.00 0.00 179.24 178.87 2wvt h ASN 59 N 0.00 0.43 0.00 6.45 2.35 -1.15 -1.53 115.58 122.13 2wvt h ASN 59 Ca -0.00 0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2wvt h ASN 59 Cb 0.44 0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.82 2wvt h ASN 59 CO 0.03 0.21 0.00 0.54 -1.65 0.00 0.00 177.43 176.55 2wvt n ARG 60 N -4.90 0.00 -3.85 0.81 5.12 -1.02 -4.59 116.66 108.23 2wvt n ARG 60 Ca 0.14 0.00 -0.36 0.00 -1.93 0.00 0.00 57.85 55.70 2wvt n ARG 60 Cb 0.36 0.00 -0.13 0.00 -1.16 0.00 0.00 32.46 31.53 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 3.30 0.28 0.55 2.96 -1.26 -1.29 118.68 123.22 2wvt s LEU 61 Ca 0.00 -0.24 0.10 0.00 -0.22 0.00 0.00 54.13 53.77 2wvt s LEU 61 Cb 0.00 -1.87 -0.05 0.00 0.50 0.00 0.00 46.19 44.77 2wvt s LEU 61 CO 0.00 -0.01 -0.14 -0.83 -1.32 0.00 0.00 176.35 174.05 2wvt s GLY 62 N 1.45 1.85 0.04 7.98 0.00 -0.37 -0.90 107.32 117.38 2wvt s GLY 62 Ca 0.05 -1.88 0.05 0.00 0.00 0.00 0.00 44.72 42.94 2wvt s GLY 62 CO 0.02 -1.92 -0.10 0.00 0.00 0.00 0.00 173.10 171.10 2wvt s ALA 63 N -2.71 2.92 -0.12 3.20 0.00 -0.05 -1.42 121.76 123.58 2wvt s ALA 63 Ca 0.29 -1.13 -0.04 0.00 0.00 0.00 0.00 51.96 51.08 2wvt s ALA 63 Cb -0.01 -0.98 -0.03 0.00 0.00 0.00 0.00 23.12 22.10 2wvt s ALA 63 CO 0.13 0.62 0.02 0.12 0.00 0.00 0.00 175.76 176.65 2wvt s PHE 64 N -1.06 3.21 -0.24 0.00 5.99 0.06 -0.35 117.98 125.59 2wvt s PHE 64 Ca 0.18 0.14 -0.00 0.00 0.00 0.00 0.00 56.93 57.25 2wvt s PHE 64 Cb -0.11 -1.89 0.03 0.00 0.00 0.00 0.00 43.02 41.06 2wvt s PHE 64 CO 0.09 0.36 -0.09 0.42 -0.00 0.00 0.00 175.22 176.01 2wvt s ILE 65 N -0.47 2.58 -0.45 3.12 -1.09 0.10 -0.50 121.20 124.49 2wvt s ILE 65 Ca 0.09 -1.18 -0.16 0.00 -2.23 0.00 0.00 60.65 57.18 2wvt s ILE 65 Cb -0.12 -2.34 0.06 0.00 -1.58 0.00 0.00 42.46 38.48 2wvt s ILE 65 CO 0.02 0.18 0.38 -1.00 -1.23 0.00 0.00 174.94 173.29 2wvt s HIS 66 N 1.26 3.23 -0.04 3.97 3.76 -0.60 -1.91 115.29 124.96 2wvt s HIS 66 Ca -0.02 -0.80 -0.00 0.00 -0.15 0.00 0.00 55.06 54.09 2wvt s HIS 66 Cb -0.17 -3.01 0.03 0.00 1.11 0.00 0.00 32.58 30.54 2wvt s HIS 66 CO -0.06 -0.74 0.00 -0.46 -0.85 0.00 0.00 174.74 172.63 2wvt s TRP 67 N 1.70 0.43 0.00 1.40 -0.00 -1.26 -3.89 118.94 117.32 2wvt s TRP 67 Ca 0.05 -0.04 0.00 0.00 -0.00 0.00 0.00 56.10 56.11 2wvt s TRP 67 Cb -0.22 -0.55 0.00 0.00 -0.00 0.00 0.00 33.47 32.70 2wvt s TRP 67 CO 0.08 -0.19 0.00 0.41 -0.00 0.00 0.00 176.95 177.25 2wvt n GLY 68 N 4.51 1.73 0.24 5.86 0.00 -1.26 -4.85 105.19 111.42 2wvt n GLY 68 Ca -0.19 -0.79 0.04 0.00 0.00 0.00 0.00 46.02 45.08 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 0.15 -1.83 0.99 3.38 -1.97 -1.91 115.31 114.12 2wvt h LEU 69 Ca 0.00 -0.03 0.12 0.00 0.09 0.00 0.00 57.88 58.06 2wvt h LEU 69 Cb 0.00 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2wvt h LEU 69 CO 0.00 0.29 0.53 0.10 0.09 0.00 0.00 178.44 179.45 2wvt h TYR 70 N 0.16 0.00 0.00 1.13 -0.00 -1.93 -0.90 116.97 115.43 2wvt h TYR 70 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 58.73 58.74 2wvt h TYR 70 Cb 0.30 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.02 2wvt h TYR 70 CO 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 178.16 178.03 2wvt h ALA 71 N 1.32 1.23 0.59 0.10 0.00 -1.60 -1.05 119.26 119.86 2wvt h ALA 71 Ca 0.20 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2wvt h ALA 71 Cb 1.26 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 19.03 2wvt h ALA 71 CO -0.00 0.17 -0.28 0.82 0.00 0.00 0.00 179.25 179.95 2wvt h ILE 72 N 0.00 0.00 0.00 0.00 2.04 -1.37 -3.26 117.51 114.92 2wvt h ILE 72 Ca -0.00 -0.37 -0.06 0.00 1.00 0.00 0.00 64.86 65.43 2wvt h ILE 72 Cb 0.40 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.48 2wvt h ILE 72 CO 0.02 0.00 -0.28 1.55 0.00 0.00 0.00 178.15 179.43 2wvt h PRO 73 N -1.16 0.00 -6.23 2.37 0.13 -1.71 -3.48 132.00 121.93 2wvt h PRO 73 Ca -0.08 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.59 2wvt h PRO 73 Cb 0.61 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.73 2wvt h PRO 73 CO 0.13 0.28 -0.76 0.41 -0.23 0.00 0.00 178.00 177.84 2wvt n GLY 74 N -0.14 -0.47 1.35 1.56 0.00 -0.40 -2.23 105.19 104.85 2wvt n GLY 74 Ca -0.01 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.71 0.75 3.35 -0.02 0.00 -1.26 -1.30 105.19 105.00 2wvt n GLY 75 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.55 2.76 -0.09 1.61 2.12 -0.95 -0.13 118.70 123.47 2wvt s GLU 76 Ca 0.00 -0.79 -0.04 0.00 0.36 0.00 0.00 54.97 54.50 2wvt s GLU 76 Cb 0.00 -2.35 0.05 0.00 0.26 0.00 0.00 34.13 32.09 2wvt s GLU 76 CO 0.00 0.41 0.19 -0.46 -0.54 0.00 0.00 175.26 174.86 2wvt s TRP 77 N -0.19 -0.24 -1.33 5.30 -0.11 -0.43 -4.73 118.94 117.20 2wvt s TRP 77 Ca -0.01 0.66 -0.03 0.00 1.22 0.00 0.00 56.10 57.94 2wvt s TRP 77 Cb -0.13 -0.11 -0.00 0.00 -1.50 0.00 0.00 33.47 31.72 2wvt s TRP 77 CO 0.03 -0.25 0.56 0.09 -4.62 0.00 0.00 176.95 172.77 2wvt n ASN 78 N 4.77 -1.30 -0.19 5.86 5.03 -1.26 -2.74 115.26 125.43 2wvt n ASN 78 Ca -0.16 -0.95 -0.03 0.00 0.87 0.00 0.00 54.58 54.32 2wvt n ASN 78 Cb 0.51 -3.44 -0.01 0.00 -1.02 0.00 0.00 39.78 35.82 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 -1.81 0.55 3.01 7.41 0.00 -1.26 -4.99 105.19 108.10 2wvt n GLY 79 Ca -0.28 -0.28 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 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 -1.37 2.22 -0.17 1.61 2.20 -1.11 -5.11 119.74 118.02 2wvt s LYS 80 Ca 0.00 -0.53 -0.25 0.00 -0.36 0.00 0.00 55.97 54.83 2wvt s LYS 80 Cb 0.00 -2.05 -0.01 0.00 -1.51 0.00 0.00 37.83 34.26 2wvt s LYS 80 CO 0.00 -0.24 0.83 0.08 -0.36 0.00 0.00 175.35 175.66 2wvt s VAL 81 N 1.51 4.88 -0.11 4.02 1.01 -1.26 -1.32 120.40 129.13 2wvt s VAL 81 Ca 0.05 1.62 -0.13 0.00 0.00 0.00 0.00 61.98 63.52 2wvt s VAL 81 Cb -0.13 -4.13 -0.05 0.00 0.00 0.00 0.00 36.38 32.07 2wvt s VAL 81 CO -0.10 0.03 0.30 -0.31 0.00 0.00 0.00 175.10 175.02 2wvt s TYR 82 N 2.14 3.56 -0.74 5.22 2.02 0.81 -4.98 117.35 125.37 2wvt s TYR 82 Ca 0.38 0.70 0.25 0.00 -0.37 0.00 0.00 57.07 58.03 2wvt s TYR 82 Cb -0.17 -2.27 0.91 0.00 -0.40 0.00 0.00 41.96 40.04 2wvt s TYR 82 CO 0.12 0.43 1.77 0.41 -1.57 0.00 0.00 175.55 176.71 2wvt n GLY 83 N 2.72 -1.52 3.71 0.71 0.00 -1.26 -4.84 105.19 104.71 2wvt n GLY 83 Ca -0.14 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 2wvt n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wvt s GLY 84 N -3.43 1.58 -0.02 -0.02 0.00 -1.26 -4.91 107.32 99.26 2wvt s GLY 84 Ca 0.09 -0.31 -0.36 0.00 0.00 0.00 0.00 44.72 44.14 2wvt s GLY 84 CO 0.51 0.25 1.66 0.00 0.00 0.00 0.00 173.10 175.53 2wvt n ALA 85 N -4.02 0.44 0.10 3.20 0.00 -1.25 -4.84 120.51 114.14 2wvt n ALA 85 Ca 0.06 0.40 0.17 0.00 0.00 0.00 0.00 53.44 54.06 2wvt n ALA 85 Cb 0.57 -2.32 0.70 0.00 0.00 0.00 0.00 19.45 18.40 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 6.97 2.26 0.00 0.00 0.00 -1.84 -1.32 119.26 125.33 2wvt h ALA 86 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2wvt h ALA 86 Cb 1.29 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2wvt h ALA 86 CO 0.90 -0.43 0.00 -0.85 0.00 0.00 0.00 179.25 178.87 2wvt n GLU 87 N -4.32 0.02 -0.49 0.00 0.00 -1.26 -2.36 120.64 112.22 2wvt n GLU 87 Ca 0.05 0.13 0.09 0.00 0.00 0.00 0.00 57.16 57.43 2wvt n GLU 87 Cb 0.43 -1.50 0.31 0.00 0.00 0.00 0.00 31.44 30.68 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 -1.49 1.18 -0.24 -1.84 7.02 -0.50 -4.68 117.44 116.89 2wvt n TRP 88 Ca 0.05 -0.61 0.03 0.00 -1.02 0.00 0.00 57.50 55.96 2wvt n TRP 88 Cb 0.25 -0.18 0.27 0.00 -2.42 0.00 0.00 31.31 29.22 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 3.49 0.83 -0.96 -0.99 5.85 -1.54 0.07 115.31 122.06 2wvt h LEU 89 Ca 0.00 -0.00 0.18 0.00 0.84 0.00 0.00 57.88 58.89 2wvt h LEU 89 Cb 1.27 -0.19 -0.10 0.00 0.37 0.00 0.00 40.66 42.01 2wvt h LEU 89 CO 0.16 0.56 0.55 0.50 -0.34 0.00 0.00 178.44 179.87 2wvt h LYS 90 N 0.96 0.69 -0.04 1.25 3.64 -1.85 0.26 116.57 121.47 2wvt h LYS 90 Ca 0.33 -0.04 -0.12 0.00 -1.27 0.00 0.00 60.65 59.55 2wvt h LYS 90 Cb 0.11 -0.16 0.01 0.00 -0.41 0.00 0.00 32.23 31.78 2wvt h LYS 90 CO -0.11 0.46 -0.43 1.03 -2.27 0.00 0.00 179.45 178.14 2wvt h SER 91 N 0.71 0.45 -0.58 4.20 0.87 -1.37 0.81 113.55 118.65 2wvt h SER 91 Ca 0.54 -0.70 -0.01 0.00 -1.23 0.00 0.00 61.79 60.39 2wvt h SER 91 Cb 0.82 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.62 2wvt h SER 91 CO -0.38 1.08 0.32 -0.50 -0.53 0.00 0.00 176.83 176.82 2wvt h TRP 92 N -0.15 0.79 -0.42 2.24 -0.00 -0.40 -2.72 115.95 115.30 2wvt h TRP 92 Ca -0.04 -0.02 0.00 0.00 -0.00 0.00 0.00 58.89 58.83 2wvt h TRP 92 Cb 1.11 -0.25 0.00 0.00 -0.00 0.00 0.00 29.16 30.02 2wvt h TRP 92 CO 0.14 0.57 0.00 0.00 -0.00 0.00 0.00 178.44 179.15 2wvt n ALA 93 N -2.31 2.44 -4.11 1.49 0.00 0.82 -4.96 120.51 113.89 2wvt n ALA 93 Ca 0.04 -0.81 -0.44 0.00 0.00 0.00 0.00 53.44 52.23 2wvt n ALA 93 Cb 0.08 -0.98 -0.00 0.00 0.00 0.00 0.00 19.45 18.56 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 0.88 -0.43 -2.99 0.00 4.76 -0.99 -4.93 118.16 114.47 2wvt n LYS 94 Ca 0.17 0.09 -0.41 0.00 -2.87 0.00 0.00 58.31 55.29 2wvt n LYS 94 Cb 0.42 -2.77 -0.05 0.00 -1.84 0.00 0.00 35.03 30.79 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 -3.68 4.94 0.61 -0.18 1.01 0.24 -5.03 120.40 118.31 2wvt s VAL 95 Ca 0.40 1.44 -0.19 0.00 0.00 0.00 0.00 61.98 63.63 2wvt s VAL 95 Cb -0.22 -4.05 -0.03 0.00 0.00 0.00 0.00 36.38 32.08 2wvt s VAL 95 CO 0.97 0.06 1.26 -2.84 0.00 0.00 0.00 175.10 174.56 2wvt s PRO 96 N 2.04 2.84 0.21 2.72 0.02 -1.26 -4.74 135.00 136.82 2wvt s PRO 96 Ca 0.34 1.98 -0.10 0.00 0.02 0.00 0.00 61.00 63.24 2wvt s PRO 96 Cb -0.16 -1.95 0.30 0.00 0.02 0.00 0.00 34.50 32.71 2wvt s PRO 96 CO 0.11 -1.35 1.67 0.00 -0.33 0.00 0.00 177.00 177.10 2wvt h ALA 97 N 0.85 0.63 -0.69 -1.55 0.00 -1.96 -0.46 119.26 116.08 2wvt h ALA 97 Ca -0.51 0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.60 2wvt h ALA 97 Cb 1.31 0.31 -0.04 0.00 0.00 0.00 0.00 17.79 19.37 2wvt h ALA 97 CO 0.55 -0.38 0.45 0.38 0.00 0.00 0.00 179.25 180.24 2wvt h ASP 98 N 0.14 0.76 -0.30 0.00 -0.00 -1.95 -0.68 116.42 114.38 2wvt h ASP 98 Ca 0.33 -0.01 -0.14 0.00 -0.00 0.00 0.00 57.03 57.20 2wvt h ASP 98 Cb 0.53 -0.18 -0.01 0.00 -0.00 0.00 0.00 39.33 39.67 2wvt h ASP 98 CO -0.51 0.54 -0.32 -0.08 -0.00 0.00 0.00 179.24 178.86 2wvt h GLU 99 N 0.90 0.83 -0.28 4.15 4.81 -1.60 -3.11 114.58 120.27 2wvt h GLU 99 Ca 0.26 -0.39 -0.08 0.00 -0.13 0.00 0.00 59.36 59.02 2wvt h GLU 99 Cb -0.06 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 2wvt h GLU 99 CO -0.08 1.03 -0.14 2.35 -0.73 0.00 0.00 179.01 181.44 2wvt h TRP 100 N 0.69 0.69 0.00 0.92 2.91 -0.72 -3.09 115.95 117.35 2wvt h TRP 100 Ca 0.07 -0.17 0.00 0.00 1.13 0.00 0.00 58.89 59.92 2wvt h TRP 100 Cb 0.88 -0.16 0.00 0.00 -0.51 0.00 0.00 29.16 29.37 2wvt h TRP 100 CO 0.05 0.84 0.00 -0.07 -1.03 0.00 0.00 178.44 178.23 2wvt h LEU 101 N 0.34 0.00 -2.60 0.65 3.38 -1.18 -2.49 115.31 113.40 2wvt h LEU 101 Ca 0.06 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.04 2wvt h LEU 101 Cb 0.66 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 2wvt h LEU 101 CO 0.04 0.00 0.04 0.11 0.09 0.00 0.00 178.44 178.73 2wvt h LYS 102 N 0.00 0.00 -0.20 1.13 1.57 -1.46 -1.86 116.57 115.75 2wvt h LYS 102 Ca 0.00 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.84 2wvt h LYS 102 Cb 0.38 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 2wvt h LYS 102 CO 0.00 0.00 0.30 -0.07 -0.57 0.00 0.00 179.45 179.11 2wvt h LEU 103 N 0.00 0.00 -1.67 2.94 3.38 -1.62 0.54 115.31 118.89 2wvt h LEU 103 Ca 0.01 0.00 0.29 0.00 0.09 0.00 0.00 57.88 58.27 2wvt h LEU 103 Cb 0.10 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.78 2wvt h LEU 103 CO -0.00 0.00 0.72 0.24 0.09 0.00 0.00 178.44 179.49 2wvt h MET 104 N 0.00 0.20 0.00 1.13 2.86 -1.57 0.13 114.93 117.69 2wvt h MET 104 Ca 0.09 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.71 2wvt h MET 104 Cb 0.70 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.31 2wvt h MET 104 CO -0.00 0.14 -0.06 -0.44 1.06 0.00 0.00 176.91 177.60 2wvt h ASP 105 N 0.21 0.00 0.02 1.22 3.32 -1.12 -2.76 116.42 117.31 2wvt h ASP 105 Ca 0.55 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.60 2wvt h ASP 105 Cb 1.76 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.31 2wvt h ASP 105 CO -0.15 0.06 -0.29 0.00 -1.72 0.00 0.00 179.24 177.14 2wvt n GLN 106 N -3.24 1.45 -2.40 3.56 6.02 0.45 -4.70 117.38 118.51 2wvt n GLN 106 Ca -0.00 -1.13 -0.41 0.00 -0.01 0.00 0.00 57.00 55.45 2wvt n GLN 106 Cb 0.28 -1.48 -0.03 0.00 1.02 0.00 0.00 30.24 30.04 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 -2.33 2.15 -0.47 1.08 -0.11 -1.04 -4.87 118.94 113.34 2wvt s TRP 107 Ca 0.23 0.26 0.06 0.00 1.22 0.00 0.00 56.10 57.87 2wvt s TRP 107 Cb 0.19 -4.46 0.19 0.00 -1.50 0.00 0.00 33.47 27.90 2wvt s TRP 107 CO 0.48 -2.09 0.62 -1.71 -4.62 0.00 0.00 176.95 169.63 2wvt n ASN 108 N 10.15 -2.27 -4.42 5.86 5.15 -1.26 -3.02 115.26 125.44 2wvt n ASN 108 Ca 0.09 -2.79 -0.39 0.00 -0.60 0.00 0.00 54.58 50.89 2wvt n ASN 108 Cb 0.50 0.92 -0.02 0.00 -0.53 0.00 0.00 39.78 40.65 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 2.65 2.62 0.27 1.20 -0.04 -1.26 -4.80 135.00 135.64 2wvt n PRO 109 Ca 0.21 -2.89 0.12 0.00 -0.04 0.00 0.00 63.50 60.89 2wvt n PRO 109 Cb 0.54 -3.50 0.74 0.00 -0.04 0.00 0.00 33.50 31.24 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 5.48 0.64 -0.01 0.52 1.03 -1.84 -1.54 112.91 117.20 2wvt h THR 110 Ca 0.40 -0.40 0.00 0.00 -0.01 0.00 0.00 66.41 66.40 2wvt h THR 110 Cb 0.85 1.25 0.00 0.00 -1.07 0.00 0.00 68.15 69.18 2wvt h THR 110 CO 1.48 0.09 -0.13 0.29 -0.01 0.00 0.00 175.52 177.25 2wvt n LYS 111 N -3.81 1.12 -1.83 0.00 5.02 0.27 -4.92 118.16 114.01 2wvt n LYS 111 Ca -0.02 -0.60 -0.42 0.00 -2.02 0.00 0.00 58.31 55.25 2wvt n LYS 111 Cb 0.20 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.69 