#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2isa n LYS 4 N 0.00 1.21 -2.17 1.43 5.02 -1.26 -5.08 118.16 117.31 2isa n LYS 4 Ca 0.00 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.87 2isa n LYS 4 Cb 0.00 -0.65 -0.03 0.00 -0.02 0.00 0.00 35.03 34.33 2isa n LYS 4 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2isa s LYS 5 N -1.29 4.32 0.15 1.97 1.02 -1.26 -4.98 119.74 119.66 2isa s LYS 5 Ca 0.00 2.07 -0.30 0.00 0.02 0.00 0.00 55.97 57.76 2isa s LYS 5 Cb 0.00 -3.29 -0.07 0.00 -0.52 0.00 0.00 37.83 33.96 2isa s LYS 5 CO 0.00 -0.45 1.01 -1.17 -0.92 0.00 0.00 175.35 173.82 2isa s LEU 6 N 1.25 4.51 0.27 3.17 2.96 -1.26 -5.04 118.68 124.54 2isa s LEU 6 Ca 0.65 1.92 0.02 0.00 -0.22 0.00 0.00 54.13 56.50 2isa s LEU 6 Cb -0.36 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 42.68 2isa s LEU 6 CO 0.30 -0.10 0.06 0.42 -1.32 0.00 0.00 176.35 175.71 2isa s THR 7 N -0.19 0.84 0.96 3.68 -4.23 -1.26 -1.81 115.64 113.62 2isa s THR 7 Ca 0.47 -2.01 -0.14 0.00 -1.18 0.00 0.00 61.69 58.84 2isa s THR 7 Cb -0.26 -2.60 0.17 0.00 1.34 0.00 0.00 72.50 71.15 2isa s THR 7 CO 0.32 -0.09 1.16 0.42 -0.54 0.00 0.00 174.62 175.89 2isa s THR 8 N -3.55 1.95 0.54 3.99 -4.23 0.77 -4.79 115.64 110.31 2isa s THR 8 Ca 0.35 0.00 0.37 0.00 -1.18 0.00 0.00 61.69 61.23 2isa s THR 8 Cb 0.08 -2.74 0.39 0.00 1.34 0.00 0.00 72.50 71.57 2isa s THR 8 CO 0.13 0.00 2.25 0.00 -0.54 0.00 0.00 174.62 176.46 2isa h ALA 9 N -1.67 1.16 -0.26 3.99 0.00 -2.01 -1.34 119.26 119.13 2isa h ALA 9 Ca -0.49 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2isa h ALA 9 Cb 1.31 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2isa h ALA 9 CO 0.55 0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.83 2isa n ALA 10 N -2.17 2.48 -0.52 0.00 0.00 -1.26 -4.95 120.51 114.09 2isa n ALA 10 Ca -0.02 -0.72 0.00 0.00 0.00 0.00 0.00 53.44 52.69 2isa n ALA 10 Cb 0.13 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.59 2isa n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2isa n GLY 11 N 1.29 0.74 3.72 0.00 0.00 -0.50 -5.05 105.19 105.38 2isa n GLY 11 Ca 0.17 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 2isa n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2isa n PRO 13 N 3.65 1.97 -3.34 0.00 -0.02 -1.26 -0.16 135.00 135.84 2isa n PRO 13 Ca 0.03 0.70 -0.40 0.00 -2.02 0.00 0.00 63.50 61.81 2isa n PRO 13 Cb 0.51 -2.38 -0.09 0.00 -0.02 0.00 0.00 33.50 31.52 2isa n PRO 13 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2isa s