2wvt n LYS 111 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2wvt s PHE 112 N -2.29 2.91 -0.22 2.13 5.36 -0.58 -4.60 117.98 120.69 2wvt s PHE 112 Ca 0.31 0.63 -0.03 0.00 -0.96 0.00 0.00 56.93 56.88 2wvt s PHE 112 Cb 0.20 -4.03 0.11 0.00 -0.34 0.00 0.00 43.02 38.97 2wvt s PHE 112 CO 0.44 -3.67 0.31 0.34 -1.46 0.00 0.00 175.22 171.18 2wvt s ASP 113 N 0.85 0.69 0.49 6.13 -1.08 -1.26 -5.04 116.67 117.44 2wvt s ASP 113 Ca 0.68 0.08 0.15 0.00 -0.52 0.00 0.00 52.55 52.94 2wvt s ASP 113 Cb -0.47 0.81 1.14 0.00 -1.46 0.00 0.00 42.92 42.95 2wvt s ASP 113 CO 0.38 -0.31 2.07 0.00 0.52 0.00 0.00 175.17 177.84 2wvt h ALA 114 N 8.24 1.85 -0.16 3.66 0.00 -1.94 -0.06 119.26 130.85 2wvt h ALA 114 Ca -0.18 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.51 2wvt h ALA 114 Cb 1.15 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2wvt h ALA 114 CO 0.27 0.11 -0.47 0.87 0.00 0.00 0.00 179.25 180.03 2wvt h LYS 115 N 0.00 0.42 -0.09 0.00 1.57 -1.92 -0.24 116.57 116.30 2wvt h LYS 115 Ca -0.00 -0.23 -0.16 0.00 -1.87 0.00 0.00 60.65 58.39 2wvt h LYS 115 Cb 0.16 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 2wvt h LYS 115 CO 0.01 0.80 -0.63 0.87 -0.57 0.00 0.00 179.45 179.93 2wvt h LYS 116 N 0.33 0.32 -0.33 3.15 1.57 -1.46 -0.63 116.57 119.53 2wvt h LYS 116 Ca 0.02 -0.23 -0.05 0.00 -1.87 0.00 0.00 60.65 58.51 2wvt h LYS 116 Cb 0.96 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.29 2wvt h LYS 116 CO 0.08 0.85 -0.00 -1.49 -0.57 0.00 0.00 179.45 178.32 2wvt h TRP 117 N 0.24 0.63 -0.62 -1.35 4.06 -1.17 -1.41 115.95 116.32 2wvt h TRP 117 Ca -0.01 -0.11 -0.07 0.00 2.06 0.00 0.00 58.89 60.75 2wvt h TRP 117 Cb 1.16 -0.16 -0.03 0.00 -1.00 0.00 0.00 29.16 29.13 2wvt h TRP 117 CO 0.03 0.70 0.09 0.00 -3.56 0.00 0.00 178.44 175.70 2wvt h ALA 118 N 0.85 0.98 -0.53 1.49 0.00 -0.89 -1.90 119.26 119.27 2wvt h ALA 118 Ca 0.09 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 2wvt h ALA 118 Cb 0.45 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2wvt h ALA 118 CO 0.02 0.64 0.23 -0.22 0.00 0.00 0.00 179.25 179.91 2wvt h LYS 119 N 0.96 0.78 -0.60 0.00 3.64 -1.09 -0.90 116.57 119.36 2wvt h LYS 119 Ca 0.19 -0.13 0.05 0.00 -1.27 0.00 0.00 60.65 59.49 2wvt h LYS 119 Cb 0.43 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 32.06 2wvt h LYS 119 CO 0.01 0.67 0.32 1.98 -2.27 0.00 0.00 179.45 180.16 2wvt h MET 120 N 0.71 0.59 0.07 1.90 4.05 -0.97 -1.06 114.93 120.22 2wvt h MET 120 Ca 0.18 -0.04 -0.00 0.00 -0.28 0.00 0.00 59.70 59.56 2wvt h MET 120 Cb 0.17 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 30.84 2wvt h MET 120 CO -0.02 0.39 -0.04 0.00 0.23 0.00 0.00 176.91 177.47 2wvt h ALA 121 N 1.32 -0.10 -0.80 0.39 0.00 -1.21 -1.86 119.26 117.01 2wvt h ALA 121 Ca 0.27 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.07 2wvt h ALA 121 Cb 0.17 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 2wvt h ALA 121 CO -0.17 -0.42 0.51 -0.22 0.00 0.00 0.00 179.25 178.94 2wvt h LYS 122 N -0.37 0.95 0.00 0.00 1.63 -1.02 -1.87 116.57 115.90 2wvt h LYS 122 Ca -0.01 -0.06 -0.03 0.00 -0.85 0.00 0.00 60.65 59.70 2wvt h LYS 122 Cb 0.32 -0.22 -0.00 0.00 -0.60 0.00 0.00 32.23 31.73 2wvt h LYS 122 CO 0.02 0.63 -0.15 0.93 -3.45 0.00 0.00 179.45 177.43 2wvt h GLU 123 N 0.98 0.00 0.00 1.90 5.08 -1.17 -2.33 114.58 119.05 2wvt h GLU 123 Ca 0.32 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.66 2wvt h GLU 123 Cb 0.02 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 2wvt h GLU 123 CO -0.12 0.15 -0.08 1.98 -1.00 0.00 0.00 179.01 179.94 2wvt h MET 124 N 0.00 0.00 0.00 2.33 4.05 -0.52 -3.35 114.93 117.44 2wvt h MET 124 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2wvt h MET 124 Cb 0.83 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.63 2wvt h MET 124 CO 0.02 0.08 0.00 0.41 0.23 0.00 0.00 176.91 177.65 2wvt n GLY 125 N 0.28 0.77 3.74 1.39 0.00 -0.88 -2.67 105.19 107.82 2wvt n GLY 125 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.08 3.31 -0.90 2.61 -4.23 -0.98 -4.84 115.64 108.53 2wvt s THR 126 Ca 0.00 1.09 0.22 0.00 -1.18 0.00 0.00 61.69 61.82 2wvt s THR 126 Cb 0.00 -3.70 -0.19 0.00 1.34 0.00 0.00 72.50 69.95 2wvt s THR 126 CO 0.00 0.17 0.96 0.29 -0.54 0.00 0.00 174.62 175.50 2wvt n LYS 127 N 2.56 0.07 -3.54 3.99 4.76 -0.08 -4.56 118.16 121.36 2wvt n LYS 127 Ca 0.05 -0.01 -0.13 0.00 -2.87 0.00 0.00 58.31 55.35 2wvt n LYS 127 Cb 0.43 -1.51 -0.04 0.00 -1.84 0.00 0.00 35.03 32.07 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 -3.05 -0.43 -0.07 2.13 -0.85 -1.22 -2.05 117.35 111.80 2wvt s TYR 128 Ca 0.07 0.37 0.02 0.00 -0.52 0.00 0.00 57.07 57.01 2wvt s TYR 128 Cb 0.16 0.39 0.02 0.00 0.38 0.00 0.00 41.96 42.90 2wvt s TYR 128 CO 0.84 -0.70 -0.11 0.08 -1.52 0.00 0.00 175.55 174.14 2wvt s VAL 129 N -2.93 1.05 -0.26 -3.49 1.01 -0.43 -0.87 120.40 114.48 2wvt s VAL 129 Ca -0.03 -0.41 -0.10 0.00 0.00 0.00 0.00 61.98 61.44 2wvt s VAL 129 Cb -0.00 -0.99 -0.05 0.00 0.00 0.00 0.00 36.38 35.34 2wvt s VAL 129 CO -0.06 0.34 0.16 -0.54 0.00 0.00 0.00 175.10 175.01 2wvt s LYS 130 N 0.84 3.94 -0.10 2.72 1.02 0.53 -0.34 119.74 128.35 2wvt s LYS 130 Ca -0.11 -0.33 0.02 0.00 0.02 0.00 0.00 55.97 55.57 2wvt s LYS 130 Cb -0.15 -3.56 -0.01 0.00 -0.52 0.00 0.00 37.83 33.58 2wvt s LYS 130 CO 0.02 -0.10 -0.18 0.42 -0.92 0.00 0.00 175.35 174.59 2wvt s ILE 131 N 1.50 2.66 -0.60 2.17 1.01 -0.37 -0.72 121.20 126.86 2wvt s ILE 131 Ca 0.07 -0.82 -0.26 0.00 0.00 0.00 0.00 60.65 59.64 2wvt s ILE 131 Cb -0.15 -2.07 -0.03 0.00 0.01 0.00 0.00 42.46 40.22 2wvt s ILE 131 CO 0.08 0.55 1.97 0.42 0.00 0.00 0.00 174.94 177.95 2wvt s THR 132 N 0.13 3.29 0.16 2.92 -4.23 -0.80 -1.11 115.64 116.00 2wvt s THR 132 Ca -0.09 0.14 -0.13 0.00 -1.18 0.00 0.00 61.69 60.44 2wvt s THR 132 Cb -0.15 -3.77 0.05 0.00 1.34 0.00 0.00 72.50 69.96 2wvt s THR 132 CO 0.06 -0.75 1.69 0.71 -0.54 0.00 0.00 174.62 175.79 2wvt h THR 133 N 7.05 1.24 -2.60 3.99 1.35 -1.50 -3.43 112.91 119.01 2wvt h THR 133 Ca -0.24 -0.80 -0.10 0.00 -0.55 0.00 0.00 66.41 64.72 2wvt h THR 133 Cb 1.17 0.73 -0.24 0.00 -1.73 0.00 0.00 68.15 68.08 2wvt h THR 133 CO 1.21 0.30 -0.19 -1.59 -0.25 0.00 0.00 175.52 175.00 2wvt s LYS 134 N -5.40 0.52 0.00 4.72 -2.85 -1.25 -0.62 119.74 114.86 2wvt s LYS 134 Ca -0.13 0.69 0.00 0.00 -1.00 0.00 0.00 55.97 55.53 2wvt s LYS 134 Cb 0.12 0.21 0.00 0.00 -2.06 0.00 0.00 37.83 36.10 2wvt s LYS 134 CO 0.80 -0.08 0.00 1.58 0.10 0.00 0.00 175.35 177.74 2wvt n HIS 135 N 3.13 -2.58 -0.34 1.78 -0.00 -1.26 -2.56 115.22 113.39 2wvt n HIS 135 Ca -0.15 0.00 0.06 0.00 -0.00 0.00 0.00 57.72 57.62 2wvt n HIS 135 Cb 0.57 0.00 0.24 0.00 -0.00 0.00 0.00 29.99 30.79 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 -0.22 1.10 -0.51 1.57 -0.00 -1.91 -1.66 115.15 113.52 2wvt h HIS 136 Ca 0.00 0.03 0.15 0.00 -0.00 0.00 0.00 60.37 60.55 2wvt h HIS 136 Cb 0.00 -0.36 -0.02 0.00 -0.00 0.00 0.00 27.41 27.03 2wvt h HIS 136 CO 0.00 0.51 0.48 1.05 -0.00 0.00 0.00 177.93 179.97 2wvt h GLU 137 N 1.02 0.00 0.00 2.45 4.11 -1.88 0.31 114.58 120.59 2wvt h GLU 137 Ca 0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.87 2wvt h GLU 137 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2wvt h GLU 137 CO -0.20 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.29 2wvt n GLY 138 N -1.54 0.72 3.69 1.06 0.00 -0.63 -3.62 105.19 104.87 2wvt n GLY 138 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.88 3.33 -0.15 1.61 5.36 -1.26 -4.87 117.98 119.12 2wvt s PHE 139 Ca 0.00 1.34 -0.10 0.00 -0.96 0.00 0.00 56.93 57.21 2wvt s PHE 139 Cb 0.00 -3.36 -0.05 0.00 -0.34 0.00 0.00 43.02 39.28 2wvt s PHE 139 CO 0.00 -1.01 0.19 0.00 -1.46 0.00 0.00 175.22 172.94 2wvt n LEU 141 N 2.91 0.39 -4.28 0.00 4.77 0.21 -1.61 117.00 119.38 2wvt n LEU 141 Ca -0.16 -0.13 -0.23 0.00 -0.03 0.00 0.00 56.01 55.46 2wvt n LEU 141 Cb 0.53 -0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.49 2wvt n LEU 141 CO 0.36 0.07 -0.50 -1.66 -1.33 0.00 0.00 177.39 174.32 2wvt s TRP 142 N -1.99 1.71 -1.20 -1.77 -2.14 -1.26 -1.43 118.94 110.85 2wvt s TRP 142 Ca 0.44 -0.44 -0.20 0.00 2.66 0.00 0.00 56.10 58.56 2wvt s TRP 142 Cb 0.21 -0.93 -0.02 0.00 -3.10 0.00 0.00 33.47 29.63 2wvt s TRP 142 CO 0.35 0.20 1.90 -0.35 -2.66 0.00 0.00 176.95 176.39 2wvt n PRO 143 N 0.98 2.33 -1.95 3.25 -0.04 -1.26 -4.36 135.00 133.95 2wvt n PRO 143 Ca -0.19 -2.69 -0.41 0.00 -0.04 0.00 0.00 63.50 60.17 2wvt n PRO 143 Cb 0.54 -3.47 -0.01 0.00 -0.04 0.00 0.00 33.50 30.52 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 5.01 6.55 0.50 3.54 0.15 -1.26 -4.94 113.70 123.26 2wvt s SER 144 Ca 0.59 2.87 0.32 0.00 0.70 0.00 0.00 55.95 60.43 2wvt s SER 144 Cb 0.05 -2.66 1.35 0.00 -1.71 0.00 0.00 66.02 63.06 2wvt s SER 144 CO 0.08 -0.72 1.95 0.50 1.20 0.00 0.00 173.24 176.26 2wvt h LYS 145 N 3.39 0.00 -0.20 5.44 3.64 -1.98 -3.35 116.57 123.51 2wvt h LYS 145 Ca -0.50 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 2wvt h LYS 145 Cb 1.23 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 2wvt h LYS 145 CO 0.66 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 178.50 2wvt n TYR 146 N -2.92 0.25 -3.61 1.91 4.01 -1.26 -4.93 117.16 110.61 2wvt n TYR 146 Ca 0.01 -0.19 -0.13 0.00 -0.16 0.00 0.00 57.90 57.43 2wvt n TYR 146 Cb 0.28 -0.01 -0.05 0.00 -0.31 0.00 0.00 39.34 39.25 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 -1.22 0.05 -0.71 -0.72 -1.32 -1.26 -5.03 115.64 105.43 2wvt s THR 147 Ca 0.25 -0.39 0.25 0.00 -1.21 0.00 0.00 61.69 60.59 2wvt s THR 147 Cb 0.15 -1.01 0.16 0.00 -1.51 0.00 0.00 72.50 70.29 2wvt s THR 147 CO 0.21 -0.21 1.55 2.29 -2.21 0.00 0.00 174.62 176.25 2wvt n LYS 148 N 0.26 0.26 -2.39 7.08 2.85 -1.26 -4.58 118.16 120.37 2wvt n LYS 148 Ca -0.18 0.14 -0.43 0.00 -1.05 0.00 0.00 58.31 56.79 2wvt n LYS 148 Cb 0.61 -1.72 0.00 0.00 -0.65 0.00 0.00 35.03 33.27 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 -2.13 3.37 -4.24 5.58 4.01 -1.26 -4.62 117.16 117.88 2wvt n TYR 149 Ca 0.04 -2.90 -0.13 0.00 -0.16 0.00 0.00 57.90 54.75 2wvt n TYR 149 Cb 0.43 -2.06 -0.10 0.00 -0.31 0.00 0.00 39.34 37.30 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 0.91 0.20 0.55 -0.72 -4.23 -1.26 -1.05 115.64 110.03 2wvt s THR 150 Ca 0.41 -1.99 0.25 0.00 -1.18 0.00 0.00 61.69 59.17 2wvt s THR 150 Cb 0.08 -2.51 0.37 0.00 1.34 0.00 0.00 72.50 71.77 2wvt s THR 150 CO -0.00 -0.04 2.04 -0.37 -0.54 0.00 0.00 174.62 175.71 2wvt h VAL 151 N 2.56 0.69 -0.74 2.29 -1.51 -1.50 -2.52 116.25 115.52 2wvt h VAL 151 Ca -0.37 0.00 0.11 0.00 -1.23 0.00 0.00 66.70 65.22 2wvt h VAL 151 Cb 1.25 0.80 -0.05 0.00 -2.13 0.00 0.00 31.29 31.15 2wvt h VAL 151 CO 0.56 0.00 0.49 0.00 -1.23 0.00 0.00 177.57 177.39 2wvt h ALA 152 N 1.77 1.91 -0.98 5.19 0.00 -1.83 -2.75 119.26 122.57 2wvt h ALA 152 Ca 0.16 -0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.44 2wvt h ALA 152 Cb 0.72 -0.12 -0.30 0.00 0.00 0.00 0.00 17.79 18.09 2wvt h ALA 152 CO -0.00 -0.08 0.75 0.09 0.00 0.00 0.00 179.25 180.01 2wvt n ASN 153 N -4.50 6.58 -4.56 0.00 3.02 -0.95 -4.58 115.26 110.28 2wvt n ASN 153 Ca 0.13 -3.75 -0.26 0.00 -0.03 0.00 0.00 54.58 50.67 2wvt n ASN 153 Cb 0.39 -0.92 -0.11 0.00 -0.61 0.00 0.00 39.78 38.54 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 -4.43 1.97 0.57 3.41 -4.23 -1.05 -4.77 115.64 107.10 2wvt s THR 154 Ca 0.62 -2.09 0.26 0.00 -1.18 0.00 0.00 61.69 59.30 2wvt s THR 154 Cb 0.50 -2.80 0.33 0.00 1.34 0.00 0.00 72.50 71.87 2wvt s THR 154 CO 0.02 -0.10 2.22 -0.65 -0.54 0.00 0.00 174.62 175.57 2wvt h PRO 155 N 1.95 0.00 -0.04 3.99 0.11 -1.75 -2.93 132.00 133.33 2wvt h PRO 155 Ca -0.43 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.46 2wvt h PRO 155 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2wvt h PRO 155 CO 0.75 0.00 -0.88 -0.92 -0.21 0.00 0.00 178.00 176.74 2wvt h TYR 156 N 0.00 0.72 0.00 0.65 3.20 -1.82 -3.47 116.97 116.25 2wvt h TYR 156 Ca -0.00 -0.36 0.00 0.00 3.14 0.00 0.00 58.73 61.51 2wvt h TYR 156 Cb 0.01 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.18 2wvt h TYR 156 CO 0.00 1.17 0.00 1.63 -1.64 0.00 0.00 178.16 179.32 2wvt n LYS 157 N -3.81 0.00 -1.71 1.82 5.02 -1.11 -4.94 118.16 113.44 2wvt n LYS 157 Ca -0.07 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.90 2wvt n LYS 157 Cb 0.80 -0.89 0.05 0.00 -0.02 0.00 0.00 35.03 34.96 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 2.87 -1.08 1.97 0.52 -1.26 -3.95 118.95 118.01 2wvt s ARG 158 Ca 0.00 1.21 -0.20 0.00 -0.52 0.00 0.00 55.73 56.22 2wvt s ARG 158 Cb 0.00 -1.97 0.08 0.00 0.52 0.00 0.00 34.95 33.58 2wvt s ARG 158 CO 0.00 -1.17 1.45 0.34 0.02 0.00 0.00 175.30 175.94 2wvt s ASP 159 N -3.04 6.66 0.18 0.23 2.15 -1.26 -4.67 116.67 116.93 2wvt s ASP 159 Ca 0.63 -1.95 -0.15 0.00 0.43 0.00 0.00 52.55 51.51 2wvt s ASP 159 Cb -0.17 -2.52 0.16 0.00 -0.30 0.00 0.00 42.92 40.09 2wvt s ASP 159 CO 0.46 -1.27 1.67 0.40 -0.17 0.00 0.00 175.17 176.25 2wvt h ILE 160 N 6.11 0.56 -0.09 4.11 1.08 -1.91 -1.00 117.51 126.37 2wvt h ILE 160 Ca 0.26 -0.02 -0.00 0.00 -0.39 0.00 0.00 64.86 64.71 2wvt h ILE 160 Cb 0.97 0.51 -0.00 0.00 -3.07 0.00 0.00 36.82 35.22 2wvt h ILE 160 CO 1.35 0.01 0.05 0.25 -0.69 0.00 0.00 178.15 179.13 2wvt h LEU 161 N 0.04 0.11 -1.01 1.44 5.85 -1.57 0.10 115.31 120.28 2wvt h LEU 161 Ca 0.24 -0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 2wvt h LEU 161 Cb 0.36 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 2wvt h LEU 161 CO -0.46 0.13 0.22 1.23 -0.34 0.00 0.00 178.44 179.23 2wvt h GLY 162 N 0.08 1.01 0.78 3.75 0.00 -1.77 0.83 103.07 107.74 2wvt h GLY 162 Ca 0.03 -0.54 -0.02 0.00 0.00 0.00 0.00 47.33 46.80 2wvt h GLY 162 CO -0.01 0.51 -0.00 0.83 0.00 0.00 0.00 176.54 177.87 2wvt h GLU 163 N 0.92 0.26 -0.43 4.80 5.08 -0.69 -2.48 114.58 122.04 2wvt h GLU 163 Ca 0.21 -0.09 0.05 0.00 -1.00 0.00 0.00 59.36 58.53 2wvt h GLU 163 Cb 0.22 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.40 2wvt h GLU 163 CO -0.01 0.50 0.17 -0.07 -1.00 0.00 0.00 179.01 178.59 2wvt h LEU 164 N 0.00 0.20 -0.27 1.33 3.38 -0.63 -2.27 115.31 117.04 2wvt h LEU 164 Ca 0.04 0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.10 2wvt h LEU 164 Cb 0.38 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.10 2wvt h LEU 164 CO 0.01 0.15 -0.00 0.58 0.09 0.00 0.00 178.44 179.26 2wvt h VAL 165 N 0.34 0.80 -0.20 1.22 2.07 -0.69 0.73 116.25 120.52 2wvt h VAL 165 Ca 0.20 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.68 2wvt h VAL 165 Cb 0.16 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 2wvt h VAL 165 CO -0.18 0.01 0.10 0.50 0.02 0.00 0.00 177.57 178.02 2wvt h LYS 166 N 0.08 0.29 -0.40 1.57 1.63 -1.42 -0.96 116.57 117.36 2wvt h LYS 166 Ca 0.13 -0.04 -0.07 0.00 -0.85 0.00 0.00 60.65 59.82 2wvt h LYS 166 Cb 0.17 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.73 2wvt h LYS 166 CO -0.22 0.31 -0.01 0.00 -3.45 0.00 0.00 179.45 176.08 2wvt h ALA 167 N 0.97 0.54 -0.41 5.00 0.00 -1.07 -1.08 119.26 123.20 2wvt h ALA 167 Ca 0.07 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 2wvt h ALA 167 Cb 0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2wvt h ALA 167 CO -0.01 0.33 0.11 1.88 0.00 0.00 0.00 179.25 181.56 2wvt h TYR 168 N 0.54 0.68 -0.37 0.00 0.05 -0.88 -2.97 116.97 114.01 2wvt h TYR 168 Ca 0.11 -0.08 -0.03 0.00 0.05 0.00 0.00 58.73 58.79 2wvt h TYR 168 Cb 0.50 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 38.02 2wvt h TYR 168 CO 0.04 0.64 0.12 -0.91 -1.05 0.00 0.00 178.16 177.00 2wvt h ASN 169 N 0.52 0.49 1.00 3.88 2.35 -0.85 -1.05 115.58 121.92 2wvt h ASN 169 Ca 0.13 -0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 55.79 2wvt h ASN 169 Cb 0.29 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 2wvt h ASN 169 CO -0.00 0.47 -0.17 0.44 -1.65 0.00 0.00 177.43 176.52 2wvt h ASP 170 N 0.53 0.00 -0.03 5.81 3.32 -1.06 -1.67 116.42 123.32 2wvt h ASP 170 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 2wvt h ASP 170 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 2wvt h ASP 170 CO -0.01 0.17 0.00 -0.62 -1.72 0.00 0.00 179.24 177.06 2wvt n GLU 171 N -3.31 1.47 -0.79 3.56 -0.58 -0.49 -4.92 120.64 115.57 2wvt n GLU 171 Ca 0.00 -0.69 0.00 0.00 -0.42 0.00 0.00 57.16 56.05 2wvt n GLU 171 Cb 0.41 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 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 1.10 0.55 3.62 0.62 0.00 -0.63 -5.00 105.19 105.46 2wvt n GLY 172 Ca 0.19 -0.50 -0.37 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.00 5.33 0.51 -0.61 1.01 -0.64 -4.97 121.20 119.82 2wvt s ILE 173 Ca 0.00 0.19 -0.21 0.00 0.00 0.00 0.00 60.65 60.63 2wvt s ILE 173 Cb 0.00 -3.53 -0.06 0.00 0.01 0.00 0.00 42.46 38.88 2wvt s ILE 173 CO 0.00 0.29 1.18 -1.81 0.00 0.00 0.00 174.94 174.60 2wvt s ASP 174 N 1.47 5.82 -0.09 3.58 1.01 -0.87 -3.51 116.67 124.08 2wvt s ASP 174 Ca 0.08 2.34 0.04 0.00 0.71 0.00 0.00 52.55 55.71 2wvt s ASP 174 Cb -0.15 -2.60 -0.00 0.00 1.01 0.00 0.00 42.92 41.18 2wvt s ASP 174 CO 0.08 -1.16 -0.23 -0.69 0.21 0.00 0.00 175.17 173.39 2wvt s VAL 175 N -1.58 2.20 0.04 -1.27 1.01 -1.26 -1.31 120.40 118.23 2wvt s VAL 175 Ca 0.69 -0.98 0.07 0.00 0.00 0.00 0.00 61.98 61.76 2wvt s VAL 175 Cb -0.29 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.22 2wvt s VAL 175 CO 0.34 0.56 -0.17 -1.00 0.00 0.00 0.00 175.10 174.83 2wvt s HIS 176 N 0.22 2.58 -0.31 5.22 3.76 0.54 -1.38 115.29 125.91 2wvt s HIS 176 Ca -0.14 -0.24 -0.08 0.00 -0.15 0.00 0.00 55.06 54.44 2wvt s HIS 176 Cb -0.17 -1.47 0.01 0.00 1.11 0.00 0.00 32.58 32.06 2wvt s HIS 176 CO 0.07 0.26 0.13 -0.06 -0.85 0.00 0.00 174.74 174.29 2wvt s PHE 177 N -0.94 3.18 0.23 1.40 0.08 -0.21 -1.23 117.98 120.48 2wvt s PHE 177 Ca 0.15 -0.82 -0.30 0.00 0.12 0.00 0.00 56.93 56.08 2wvt s PHE 177 Cb -0.11 -2.32 -0.09 0.00 -0.57 0.00 0.00 43.02 39.94 2wvt s PHE 177 CO 0.06 -0.54 1.03 -0.47 -0.10 0.00 0.00 175.22 175.19 2wvt s TYR 178 N 1.55 3.76 -0.11 0.36 5.04 -0.26 -0.97 117.35 126.71 2wvt s TYR 178 Ca 0.03 1.77 -0.04 0.00 -2.44 0.00 0.00 57.07 56.39 2wvt s TYR 178 Cb -0.17 -3.15 0.06 0.00 0.35 0.00 0.00 41.96 39.05 2wvt s TYR 178 CO 0.05 -0.11 0.23 0.12 -1.34 0.00 0.00 175.55 174.49 2wvt s PHE 179 N -0.85 -0.34 -0.28 4.97 5.36 -0.74 -1.16 117.98 124.94 2wvt s PHE 179 Ca 0.44 0.85 -0.26 0.00 -0.96 0.00 0.00 56.93 57.01 2wvt s PHE 179 Cb -0.28 -0.11 0.00 0.00 -0.34 0.00 0.00 43.02 42.29 2wvt s PHE 179 CO 0.35 -0.33 0.90 0.45 -1.46 0.00 0.00 175.22 175.14 2wvt s SER 180 N 2.38 6.84 0.02 6.13 0.15 -1.06 -1.83 113.70 126.32 2wvt s SER 180 Ca 0.02 0.96 -0.25 0.00 0.70 0.00 0.00 55.95 57.38 2wvt s SER 180 Cb -0.12 -2.47 -0.18 0.00 -1.71 0.00 0.00 66.02 61.55 2wvt s SER 180 CO -0.08 -0.66 1.36 0.58 1.20 0.00 0.00 173.24 175.65 2wvt h VAL 181 N 5.56 0.97 -2.05 4.45 2.07 -1.50 -3.42 116.25 122.33 2wvt h VAL 181 Ca -0.22 -0.64 -0.62 0.00 0.82 0.00 0.00 66.70 66.04 2wvt h VAL 181 Cb 1.08 1.36 0.05 0.00 -1.52 0.00 0.00 31.29 32.26 2wvt h VAL 181 CO 0.93 0.15 0.75 0.80 0.02 0.00 0.00 177.57 180.22 2wvt n MET 182 N -5.04 1.85 -3.53 1.57 0.00 -0.59 -4.97 117.12 106.40 2wvt n MET 182 Ca -0.09 0.67 -0.24 0.00 -0.00 0.00 0.00 57.70 58.04 2wvt n MET 182 Cb 0.21 -2.41 -0.14 0.00 0.00 0.00 0.00 33.22 30.88 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 1.33 2.33 0.00 6.12 -1.08 -1.26 -4.38 116.67 119.74 2wvt s ASP 183 Ca 0.83 -0.72 0.21 0.00 -0.52 0.00 0.00 52.55 52.34 2wvt s ASP 183 Cb -0.77 -0.00 1.14 0.00 -1.46 0.00 0.00 42.92 41.82 2wvt s ASP 183 CO 0.43 -0.38 1.63 0.79 0.52 0.00 0.00 175.17 178.17 2wvt n TRP 184 N 5.29 0.00 0.10 -5.34 8.01 0.11 -2.80 117.44 122.81 2wvt n TRP 184 Ca -0.06 0.00 0.11 0.00 -1.31 0.00 0.00 57.50 56.25 2wvt n TRP 184 Cb 0.47 -0.14 -0.09 0.00 -2.01 0.00 0.00 31.31 29.53 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 -1.14 0.37 -4.44 -0.99 3.41 -1.24 -4.80 113.62 104.79 2wvt n SER 185 Ca 0.13 0.07 -0.42 0.00 -0.26 0.00 0.00 58.87 58.40 2wvt n SER 185 Cb 0.11 1.33 -0.11 0.00 -0.26 0.00 0.00 64.21 65.29 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 -4.73 5.95 0.00 4.04 3.84 -1.12 -4.97 114.94 117.95 2wvt s ASN 186 Ca -0.04 -0.83 0.14 0.00 0.21 0.00 0.00 52.86 52.34 2wvt s ASN 186 Cb 0.13 -2.10 0.69 0.00 -0.55 0.00 0.00 41.25 39.41 2wvt s ASN 186 CO 0.86 -0.38 1.40 -0.81 -2.79 0.00 0.00 177.10 175.38 2wvt n PRO 187 N 5.09 0.15 0.00 0.43 -0.04 -1.26 -1.56 135.00 137.81 2wvt n PRO 187 Ca -0.12 0.18 0.14 0.00 -0.04 0.00 0.00 63.50 63.66 2wvt n PRO 187 Cb 0.47 -1.50 0.74 0.00 -0.04 0.00 0.00 33.50 33.18 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 -1.34 0.00 -4.77 3.54 8.00 -1.26 -4.84 116.55 115.88 2wvt n ASP 188 Ca 0.06 -0.22 -0.39 0.00 0.71 0.00 0.00 54.79 54.96 2wvt n ASP 188 Cb 0.13 -0.25 -0.00 0.00 -0.02 0.00 0.00 41.12 40.97 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 -2.51 2.79 0.02 1.24 5.04 -0.60 -3.53 117.35 119.81 2wvt s TYR 189 Ca 0.29 1.46 0.02 0.00 -2.44 0.00 0.00 57.07 56.40 2wvt s TYR 189 Cb 0.19 -3.58 -0.01 0.00 0.35 0.00 0.00 41.96 38.91 2wvt s TYR 189 CO 0.43 -1.94 -0.07 1.03 -1.34 0.00 0.00 175.55 173.65 2wvt s ARG 190 N -2.45 0.54 0.21 4.97 1.81 -1.26 -4.97 118.95 117.79 2wvt s ARG 190 Ca 0.61 -0.50 0.20 0.00 -1.72 0.00 0.00 55.73 54.31 2wvt s ARG 190 Cb -0.35 -0.43 0.02 0.00 -0.45 0.00 0.00 34.95 33.75 2wvt s ARG 190 CO 0.44 0.10 1.13 1.88 -0.68 0.00 0.00 175.30 178.17 2wvt h TYR 191 N 5.23 0.00 -3.23 -0.53 -1.99 -1.98 -3.42 116.97 111.04 2wvt h TYR 191 Ca -0.33 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.39 2wvt h TYR 191 Cb 1.19 0.00 -0.11 0.00 2.00 0.00 0.00 36.73 39.82 2wvt h TYR 191 CO 0.53 0.25 0.07 0.34 -0.00 0.00 0.00 178.16 179.35 2wvt s ASP 192 N -5.80 -0.33 -0.38 3.88 -1.08 -1.26 -2.35 116.67 109.35 2wvt s ASP 192 Ca 0.01 -0.36 -0.00 0.00 -0.52 0.00 0.00 52.55 51.68 2wvt s ASP 192 Cb 0.08 0.58 0.10 0.00 -1.46 0.00 0.00 42.92 42.22 2wvt s ASP 192 CO 0.77 -1.02 0.14 -0.63 0.52 0.00 0.00 175.17 174.95 2wvt s ILE 193 N -3.84 2.91 -0.10 4.11 -1.09 -1.26 -4.86 121.20 117.08 2wvt s ILE 193 Ca 0.06 -2.14 0.13 0.00 -2.23 0.00 0.00 60.65 56.48 2wvt s ILE 193 Cb -0.01 -3.03 0.22 0.00 -1.58 0.00 0.00 42.46 38.06 2wvt s ILE 193 CO -0.06 -0.64 1.11 0.29 -1.23 0.00 0.00 174.94 174.42 2wvt n LYS 194 N 4.47 0.90 -3.53 2.79 5.02 -1.26 -4.99 118.16 121.57 2wvt n LYS 194 Ca -0.00 -2.17 -0.08 0.00 -2.02 0.00 0.00 58.31 54.04 2wvt n LYS 194 Cb 0.42 -1.18 -0.02 0.00 -0.02 0.00 0.00 35.03 34.22 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 -2.35 -0.35 0.27 4.39 1.04 -1.26 -5.00 113.70 110.44 2wvt s SER 195 Ca 0.23 -0.05 0.01 0.00 0.48 0.00 0.00 55.95 56.62 2wvt s SER 195 Cb 0.21 0.41 0.57 0.00 0.10 0.00 0.00 66.02 67.30 2wvt s SER 195 CO 0.01 -0.67 1.79 0.50 0.98 0.00 0.00 173.24 175.85 2wvt h LYS 196 N 2.00 0.76 -0.31 4.02 1.63 -1.99 -0.91 116.57 121.76 2wvt h LYS 196 Ca -0.23 -0.05 -0.04 0.00 -0.85 0.00 0.00 60.65 59.48 2wvt h LYS 196 Cb 1.24 -0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 32.69 2wvt h LYS 196 CO 0.31 0.50 0.02 0.93 -3.45 0.00 0.00 179.45 177.76 2wvt h GLU 197 N 0.78 0.53 -0.50 1.90 3.07 -1.99 -1.62 114.58 116.75 2wvt h GLU 197 Ca 0.49 -0.16 0.09 0.00 -0.50 0.00 0.00 59.36 59.28 2wvt h GLU 197 Cb 0.63 -0.05 -0.07 0.00 -0.84 0.00 0.00 28.75 28.41 2wvt h GLU 197 CO -0.32 0.65 0.07 -0.44 -1.40 0.00 0.00 179.01 177.56 2wvt h ASP 198 N 0.34 -0.07 -0.43 1.42 3.32 -1.86 0.76 116.42 119.91 2wvt h ASP 198 Ca 0.09 0.10 0.01 0.00 0.02 0.00 0.00 57.03 57.25 2wvt h ASP 198 Cb 0.40 0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.07 2wvt h ASP 198 CO 0.01 -0.01 0.27 0.28 -1.72 0.00 0.00 179.24 178.07 2wvt h SER 199 N 0.20 0.44 -0.23 6.45 0.02 -0.74 0.05 113.55 119.74 2wvt h SER 199 Ca 0.25 -0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.14 2wvt h SER 199 Cb 0.36 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.79 2wvt h SER 199 CO -0.36 0.32 -0.11 0.40 -1.14 0.00 0.00 176.83 175.94 2wvt h ILE 200 N 0.54 1.30 -0.16 3.27 2.04 -1.02 -2.26 117.51 121.23 2wvt h ILE 200 Ca 0.17 -1.19 -0.01 0.00 1.00 0.00 0.00 64.86 64.83 2wvt h ILE 200 Cb -0.02 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 2wvt h ILE 200 CO -0.06 0.37 0.07 0.00 0.00 0.00 0.00 178.15 178.52 2wvt h ALA 201 N 0.71 0.20 -0.06 1.87 0.00 -0.76 -2.88 119.26 118.35 2wvt h ALA 201 Ca 0.05 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 2wvt h ALA 201 Cb 0.61 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2wvt h ALA 201 CO 0.03 -0.21 -0.35 0.35 0.00 0.00 0.00 179.25 179.07 2wvt h PHE 202 N 0.11 0.14 -0.34 0.00 3.57 -1.00 -1.44 116.94 117.97 2wvt h PHE 202 Ca 0.05 -0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.54 2wvt h PHE 202 Cb 0.16 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.84 2wvt h PHE 202 CO -0.02 0.46 0.20 1.03 -2.23 0.00 0.00 178.31 177.75 2wvt h SER 203 N 0.11 0.31 -0.83 0.41 0.87 -1.32 0.35 113.55 113.44 2wvt h SER 203 Ca 0.01 0.00 0.08 0.00 -1.23 0.00 0.00 61.79 60.66 2wvt h SER 203 Cb 0.68 -0.06 -0.07 0.00 -0.44 0.00 0.00 62.40 62.51 2wvt h SER 203 CO 0.05 0.23 0.49 0.03 -0.53 0.00 0.00 176.83 177.10 2wvt h ARG 204 N 0.40 0.82 -0.31 2.24 3.08 -1.19 -2.27 114.38 117.15 2wvt h ARG 204 Ca 0.14 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.10 2wvt h ARG 204 Cb 0.01 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.86 2wvt h ARG 204 CO -0.07 0.54 0.05 0.35 -1.07 0.00 0.00 179.97 179.77 2wvt h PHE 205 N 0.85 0.55 -0.83 3.04 3.57 -0.62 -0.96 116.94 122.54 2wvt h PHE 205 Ca 0.39 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.81 2wvt h PHE 205 Cb 0.30 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.85 2wvt h PHE 205 CO -0.05 0.60 0.53 -0.07 -2.23 0.00 0.00 178.31 177.09 2wvt h LEU 206 N 0.34 0.98 0.01 0.59 3.38 -0.78 -0.64 115.31 119.19 2wvt h LEU 206 Ca 0.09 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2wvt h LEU 206 Cb 0.35 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2wvt h LEU 206 CO 0.01 0.73 -0.01 -0.33 0.09 0.00 0.00 178.44 178.93 2wvt h GLU 207 N 1.14 -0.01 -0.32 1.13 5.08 -1.25 0.26 114.58 120.61 2wvt h GLU 207 Ca 0.30 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.73 2wvt h GLU 207 Cb -0.09 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.10 2wvt h GLU 207 CO -0.06 0.03 -0.11 0.35 -1.00 0.00 0.00 179.01 178.22 2wvt h PHE 208 N -0.05 -0.26 -0.33 4.33 3.57 -0.94 -0.17 116.94 123.09 2wvt h PHE 208 Ca -0.00 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.56 2wvt h PHE 208 Cb 0.05 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 38.92 2wvt h PHE 208 CO -0.07 -0.18 0.14 1.15 -2.23 0.00 0.00 178.31 177.12 2wvt h THR 209 N -0.05 0.94 -0.71 4.41 2.02 -1.01 -0.76 112.91 117.75 2wvt h THR 209 Ca 0.16 -0.10 0.08 0.00 0.77 0.00 0.00 66.41 67.32 2wvt h THR 209 Cb 0.29 0.62 -0.07 0.00 -1.74 0.00 0.00 68.15 67.25 2wvt h THR 209 CO -0.35 0.05 0.38 0.44 0.37 0.00 0.00 175.52 176.41 2wvt h ASP 210 N 0.29 0.52 -0.64 4.18 3.32 -0.56 -0.89 116.42 122.65 2wvt h ASP 210 Ca 0.15 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.22 2wvt h ASP 210 Cb 0.09 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.57 2wvt h ASP 210 CO -0.13 0.31 0.32 0.78 -1.72 0.00 0.00 179.24 178.80 2wvt h ASN 211 N 0.66 0.83 -0.49 6.45 2.35 -0.17 -1.30 115.58 123.90 2wvt h ASN 211 Ca 0.34 -0.12 -0.08 0.00 -0.55 0.00 0.00 56.30 55.88 2wvt h ASN 211 Cb 0.30 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 2wvt h ASN 211 CO -0.24 0.72 -0.01 1.56 -1.65 0.00 0.00 177.43 177.81 2wvt h GLN 212 N 0.87 0.87 -0.17 0.81 4.20 -0.70 -2.08 115.11 118.91 2wvt h GLN 212 Ca 0.22 -0.28 -0.00 0.00 0.06 0.00 0.00 58.65 58.64 2wvt h GLN 212 Cb 0.10 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 2wvt h GLN 212 CO -0.03 0.92 0.10 -0.07 -0.67 