VAL 14 N 0.21 5.12 0.02 -1.45 1.01 -0.75 -4.80 120.40 119.75 2isa s VAL 14 Ca 0.72 0.31 0.07 0.00 0.00 0.00 0.00 61.98 63.08 2isa s VAL 14 Cb -0.68 -3.84 -0.23 0.00 0.00 0.00 0.00 36.38 31.63 2isa s VAL 14 CO 0.47 -0.06 0.91 0.00 0.00 0.00 0.00 175.10 176.42 2isa h ALA 15 N 8.37 0.52 -3.34 5.51 0.00 -1.93 -3.45 119.26 124.93 2isa h ALA 15 Ca -0.30 -1.20 -0.56 0.00 0.00 0.00 0.00 54.91 52.86 2isa h ALA 15 Cb 1.14 0.22 -0.39 0.00 0.00 0.00 0.00 17.79 18.76 2isa h ALA 15 CO 0.71 1.37 -0.77 -1.01 0.00 0.00 0.00 179.25 179.55 2isa s HIS 16 N -2.64 1.57 -0.15 0.00 3.76 -1.26 -4.95 115.29 111.61 2isa s HIS 16 Ca -0.04 -1.32 0.08 0.00 -0.15 0.00 0.00 55.06 53.62 2isa s HIS 16 Cb 0.08 -1.35 0.15 0.00 1.11 0.00 0.00 32.58 32.57 2isa s HIS 16 CO 0.83 -0.72 1.10 -1.71 -0.85 0.00 0.00 174.74 173.38 2isa n ASN 17 N 4.90 2.31 0.00 1.40 5.15 -1.26 -4.72 115.26 123.04 2isa n ASN 17 Ca -0.08 -2.37 0.00 0.00 -0.60 0.00 0.00 54.58 51.53 2isa n ASN 17 Cb 0.45 -0.18 0.00 0.00 -0.53 0.00 0.00 39.78 39.52 2isa n ASN 17 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2isa n GLN 18 N -0.65 3.81 -3.96 1.20 1.13 -1.26 -5.03 117.38 112.62 2isa n GLN 18 Ca 0.07 0.00 -0.22 0.00 -1.94 0.00 0.00 57.00 54.92 2isa n GLN 18 Cb 0.42 -0.98 -0.17 0.00 0.11 0.00 0.00 30.24 29.62 2isa n GLN 18 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 2isa s ASN 19 N -2.94 1.28 0.78 1.08 0.01 -1.26 -5.15 114.94 108.74 2isa s ASN 19 Ca 0.00 -0.11 -0.11 0.00 -0.71 0.00 0.00 52.86 51.93 2isa s ASN 19 Cb 0.00 -0.46 0.06 0.00 0.41 0.00 0.00 41.25 41.26 2isa s ASN 19 CO 0.00 -0.12 1.08 0.68 -1.51 0.00 0.00 177.10 177.23 2isa s VAL 20 N 1.43 3.32 -0.09 1.60 -7.23 -1.26 -4.93 120.40 113.23 2isa s VAL 20 Ca -0.03 0.43 -0.27 0.00 -1.81 0.00 0.00 61.98 60.30 2isa s VAL 20 Cb -0.13 -3.01 -0.02 0.00 0.56 0.00 0.00 36.38 33.77 2isa s VAL 20 CO -0.03 -0.56 0.87 -1.58 -0.31 0.00 0.00 175.10 173.49 2isa s GLN 21 N -4.98 4.41 0.19 4.82 0.74 -1.26 -5.02 119.66 118.55 2isa s GLN 21 Ca 0.61 1.15 0.05 0.00 0.05 0.00 0.00 55.36 57.21 2isa s GLN 21 Cb -0.16 -3.51 -0.05 0.00 1.10 0.00 0.00 33.01 30.39 2isa s GLN 21 CO 0.56 -0.17 -0.08 0.95 -0.55 0.00 0.00 175.29 176.00 2isa s THR 22 N 1.55 1.22 -1.25 -0.34 -4.23 -1.26 -0.67 115.64 110.65 2isa s THR 22 Ca 0.43 -2.08 -0.17 0.00 -1.18 0.00 0.00 61.69 58.70 2isa s THR 22 Cb -0.18 -2.05 0.11 0.00 1.34 0.00 0.00 72.50 71.72 2isa s THR 22 CO 0.18 -0.58 1.62 0.00 -0.54 0.00 0.00 174.62 175.30 2isa s ALA 23 N -3.30 3.54 0.00 3.99 0.00 -0.43 -4.81 121.76 120.75 2isa s ALA 23 Ca 0.21 -3.05 0.00 0.00 0.00 0.00 0.00 51.96 49.12 2isa s ALA 23 Cb 0.03 -4.46 0.00 0.00 0.00 0.00 0.00 23.12 18.70 2isa s ALA 23 CO 0.04 -3.12 0.00 0.41 0.00 0.00 0.00 175.76 173.09 2isa n GLY 24 N 5.00 -0.70 0.30 0.00 0.00 -1.26 -3.34 105.19 105.19 2isa n GLY 24 Ca 0.44 -1.63 0.10 0.00 0.00 0.00 0.00 46.02 44.93 2isa n GLY 24 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2isa h LYS 25 N 0.00 0.12 -0.34 1.61 1.57 -2.00 -1.79 116.57 115.74 2isa h LYS 25 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2isa h LYS 25 Cb 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2isa h LYS 25 CO 0.00 0.08 0.00 0.54 -0.57 0.00 0.00 179.45 179.50 2isa n ARG 26 N -5.33 3.20 -2.61 3.15 5.12 -1.26 -5.03 116.66 113.90 2isa n ARG 26 Ca 0.19 -2.73 -0.23 0.00 -1.93 0.00 0.00 57.85 53.14 2isa n ARG 26 Cb 0.62 -1.79 0.04 0.00 -1.16 0.00 0.00 32.46 30.17 2isa n ARG 26 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2isa s GLY 27 N -1.56 1.71 0.84 -0.13 0.00 -0.68 -5.05 107.32 102.45 2isa s GLY 27 Ca 0.41 -1.09 -0.11 0.00 0.00 0.00 0.00 44.72 43.92 2isa s GLY 27 CO 0.12 -0.82 1.10 -4.14 0.00 0.00 0.00 173.10 169.36 2isa s PRO 28 N -4.83 1.69 0.33 2.90 0.02 -1.26 -4.36 135.00 129.49 2isa s PRO 28 Ca 0.55 1.11 -0.28 0.00 0.02 0.00 0.00 61.00 62.41 2isa s PRO 28 Cb -0.10 -1.84 -0.09 0.00 0.02 0.00 0.00 34.50 32.49 2isa s PRO 28 CO 0.40 -2.02 1.14 -1.14 -0.33 0.00 0.00 177.00 175.05 2isa s GLN 29 N -4.86 4.42 0.01 5.54 0.74 -1.26 -1.31 119.66 122.93 2isa s GLN 29 Ca 0.63 1.84 -0.19 0.00 0.05 0.00 0.00 55.36 57.69 2isa s GLN 29 Cb -0.18 -2.99 -0.06 0.00 1.10 0.00 0.00 33.01 30.88 2isa s GLN 29 CO 0.57 -0.00 0.54 -0.51 -0.55 0.00 0.00 175.29 175.34 2isa s LEU 30 N -1.86 4.45 0.49 3.68 1.43 0.15 -4.88 118.68 122.14 2isa s LEU 30 Ca 0.49 1.13 0.16 0.00 -1.03 0.00 0.00 54.13 54.88 2isa s LEU 30 Cb -0.32 -2.84 1.19 0.00 0.03 0.00 0.00 46.19 44.25 2isa s LEU 30 CO 0.41 0.19 2.08 0.25 0.23 0.00 0.00 176.35 179.51 2isa h LEU 31 N 5.23 0.13 0.00 1.79 5.85 -1.96 -2.87 115.31 123.49 2isa h LEU 31 Ca -0.47 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.25 2isa h LEU 31 Cb 1.21 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.21 2isa h LEU 31 CO 0.67 0.09 0.00 0.00 -0.34 0.00 0.00 178.44 178.86 2isa n GLN 32 N -4.49 0.67 -2.23 1.25 10.64 -1.26 -4.33 117.38 117.64 2isa n GLN 32 Ca 0.02 0.00 -0.32 0.00 -1.83 0.00 0.00 57.00 54.87 2isa n GLN 32 Cb 0.22 -1.43 -0.04 0.00 -0.86 0.00 