0.00 0.00 178.83 179.08 2wvt h LEU 213 N 0.73 0.21 -1.11 1.46 3.38 -0.85 0.37 115.31 119.49 2wvt h LEU 213 Ca 0.14 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.06 2wvt h LEU 213 Cb 0.53 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.18 2wvt h LEU 213 CO 0.03 0.21 0.60 0.11 0.09 0.00 0.00 178.44 179.47 2wvt h LYS 214 N 0.20 1.18 -0.11 1.13 1.57 -1.25 -1.28 116.57 118.02 2wvt h LYS 214 Ca 0.06 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2wvt h LYS 214 Cb 0.04 -0.27 -0.00 0.00 0.08 0.00 0.00 32.23 32.07 2wvt h LYS 214 CO -0.01 0.78 0.04 1.49 -0.57 0.00 0.00 179.45 181.18 2wvt h GLU 215 N 1.22 0.16 -0.52 3.15 4.81 -0.84 -1.50 114.58 121.07 2wvt h GLU 215 Ca 0.34 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.56 2wvt h GLU 215 Cb -0.12 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.20 2wvt h GLU 215 CO -0.08 0.29 0.30 -0.07 -0.73 0.00 0.00 179.01 178.72 2wvt h LEU 216 N 0.00 0.48 -1.59 1.64 3.38 -0.64 0.11 115.31 118.69 2wvt h LEU 216 Ca 0.04 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 2wvt h LEU 216 Cb 0.19 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2wvt h LEU 216 CO -0.00 0.34 -0.15 0.00 0.09 0.00 0.00 178.44 178.72 2wvt h ALA 217 N 1.24 1.67 0.05 1.53 0.00 -1.04 -1.46 119.26 121.25 2wvt h ALA 217 Ca 0.21 -0.16 -0.37 0.00 0.00 0.00 0.00 54.91 54.59 2wvt h ALA 217 Cb 0.04 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 2wvt h ALA 217 CO -0.10 0.25 -2.23 0.25 0.00 0.00 0.00 179.25 177.42 2wvt n THR 218 N -4.33 1.60 -0.26 0.00 -2.24 -0.58 -3.63 114.28 104.84 2wvt n THR 218 Ca -0.02 -0.65 -0.02 0.00 -2.27 0.00 0.00 64.05 61.09 2wvt n THR 218 Cb 0.24 -1.42 0.15 0.00 -2.10 0.00 0.00 70.33 67.20 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 0.03 1.10 -2.15 -0.78 3.08 -0.80 -3.37 114.38 111.50 2wvt h ARG 219 Ca -0.50 -0.13 -0.58 0.00 0.07 0.00 0.00 59.98 58.84 2wvt h ARG 219 Cb 1.99 -0.22 -0.41 0.00 0.08 0.00 0.00 29.97 31.42 2wvt h ARG 219 CO 0.00 0.81 -0.75 0.66 -1.07 0.00 0.00 179.97 179.63 2wvt n TYR 220 N -4.34 2.61 0.53 3.04 4.01 -0.55 -4.95 117.16 117.51 2wvt n TYR 220 Ca 0.08 -3.98 0.06 0.00 -0.16 0.00 0.00 57.90 53.89 2wvt n TYR 220 Cb 0.10 -0.49 0.28 0.00 -0.31 0.00 0.00 39.34 38.92 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 0.79 0.16 0.00 -0.72 -0.04 -1.24 -1.68 135.00 132.28 2wvt n PRO 221 Ca 0.28 0.18 0.14 0.00 -0.04 0.00 0.00 63.50 64.06 2wvt n PRO 221 Cb 0.45 -1.50 0.63 0.00 -0.04 0.00 0.00 33.50 33.04 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 -1.28 0.00 -1.65 0.52 -2.24 -1.26 -4.91 114.28 103.46 2wvt n THR 222 Ca 0.05 -0.05 -0.47 0.00 -2.27 0.00 0.00 64.05 61.32 2wvt n THR 222 Cb 0.09 -0.17 -0.04 0.00 -2.10 0.00 0.00 70.33 68.11 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 -1.03 0.23 0.74 2.28 3.14 -0.67 -4.69 118.33 118.34 2wvt n VAL 223 Ca 0.14 -0.06 0.09 0.00 -2.96 0.00 0.00 64.34 61.55 2wvt n VAL 223 Cb 0.27 -1.35 -0.11 0.00 -1.06 0.00 0.00 33.84 31.59 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 2.88 0.92 -3.60 1.45 4.76 -0.48 -4.86 118.16 119.23 2wvt n LYS 224 Ca 0.16 -0.02 -0.13 0.00 -2.87 0.00 0.00 58.31 55.45 2wvt n LYS 224 Cb 0.27 -1.37 -0.07 0.00 -1.84 0.00 0.00 35.03 32.02 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 -2.92 -0.59 -0.18 4.39 2.15 -1.26 -1.09 116.67 117.17 2wvt s ASP 225 Ca 0.05 0.97 -0.01 0.00 0.43 0.00 0.00 52.55 53.99 2wvt s ASP 225 Cb 0.14 0.93 -0.00 0.00 -0.30 0.00 0.00 42.92 43.68 2wvt s ASP 225 CO 0.75 -0.31 -0.11 -0.36 -0.17 0.00 0.00 175.17 174.97 2wvt s PHE 226 N -0.22 2.87 -0.42 -5.34 0.40 -0.19 -1.04 117.98 114.03 2wvt s PHE 226 Ca -0.02 -1.00 -0.05 0.00 -0.60 0.00 0.00 56.93 55.27 2wvt s PHE 226 Cb -0.03 -1.98 0.11 0.00 0.51 0.00 0.00 43.02 41.63 2wvt s PHE 226 CO 0.01 -0.50 0.23 -0.46 0.70 0.00 0.00 175.22 175.20 2wvt s TRP 227 N 1.06 3.51 0.33 0.36 -0.00 -0.14 -2.67 118.94 121.40 2wvt s TRP 227 Ca -0.00 -2.18 -0.22 0.00 -0.00 0.00 0.00 56.10 53.70 2wvt s TRP 227 Cb -0.15 -3.19 -0.10 0.00 -0.00 0.00 0.00 33.47 30.04 2wvt s TRP 227 CO -0.02 -0.96 0.87 -0.06 -0.00 0.00 0.00 176.95 176.78 2wvt s PHE 228 N 1.22 3.52 0.22 5.86 0.08 -1.26 -1.80 117.98 125.82 2wvt s PHE 228 Ca 0.06 1.57 -0.04 0.00 0.12 0.00 0.00 56.93 58.64 2wvt s PHE 228 Cb -0.23 -2.79 -0.03 0.00 -0.57 0.00 0.00 43.02 39.40 2wvt s PHE 228 CO -0.03 0.12 0.23 0.34 -0.10 0.00 0.00 175.22 175.79 2wvt s ASP 229 N -1.89 0.11 -1.31 1.36 2.15 -0.76 -4.44 116.67 111.90 2wvt s ASP 229 Ca 0.53 -1.27 -0.08 0.00 0.43 0.00 0.00 52.55 52.15 2wvt s ASP 229 Cb -0.14 0.44 0.01 0.00 -0.30 0.00 0.00 42.92 42.93 2wvt s ASP 229 CO 0.19 -0.93 1.14 0.61 -0.17 0.00 0.00 175.17 176.02 2wvt n GLY 230 N -0.31 -0.49 0.20 2.66 0.00 -1.26 -1.76 105.19 104.24 2wvt n GLY 230 Ca 0.01 0.22 0.06 0.00 0.00 0.00 0.00 46.02 46.31 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 -4.90 1.55 0.75 2.61 -2.24 -1.26 -1.54 114.28 109.25 2wvt n THR 231 Ca 0.00 -1.66 0.13 0.00 -2.27 0.00 0.00 64.05 60.24 2wvt n THR 231 Cb 0.56 0.08 0.34 0.00 -2.10 0.00 0.00 70.33 69.22 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 -0.81 0.45 -2.22 4.78 2.14 -1.26 -4.49 117.44 116.02 2wvt n TRP 232 Ca 0.11 0.13 -0.33 0.00 2.07 0.00 0.00 57.50 59.48 2wvt n TRP 232 Cb 0.52 -0.63 -0.01 0.00 -0.81 0.00 0.00 31.31 30.38 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 -3.83 6.08 0.49 -0.67 1.01 -1.26 -4.84 116.67 113.65 2wvt s ASP 233 Ca 0.10 1.78 0.19 0.00 0.71 0.00 0.00 52.55 55.33 2wvt s ASP 233 Cb 0.15 -2.53 1.23 0.00 1.01 0.00 0.00 42.92 42.77 2wvt s ASP 233 CO 0.64 -0.96 2.01 0.00 0.21 0.00 0.00 175.17 177.08 2wvt h ALA 234 N 0.77 2.22 -0.94 5.23 0.00 -1.88 -0.51 119.26 124.15 2wvt h ALA 234 Ca -0.47 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.50 2wvt h ALA 234 Cb 1.21 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 2wvt h ALA 234 CO 0.59 -0.34 0.61 0.66 0.00 0.00 0.00 179.25 180.76 2wvt h SER 235 N 0.17 0.94 0.07 0.00 4.64 -1.73 -0.10 113.55 117.54 2wvt h SER 235 Ca 0.22 0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 61.44 2wvt h SER 235 Cb 0.66 -0.19 0.01 0.00 -0.31 0.00 0.00 62.40 62.56 2wvt h SER 235 CO -0.03 0.59 -0.56 0.58 -0.87 0.00 0.00 176.83 176.54 2wvt h VAL 236 N 1.06 1.54 -0.94 0.95 2.07 -1.42 -3.29 116.25 116.21 2wvt h VAL 236 Ca 0.41 -2.41 0.17 0.00 0.82 0.00 0.00 66.70 65.69 2wvt h VAL 236 Cb 0.23 3.16 -0.08 0.00 -1.52 0.00 0.00 31.29 33.07 2wvt h VAL 236 CO -0.16 0.64 0.60 0.11 0.02 0.00 0.00 177.57 178.77 2wvt h LYS 237 N -0.69 0.66 0.00 1.57 1.57 -1.25 -0.69 116.57 117.74 2wvt h LYS 237 Ca -0.11 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 2wvt h LYS 237 Cb 1.35 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.51 2wvt h LYS 237 CO 0.05 0.43 0.00 1.63 -0.57 0.00 0.00 179.45 180.99 2wvt n LYS 238 N -4.61 0.11 -2.58 3.15 5.02 -0.06 -3.80 118.16 115.39 2wvt n LYS 238 Ca 0.20 0.16 -0.29 0.00 -2.02 0.00 0.00 58.31 56.36 2wvt n LYS 238 Cb 0.54 -1.65 -0.01 0.00 -0.02 0.00 0.00 35.03 33.89 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 -1.85 5.11 -0.34 4.39 4.13 -0.27 -4.86 115.26 121.57 2wvt n ASN 239 Ca 0.05 -3.72 0.03 0.00 1.68 0.00 0.00 54.58 52.62 2wvt n ASN 239 Cb 0.33 -0.60 0.17 0.00 -1.54 0.00 0.00 39.78 38.14 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 2.86 1.45 -0.31 7.41 0.00 -1.66 -0.75 103.07 112.07 2wvt h GLY 240 Ca 0.29 -0.42 0.26 0.00 0.00 0.00 0.00 47.33 47.45 2wvt h GLY 240 CO 0.92 0.26 0.47 0.11 0.00 0.00 0.00 176.54 178.30 2wvt h TRP 241 N 1.04 0.77 -0.25 5.60 5.08 -1.85 -1.41 115.95 124.94 2wvt h TRP 241 Ca 0.42 0.04 -0.08 0.00 1.08 0.00 0.00 58.89 60.35 2wvt h TRP 241 Cb 0.24 -0.19 -0.01 0.00 -3.00 0.00 0.00 29.16 26.21 2wvt h TRP 241 CO -0.02 -0.08 -0.17 2.35 -1.28 0.00 0.00 178.44 179.25 2wvt h TRP 242 N 0.40 0.65 -0.82 0.12 7.01 -1.51 -0.75 115.95 121.05 2wvt h TRP 242 Ca 0.63 -0.18 -0.00 0.00 2.11 0.00 0.00 58.89 61.45 2wvt h TRP 242 Cb 1.27 -0.15 -0.04 0.00 -2.10 0.00 0.00 29.16 28.15 2wvt h TRP 242 CO -0.09 0.84 0.49 1.79 -2.79 0.00 0.00 178.44 178.69 2wvt h THR 243 N 0.28 1.23 -0.64 2.65 1.35 -1.24 0.19 112.91 116.73 2wvt h THR 243 Ca 0.05 -0.50 -0.08 0.00 -0.55 0.00 0.00 66.41 65.34 2wvt h THR 243 Cb 0.70 0.07 -0.03 0.00 -1.73 0.00 0.00 68.15 67.16 2wvt h THR 243 CO 0.05 0.24 0.09 0.00 -0.25 0.00 0.00 175.52 175.64 2wvt h ALA 244 N 1.42 0.94 -0.48 6.62 0.00 -1.22 -2.45 119.26 124.09 2wvt h ALA 244 Ca 0.29 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2wvt h ALA 244 Cb -0.05 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2wvt h ALA 244 CO -0.06 0.65 0.20 1.25 0.00 0.00 0.00 179.25 181.30 2wvt h HIS 245 N 0.99 0.72 -0.69 0.00 -0.00 0.15 -1.86 115.15 114.45 2wvt h HIS 245 Ca 0.19 -0.05 -0.06 0.00 -0.00 0.00 0.00 60.37 60.46 2wvt h HIS 245 Cb 0.45 -0.22 -0.03 0.00 -0.00 0.00 0.00 27.41 27.61 2wvt h HIS 245 CO 0.03 0.59 0.20 0.00 -0.00 0.00 0.00 177.93 178.76 2wvt h ALA 246 N 1.05 0.91 -0.41 5.26 0.00 -0.59 0.29 119.26 125.77 2wvt h ALA 246 Ca 0.16 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.85 2wvt h ALA 246 Cb 0.17 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2wvt h ALA 246 CO -0.02 0.61 0.26 1.49 0.00 0.00 0.00 179.25 181.59 2wvt h GLU 247 N 1.03 0.52 -0.10 0.00 4.81 -1.32 -1.56 114.58 117.96 2wvt h GLU 247 Ca 0.22 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.36 2wvt h GLU 247 Cb 0.33 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.59 2wvt h GLU 247 CO -0.00 0.35 -0.17 0.37 -0.73 0.00 0.00 179.01 178.82 2wvt h GLN 248 N 0.54 0.29 -0.70 1.92 5.75 -0.83 -1.56 115.11 120.52 2wvt h GLN 248 Ca 0.16 -0.18 0.15 0.00 -0.15 0.00 0.00 58.65 58.62 2wvt h GLN 248 Cb -0.04 0.02 -0.10 0.00 1.07 0.00 0.00 27.48 28.43 2wvt h GLN 248 CO -0.05 0.77 0.17 1.98 -2.65 0.00 0.00 178.83 179.05 2wvt h MET 249 N -0.15 0.27 0.01 1.69 4.05 -0.39 -1.36 114.93 119.04 2wvt h MET 249 Ca 0.01 -0.02 -0.20 0.00 -0.28 0.00 0.00 59.70 59.21 2wvt h MET 249 Cb 0.75 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.48 2wvt h MET 249 CO 0.04 0.18 -0.88 -0.07 0.23 0.00 0.00 176.91 176.41 2wvt h LEU 250 N 0.28 0.22 -1.04 3.39 3.38 -1.16 -2.25 115.31 118.13 2wvt h LEU 250 Ca 0.39 -0.18 -0.10 0.00 0.09 0.00 0.00 57.88 58.08 2wvt h LEU 250 Cb 0.64 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 2wvt h LEU 250 CO -0.48 0.99 -0.42 0.11 0.09 0.00 0.00 178.44 178.74 2wvt h LYS 251 N 0.09 0.13 -0.23 1.13 1.57 -0.80 0.50 116.57 118.97 2wvt h LYS 251 Ca -0.04 -0.06 -0.20 0.00 -1.87 0.00 0.00 60.65 58.48 2wvt h LYS 251 Cb 1.51 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.83 2wvt h LYS 251 CO 0.13 0.53 -0.65 0.93 -0.57 0.00 0.00 179.45 179.82 2wvt h GLU 252 N 0.11 0.83 -0.08 3.15 5.08 -1.14 -3.30 114.58 119.23 2wvt h GLU 252 Ca 0.01 -0.59 -0.19 0.00 -1.00 0.00 0.00 59.36 57.60 2wvt h GLU 252 Cb 0.79 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.13 2wvt h GLU 252 CO 0.06 1.21 -0.73 -0.07 -1.00 0.00 0.00 179.01 178.48 2wvt h LEU 253 N 0.61 0.52 -7.30 1.33 3.38 -1.23 -3.42 115.31 109.20 2wvt h LEU 253 Ca -0.01 -0.34 -0.63 0.00 0.09 0.00 0.00 57.88 56.99 2wvt h LEU 253 Cb 1.26 -0.15 -0.40 0.00 0.09 0.00 0.00 40.66 41.46 2wvt h LEU 253 CO 0.14 1.08 -0.71 -0.69 0.09 0.00 0.00 178.44 178.35 2wvt s VAL 254 N -3.63 1.83 0.24 1.22 1.01 0.15 -4.99 120.40 116.24 2wvt s VAL 254 Ca -0.06 -2.47 -0.31 0.00 0.00 0.00 0.00 61.98 59.14 2wvt s VAL 254 Cb 0.10 -2.31 -0.12 0.00 0.00 0.00 0.00 36.38 34.05 2wvt s VAL 254 CO 0.84 -0.75 1.68 -2.84 0.00 0.00 0.00 175.10 174.03 2wvt s PRO 255 N 0.58 4.12 0.00 2.72 0.02 -1.25 -1.77 135.00 139.41 2wvt s PRO 255 Ca 0.14 2.61 0.00 0.00 0.02 0.00 0.00 61.00 63.77 2wvt s PRO 255 Cb -0.22 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.25 2wvt s PRO 255 CO -0.07 -0.71 0.00 0.41 -0.33 0.00 0.00 177.00 176.30 2wvt n GLY 256 N 3.24 1.36 3.68 0.52 0.00 -1.26 -5.02 105.19 107.70 2wvt n GLY 256 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 2wvt n GLY 256 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2wvt n VAL 257 N -2.00 4.24 -4.00 1.61 3.14 -0.73 -4.65 118.33 115.94 2wvt n VAL 257 Ca 0.00 -0.50 -0.32 0.00 -2.96 0.00 0.00 64.34 60.56 2wvt n VAL 257 Cb 0.00 -1.34 -0.06 0.00 -1.06 0.00 0.00 33.84 31.38 2wvt n VAL 257 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2wvt s ALA 258 N -1.43 3.77 -0.04 1.55 0.00 -0.25 -4.94 121.76 120.42 2wvt s ALA 258 Ca 0.78 -0.88 0.01 0.00 0.00 0.00 0.00 51.96 51.87 2wvt s ALA 258 Cb -0.40 -1.67 0.02 0.00 0.00 0.00 0.00 23.12 21.07 2wvt s ALA 258 CO 0.44 0.76 -0.02 0.42 0.00 0.00 0.00 175.76 177.36 2wvt s ILE 259 N -1.36 0.36 0.59 0.00 -1.09 -1.26 -1.02 121.20 117.41 2wvt s ILE 259 Ca 0.29 -0.01 -0.14 0.00 -2.23 0.00 0.00 60.65 58.56 2wvt s ILE 259 Cb -0.12 -0.42 -0.05 0.00 -1.58 0.00 0.00 42.46 40.29 2wvt s ILE 259 CO 0.21 0.19 1.02 0.54 -1.23 0.00 0.00 174.94 175.67 2wvt s ASN 260 N 1.01 6.21 0.47 3.58 4.22 -1.09 -0.95 114.94 128.40 2wvt s ASN 260 Ca -0.10 1.55 0.22 0.00 -2.14 0.00 0.00 52.86 52.39 2wvt s ASN 260 Cb -0.14 -2.50 1.19 0.00 1.28 0.00 0.00 41.25 41.09 2wvt s ASN 260 CO -0.01 -0.88 1.99 0.77 -2.04 0.00 0.00 177.10 176.94 2wvt h SER 261 N 0.18 0.00 -0.02 3.54 4.64 -1.40 -3.06 113.55 117.44 2wvt h SER 261 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 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 0.61 0.19 0.01 -0.09 -0.87 0.00 0.00 176.83 176.67 2wvt h ARG 262 N 0.00 0.00 -0.95 4.77 2.43 -1.85 -1.00 114.38 117.79 2wvt h ARG 262 Ca -0.00 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 2wvt h ARG 262 Cb 0.42 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.92 2wvt h ARG 262 CO 0.02 0.00 0.62 1.25 -1.51 0.00 0.00 179.97 180.36 2wvt h LEU 263 N 0.00 1.04 -9.58 3.80 5.85 -1.75 -3.45 115.31 111.22 2wvt h LEU 263 Ca 0.01 -0.01 -0.63 0.00 0.84 0.00 0.00 57.88 58.08 2wvt h LEU 263 Cb 0.04 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 40.75 2wvt h LEU 263 CO -0.00 0.72 -0.35 -0.13 -0.34 0.00 0.00 178.44 178.34 2wvt s ARG 264 N -6.02 3.79 0.04 1.25 1.81 -0.38 -4.84 118.95 114.60 2wvt s ARG 264 Ca -0.12 0.12 0.04 0.00 -1.72 0.00 0.00 55.73 54.05 2wvt s ARG 264 Cb 0.19 -3.25 -0.02 0.00 -0.45 0.00 0.00 34.95 31.42 2wvt s ARG 264 CO 0.81 0.64 -0.13 0.00 -0.68 0.00 0.00 175.30 175.94 2wvt s ALA 265 N -0.74 1.06 0.51 2.13 0.00 -1.26 -2.18 121.76 121.28 2wvt s ALA 265 Ca 0.18 -0.78 -0.00 0.00 0.00 0.00 0.00 51.96 51.37 2wvt s ALA 265 Cb -0.14 -0.16 0.01 0.00 0.00 0.00 0.00 23.12 22.84 2wvt s ALA 265 CO 0.07 0.19 0.08 -0.40 0.00 0.00 0.00 175.76 175.71 2wvt n ASP 266 N 1.94 0.09 0.31 0.00 5.75 -0.52 -4.44 116.55 119.67 2wvt n ASP 266 Ca -0.18 -1.08 0.17 0.00 -0.01 0.00 0.00 54.79 53.69 2wvt n ASP 266 Cb 0.55 -0.06 0.99 0.00 -1.03 0.00 0.00 41.12 41.57 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 0.00 -0.02 -1.12 3.45 -1.91 -1.44 116.42 115.31 2wvt h ASP 267 Ca -0.03 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.43 2wvt h ASP 267 Cb 0.10 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.87 2wvt h ASP 267 CO 0.03 0.01 -0.10 0.29 -1.57 0.00 0.00 179.24 177.89 2wvt n LYS 268 N -3.61 2.05 -0.59 3.56 4.01 -1.26 -4.97 118.16 117.36 2wvt n LYS 268 Ca -0.03 -1.68 0.00 0.00 -0.51 0.00 0.00 58.31 56.09 2wvt n LYS 268 Cb 0.09 -1.47 0.00 0.00 -0.51 0.00 0.00 35.03 33.15 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 1.36 0.75 3.72 0.72 0.00 -0.54 -5.04 105.19 106.16 2wvt n GLY 269 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2wvt n GLY 269 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wvt s LYS 270 N -0.41 4.56 0.15 1.61 2.47 -1.26 -4.73 119.74 122.13 2wvt s LYS 270 Ca 0.00 1.63 0.05 0.00 -1.56 0.00 0.00 55.97 56.08 2wvt s LYS 270 Cb 0.00 -3.35 -0.04 0.00 -1.46 0.00 0.00 37.83 32.98 2wvt s LYS 270 CO 0.00 -0.02 0.15 1.03 0.16 0.00 0.00 175.35 176.66 2wvt s ARG 271 N 0.38 2.95 0.00 4.03 0.52 -1.26 -1.44 118.95 124.13 2wvt s ARG 271 Ca 0.52 -0.83 0.00 0.00 -0.52 0.00 0.00 55.73 54.91 2wvt s ARG 271 Cb -0.27 -2.69 0.00 0.00 0.52 0.00 0.00 34.95 32.52 2wvt s ARG 271 CO 0.31 0.50 0.00 0.72 0.02 0.00 0.00 175.30 176.85 2wvt n HIS 272 N -0.29 0.00 -4.69 -0.53 8.25 -0.93 -4.68 115.22 112.34 2wvt n HIS 272 Ca -0.08 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.04 2wvt n HIS 272 Cb 0.54 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.53 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 2.87 0.91 4.41 0.40 -1.26 -1.31 117.98 124.00 2wvt s PHE 273 Ca 0.00 -0.13 -0.16 0.00 -0.60 0.00 0.00 56.93 56.04 2wvt s PHE 273 Cb 0.00 -1.73 0.21 0.00 0.51 0.00 0.00 43.02 42.02 2wvt s PHE 273 CO 0.00 0.20 1.17 -0.40 0.70 0.00 0.00 175.22 176.88 2wvt n ASP 274 N 2.52 -0.22 0.08 1.36 5.68 -0.03 -4.83 116.55 121.11 2wvt n ASP 274 Ca -0.18 -1.38 0.09 0.00 -0.50 0.00 0.00 54.79 52.82 2wvt n ASP 274 Cb 0.53 -0.91 0.40 0.00 -1.14 0.00 0.00 41.12 40.00 2wvt n ASP 274 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2wvt n SER 275 N -3.91 0.39 -1.04 -1.12 7.64 -1.26 -0.72 113.62 113.59 2wvt n SER 275 Ca 0.15 0.61 0.09 0.00 1.01 0.00 0.00 58.87 60.73 2wvt n SER 275 Cb 0.52 -0.69 0.25 0.00 -1.01 0.00 0.00 64.21 63.28 2wvt n SER 275 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2wvt n ASN 276 N -1.95 3.01 -0.18 6.43 3.02 -1.26 -4.87 115.26 119.47 2wvt n ASN 276 Ca 0.02 -2.01 -0.02 0.00 -0.03 0.00 0.00 54.58 52.54 2wvt n ASN 276 Cb 0.17 -0.38 -0.01 0.00 -0.61 0.00 0.00 39.78 38.95 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 1.39 0.56 3.85 7.41 0.00 0.10 -5.04 105.19 113.46 2wvt n GLY 277 Ca 0.19 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 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 -1.38 3.58 0.09 1.61 0.52 -1.25 -4.74 118.95 117.38 2wvt s ARG 278 Ca 0.00 -0.13 -0.31 0.00 -0.52 0.00 0.00 55.73 54.77 2wvt s ARG 278 Cb 0.00 -3.23 -0.09 0.00 0.52 0.00 0.00 34.95 32.15 2wvt s ARG 278 CO 0.00 0.70 1.61 -1.17 0.02 0.00 0.00 175.30 176.46 2wvt s LEU 279 N -0.79 4.36 0.29 2.53 2.96 -1.26 -0.85 118.68 125.92 2wvt s LEU 279 Ca 0.14 2.50 -0.05 0.00 -0.22 0.00 0.00 54.13 56.50 2wvt s LEU 279 Cb -0.12 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 42.95 2wvt s LEU 279 CO 0.03 -0.86 0.57 -0.04 -1.32 0.00 0.00 176.35 174.73 2wvt s MET 280 N 2.19 3.64 2.12 1.98 -1.94 -0.43 -4.47 119.30 122.40 2wvt s MET 280 Ca 0.72 0.04 0.00 0.00 -1.71 0.00 0.00 55.69 54.74 2wvt s MET 280 Cb -0.40 -2.63 0.00 0.00 2.01 0.00 0.00 34.83 33.80 2wvt s MET 280 CO 0.32 0.20 0.00 0.41 -0.01 0.00 0.00 175.02 175.94 2wvt n GLY 281 N -0.94 -0.69 0.01 -0.03 0.00 -1.26 -4.01 105.19 98.27 2wvt n GLY 281 Ca -0.01 -1.09 0.09 0.00 0.00 0.00 0.00 46.02 45.00 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 -1.59 0.94 -3.61 1.61 8.00 -0.12 -4.71 116.55 117.06 2wvt n ASP 282 Ca 0.00 -0.12 -0.16 0.00 0.71 0.00 0.00 54.79 55.22 2wvt n ASP 282 Cb 0.00 1.71 -0.07 0.00 -0.02 0.00 0.00 41.12 42.74 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 -3.15 -0.51 0.26 1.24 -0.85 -1.25 -4.62 117.35 108.46 2wvt s TYR 283 Ca -0.05 0.90 -0.30 0.00 -0.52 0.00 0.00 57.07 57.11 2wvt s TYR 283 Cb 0.12 0.30 -0.09 0.00 0.38 0.00 0.00 41.96 42.66 2wvt s TYR 283 CO 0.73 -0.52 1.02 -2.00 -1.52 0.00 0.00 175.55 173.27 2wvt s GLU 284 N -1.10 4.74 -0.15 -3.49 -6.30 0.05 -1.50 118.70 110.95 2wvt s GLU 284 Ca -0.11 1.65 0.24 0.00 -2.50 0.00 0.00 54.97 54.25 2wvt s GLU 284 Cb -0.02 -3.24 0.47 0.00 0.00 0.00 0.00 34.13 31.35 2wvt s GLU 284 CO 0.07 0.35 1.14 -1.13 0.02 0.00 0.00 175.26 175.71 2wvt n SER 285 N 1.38 1.39 -0.00 -1.70 3.41 -1.26 -1.27 113.62 115.57 2wvt n SER 285 Ca -0.01 -2.06 0.10 0.00 -0.26 0.00 0.00 58.87 56.63 2wvt n SER 285 Cb 0.46 -0.40 -0.12 0.00 -0.26 0.00 0.00 64.21 63.88 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 -0.15 -0.92 3.53 5.00 0.00 -1.26 -4.81 105.19 106.57 2wvt n GLY 286 Ca 0.07 -0.56 -0.42 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 -2.99 2.63 -0.28 1.61 1.51 -1.26 -4.93 117.35 113.64 2wvt s TYR 287 Ca 0.06 -0.82 0.01 0.00 -1.01 0.00 0.00 57.07 55.31 2wvt s TYR 287 Cb 0.15 -4.56 0.06 0.00 -0.11 0.00 0.00 41.96 37.50 2wvt s TYR 287 CO 0.84 -1.84 -0.05 -2.00 -1.11 0.00 0.00 175.55 171.39 2wvt s GLU 288 N 4.51 2.24 -1.67 -0.62 2.12 -1.26 -1.75 118.70 122.26 2wvt s GLU 288 Ca 0.39 -1.38 0.00 0.00 0.36 0.00 0.00 54.97 54.35 2wvt s GLU 288 Cb -0.04 -3.03 0.00 0.00 0.26 0.00 0.00 34.13 31.33 2wvt s GLU 288 CO -0.04 -0.63 0.00 0.54 -0.54 0.00 0.00 175.26 174.59 2wvt n ARG 289 N 4.48 -1.21 -3.46 4.30 1.74 0.18 -4.95 116.66 117.74 2wvt n ARG 289 Ca -0.12 1.01 -0.12 0.00 -0.77 0.00 0.00 57.85 57.85 2wvt n ARG 289 Cb 0.42 -5.28 -0.02 0.00 -1.02 0.00 0.00 32.46 26.56 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 -3.83 1.24 0.09 5.56 1.70 -1.26 -5.04 118.95 117.41 2wvt s ARG 290 Ca 0.00 -0.50 0.03 0.00 -0.47 0.00 0.00 55.73 54.79 2wvt s ARG 290 Cb 0.00 0.57 -0.04 0.00 -0.57 0.00 0.00 34.95 34.91 2wvt s ARG 290 CO 0.00 -0.53 -0.09 -0.51 -1.08 0.00 0.00 175.30 173.09 2wvt s LEU 291 N -2.74 2.41 0.60 -1.89 1.43 -1.26 -4.70 118.68 112.53 2wvt s LEU 291 Ca 0.01 -0.82 -0.19 0.00 -1.03 0.00 0.00 54.13 52.11 2wvt s LEU 291 Cb -0.01 -0.22 -0.03 0.00 0.03 0.00 0.00 46.19 45.96 2wvt s LEU 291 CO -0.13 -0.30 1.21 -2.16 0.23 0.00 0.00 176.35 175.20 2wvt s PRO 292 N -2.84 2.93 0.02 1.29 0.04 -1.26 -4.98 135.00 130.21 2wvt s PRO 292 Ca 0.04 1.81 -0.30 0.00 0.04 0.00 0.00 61.00 62.59 2wvt s PRO 292 Cb -0.02 -1.93 -0.05 0.00 0.04 0.00 0.00 34.50 32.54 2wvt s PRO 292 CO -0.01 -1.23 1.21 0.34 0.04 0.00 0.00 177.00 177.35 2wvt s ASP 293 N -1.63 7.06 0.52 6.66 2.15 -1.26 -4.92 116.67 125.24 2wvt s ASP 293 Ca 0.77 1.96 0.35 0.00 0.43 0.00 0.00 52.55 56.06 2wvt s ASP 293 Cb -0.30 -2.57 1.86 0.00 -0.30 0.00 0.00 42.92 41.61 2wvt s ASP 293 CO 0.34 -0.52 2.06 -0.65 -0.17 0.00 0.00 175.17 176.23 2wvt h PRO 294 N 7.06 0.00 0.00 4.34 0.11 -1.93 -1.37 132.00 140.21 2wvt h PRO 294 Ca -0.39 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.41 2wvt h PRO 294 Cb 1.20 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.25 2wvt h PRO 294 CO 0.84 0.00 -2.13 0.28 -0.21 0.00 0.00 178.00 176.78 2wvt n VAL 295 N -2.73 1.12 0.09 3.15 0.31 -1.26 -4.71 118.33 114.30 2wvt n VAL 295 Ca -0.02 -0.38 0.10 0.00 -0.01 0.00 0.00 64.34 64.03 2wvt n VAL 295 Cb 0.07 -1.38 -0.02 0.00 -0.91 0.00 0.00 33.84 31.59 2wvt n VAL 295 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2wvt n LYS 296 N -3.35 0.61 -1.69 5.55 5.02 -1.17 -4.35 118.16 118.78 2wvt n LYS 296 Ca -0.37 0.10 -0.23 0.00 -2.02 0.00 0.00 58.31 55.79 2wvt n LYS 296 Cb 0.84 -1.80 0.06 0.00 -0.02 0.00 0.00 35.03 34.11 2wvt n LYS 296 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2wvt n ASP 297 N -2.66 5.18 0.03 4.39 8.00 -0.53 -4.72 116.55 126.25 2wvt n ASP 297 Ca -0.01 -3.77 0.05 0.00 0.71 0.00 0.00 54.79 51.77 2wvt n ASP 297 Cb 0.58 -0.52 0.22 0.00 -0.02 0.00 0.00 41.12 41.38 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 -0.81 0.13 0.25 0.64 4.77 -1.26 -2.52 117.00 118.20 2wvt n LEU 298 Ca 0.46 0.55 0.15 0.00 -0.03 0.00 0.00 56.01 57.14 2wvt n LEU 298 Cb 0.90 -0.55 0.84 0.00 -2.33 0.00 0.00 43.42 42.28 2wvt n LEU 298 CO 0.45 -0.47 1.13 0.07 -1.33 0.00 0.00 177.39 177.24 2wvt h LYS 299 N 0.00 0.00 0.00 3.23 2.10 -1.96 -1.94 116.57 118.00 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 0.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.45 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 -1.83 -2.38 116.25 110.60 2wvt h VAL 300 Ca 0.04 -0.22 0.00 0.00 -1.23 0.00 0.00 66.70 65.29 2wvt h VAL 300 Cb 0.19 1.08 0.00 0.00 -2.13 0.00 0.00 31.29 30.44 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 -2.80 1.08 0.54 7.19 -2.24 -0.73 -2.75 114.28 114.57 2wvt n THR 301 Ca -0.01 0.28 0.13 0.00 -2.27 0.00 0.00 64.05 62.18 2wvt n THR 301 Cb 0.17 -1.10 0.31 0.00 -2.10 0.00 0.00 70.33 67.61 2wvt n THR 301 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2wvt h GLN 302 N 0.00 0.00 -4.54 -0.78 4.20 -1.64 -3.47 115.11 108.88 2wvt h GLN 302 Ca 0.00 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.51 2wvt h GLN 302 Cb 0.24 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 27.87 2wvt h GLN 302 CO 0.00 0.00 -0.69 1.67 -0.67 0.00 0.00 178.83 179.14 2wvt s TRP 303 N -3.14 0.79 0.44 2.96 -2.14 -1.11 -4.54 118.94 112.19 2wvt s TRP 303 Ca 0.09 -0.94 -0.24 0.00 2.66 0.00 0.00 56.10 57.66 2wvt s TRP 303 Cb 0.12 -0.48 -0.08 0.00 -3.10 0.00 0.00 33.47 29.93 2wvt s TRP 303 CO 0.64 -0.21 1.24 -0.51 -2.66 0.00 0.00 176.95 175.45 2wvt s ASP 304 N -2.97 6.18 0.17 -2.66 1.01 -1.26 -4.94 116.67 112.20 2wvt s ASP 304 Ca 0.10 2.49 -0.20 0.00 0.71 0.00 0.00 52.55 55.65 2wvt s ASP 304 Cb 0.06 -2.62 0.05 0.00 1.01 0.00 0.00 42.92 41.41 2wvt s ASP 304 CO -0.06 -0.92 0.54 -1.66 0.21 0.00 0.00 175.17 173.28 2wvt s TRP 305 N -1.38 -0.35 -0.06 4.23 1.48 -1.26 -0.77 118.94 120.83 2wvt s TRP 305 Ca 0.61 0.07 -0.02 0.00 -1.06 0.00 0.00 56.10 55.69 2wvt s TRP 305 Cb -0.34 0.46 0.04 0.00 -1.16 0.00 0.00 33.47 32.47 2wvt s TRP 305 CO 0.42 -0.85 0.11 -2.00 -4.06 0.00 0.00 176.95 170.57 2wvt s GLU 306 N -3.80 -0.02 0.32 3.25 2.12 -0.40 -1.27 118.70 118.90 2wvt s GLU 306 Ca 0.04 0.44 -0.05 0.00 0.36 0.00 0.00 54.97 55.76 2wvt s GLU 306 Cb -0.01 -0.37 -0.05 0.00 0.26 0.00 0.00 34.13 33.97 2wvt s GLU 306 CO -0.10 -0.30 0.59 0.00 -0.54 0.00 0.00 175.26 174.91 2wvt s ALA 307 N 2.07 3.59 0.13 6.30 0.00 0.35 -4.48 121.76 129.73 2wvt s ALA 307 Ca 0.02 -0.56 0.05 0.00 0.00 0.00 0.00 51.96 51.47 2wvt s ALA 307 Cb -0.12 -2.33 -0.04 0.00 0.00 0.00 0.00 23.12 20.63 2wvt s ALA 307 CO -0.04 0.16 -0.12 0.00 0.00 0.00 0.00 175.76 175.76 2wvt s MET 309 N -3.20 1.01 0.22 0.00 0.23 -0.62 -0.65 119.30 116.29 2wvt s MET 309 Ca 0.12 -0.71 0.08 0.00 -1.03 0.00 0.00 55.69 54.16 2wvt s MET 309 Cb -0.01 0.44 -0.04 0.00 -1.53 0.00 0.00 34.83 33.69 2wvt s MET 309 CO 0.02 -0.38 -0.01 0.95 -2.03 0.00 0.00 175.02 173.57 2wvt s THR 310 N -3.67 3.55 -0.12 3.16 -4.23 -1.26 -1.50 115.64 111.57 2wvt s THR 310 Ca 0.02 -1.66 -0.28 0.00 -1.18 0.00 0.00 61.69 58.59 2wvt s THR 310 Cb 0.02 -2.83 -0.25 0.00 1.34 0.00 0.00 72.50 70.78 2wvt s THR 310 CO -0.11 -0.23 0.84 0.40 -0.54 0.00 0.00 174.62 174.98 2wvt h ILE 311 N 2.24 1.70 -3.82 2.99 2.04 -1.82 -3.45 117.51 117.39 2wvt h ILE 311 Ca -0.46 -2.13 -0.43 0.00 1.00 0.00 0.00 64.86 62.83 2wvt h ILE 311 Cb 1.22 3.14 0.18 0.00 -0.74 0.00 0.00 36.82 40.62 2wvt h ILE 311 CO 0.58 0.55 0.31 -2.84 0.00 0.00 0.00 178.15 176.75 2wvt s PRO 312 N -2.53 -0.11 0.17 2.37 0.02 -1.26 -1.37 135.00 132.28 2wvt s PRO 312 Ca -0.18 -0.28 -0.14 0.00 0.02 0.00 0.00 61.00 60.41 2wvt s PRO 312 Cb -0.02 -1.75 0.11 0.00 0.02 0.00 0.00 34.50 32.86 2wvt s PRO 312 CO 0.68 -2.94 1.78 1.49 -0.33 0.00 0.00 177.00 177.67 2wvt h GLU 313 N -2.02 0.42 -1.07 5.54 4.81 -1.70 -3.39 114.58 117.17 2wvt h GLU 313 Ca -0.44 -0.03 -0.21 0.00 -0.13 0.00 0.00 59.36 58.55 2wvt h GLU 313 Cb 1.26 -0.10 -0.19 0.00 0.63 0.00 0.00 28.75 30.35 2wvt h GLU 313 CO 0.36 0.28 -0.56 -1.71 -0.73 0.00 0.00 179.01 176.66 2wvt n ASN 314 N -4.92 -3.02 -3.69 1.04 2.85 -1.26 -4.85 115.26 101.42 2wvt n ASN 314 Ca 0.03 -2.89 -0.16 0.00 -0.11 0.00 0.00 54.58 51.45 2wvt n ASN 314 Cb 0.13 1.47 -0.15 0.00 1.24 0.00 0.00 39.78 42.46 2wvt n ASN 314 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 2wvt s GLN 315 N 0.73 0.04 -0.18 1.20 -1.52 -1.26 -3.84 119.66 114.83 2wvt s GLN 315 Ca 0.31 0.51 -0.14 0.00 -1.95 0.00 0.00 55.36 54.09 2wvt s GLN 315 Cb 0.03 -0.26 -0.07 0.00 -0.22 0.00 0.00 33.01 32.48 2wvt s GLN 315 CO -0.09 -0.28 -0.30 0.91 -0.25 0.00 0.00 175.29 175.28 2wvt n TRP 316 N 5.08 0.00 -1.39 0.91 7.02 -1.26 -4.63 117.44 123.17 2wvt n TRP 316 Ca -0.09 0.00 -0.30 0.00 -1.02 0.00 0.00 57.50 56.09 2wvt n TRP 316 