0.00 30.24 28.13 2isa n GLN 32 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 2isa s ASP 33 N -1.90 5.61 0.25 2.61 -1.08 -1.09 -4.77 116.67 116.29 2isa s ASP 33 Ca 0.27 -1.33 0.13 0.00 -0.52 0.00 0.00 52.55 51.11 2isa s ASP 33 Cb 0.13 -2.57 0.03 0.00 -1.46 0.00 0.00 42.92 39.05 2isa s ASP 33 CO 0.21 -2.38 1.42 -0.37 0.52 0.00 0.00 175.17 174.57 2isa h VAL 34 N 6.66 1.07 -0.58 1.11 -1.51 -1.91 -2.86 116.25 118.23 2isa h VAL 34 Ca 0.20 -2.47 -0.10 0.00 -1.23 0.00 0.00 66.70 63.09 2isa h VAL 34 Cb 0.97 2.50 -0.02 0.00 -2.13 0.00 0.00 31.29 32.61 2isa h VAL 34 CO 1.29 0.60 -0.03 -0.25 -1.23 0.00 0.00 177.57 177.95 2isa h TRP 35 N 0.00 1.14 -0.14 5.19 2.91 -1.95 -1.25 115.95 121.85 2isa h TRP 35 Ca -0.01 -0.21 0.03 0.00 1.13 0.00 0.00 58.89 59.84 2isa h TRP 35 Cb 1.45 -0.30 -0.03 0.00 -0.51 0.00 0.00 29.16 29.78 2isa h TRP 35 CO 0.00 1.02 -0.04 0.35 -1.03 0.00 0.00 178.44 178.74 2isa h PHE 36 N 0.95 -0.09 -0.56 2.65 3.57 -1.88 -0.97 116.94 120.62 2isa h PHE 36 Ca 0.16 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.67 2isa h PHE 36 Cb 0.59 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.36 2isa h PHE 36 CO 0.04 -0.07 0.34 -0.07 -2.23 0.00 0.00 178.31 176.33 2isa h LEU 37 N -0.01 0.67 0.00 0.59 3.38 -1.38 -1.53 115.31 117.03 2isa h LEU 37 Ca 0.07 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2isa h LEU 37 Cb 0.11 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2isa h LEU 37 CO -0.15 0.52 -0.00 -0.08 0.09 0.00 0.00 178.44 178.82 2isa h GLU 38 N 0.75 -0.00 -0.51 1.13 4.81 -1.04 -0.25 114.58 119.46 2isa h GLU 38 Ca 0.20 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 2isa h GLU 38 Cb -0.03 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 2isa h GLU 38 CO -0.04 0.18 0.33 -0.22 -0.73 0.00 0.00 179.01 178.53 2isa h LYS 39 N -0.19 0.68 -0.11 1.92 3.64 -1.10 -1.27 116.57 120.14 2isa h LYS 39 Ca -0.00 -0.05 -0.20 0.00 -1.27 0.00 0.00 60.65 59.13 2isa h LYS 39 Cb 0.19 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 2isa h LYS 39 CO 0.00 0.47 -0.76 -0.07 -2.27 0.00 0.00 179.45 176.82 2isa h LEU 40 N 0.69 0.71 -1.00 5.20 -0.00 -1.28 -1.75 115.31 117.88 2isa h LEU 40 Ca 0.19 -0.47 -0.05 0.00 -0.00 0.00 0.00 57.88 57.55 2isa h LEU 40 Cb -0.05 -0.21 -0.03 0.00 -0.00 0.00 0.00 40.66 40.37 2isa h LEU 40 CO -0.04 1.24 0.20 0.00 -0.00 0.00 0.00 178.44 179.84 2isa h ALA 41 N 0.75 1.20 -0.21 1.53 0.00 -0.79 0.10 119.26 121.83 2isa h ALA 41 Ca -0.04 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.57 