Cb 0.50 -0.61 0.11 0.00 -2.42 0.00 0.00 31.31 28.90 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 -5.05 1.62 0.08 6.99 0.00 -1.26 -3.70 107.32 106.00 2wvt s GLY 317 Ca -0.28 -0.14 -0.32 0.00 0.00 0.00 0.00 44.72 43.98 2wvt s GLY 317 CO 0.39 0.32 1.85 2.98 0.00 0.00 0.00 173.10 178.64 2wvt n TYR 318 N -3.64 2.53 -5.07 1.90 9.36 -1.26 -4.59 117.16 116.39 2wvt n TYR 318 Ca 0.07 -0.13 -0.32 0.00 3.32 0.00 0.00 57.90 60.84 2wvt n TYR 318 Cb 0.56 -2.72 -0.15 0.00 -0.63 0.00 0.00 39.34 36.40 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 3.10 2.57 -0.26 2.98 5.65 -1.26 -4.31 115.29 123.77 2wvt s HIS 319 Ca 0.85 -0.47 0.27 0.00 0.25 0.00 0.00 55.06 55.96 2wvt s HIS 319 Cb -0.52 -1.63 0.79 0.00 -1.18 0.00 0.00 32.58 30.03 2wvt s HIS 319 CO 0.41 -0.05 1.77 1.57 -0.65 0.00 0.00 174.74 177.78 2wvt h LYS 320 N 5.83 0.00 -3.83 2.88 2.10 -1.54 -3.40 116.57 118.62 2wvt h LYS 320 Ca -0.38 0.00 -0.63 0.00 -2.00 0.00 0.00 60.65 57.64 2wvt h LYS 320 Cb 1.17 0.00 -0.40 0.00 -0.90 0.00 0.00 32.23 32.09 2wvt h LYS 320 CO 0.49 0.00 -0.71 0.34 -2.00 0.00 0.00 179.45 177.58 2wvt s ASP 321 N -5.80 4.30 0.00 7.07 -1.08 -1.26 -4.94 116.67 114.95 2wvt s ASP 321 Ca 0.05 -2.34 0.14 0.00 -0.52 0.00 0.00 52.55 49.87 2wvt s ASP 321 Cb 0.07 -1.37 0.68 0.00 -1.46 0.00 0.00 42.92 40.84 2wvt s ASP 321 CO 0.60 -0.33 1.46 0.79 0.52 0.00 0.00 175.17 178.21 2wvt n TRP 322 N 3.97 0.10 1.23 -5.34 7.02 -1.26 -3.51 117.44 119.65 2wvt n TRP 322 Ca 0.04 -0.05 0.13 0.00 -1.02 0.00 0.00 57.50 56.60 2wvt n TRP 322 Cb 0.38 0.00 0.45 0.00 -2.42 0.00 0.00 31.31 29.72 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 -0.33 0.65 0.12 -0.99 3.41 -1.26 -3.87 113.62 111.35 2wvt n SER 323 Ca 0.11 -0.54 0.13 0.00 -0.26 0.00 0.00 58.87 58.30 2wvt n SER 323 Cb 0.13 0.04 0.39 0.00 -0.26 0.00 0.00 64.21 64.51 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 0.65 0.00 -8.49 1.04 3.38 -2.00 -3.46 115.31 106.43 2wvt h LEU 324 Ca 0.00 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.75 2wvt h LEU 324 Cb 0.45 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.10 2wvt h LEU 324 CO 0.00 0.00 -0.27 -0.94 0.09 0.00 0.00 178.44 177.32 2wvt s SER 325 N -4.72 0.56 0.22 -0.43 1.04 -1.25 -5.10 113.70 104.01 2wvt s SER 325 Ca 0.09 -1.34 -0.30 0.00 0.48 0.00 0.00 55.95 54.88 2wvt s SER 325 Cb 0.11 0.58 -0.09 0.00 0.10 0.00 0.00 66.02 66.72 2wvt s SER 325 CO 0.58 -1.16 1.35 -0.47 0.98 0.00 0.00 173.24 174.53 2wvt s TYR 326 N -3.53 3.17 -0.21 5.02 5.04 -1.26 -4.84 117.35 120.73 2wvt s TYR 326 Ca 0.31 1.16 -0.03 0.00 -2.44 0.00 0.00 57.07 56.06 2wvt s TYR 326 Cb 0.01 -3.68 -0.01 0.00 0.35 0.00 0.00 41.96 38.63 2wvt s TYR 326 CO 0.16 -2.15 -0.05 0.08 -1.34 0.00 0.00 175.55 172.25 2wvt s VAL 327 N 0.03 3.31 0.36 3.14 1.01 -1.26 -1.92 120.40 125.08 2wvt s VAL 327 Ca 0.57 -0.51 -0.27 0.00 0.00 0.00 0.00 61.98 61.76 2wvt s VAL 327 Cb -0.38 -2.50 -0.10 0.00 0.00 0.00 0.00 36.38 33.40 2wvt s VAL 327 CO 0.40 0.43 1.29 -0.54 0.00 0.00 0.00 175.10 176.69 2wvt s LYS 328 N 1.40 4.20 0.72 2.72 1.02 -0.47 -4.99 119.74 124.34 2wvt s LYS 328 Ca 0.05 2.17 -0.11 0.00 0.02 0.00 0.00 55.97 58.09 2wvt s LYS 328 Cb -0.14 -2.93 0.02 0.00 -0.52 0.00 0.00 37.83 34.26 2wvt s LYS 328 CO -0.03 -0.30 1.09 0.95 -0.92 0.00 0.00 175.35 176.14 2wvt s THR 329 N -1.20 3.47 0.26 2.17 -4.23 -1.26 -4.91 115.64 109.94 2wvt s THR 329 Ca 0.52 0.48 -0.03 0.00 -1.18 0.00 0.00 61.69 61.48 2wvt s THR 329 Cb -0.38 -3.42 0.25 0.00 1.34 0.00 0.00 72.50 70.29 2wvt s THR 329 CO 0.50 -0.62 1.86 -0.65 -0.54 0.00 0.00 174.62 175.17 2wvt h PRO 330 N -0.73 1.04 -0.42 3.99 0.11 -1.96 -1.61 132.00 132.43 2wvt h PRO 330 Ca -0.45 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 65.49 2wvt h PRO 330 Cb 1.25 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 2wvt h PRO 330 CO 0.63 0.69 -0.18 0.82 -0.21 0.00 0.00 178.00 179.75 2wvt h ILE 331 N 1.07 1.27 -0.51 4.15 2.04 -1.98 0.85 117.51 124.40 2wvt h ILE 331 Ca 0.41 -1.27 -0.03 0.00 1.00 0.00 0.00 64.86 64.97 2wvt h ILE 331 Cb 0.20 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 2wvt h ILE 331 CO -0.18 0.43 0.19 -0.33 0.00 0.00 0.00 178.15 178.26 2wvt h GLU 332 N 0.71 0.73 -0.10 2.37 5.08 -1.80 0.68 114.58 122.25 2wvt h GLU 332 Ca 0.11 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 2wvt h GLU 332 Cb 0.68 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2wvt h GLU 332 CO 0.05 0.61 -0.20 0.28 -1.00 0.00 0.00 179.01 178.75 2wvt h VAL 333 N 0.73 1.39 -0.99 3.13 2.07 -0.85 -3.00 116.25 118.72 2wvt h VAL 333 Ca 0.17 -1.49 0.04 0.00 0.82 0.00 0.00 66.70 66.24 2wvt h VAL 333 Cb 0.16 2.10 -0.06 0.00 -1.52 0.00 0.00 31.29 31.97 2wvt h VAL 333 CO -0.02 0.43 0.65 0.40 0.02 0.00 0.00 177.57 179.05 2wvt h ILE 334 N -0.12 1.18 -0.40 4.57 2.04 -0.54 -1.22 117.51 123.02 2wvt h ILE 334 Ca 0.00 -0.43 0.07 0.00 1.00 0.00 0.00 64.86 65.51 2wvt h ILE 334 Cb 0.79 -0.20 -0.07 0.00 -0.74 0.00 0.00 36.82 36.61 2wvt h ILE 334 CO 0.05 0.23 -0.01 -0.78 0.00 0.00 0.00 178.15 177.64 2wvt h ASP 335 N 1.26 -0.18 -0.69 1.72 3.58 -0.89 -0.30 116.42 120.93 2wvt h ASP 335 Ca 0.39 0.10 -0.05 0.00 0.42 0.00 0.00 57.03 57.89 2wvt h ASP 335 Cb -0.01 0.17 -0.03 0.00 1.72 0.00 0.00 39.33 41.18 2wvt h ASP 335 CO -0.12 -0.05 0.23 0.03 -2.88 0.00 0.00 179.24 176.44 2wvt h ARG 336 N 0.10 1.08 -0.18 0.28 3.08 -1.26 -0.31 114.38 117.18 2wvt h ARG 336 Ca 0.20 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 2wvt h ARG 336 Cb 0.28 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 2wvt h ARG 336 CO -0.34 0.92 0.11 0.82 -1.07 0.00 0.00 179.97 180.42 2wvt h ILE 337 N 1.05 1.07 -0.39 2.04 2.04 -0.58 -2.03 117.51 120.71 2wvt h ILE 337 Ca 0.23 -0.18 -0.09 0.00 1.00 0.00 0.00 64.86 65.82 2wvt h ILE 337 Cb 0.29 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 2wvt h ILE 337 CO -0.01 0.07 -0.13 0.58 0.00 0.00 0.00 178.15 178.66 2wvt h VAL 338 N 0.22 1.25 -0.27 1.67 2.07 -0.83 -2.42 116.25 117.94 2wvt h VAL 338 Ca 0.06 -1.16 0.01 0.00 0.82 0.00 0.00 66.70 66.43 2wvt h VAL 338 Cb 0.02 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 2wvt h VAL 338 CO -0.01 0.39 0.17 -0.74 0.02 0.00 0.00 177.57 177.40 2wvt h HIS 339 N 0.63 0.32 0.13 1.57 6.17 -0.88 0.62 115.15 123.71 2wvt h HIS 339 Ca 0.11 0.01 0.02 0.00 0.71 0.00 0.00 60.37 61.21 2wvt h HIS 339 Cb 0.58 -0.10 -0.03 0.00 2.52 0.00 0.00 27.41 30.38 2wvt h HIS 339 CO 0.03 0.19 -0.24 0.00 0.71 0.00 0.00 177.93 178.62 2wvt h ALA 340 N 1.11 -0.41 -0.50 5.26 0.00 -1.07 -2.20 119.26 121.44 2wvt h ALA 340 Ca 0.10 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2wvt h ALA 340 Cb -0.02 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2wvt h ALA 340 CO -0.04 -0.78 0.21 0.28 0.00 0.00 0.00 179.25 178.93 2wvt h VAL 341 N -0.45 1.18 0.00 0.00 2.07 -1.14 0.25 116.25 118.16 2wvt h VAL 341 Ca 0.03 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 2wvt h VAL 341 Cb 0.47 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 30.81 2wvt h VAL 341 CO -0.13 0.22 -0.04 0.77 0.02 0.00 0.00 177.57 178.41 2wvt h SER 342 N 0.71 0.00 -0.32 0.57 4.64 -0.39 -1.05 113.55 117.71 2wvt h SER 342 Ca 0.17 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.37 2wvt h SER 342 Cb 0.12 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.14 2wvt h SER 342 CO -0.02 0.04 -0.04 0.23 -0.87 0.00 0.00 176.83 176.17 2wvt n MET 343 N -3.45 2.12 -1.54 4.77 2.81 -0.65 -4.08 117.12 117.11 2wvt n MET 343 Ca -0.02 -3.06 -0.02 0.00 -1.81 0.00 0.00 57.70 52.78 2wvt n MET 343 Cb 0.16 -1.82 -0.01 0.00 -0.71 0.00 0.00 33.22 30.85 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 -0.97 0.42 3.42 3.03 0.00 -0.40 -4.20 105.19 106.49 2wvt n GLY 344 Ca 0.30 -0.89 -0.22 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.94 1.69 0.41 -0.02 0.00 0.79 -4.27 107.32 102.98 2wvt s GLY 345 Ca 0.00 -1.77 -0.06 0.00 0.00 0.00 0.00 44.72 42.89 2wvt s GLY 345 CO 0.00 -1.86 0.71 -1.31 0.00 0.00 0.00 173.10 170.65 2wvt s ASN 346 N -3.36 6.36 -0.04 1.64 -0.87 -0.40 -2.52 114.94 115.76 2wvt s ASN 346 Ca 0.26 0.88 0.04 0.00 -1.57 0.00 0.00 52.86 52.47 2wvt s ASN 346 Cb -0.04 -2.22 -0.00 0.00 -0.02 0.00 0.00 41.25 38.97 2wvt s ASN 346 CO 0.11 -0.44 -0.14 -0.32 -2.57 0.00 0.00 177.10 173.74 2wvt s MET 347 N -4.27 1.48 -0.16 -0.60 -2.45 -0.41 -0.49 119.30 112.38 2wvt s MET 347 Ca 0.47 -0.50 0.01 0.00 -1.25 0.00 0.00 55.69 54.41 2wvt s MET 347 Cb -0.10 -1.32 0.01 0.00 1.25 0.00 0.00 34.83 34.67 2wvt s MET 347 CO 0.38 0.21 -0.18 0.08 1.05 0.00 0.00 175.02 176.56 2wvt s VAL 348 N 0.07 2.36 -0.22 10.11 1.01 -0.37 -1.23 120.40 132.14 2wvt s VAL 348 Ca -0.03 -0.86 -0.11 0.00 0.00 0.00 0.00 61.98 60.98 2wvt s VAL 348 Cb -0.10 -1.99 -0.05 0.00 0.00 0.00 0.00 36.38 34.24 2wvt s VAL 348 CO 0.01 0.52 0.20 -0.69 0.00 0.00 0.00 175.10 175.15 2wvt s VAL 349 N 1.02 5.34 0.22 2.92 1.01 -0.51 -1.59 120.40 128.82 2wvt s VAL 349 Ca -0.02 0.29 -0.27 0.00 0.00 0.00 0.00 61.98 61.99 2wvt s VAL 349 Cb -0.15 -3.54 -0.09 0.00 0.00 0.00 0.00 36.38 32.61 2wvt s VAL 349 CO -0.05 0.36 0.87 0.21 0.00 0.00 0.00 175.10 176.48 2wvt s ASN 350 N 0.84 7.47 -0.02 3.32 2.47 -0.56 -0.76 114.94 127.69 2wvt s ASN 350 Ca 0.10 1.79 0.05 0.00 0.42 0.00 0.00 52.86 55.22 2wvt s ASN 350 Cb -0.13 -2.55 -0.01 0.00 -1.45 0.00 0.00 41.25 37.11 2wvt s ASN 350 CO 0.03 0.14 -0.19 -0.36 -3.72 0.00 0.00 177.10 173.01 2wvt s PHE 351 N -1.26 1.72 -0.51 0.43 0.08 0.34 -4.48 117.98 114.32 2wvt s PHE 351 Ca 0.41 -0.38 0.04 0.00 0.12 0.00 0.00 56.93 57.11 2wvt s PHE 351 Cb -0.23 -1.12 0.13 0.00 -0.57 0.00 0.00 43.02 41.23 2wvt s PHE 351 CO 0.28 -0.07 0.25 0.20 -0.10 0.00 0.00 175.22 175.78 2wvt s GLY 352 N -0.30 2.33 0.70 4.36 0.00 -1.24 -1.56 107.32 111.60 2wvt s GLY 352 Ca 0.04 -3.17 -0.17 0.00 0.00 0.00 0.00 44.72 41.43 2wvt s GLY 352 CO 0.00 1.09 1.26 -4.14 0.00 0.00 0.00 173.10 171.31 2wvt s PRO 353 N -0.18 2.27 0.78 2.90 0.02 -1.25 -3.98 135.00 135.55 2wvt s PRO 353 Ca 0.17 1.96 -0.11 0.00 0.02 0.00 0.00 61.00 63.04 2wvt s PRO 353 Cb -0.26 -1.82 0.06 0.00 0.02 0.00 0.00 34.50 32.50 2wvt s PRO 353 CO -0.00 -1.79 1.11 -0.65 -0.33 0.00 0.00 177.00 175.34 2wvt s GLN 354 N -3.62 2.09 0.59 5.54 -0.21 -0.43 -4.43 119.66 119.19 2wvt s GLN 354 Ca 0.80 1.31 0.29 0.00 0.02 0.00 0.00 55.36 57.78 2wvt s GLN 354 Cb -0.35 -1.87 1.57 0.00 1.00 0.00 0.00 33.01 33.37 2wvt s GLN 354 CO 0.43 -1.79 2.00 0.00 -2.12 0.00 0.00 175.29 173.81 2wvt h ALA 355 N -1.05 1.96 -0.01 6.09 0.00 -1.87 -2.26 119.26 122.12 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 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2wvt h ALA 355 CO 0.50 -0.49 -0.05 -0.40 0.00 0.00 0.00 179.25 178.81 2wvt n ASP 356 N -3.73 0.82 0.00 0.00 5.68 -1.26 -4.13 116.55 113.92 2wvt n ASP 356 Ca 0.04 -1.09 0.00 0.00 -0.50 0.00 0.00 54.79 53.24 2wvt n ASP 356 Cb 0.48 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 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 1.17 0.73 3.85 6.12 0.00 -0.85 -0.57 105.19 115.64 2wvt n GLY 357 Ca 0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.80 5.04 -0.09 1.61 2.15 -1.26 -3.93 116.67 117.38 2wvt s ASP 358 Ca 0.00 -0.70 -0.04 0.00 0.43 0.00 0.00 52.55 52.23 2wvt s ASP 358 Cb 0.00 -0.68 -0.04 0.00 -0.30 0.00 0.00 42.92 41.90 2wvt s ASP 358 CO 0.00 -0.54 0.08 -0.36 -0.17 0.00 0.00 175.17 174.18 2wvt s PHE 359 N -2.43 3.39 0.76 -5.34 0.08 -1.26 -1.32 117.98 111.86 2wvt s PHE 359 Ca 0.45 0.36 -0.14 0.00 0.12 0.00 0.00 56.93 57.71 2wvt s PHE 359 Cb -0.03 -1.85 0.06 0.00 -0.57 0.00 0.00 43.02 40.62 2wvt s PHE 359 CO 0.27 0.61 1.19 -0.98 -0.10 0.00 0.00 175.22 176.21 2wvt s ARG 360 N -1.06 1.96 0.28 0.44 1.70 -1.26 -4.74 118.95 116.28 2wvt s ARG 360 Ca 0.15 1.70 0.01 0.00 -0.47 0.00 0.00 55.73 57.13 2wvt s ARG 360 Cb -0.12 -1.82 0.56 0.00 -0.57 0.00 0.00 34.95 33.01 2wvt s ARG 360 CO 0.05 -1.96 1.83 -1.35 -1.08 0.00 0.00 175.30 172.79 2wvt h PRO 361 N -0.59 0.93 -0.63 3.89 0.11 -1.99 -1.75 132.00 131.97 2wvt h PRO 361 Ca -0.47 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.56 2wvt h PRO 361 Cb 1.29 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 2wvt h PRO 361 CO 0.48 0.62 0.30 0.93 -0.21 0.00 0.00 178.00 180.12 2wvt h GLU 362 N 0.96 0.89 -0.06 1.05 3.07 -2.00 -0.87 114.58 117.62 2wvt h GLU 362 Ca 0.50 -0.11 -0.24 0.00 -0.50 0.00 0.00 59.36 59.01 2wvt h GLU 362 Cb 0.53 -0.17 0.01 0.00 -0.84 0.00 0.00 28.75 28.28 2wvt h GLU 362 CO -0.28 0.69 -0.92 0.93 -1.40 0.00 0.00 179.01 178.03 2wvt h GLU 363 N 0.89 0.67 -0.41 2.33 5.08 -1.70 -1.86 114.58 119.58 2wvt h GLU 363 Ca 0.22 -0.65 0.03 0.00 -1.00 0.00 0.00 59.36 57.96 2wvt h GLU 363 Cb 0.09 0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 2wvt h GLU 363 CO -0.03 1.25 0.22 0.87 -1.00 0.00 0.00 179.01 180.31 2wvt h LYS 364 N 0.41 0.42 -0.87 2.33 1.57 -1.05 -0.74 116.57 118.65 2wvt h LYS 364 Ca -0.09 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 2wvt h LYS 364 Cb 1.55 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 33.73 2wvt h LYS 364 CO 0.18 0.28 0.50 0.00 -0.57 0.00 0.00 179.45 179.84 2wvt h ALA 365 N 1.21 1.11 -0.01 3.86 0.00 -1.13 -2.22 119.26 122.08 2wvt h ALA 365 Ca 0.17 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2wvt h ALA 365 Cb 0.06 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 2wvt h ALA 365 CO -0.11 0.59 0.00 1.98 0.00 0.00 0.00 179.25 181.72 2wvt h MET 366 N 1.20 0.01 -0.69 0.00 1.85 -1.03 -0.38 114.93 115.90 2wvt h MET 366 Ca 0.31 -0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.40 2wvt h MET 366 Cb -0.01 -0.00 -0.03 0.00 0.43 0.00 0.00 31.60 31.98 2wvt h MET 366 CO -0.05 0.14 0.44 0.00 -0.40 0.00 0.00 176.91 177.04 2wvt h ALA 367 N 0.87 0.87 -0.34 0.39 0.00 -1.00 -0.36 119.26 119.69 2wvt h ALA 367 Ca 0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2wvt h ALA 367 Cb 0.14 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2wvt