2isa h ALA 41 Cb 1.36 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 2isa h ALA 41 CO 0.14 0.56 -0.26 0.45 0.00 0.00 0.00 179.25 180.14 2isa h HIS 42 N 0.89 0.67 -0.62 0.00 3.86 -1.25 -3.19 115.15 115.52 2isa h HIS 42 Ca 0.20 -0.22 0.09 0.00 -1.16 0.00 0.00 60.37 59.28 2isa h HIS 42 Cb 0.25 -0.14 -0.07 0.00 1.06 0.00 0.00 27.41 28.51 2isa h HIS 42 CO 0.02 0.92 0.26 0.35 0.86 0.00 0.00 177.93 180.34 2isa h PHE 43 N 0.23 0.46 0.00 2.45 3.57 -1.01 -1.58 116.94 121.06 2isa h PHE 43 Ca 0.03 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.56 2isa h PHE 43 Cb 0.83 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.46 2isa h PHE 43 CO 0.08 0.15 0.00 -0.25 -2.23 0.00 0.00 178.31 176.06 2isa n ASP 44 N -4.95 0.39 -0.08 0.41 8.00 0.33 -2.61 116.55 118.03 2isa n ASP 44 Ca 0.09 0.67 0.07 0.00 0.71 0.00 0.00 54.79 56.32 2isa n ASP 44 Cb 0.25 -0.72 0.10 0.00 -0.02 0.00 0.00 41.12 40.73 2isa n ASP 44 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2isa n ARG 45 N -2.01 1.56 0.04 -1.24 1.74 -0.61 -4.77 116.66 111.38 2isa n ARG 45 Ca -0.00 -2.20 -0.01 0.00 -0.77 0.00 0.00 57.85 54.86 2isa n ARG 45 Cb 0.05 -1.31 0.27 0.00 -1.02 0.00 0.00 32.46 30.45 2isa n ARG 45 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 2isa h GLU 46 N 0.00 0.42 -6.24 5.56 5.08 -1.38 -3.44 114.58 114.58 2isa h GLU 46 Ca 0.00 -0.13 -0.55 0.00 -1.00 0.00 0.00 59.36 57.68 2isa h GLU 46 Cb 0.91 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.08 2isa h GLU 46 CO 0.00 0.58 0.07 0.08 -1.00 0.00 0.00 179.01 178.74 2isa s VAL 47 N -4.66 4.75 0.30 3.13 1.01 -1.26 -5.09 120.40 118.58 2isa s VAL 47 Ca -0.07 1.44 0.10 0.00 0.00 0.00 0.00 61.98 63.46 2isa s VAL 47 Cb 0.15 -4.02 -0.05 0.00 0.00 0.00 0.00 36.38 32.45 2isa s VAL 47 CO 0.77 0.43 -0.07 0.27 0.00 0.00 0.00 175.10 176.50 2isa s ILE 48 N -0.41 2.76 0.36 2.22 -4.36 -1.26 -5.10 121.20 115.41 2isa s ILE 48 Ca 0.34 -2.13 -0.28 0.00 -0.26 0.00 0.00 60.65 58.32 2isa s ILE 48 Cb -0.20 -2.63 -0.12 0.00 1.25 0.00 0.00 42.46 40.77 2isa s ILE 48 CO 0.21 -0.32 1.39 -2.65 0.24 0.00 0.00 174.94 173.81 2isa n PRO 49 N -0.81 2.38 -1.30 0.37 -0.02 -1.26 -4.98 135.00 129.39 2isa n PRO 49 Ca -0.05 0.84 -0.30 0.00 -2.02 0.00 0.00 63.50 61.97 2isa n PRO 49 Cb 0.61 -2.49 0.12 0.00 -0.02 0.00 0.00 33.50 31.72 2isa n PRO 49 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 2isa s GLU 50 N -1.93 1.49 0.36 -0.52 -1.05 -1.26 -4.95 118.70 110.85 2isa s GLU 50 Ca 0.55 0.77 -0.28 0.00 -0.15 0.00 0.00 54.97 55.86 2isa s GLU 50 Cb -0.53 -1.84 -0.12 0.00 -0.44 0.00 0.00 34.13 31.21 2isa s GLU 50 CO 0.63 -2.07 1.42 0.54 0.95 0.00 0.00 175.26 176.73 2isa n ARG 51 N -3.76 2.48 0.00 -4.83 1.74 -1.26 -5.04 116.66 105.99 2isa n ARG 51 Ca 0.07 0.87 0.00 0.00 -0.77 0.00 0.00 57.85 58.02 2isa n ARG 51 Cb 0.55 -2.55 0.01 0.00 -1.02 0.00 0.00 32.46 29.46 2isa n ARG 51 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2isa n ARG 52 N 0.53 0.23 -1.53 5.56 3.00 -1.26 -4.22 116.66 118.96 2isa n ARG 52 Ca 0.03 0.00 -0.02 0.00 -0.00 0.00 0.00 57.85 57.85 2isa n ARG 52 Cb 0.38 -1.03 -0.00 0.00 0.00 0.00 0.00 32.46 31.80 2isa n ARG 52 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 2isa n HIS 54 N -0.53 -0.08 0.23 -0.14 8.25 -0.53 -5.06 115.22 117.36 2isa n HIS 54 Ca 0.00 0.04 0.07 0.00 -0.26 0.00 0.00 57.72 57.57 2isa n HIS 54 Cb 0.00 -0.11 0.54 0.00 1.12 0.00 0.00 29.99 31.55 2isa n HIS 54 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2isa h ALA 55 N 1.93 1.62 -2.91 -1.41 0.00 -1.73 -3.42 119.26 113.33 2isa h ALA 55 Ca -0.03 -0.16 -0.61 0.00 0.00 0.00 0.00 54.91 54.11 2isa h ALA 55 Cb 0.08 -0.03 -0.13 0.00 0.00 0.00 0.00 17.79 17.71 2isa h ALA 55 CO 0.05 0.22 -0.32 0.21 0.00 0.00 0.00 179.25 179.40 2isa s LYS 56 N -4.55 4.10 0.17 0.00 2.47 -1.24 -4.49 119.74 116.20 2isa s LYS 56 Ca -0.04 -0.01 -0.24 0.00 -1.56 0.00 0.00 55.97 54.12 2isa s LYS 56 Cb 0.15 -3.56 0.06 0.00 -1.46 0.00 0.00 37.83 33.02 2isa s LYS 56 CO 0.68 -0.05 0.91 0.20 0.16 0.00 0.00 175.35 177.25 2isa s GLY 57 N 1.17 -0.21 0.01 5.54 0.00 -1.26 -1.78 107.32 110.79 2isa s GLY 57 Ca 0.14 0.06 0.00 0.00 0.00 0.00 0.00 44.72 44.92 2isa s GLY 57 CO 0.07 -0.01 -0.01 -0.56 0.00 0.00 0.00 173.10 172.59 2isa s SER 58 N -2.93 0.15 0.09 1.64 0.01 0.10 -4.98 113.70 107.78 2isa s SER 58 Ca 0.12 -0.13 0.03 0.00 1.31 0.00 0.00 55.95 57.28 2isa s SER 58 Cb -0.02 0.01 -0.04 0.00 0.21 0.00 0.00 66.02 66.19 2isa s SER 58 CO 0.03 -0.06 -0.09 -0.83 0.41 0.00 0.00 173.24 172.69 2isa s GLY 59 N -0.36 0.80 0.07 3.44 0.00 -1.26 0.08 107.32 110.09 2isa s GLY 59 Ca -0.03 -1.18 -0.23 0.00 0.00 0.00 0.00 44.72 43.28 2isa s GLY 59 CO -0.00 -1.25 0.55 0.00 0.00 0.00 0.00 173.10 172.39 2isa s ALA 60 N -2.53 -1.41 0.28 3.20 0.00 -0.68 -4.50 121.76 116.12 2isa s ALA 60 Ca 0.05 0.59 0.02 0.00 0.00 0.00 0.00 51.96 52.62 2isa s ALA 60 Cb -0.02 0.50 -0.03 0.00 0.00 0.00 0.00 23.12 23.56 2isa s ALA 60 CO -0.01 -0.57 0.45 0.71 0.00 0.00 0.00 175.76 176.35 2isa s TYR 