h ALA 367 CO -0.00 0.32 0.11 1.15 0.00 0.00 0.00 179.25 180.84 2wvt h THR 368 N 0.93 1.20 -0.44 0.00 2.02 -1.24 -1.26 112.91 114.12 2wvt h THR 368 Ca 0.25 -0.64 -0.08 0.00 0.77 0.00 0.00 66.41 66.71 2wvt h THR 368 Cb -0.07 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 2wvt h THR 368 CO -0.05 0.22 -0.04 0.00 0.37 0.00 0.00 175.52 176.02 2wvt h ALA 369 N 0.95 0.59 -0.51 6.16 0.00 -0.72 -1.93 119.26 123.81 2wvt h ALA 369 Ca 0.11 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2wvt h ALA 369 Cb 0.23 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2wvt h ALA 369 CO -0.01 0.42 0.27 0.82 0.00 0.00 0.00 179.25 180.76 2wvt h ILE 370 N 0.63 1.18 -0.83 0.00 2.04 -1.02 -2.35 117.51 117.17 2wvt h ILE 370 Ca 0.12 -0.46 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 2wvt h ILE 370 Cb 0.55 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 37.14 2wvt h ILE 370 CO 0.03 0.19 0.39 1.23 0.00 0.00 0.00 178.15 179.99 2wvt h GLY 371 N 0.68 1.28 0.77 5.37 0.00 -0.98 0.65 103.07 110.83 2wvt h GLY 371 Ca 0.18 -0.65 0.02 0.00 0.00 0.00 0.00 47.33 46.88 2wvt h GLY 371 CO -0.03 0.61 -0.10 1.70 0.00 0.00 0.00 176.54 178.73 2wvt h LYS 372 N 1.18 -0.17 -0.23 4.80 3.64 -1.17 0.28 116.57 124.91 2wvt h LYS 372 Ca 0.28 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.67 2wvt h LYS 372 Cb 0.13 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2wvt h LYS 372 CO -0.03 -0.11 0.13 2.35 -2.27 0.00 0.00 179.45 179.52 2wvt h TRP 373 N -0.17 0.30 -0.29 1.91 7.01 -1.28 -2.73 115.95 120.70 2wvt h TRP 373 Ca 0.03 -0.00 -0.03 0.00 2.11 0.00 0.00 58.89 61.00 2wvt h TRP 373 Cb 0.21 -0.10 -0.02 0.00 -2.10 0.00 0.00 29.16 27.16 2wvt h TRP 373 CO -0.16 0.26 0.05 0.52 -2.79 0.00 0.00 178.44 176.32 2wvt h MET 374 N 0.27 0.42 -0.71 2.65 2.86 -0.48 0.15 114.93 120.09 2wvt h MET 374 Ca 0.08 -0.07 0.04 0.00 -2.06 0.00 0.00 59.70 57.70 2wvt h MET 374 Cb 0.05 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.58 2wvt h MET 374 CO -0.01 0.41 0.43 -0.97 1.06 0.00 0.00 176.91 177.83 2wvt h ASN 375 N 0.42 0.69 0.00 1.22 -1.24 -0.19 0.76 115.58 117.24 2wvt h ASN 375 Ca 0.10 0.01 -0.06 0.00 0.71 0.00 0.00 56.30 57.06 2wvt h ASN 375 Cb 0.20 -0.13 0.01 0.00 0.73 0.00 0.00 38.32 39.12 2wvt h ASN 375 CO -0.00 0.46 -0.25 0.03 -1.29 0.00 0.00 177.43 176.38 2wvt h ARG 376 N 0.82 0.16 -0.11 6.67 3.08 -0.96 -3.41 114.38 120.63 2wvt h ARG 376 Ca 0.30 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.17 2wvt h ARG 376 Cb 0.09 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2wvt h ARG 376 CO -0.14 0.93 0.00 0.66 -1.07 0.00 0.00 179.97 180.36 2wvt n TYR 377 N -4.50 0.15 0.28 3.04 4.01 0.43 -4.76 117.16 115.80 2wvt n TYR 377 Ca -0.10 -0.40 0.18 0.00 -0.16 0.00 0.00 57.90 57.42 2wvt n TYR 377 Cb 0.51 -0.03 0.95 0.00 -0.31 0.00 0.00 39.34 40.46 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 0.82 0.00 0.74 2.72 0.00 -1.02 -1.95 103.07 104.39 2wvt h GLY 378 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 47.33 47.50 2wvt h GLY 378 CO 0.00 0.00 0.47 1.70 0.00 0.00 0.00 176.54 178.71 2wvt h LYS 379 N 0.00 0.00 -0.23 4.80 3.64 -1.86 -0.01 116.57 122.91 2wvt h LYS 379 Ca 0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2wvt h LYS 379 Cb 0.23 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 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 -2.55 2.49 0.05 5.00 0.00 -0.73 -4.49 120.51 120.27 2wvt n ALA 380 Ca 0.11 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.90 2wvt n ALA 380 Cb 0.70 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 19.12 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 0.65 1.13 -1.95 0.00 0.31 -0.15 -4.78 118.33 113.54 2wvt n VAL 381 Ca 0.17 0.37 -0.41 0.00 -0.01 0.00 0.00 64.34 64.46 2wvt n VAL 381 Cb 0.40 -1.53 -0.02 0.00 -0.91 0.00 0.00 33.84 31.78 2wvt n VAL 381 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 2wvt s TYR 382 N -1.91 2.93 -1.95 3.52 2.02 -0.45 -2.17 117.35 119.34 2wvt s TYR 382 Ca 0.00 1.03 0.00 0.00 -0.37 0.00 0.00 57.07 57.73 2wvt s TYR 382 Cb 0.00 -3.88 0.00 0.00 -0.40 0.00 0.00 41.96 37.68 2wvt s TYR 382 CO 0.00 -2.81 0.00 0.00 -1.57 0.00 0.00 175.55 171.17 2wvt n ALA 383 N 1.98 -0.38 -2.23 3.71 0.00 -0.58 -4.84 120.51 118.18 2wvt n ALA 383 Ca 0.06 0.27 -0.21 0.00 0.00 0.00 0.00 53.44 53.56 2wvt n ALA 383 Cb 0.40 -1.95 -0.03 0.00 0.00 0.00 0.00 19.45 17.87 2wvt n ALA 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wvt n ASP 385 N -1.57 -1.81 -4.74 0.00 -0.08 -0.60 -4.92 116.55 102.83 2wvt n ASP 385 Ca 0.04 -2.46 -0.42 0.00 -1.51 0.00 0.00 54.79 50.44 2wvt n ASP 385 Cb 0.62 3.08 -0.02 0.00 2.34 0.00 0.00 41.12 47.13 2wvt n ASP 385 CO 0.00 0.00 0.00 -0.47 0.12 0.00 0.00 177.20 176.85 2wvt s TYR 386 N -3.09 2.97 -1.04 -0.67 5.04 -1.24 -0.73 117.35 118.61 2wvt s TYR 386 Ca 0.17 0.90 0.23 0.00 -2.44 0.00 0.00 57.07 55.93 2wvt s TYR 386 Cb -0.03 -3.89 0.20 0.00 0.35 0.00 0.00 41.96 38.59 2wvt s TYR 386 CO 0.12 -2.99 1.20 0.00 -1.34 0.00 0.00 175.55 172.55 2wvt n ALA 387 N 2.61 4.03 -1.10 3.97 0.00 -1.26 -4.64 120.51 124.12 2wvt n ALA 387 Ca 0.08 -0.46 -0.03 0.00 0.00 0.00 0.00 53.44 53.03 2wvt n ALA 387 Cb 0.39 -0.97 -0.01 0.00 0.00 0.00 0.00 19.45 18.86 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 1.49 0.60 3.84 0.00 0.00 -1.26 -4.98 105.19 104.87 2wvt n GLY 388 Ca 0.05 -0.29 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.91 3.38 0.30 1.61 0.40 -1.26 -4.75 117.98 115.74 2wvt s PHE 389 Ca 0.00 0.22 -0.30 0.00 -0.60 0.00 0.00 56.93 56.26 2wvt s PHE 389 Cb 0.00 -1.74 -0.11 0.00 0.51 0.00 0.00 43.02 41.68 2wvt s PHE 389 CO 0.00 0.58 1.53 -1.21 0.70 0.00 0.00 175.22 176.82 2wvt s GLU 390 N -2.08 4.16 0.35 0.44 2.02 -1.26 -4.95 118.70 117.38 2wvt s GLU 390 Ca 0.28 2.50 -0.29 0.00 0.02 0.00 0.00 54.97 57.49 2wvt s GLU 390 Cb -0.12 -3.03 -0.11 0.00 0.10 0.00 0.00 34.13 30.96 2wvt s GLU 390 CO 0.20 -0.55 1.51 1.17 0.02 0.00 0.00 175.26 177.60 2wvt n LYS 391 N 1.87 2.65 -4.46 1.61 3.00 -1.26 -4.84 118.16 116.74 2wvt n LYS 391 Ca 0.06 0.93 -0.23 0.00 -0.00 0.00 0.00 58.31 59.07 2wvt n LYS 391 Cb 0.38 -2.67 -0.10 0.00 0.00 0.00 0.00 35.03 32.64 2wvt n LYS 391 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 2wvt s GLN 392 N -1.60 1.63 0.51 1.64 -1.52 -1.26 -5.06 119.66 113.99 2wvt s GLN 392 Ca 0.57 -1.77 0.27 0.00 -1.95 0.00 0.00 55.36 52.47 2wvt s GLN 392 Cb -0.49 -1.57 1.39 0.00 -0.22 0.00 0.00 33.01 32.12 2wvt s GLN 392 CO 0.59 0.24 2.05 -0.44 -0.25 0.00 0.00 175.29 177.47 2wvt h ASP 393 N 2.28 0.00 1.23 5.90 3.32 -1.96 -3.16 116.42 124.03 2wvt h ASP 393 Ca -0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.65 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 0.63 0.13 0.00 -2.67 -1.72 0.00 0.00 179.24 175.61 2wvt n TRP 394 N -3.64 0.71 0.00 4.55 4.27 -1.26 -4.69 117.44 117.38 2wvt n TRP 394 Ca -0.02 0.22 0.00 0.00 -3.89 0.00 0.00 57.50 53.81 2wvt n TRP 394 Cb 0.26 -0.86 0.00 0.00 -1.36 0.00 0.00 31.31 29.35 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 1.07 -0.06 3.18 -1.67 0.00 -1.19 -0.53 105.19 105.98 2wvt n GLY 395 Ca 0.05 -0.68 -0.22 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.36 1.41 0.06 1.61 2.02 -0.40 -4.34 117.35 115.35 2wvt s TYR 396 Ca 0.00 -0.36 -0.15 0.00 -0.37 0.00 0.00 57.07 56.19 2wvt s TYR 396 Cb 0.00 -0.84 -0.06 0.00 -0.40 0.00 0.00 41.96 40.66 2wvt s TYR 396 CO 0.00 0.06 0.48 0.71 -1.57 0.00 0.00 175.55 175.22 2wvt s TYR 397 N -0.85 3.70 0.19 2.71 2.02 -1.26 -0.57 117.35 123.28 2wvt s TYR 397 Ca 0.03 1.05 0.07 0.00 -0.37 0.00 0.00 57.07 57.85 2wvt s TYR 397 Cb -0.08 -2.34 -0.05 0.00 -0.40 0.00 0.00 41.96 39.09 2wvt s TYR 397 CO 0.01 0.56 -0.13 0.95 -1.57 0.00 0.00 175.55 175.38 2wvt s THR 398 N -1.22 1.57 -0.14 -0.71 -4.23 -0.54 -4.44 115.64 105.92 2wvt s THR 398 Ca 0.29 -2.15 0.02 0.00 -1.18 0.00 0.00 61.69 58.67 2wvt s THR 398 Cb -0.17 -1.97 0.01 0.00 1.34 0.00 0.00 72.50 71.72 2wvt s THR 398 CO 0.17 -0.63 -0.20 -0.60 -0.54 0.00 0.00 174.62 172.82 2wvt s ARG 399 N -3.63 2.85 1.07 3.99 3.52 0.09 -0.33 118.95 126.52 2wvt s ARG 399 Ca 0.20 -0.79 -0.17 0.00 -0.13 0.00 0.00 55.73 54.84 2wvt s ARG 399 Cb -0.00 -2.36 0.24 0.00 -1.56 0.00 0.00 34.95 31.27 2wvt s ARG 399 CO 0.05 -0.08 1.22 0.20 -0.81 0.00 0.00 175.30 175.88 2wvt s GLY 400 N 0.99 1.68 0.39 8.12 0.00 -0.47 -1.56 107.32 116.49 2wvt s GLY 400 Ca -0.03 -1.07 0.20 0.00 0.00 0.00 0.00 44.72 43.82 2wvt s GLY 400 CO -0.05 -0.25 1.74 0.50 0.00 0.00 0.00 173.10 175.04 2wvt h LYS 401 N -2.08 0.00 -1.40 2.90 1.57 -1.90 -3.18 116.57 112.48 2wvt h LYS 401 Ca -0.45 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 57.66 2wvt h LYS 401 Cb 1.26 0.00 -0.34 0.00 0.08 0.00 0.00 32.23 33.24 2wvt h LYS 401 CO 0.37 0.33 0.31 0.09 -0.57 0.00 0.00 179.45 179.98 2wvt n ASN 402 N -3.46 6.54 -1.71 0.86 5.03 -1.26 -4.90 115.26 116.35 2wvt n ASN 402 Ca 0.00 -3.79 -0.12 0.00 0.87 0.00 0.00 54.58 51.54 2wvt n ASN 402 Cb 0.50 -0.79 -0.04 0.00 -1.02 0.00 0.00 39.78 38.43 2wvt n ASN 402 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 2wvt n ASP 403 N -0.66 -3.49 -4.75 6.41 8.00 -1.20 -4.97 116.55 115.89 2wvt n ASP 403 Ca 0.52 0.27 -0.37 0.00 0.71 0.00 0.00 54.79 55.91 2wvt n ASP 403 Cb 0.57 -3.17 0.03 0.00 -0.02 0.00 0.00 41.12 38.53 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 -3.68 3.16 -0.16 -1.24 8.01 -1.26 -4.58 118.70 118.93 2wvt s GLU 404 Ca 0.00 2.03 0.00 0.00 0.01 0.00 0.00 54.97 57.02 2wvt s GLU 404 Cb 0.00 -2.17 0.03 0.00 -4.31 0.00 0.00 34.13 27.68 2wvt s GLU 404 CO 0.00 -1.12 -0.13 0.08 0.01 0.00 0.00 175.26 174.11 2wvt s VAL 405 N -1.42 1.58 -0.17 2.63 1.01 -0.93 -1.36 120.40 121.74 2wvt s VAL 405 Ca 0.73 -0.74 -0.07 0.00 0.00 0.00 0.00 61.98 61.90 2wvt s VAL 405 Cb -0.36 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 2wvt s VAL 405 CO 0.41 0.37 0.07 -0.31 0.00 0.00 0.00 175.10 175.64 2wvt s TYR 406 N 1.46 3.29 -0.32 5.22 2.02 0.55 0.22 117.35 129.79 2wvt s TYR 406 Ca 0.03 0.15 -0.17 0.00 -0.37 0.00 0.00 57.07 56.70 2wvt s TYR 406 Cb -0.14 -2.05 -0.01 0.00 -0.40 0.00 0.00 41.96 39.36 2wvt s TYR 406 CO -0.10 0.25 0.49 -1.64 -1.57 0.00 0.00 175.55 172.98 2wvt s MET 407 N 0.12 3.75 -0.39 -0.62 -1.94 0.60 -1.47 119.30 119.35 2wvt s MET 407 Ca 0.05 -0.06 -0.11 0.00 -1.71 0.00 0.00 55.69 53.86 2wvt s MET 407 Cb -0.12 -3.76 0.03 0.00 2.01 0.00 0.00 34.83 32.99 2wvt s MET 407 CO 0.00 -0.54 0.23 0.08 -0.01 0.00 0.00 175.02 174.78 2wvt s VAL 408 N 2.32 4.64 -0.36 -6.03 1.01 0.26 -1.41 120.40 120.83 2wvt s VAL 408 Ca 0.18 -0.90 -0.18 0.00 0.00 0.00 0.00 61.98 61.09 2wvt s VAL 408 Cb -0.16 -3.62 -0.00 0.00 0.00 0.00 0.00 36.38 32.60 2wvt s VAL 408 CO 0.12 -0.28 0.48 -0.69 0.00 0.00 0.00 175.10 174.73 2wvt s VAL 409 N 1.56 5.04 -0.03 2.92 1.01 0.36 -1.28 120.40 129.98 2wvt s VAL 409 Ca 0.02 0.19 0.15 0.00 0.00 0.00 0.00 61.98 62.35 2wvt s VAL 409 Cb -0.20 -3.96 -0.24 0.00 0.00 0.00 0.00 36.38 31.99 2wvt s VAL 409 CO 0.07 -0.24 0.31 0.49 0.00 0.00 0.00 175.10 175.73 2wvt n PHE 410 N 5.68 0.00 -3.80 5.22 3.72 0.31 -2.51 117.46 126.08 2wvt n PHE 410 Ca -0.06 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.05 2wvt n PHE 410 Cb 0.49 -0.39 -0.15 0.00 -0.94 0.00 0.00 39.48 38.48 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 -3.89 3.78 -0.22 4.37 0.01 -0.69 -4.92 114.94 113.38 2wvt s ASN 411 Ca -0.06 -1.39 -0.29 0.00 -0.71 0.00 0.00 52.86 50.41 2wvt s ASN 411 Cb 0.09 -0.92 -0.00 0.00 0.41 0.00 0.00 41.25 40.83 2wvt s ASN 411 CO 0.64 -0.35 1.18 -1.58 -1.51 0.00 0.00 177.10 175.48 2wvt s GLN 412 N 1.58 4.18 0.04 -0.60 2.00 -1.26 -4.48 119.66 121.11 2wvt s GLN 412 Ca 0.04 1.44 -0.30 0.00 -2.00 0.00 0.00 55.36 54.54 2wvt s GLN 412 Cb -0.18 -3.74 -0.04 0.00 0.80 0.00 0.00 33.01 29.85 2wvt s GLN 412 CO -0.16 -0.76 1.09 -1.25 -0.50 0.00 0.00 175.29 173.70 2wvt s PRO 413 N 3.52 4.50 0.59 1.67 0.04 -1.26 -4.91 135.00 139.15 2wvt s PRO 413 Ca 0.51 1.60 0.29 0.00 0.04 0.00 0.00 61.00 63.43 2wvt s PRO 413 Cb -0.18 -3.40 1.76 0.00 0.04 0.00 0.00 34.50 32.73 2wvt s PRO 413 CO 0.13 -0.14 2.21 1.88 0.04 0.00 0.00 177.00 181.13 2wvt h TYR 414 N 6.72 0.00 0.00 0.56 0.05 -1.94 -0.96 116.97 121.39 2wvt h TYR 414 Ca -0.41 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.37 2wvt h TYR 414 Cb 1.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.96 2wvt h TYR 414 CO 0.67 0.00 0.00 -1.13 -1.05 0.00 0.00 178.16 176.65 2wvt n SER 415 N -3.86 0.42 -1.14 3.88 3.41 -1.26 -4.83 113.62 110.24 2wvt n SER 415 Ca -0.02 0.68 -0.15 0.00 -0.26 0.00 0.00 58.87 59.12 2wvt n SER 415 Cb 0.15 -0.74 -0.06 0.00 -0.26 0.00 0.00 64.21 63.29 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 -2.05 -1.30 -4.39 4.33 1.02 -0.37 -4.97 120.64 112.92 2wvt n GLU 416 Ca -0.00 1.01 -0.21 0.00 -0.02 0.00 0.00 57.16 57.93 2wvt n GLU 416 Cb 0.05 -5.26 -0.16 0.00 -0.02 0.00 0.00 31.44 26.05 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 -3.21 1.14 -0.35 3.49 0.52 -1.26 -0.84 118.95 118.43 2wvt s ARG 417 Ca 0.00 -0.28 -0.11 0.00 -0.52 0.00 0.00 55.73 54.82 2wvt s ARG 417 Cb 0.00 -1.03 0.01 0.00 0.52 0.00 0.00 34.95 34.46 2wvt s ARG 417 CO 0.00 0.03 0.20 -0.51 0.02 0.00 0.00 175.30 175.04 2wvt s LEU 418 N 0.53 4.54 0.04 2.53 1.43 0.25 -4.76 118.68 123.24 2wvt s LEU 418 Ca -0.09 -0.79 -0.30 0.00 -1.03 0.00 0.00 54.13 51.91 2wvt s LEU 418 Cb -0.12 -2.04 -0.06 0.00 0.03 0.00 0.00 46.19 44.00 2wvt s LEU 418 CO 0.01 -0.32 1.30 -0.63 0.23 0.00 0.00 176.35 176.95 2wvt s ILE 419 N 1.60 3.81 -0.24 -0.59 1.01 -1.26 -0.65 121.20 124.87 2wvt s ILE 419 Ca 0.03 1.25 0.01 0.00 0.00 0.00 0.00 60.65 61.95 2wvt s ILE 419 Cb -0.18 -3.80 0.06 0.00 0.01 0.00 0.00 42.46 38.54 2wvt s ILE 419 CO 0.07 0.05 -0.06 -0.69 0.00 0.00 0.00 174.94 174.32 2wvt s VAL 420 N 1.66 1.61 -0.27 2.92 1.01 0.02 -4.91 120.40 122.44 2wvt s VAL 420 Ca 0.61 -1.30 -0.15 0.00 0.00 0.00 0.00 61.98 61.14 2wvt s VAL 420 Cb -0.31 -1.87 -0.03 0.00 0.00 0.00 0.00 36.38 34.16 2wvt s VAL 420 CO 0.27 -0.11 0.39 -0.75 0.00 0.00 0.00 175.10 174.90 2wvt s LYS 421 N 1.35 4.00 0.24 2.72 2.20 -1.26 -0.28 119.74 128.71 2wvt s LYS 421 Ca -0.06 0.05 -0.07 0.00 -0.36 0.00 0.00 55.97 55.53 2wvt s LYS 421 Cb -0.19 -3.66 -0.06 0.00 -1.51 0.00 0.00 37.83 32.41 2wvt s LYS 421 CO -0.06 -0.30 0.53 0.95 -0.36 0.00 0.00 175.35 176.11 2wvt s THR 422 N 2.10 4.99 0.79 3.43 -4.23 -0.29 -4.32 115.64 118.12 2wvt s THR 422 Ca 0.16 0.27 -0.11 0.00 -1.18 0.00 0.00 61.69 60.82 2wvt s THR 422 Cb -0.16 -3.66 0.07 0.00 1.34 0.00 0.00 72.50 70.09 2wvt s THR 422 CO 0.10 -0.15 1.12 -2.84 -0.54 0.00 0.00 174.62 172.31 2wvt s PRO 423 N -3.05 2.02 -0.42 3.99 0.02 -1.26 -4.86 135.00 131.44 2wvt s PRO 423 Ca 0.45 1.35 -0.41 0.00 0.02 0.00 0.00 61.00 62.42 2wvt s PRO 423 Cb -0.11 -1.86 -0.16 0.00 0.02 0.00 0.00 34.50 32.39 2wvt s PRO 423 CO 0.25 -1.85 2.08 0.36 -0.33 0.00 0.00 177.00 177.51 2wvt n LYS 424 N -3.46 0.52 -0.30 5.54 0.00 -1.26 -2.06 118.16 117.14 2wvt n LYS 424 Ca 0.10 0.15 0.00 0.00 -0.00 0.00 0.00 58.31 58.57 2wvt n LYS 424 Cb 0.52 -1.92 0.00 0.00 -0.00 0.00 0.00 35.03 33.63 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 6.58 0.82 3.31 2.58 0.00 -1.26 -5.03 105.19 112.19 2wvt n GLY 425 Ca 0.45 -0.30 -0.31 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 -2.00 2.05 0.20 -0.61 -1.09 -0.88 -3.44 121.20 115.44 2wvt s ILE 426 Ca 0.00 -1.13 0.10 0.00 -2.23 0.00 0.00 60.65 57.39 2wvt s ILE 426 Cb 0.00 -1.70 -0.05 0.00 -1.58 0.00 0.00 42.46 39.13 2wvt s ILE 426 CO 0.00 0.56 -0.19 0.42 -1.23 0.00 0.00 174.94 174.51 2wvt s THR 427 N -0.62 2.02 -0.24 2.92 -4.23 -0.81 -4.76 115.64 109.93 2wvt s THR 427 Ca 0.10 -2.11 -0.08 0.00 -1.18 0.00 0.00 61.69 58.41 2wvt s THR 427 Cb -0.10 -2.03 -0.04 0.00 1.34 0.00 0.00 72.50 71.67 2wvt s THR 427 CO -0.01 -0.37 0.10 -0.69 -0.54 0.00 0.00 174.62 173.11 2wvt s VAL 428 N -2.32 4.72 -0.17 2.29 1.01 -1.26 -2.68 120.40 121.99 2wvt s VAL 428 Ca 0.21 -0.04 0.10 0.00 0.00 0.00 0.00 61.98 62.26 2wvt s VAL 428 Cb -0.05 -3.20 -0.17 0.00 0.00 0.00 0.00 36.38 32.96 2wvt s VAL 428 CO 0.09 0.35 -0.02 -0.62 0.00 0.00 0.00 175.10 174.89 2wvt n GLU 429 N 4.60 1.13 -3.71 2.72 1.02 0.25 -5.02 120.64 121.62 2wvt n GLU 429 Ca -0.16 0.03 -0.10 0.00 -0.02 0.00 0.00 57.16 56.92 2wvt n GLU 429 Cb 0.52 -1.41 -0.06 0.00 -0.02 0.00 0.00 31.44 30.48 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 -2.39 0.98 0.02 3.49 2.20 -1.25 -4.97 119.74 117.81 2wvt s LYS 430 Ca -0.14 -0.78 0.00 0.00 -0.36 0.00 0.00 55.97 54.70 2wvt s LYS 430 Cb 0.05 0.42 -0.02 0.00 -1.51 0.00 0.00 37.83 36.78 2wvt s LYS 430 CO 0.59 -0.36 -0.03 0.00 -0.36 0.00 0.00 175.35 175.19 2wvt s ALA 431 N -3.74 0.13 -0.14 3.13 0.00 -1.26 -2.90 121.76 116.98 2wvt s ALA 431 Ca 0.03 -0.49 -0.07 0.00 0.00 0.00 0.00 51.96 51.43 2wvt s ALA 431 Cb 0.03 0.11 0.06 0.00 0.00 0.00 0.00 23.12 23.32 2wvt s ALA 431 CO -0.11 -0.12 0.32 0.99 0.00 0.00 0.00 175.76 176.84 2wvt s THR 432 N -1.18 -0.15 -0.29 0.00 2.01 -1.12 -1.45 115.64 113.45 2wvt s THR 432 Ca -0.13 0.15 -0.28 0.00 0.31 0.00 0.00 61.69 61.74 2wvt s THR 432 Cb -0.08 -0.49 -0.02 0.00 0.01 0.00 0.00 72.50 71.91 2wvt s THR 432 CO -0.01 0.06 1.80 -0.22 -0.69 0.00 0.00 174.62 175.56 2wvt s LEU 433 N 1.61 3.58 0.23 4.42 2.96 -0.17 -2.32 118.68 129.00 2wvt s LEU 433 Ca -0.07 1.42 -0.07 0.00 -0.22 0.00 0.00 54.13 55.19 2wvt s LEU 433 Cb -0.10 -3.53 0.40 0.00 0.50 0.00 0.00 46.19 43.46 2wvt s LEU 433 CO -0.10 -1.63 1.69 0.25 -1.32 0.00 0.00 176.35 175.23 2wvt h LEU 434 N 13.34 -0.03 -0.44 -0.68 5.85 -1.74 0.48 115.31 132.09 2wvt h LEU 434 Ca -0.35 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 2wvt h LEU 434 Cb 1.17 0.20 -0.00 0.00 0.37 0.00 0.00 40.66 42.40 2wvt h LEU 434 CO 1.02 -0.04 -0.04 0.71 -0.34 0.00 0.00 178.44 179.75 2wvt h THR 435 N 0.25 0.09 0.00 1.05 1.35 -1.88 -3.33 112.91 110.44 2wvt h THR 435 Ca 0.38 -0.96 0.00 0.00 -0.55 0.00 0.00 66.41 65.28 2wvt h THR 435 Cb 0.63 1.89 0.00 0.00 -1.73 0.00 0.00 68.15 68.94 2wvt h THR 435 CO -0.49 0.04 0.00 0.35 -0.25 0.00 0.00 175.52 175.17 2wvt n THR 436 N -3.12 0.00 -0.25 6.82 -2.24 -1.00 -5.01 114.28 109.49 2wvt n THR 436 Ca 0.03 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 2wvt n THR 436 Cb 0.48 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.72 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 0.53 1.17 3.76 3.38 0.00 0.16 -4.98 105.19 109.22 2wvt n GLY 437 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.17 3.70 0.41 1.61 -1.05 -1.24 -4.54 118.70 117.43 2wvt s GLU 438 Ca 0.00 2.21 -0.23 0.00 -0.15 0.00 0.00 54.97 56.80 2wvt s GLU 438 Cb 0.00 -2.59 -0.10 0.00 -0.44 0.00 0.00 34.13 31.00 2wvt s GLU 438 CO 0.00 -0.73 0.98 0.34 0.95 0.00 0.00 175.26 176.80 2wvt s ASP 439 N -0.78 6.91 -0.09 0.83 2.15 -1.26 -1.00 116.67 123.43 2wvt s ASP 439 Ca 0.62 1.82 0.01 0.00 0.43 0.00 0.00 52.55 55.44 2wvt s ASP 439 Cb -0.39 -2.56 0.02 0.00 -0.30 0.00 0.00 42.92 39.68 2wvt s ASP 439 CO 0.49 -0.38 -0.13 -0.63 -0.17 0.00 0.00 175.17 174.36 2wvt s ILE 440 N -1.92 1.27 0.17 4.11 -1.09 -0.53 -4.87 121.20 118.34 2wvt s ILE 440 Ca 0.59 -0.51 -0.31 0.00 -2.23 0.00 0.00 60.65 58.20 2wvt s ILE 440 Cb -0.15 -1.18 -0.09 0.00 -1.58 0.00 0.00 42.46 39.46 2wvt s ILE 440 CO 0.19 0.39 1.39 -0.89 -1.23 0.00 0.00 174.94 174.79 2wvt s THR 441 N 1.02 3.11 -0.23 2.92 2.01 -1.26 -4.07 115.64 119.13 2wvt s THR 441 Ca -0.07 0.85 -0.01 0.00 0.31 0.00 0.00 61.69 62.77 2wvt s THR 441 Cb -0.15 -3.54 0.02 0.00 0.01 0.00 0.00 72.50 68.84 2wvt s THR 441 CO -0.01 0.10 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.23 2wvt s VAL 442 N 0.59 2.67 -0.14 3.82 1.01 -1.26 -1.66 120.40 125.43 2wvt s VAL 442 Ca 0.61 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.63 2wvt s VAL 442 Cb -0.38 -2.29 -0.01 0.00 0.00 0.00 0.00 36.38 33.70 2wvt s VAL 442 CO 0.35 0.30 -0.16 -0.69 0.00 0.00 0.00 175.10 174.91 2wvt s VAL 443 N 1.32 2.70 0.24 2.92 1.01 0.05 -4.99 120.40 123.65 2wvt s VAL 443 Ca 0.02 -0.77 -0.30 0.00 0.00 0.00 0.00 61.98 60.93 2wvt s VAL 443 Cb -0.16 -2.13 -0.09 0.00 0.00 0.00 0.00 36.38 34.01 2wvt s VAL 443 CO -0.07 0.52 1.19 -0.70 0.00 0.00 0.00 175.10 176.05 2wvt s GLU 444 N 0.61 4.51 -0.04 2.72 2.12 -1.26 0.21 118.70 127.57 2wvt s GLU 444 Ca -0.09 1.92 0.01 0.00 0.36 0.00 0.00 54.97 57.17 2wvt s GLU 444 Cb -0.16 -3.19 -0.03 0.00 0.26 0.00 0.00 34.13 31.01 2wvt s GLU 444 CO 0.03 -0.02 -0.03 0.25 -0.54 0.00 0.00 175.26 174.96 2wvt n THR 445 N 1.82 0.23 -3.31 -1.70 -2.24 -0.62 -4.85 114.28 103.62 2wvt n THR 445 Ca 0.02 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2wvt n THR 445 Cb 0.44 -0.70 0.00 0.00 -2.10 0.00 0.00 70.33 67.97 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 -2.51 0.00 -1.97 4.28 5.66 -1.18 -5.04 114.28 113.52 2wvt n THR 446 Ca -0.07 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.51 2wvt n THR 446 Cb 0.58 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.33 2wvt n THR 446 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 2wvt s ARG 447 N -1.97 4.21 -1.72 1.09 3.52 -1.26 -2.68 118.95 120.14 2wvt s ARG 447 Ca 0.00 2.28 0.00 0.00 -0.13 0.00 0.00 55.73 57.88 2wvt s ARG 447 Cb 0.00 -3.58 0.00 0.00 -1.56 0.00 0.00 34.95 29.81 2wvt s ARG 447 CO 0.00 -0.71 0.00 0.09 -0.81 0.00 0.00 175.30 173.87 2wvt n ASN 448 N 5.52 -5.14 -3.85 -2.12 4.13 -1.26 -5.00 115.26 107.54 2wvt n ASN 448 Ca 0.15 0.25 -0.12 0.00 1.68 0.00 0.00 54.58 56.54 2wvt n ASN 448 Cb 0.41 -4.20 -0.14 0.00 -1.54 0.00 0.00 39.78 34.31 2wvt n ASN 448 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 2wvt s GLU 449 N -4.07 0.03 0.14 3.52 2.12 -1.09 -1.14 118.70 118.21 2wvt s GLU 449 Ca 0.00 0.06 0.05 0.00 0.36 0.00 0.00 54.97 55.44 2wvt s GLU 449 Cb 0.00 -0.01 -0.04 0.00 0.26 0.00 0.00 34.13 34.34 2wvt s GLU 449 CO 0.00 -0.02 -0.12 0.71 -0.54 0.00 0.00 175.26 175.29 2wvt s TYR 450 N 0.13 1.31 -0.20 5.30 2.02 0.62 -1.58 117.35 124.94 2wvt s TYR 450 Ca -0.01 -0.67 -0.08 0.00 -0.37 0.00 0.00 57.07 55.95 2wvt s TYR 450 Cb -0.01 -0.67 -0.04 0.00 -0.40 0.00 0.00 41.96 40.84 2wvt s TYR 450 CO -0.00 0.11 0.07 -0.80 -1.57 0.00 0.00 175.55 173.36 2wvt s ASN 451 N -2.85 5.60 -0.21 2.29 0.01 0.13 -0.80 114.94 119.12 2wvt s ASN 451 Ca 0.13 0.04 -0.05 0.00 -0.71 0.00 0.00 52.86 52.28 2wvt s ASN 451 Cb -0.01 -1.97 -0.02 0.00 0.41 0.00 0.00 41.25 39.66 2wvt s ASN 451 CO 0.02 0.14 -0.01 -0.69 -1.51 0.00 0.00 177.10 175.05 2wvt s VAL 452 N 0.60 3.85 0.65 1.60 1.01 0.17 -0.77 120.40 127.50 2wvt s VAL 452 Ca 0.04 -0.35 -0.17 0.00 0.00 0.00 0.00 61.98 61.50 2wvt s VAL 452 Cb -0.13 -2.74 -0.01 0.00 0.00 0.00 0.00 36.38 33.50 2wvt s VAL 452 CO 0.01 0.42 1.19 -0.44 0.00 0.00 0.00 175.10 176.28 2wvt s SER 453 N 1.12 4.89 1.10 3.32 0.01 -0.66 0.88 113.70 124.36 2wvt s SER 453 Ca 0.02 2.30 -0.16 0.00 1.31 0.00 0.00 55.95 59.42 2wvt s SER 453 Cb -0.14 -2.59 0.24 0.00 0.21 0.00 0.00 66.02 63.74 2wvt s SER 453 CO 0.01 -1.79 1.11 0.68 0.41 0.00 0.00 173.24 173.66 2wvt s VAL 454 N -1.86 1.80 0.71 3.43 -7.23 -0.02 -4.74 120.40 112.48 2wvt s VAL 454 Ca 0.74 0.00 -0.08 0.00 -1.81 0.00 0.00 61.98 60.84 2wvt s VAL 454 Cb -0.28 -2.51 0.06 0.00 0.56 0.00 0.00 36.38 34.21 2wvt s VAL 454 CO 0.38 0.00 1.03 -2.84 -0.31 0.00 0.00 175.10 173.36 2wvt s PRO 455 N -5.22 2.24 0.13 4.82 0.02 -1.26 -4.88 135.00 130.86 2wvt s PRO 455 Ca 0.68 -0.16 -0.10 0.00 0.02 0.00 0.00 61.00 61.45 2wvt s PRO 455 Cb -0.14 -2.14 -0.07 0.00 0.02 0.00 0.00 34.50 32.18 2wvt s PRO 455 CO 0.57 -1.24 1.39 0.87 -0.33 0.00 0.00 177.00 178.25 2wvt h LYS 456 N -0.64 0.76 -5.37 5.54 1.79 -1.97 -3.36 116.57 113.32 2wvt h LYS 456 Ca -0.45 -0.54 -0.60 0.00 -2.18 0.00 0.00 60.65 56.88 2wvt h LYS 456 Cb 1.31 0.09 -0.12 0.00 -1.58 0.00 0.00 32.23 31.93 2wvt h LYS 456 CO 0.61 1.16 -0.34 -1.59 -1.08 0.00 0.00 179.45 178.22 2wvt s LYS 457 N -3.94 4.19 -0.11 3.15 0.00 -1.26 -5.04 119.74 116.73 2wvt s LYS 457 Ca -0.10 0.03 -0.32 0.00 0.00 0.00 0.00 55.97 55.59 2wvt s LYS 457 Cb 0.10 -3.48 -0.09 0.00 0.00 0.00 0.00 37.83 34.35 2wvt s LYS 457 CO 0.88 0.12 2.03 -1.71 0.00 0.00 0.00 175.35 176.67 2wvt n ASN 458 N 4.00 3.49 0.27 0.03 2.85 -1.26 -4.83 115.26 119.81 2wvt n ASN 458 Ca -0.12 0.71 0.14 0.00 -0.11 0.00 0.00 54.58 55.20 2wvt n ASN 458 Cb 0.52 -1.45 0.65 0.00 1.24 0.00 0.00 39.78 40.73 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 11.38 0.00 0.00 1.20 0.11 -1.96 -3.45 132.00 139.28 2wvt h PRO 459 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2wvt h PRO 459 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2wvt h PRO 459 CO 0.96 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 179.16 2wvt n GLY 460 N -1.34 0.79 3.83 -0.55 0.00 -1.26 -4.96 105.19 101.71 2wvt n GLY 460 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.11 1.66 0.19 1.61 -1.05 -1.26 -5.12 118.70 114.62 2wvt s GLU 461 Ca 0.00 -0.94 -0.33 0.00 -0.15 0.00 0.00 54.97 53.55 2wvt s GLU 461 Cb 0.00 0.55 -0.14 0.00 -0.44 0.00 0.00 34.13 34.11 2wvt s GLU 461 CO 0.00 -0.76 1.48 -2.30 0.95 0.00 0.00 175.26 174.63 2wvt n PRO 462 N -0.48 2.02 -4.33 -4.83 -0.02 -1.26 -4.92 135.00 121.19 2wvt n PRO 462 Ca -0.05 0.72 -0.18 0.00 -2.02 0.00 0.00 63.50 61.98 2wvt n PRO 462 Cb 0.60 -2.43 -0.09 0.00 -0.02 0.00 0.00 33.50 31.55 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 0.43 1.57 -0.07 6.00 1.13 -1.05 -4.94 117.35 120.42 2wvt s TYR 463 Ca 0.74 -1.33 0.04 0.00 -1.41 0.00 0.00 57.07 55.11 2wvt s TYR 463 Cb -0.68 -0.86 0.00 0.00 -1.10 0.00 0.00 41.96 39.32 2wvt s TYR 463 CO 0.44 -0.48 -0.19 0.08 -2.51 0.00 0.00 175.55 172.89 2wvt s VAL 464 N -3.66 1.60 -0.08 -3.49 1.01 -1.26 -0.49 120.40 114.03 2wvt s VAL 464 Ca 0.36 -0.77 0.05 0.00 0.00 0.00 0.00 61.98 61.62 2wvt s VAL 464 Cb 0.06 -1.39 -0.00 0.00 0.00 0.00 0.00 36.38 35.04 2wvt s VAL 464 CO 0.16 0.46 -0.24 -0.63 0.00 0.00 0.00 175.10 174.85 2wvt s ILE 465 N 0.30 2.05 -0.16 2.22 1.01 -0.50 -2.00 121.20 124.13 2wvt s ILE 465 Ca -0.12 -1.04 -0.05 0.00 0.00 0.00 0.00 60.65 59.45 2wvt s ILE 465 Cb -0.15 -1.76 -0.03 0.00 0.01 0.00 0.00 42.46 40.53 2wvt s ILE 465 CO 0.05 0.56 -0.01 -1.58 0.00 0.00 0.00 174.94 173.96 2wvt s GLN 466 N 0.10 3.73 -0.01 2.79 0.74 -0.98 -0.29 119.66 125.75 2wvt s GLN 466 Ca -0.12 -0.47 0.02 0.00 0.05 0.00 0.00 55.36 54.84 2wvt s GLN 466 Cb -0.16 -2.98 -0.03 0.00 1.10 0.00 0.00 33.01 30.93 2wvt s GLN 466 CO 0.06 0.26 -0.02 -0.51 -0.55 0.00 0.00 175.29 174.54 2wvt s LEU 467 N 0.32 3.40 -0.18 3.68 1.43 0.13 -2.80 118.68 124.66 2wvt s LEU 467 Ca -0.02 -0.04 -0.07 0.00 -1.03 0.00 0.00 54.13 52.97 2wvt s LEU 467 Cb -0.14 -1.93 -0.04 0.00 0.03 0.00 0.00 46.19 44.11 2wvt s LEU 467 CO 0.02 0.29 0.05 -0.75 0.23 0.00 0.00 176.35 176.19 2wvt s LYS 468 N -1.45 3.93 0.35 1.70 2.20 -1.14 -2.20 119.74 123.13 2wvt s LYS 468 Ca 0.18 -0.37 0.06 0.00 -0.36 0.00 0.00 55.97 55.48 2wvt s LYS 468 Cb -0.11 -3.18 -0.07 0.00 -1.51 0.00 0.00 37.83 32.96 2wvt s LYS 468 CO 0.09 0.25 0.02 0.14 -0.36 0.00 0.00 175.35 175.48 2wvt s VAL 469 N 0.41 1.61 -0.12 4.02 -7.23 -1.26 -0.58 120.40 117.25 2wvt s VAL 469 Ca 0.02 -2.03 -0.06 0.00 -1.81 0.00 0.00 61.98 58.10 2wvt s VAL 469 Cb -0.13 -2.81 0.05 0.00 0.56 0.00 0.00 36.38 34.05 2wvt s VAL 469 CO 0.01 -0.06 0.28 -0.60 -0.31 0.00 0.00 175.10 174.42 2wvt s ARG 470 N -3.79 0.25 0.47 4.82 3.52 -1.09 -4.95 118.95 118.18 2wvt s ARG 470 Ca 0.35 0.55 0.05 0.00 -0.13 0.00 0.00 55.73 56.56 2wvt s ARG 470 Cb 0.08 -0.08 0.05 0.00 -1.56 0.00 0.00 34.95 33.45 2wvt s ARG 470 CO 0.16 -0.15 0.45 0.00 -0.81 0.00 0.00 175.30 174.95 2wvt n ALA 471 N 4.09 0.82 0.47 6.12 0.00 -1.26 -1.93 120.51 128.83 2wvt n ALA 471 Ca -0.24 -1.84 0.06 0.00 0.00 0.00 0.00 53.44 51.42 2wvt n ALA 471 Cb 0.54 0.68 0.05 0.00 0.00 0.00 0.00 19.45 20.71 2wvt n ALA 471 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50