61 N -2.77 3.48 0.00 0.00 1.51 0.14 -1.06 117.35 118.65 2isa s TYR 61 Ca -0.03 0.23 0.00 0.00 -1.01 0.00 0.00 57.07 56.25 2isa s TYR 61 Cb -0.00 -1.78 0.00 0.00 -0.11 0.00 0.00 41.96 40.07 2isa s TYR 61 CO -0.04 0.28 0.00 0.41 -1.11 0.00 0.00 175.55 175.09 2isa n GLY 62 N -1.43 2.54 2.92 0.71 0.00 -0.53 -1.07 105.19 108.32 2isa n GLY 62 Ca -0.06 -0.75 -0.13 0.00 0.00 0.00 0.00 46.02 45.07 2isa n GLY 62 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2isa s THR 63 N -2.83 -0.04 -0.11 2.61 2.01 -0.74 -1.38 115.64 115.17 2isa s THR 63 Ca 0.00 0.14 -0.03 0.00 0.31 0.00 0.00 61.69 62.11 2isa s THR 63 Cb 0.00 -0.21 -0.03 0.00 0.01 0.00 0.00 72.50 72.27 2isa s THR 63 CO 0.00 0.06 0.02 0.12 -0.69 0.00 0.00 174.62 174.13 2isa s PHE 64 N 0.89 3.21 -0.05 4.92 5.36 0.37 -1.75 117.98 130.93 2isa s PHE 64 Ca -0.07 0.17 0.03 0.00 -0.96 0.00 0.00 56.93 56.10 2isa s PHE 64 Cb -0.09 -1.86 0.00 0.00 -0.34 0.00 0.00 43.02 40.73 2isa s PHE 64 CO -0.04 0.41 -0.14 0.99 -1.46 0.00 0.00 175.22 174.97 2isa s THR 65 N -0.61 1.23 0.08 0.12 2.01 0.01 -0.95 115.64 117.54 2isa s THR 65 Ca 0.10 -0.59 -0.30 0.00 0.31 0.00 0.00 61.69 61.21 2isa s THR 65 Cb -0.12 -1.08 -0.06 0.00 0.01 0.00 0.00 72.50 71.25 2isa s THR 65 CO 0.02 0.37 1.14 -0.69 -0.69 0.00 0.00 174.62 174.77 2isa s VAL 66 N 0.25 4.12 -0.01 3.82 1.01 -0.78 -1.67 120.40 127.15 2isa s VAL 66 Ca -0.07 1.59 0.02 0.00 0.00 0.00 0.00 61.98 63.52 2isa s VAL 66 Cb -0.12 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 2isa s VAL 66 CO 0.02 0.16 0.05 0.35 0.00 0.00 0.00 175.10 175.68 2isa n THR 67 N 3.55 0.00 -4.22 3.92 -2.24 -0.26 -0.57 114.28 114.47 2isa n THR 67 Ca 0.07 -0.07 -0.13 0.00 -2.27 0.00 0.00 64.05 61.65 2isa n THR 67 Cb 0.47 0.48 -0.10 0.00 -2.10 0.00 0.00 70.33 69.08 2isa n THR 67 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2isa s HIS 68 N -2.09 1.12 -0.49 4.78 3.76 -0.42 -4.94 115.29 117.01 2isa s HIS 68 Ca -0.01 -0.80 -0.18 0.00 -0.15 0.00 0.00 55.06 53.92 2isa s HIS 68 Cb 0.01 -0.59 0.06 0.00 1.11 0.00 0.00 32.58 33.17 2isa s HIS 68 CO 0.09 -0.00 0.55 0.34 -0.85 0.00 0.00 174.74 174.87 2isa s ASP 69 N -3.05 6.20 -0.17 1.40 -1.08 -1.26 -4.79 116.67 113.92 2isa s ASP 69 Ca 0.14 -1.01 0.17 0.00 -0.52 0.00 0.00 52.55 51.33 2isa s ASP 69 Cb 0.03 -2.26 0.42 0.00 -1.46 0.00 0.00 42.92 39.66 2isa s ASP 69 CO -0.01 -0.81 1.30 2.30 0.52 0.00 0.00 175.17 178.47 2isa n ILE 70 N 5.50 2.14 0.26 4.11 -5.35 -1.26 -4.75 119.36 120.00 2isa n ILE 70 Ca -0.08 -2.15 0.06 0.00 -0.27 0.00 0.00 62.75 60.31 2isa n ILE 70 Cb 0.45 -0.25 0.28 0.00 -1.74 0.00 0.00 39.64 38.38 2isa n ILE 70 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 2isa n THR 71 N -0.96 1.31 0.23 7.28 -2.24 -1.26 -1.48 114.28 117.15 2isa n THR 71 Ca 0.20 0.41 0.08 0.00 -2.27 0.00 0.00 64.05 62.47 2isa n THR 71 Cb 0.79 -1.31 0.54 0.00 -2.10 0.00 0.00 70.33 68.25 2isa n THR 71 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2isa h LYS 72 N 0.00 0.00 0.00 -0.78 3.64 -1.99 -3.31 116.57 114.13 2isa h LYS 72 Ca 0.00 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.19 2isa h LYS 72 Cb 0.15 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.93 2isa h LYS 72 CO 0.00 0.23 -1.90 0.66 -2.27 0.00 0.00 179.45 176.17 2isa n TYR 73 N -3.81 0.00 -3.82 1.91 4.01 -0.55 -4.84 117.16 110.07 2isa n TYR 73 Ca -0.02 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.59 2isa n TYR 73 Cb 0.33 -0.61 -0.15 0.00 -0.31 0.00 0.00 39.34 38.60 2isa n TYR 73 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2isa s THR 74 N -2.52 -0.03 -2.25 -0.72 -1.32 -1.12 -3.17 115.64 104.52 2isa s THR 74 Ca -0.07 0.10 0.19 0.00 -1.21 0.00 0.00 61.69 60.70 2isa s THR 74 Cb 0.06 -0.08 0.43 0.00 -1.51 0.00 0.00 72.50 71.39 2isa s THR 74 CO 0.59 0.04 1.46 2.29 -2.21 0.00 0.00 174.62 176.79 2isa n LYS 75 N 3.58 1.92 -1.71 7.08 2.85 -0.51 -4.37 118.16 127.00 2isa n LYS 75 Ca -0.19 -1.40 -0.43 0.00 -1.05 0.00 0.00 58.31 55.24 2isa n LYS 75 Cb 0.55 -1.40 -0.03 0.00 -0.65 0.00 0.00 35.03 33.51 2isa n LYS 75 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2isa n ALA 76 N 0.62 2.28 0.08 0.58 0.00 -1.20 -4.80 120.51 118.07 2isa n ALA 76 Ca 0.16 0.40 0.02 0.00 0.00 0.00 0.00 53.44 54.02 2isa n ALA 76 Cb 0.38 -2.44 0.36 0.00 0.00 0.00 0.00 19.45 17.75 2isa n ALA 76 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2isa h LYS 77 N 5.62 0.34 -0.84 0.00 1.79 -1.93 -2.47 116.57 119.08 2isa h LYS 77 Ca -0.45 -0.07 0.17 0.00 -2.18 0.00 0.00 60.65 58.12 2isa h LYS 77 Cb 1.23 -0.05 -0.06 0.00 -1.58 0.00 0.00 32.23 31.77 2isa h LYS 77 CO 0.86 0.43 0.56 0.97 -1.08 0.00 0.00 179.45 181.19 2isa h ILE 78 N 0.33 0.74 -0.58 1.86 2.10 -1.94 -2.21 117.51 117.80 2isa h ILE 78 Ca 0.07 -0.15 0.00 0.00 1.08 0.00 0.00 64.86 65.86 2isa h ILE 78 Cb 0.34 0.26 0.00 0.00 -1.09 0.00 0.00 36.82 36.33 2isa h ILE 78 CO 0.02 0.08 0.00 0.49 -1.08 0.00 0.00 178.15 177.66 2isa n PHE 79 N -4.50 1.09 0.17 2.19 3.72 -0.94 -4.74 117.46 114.45 2isa n PHE 79 Ca 0.17 -0.58 0.01 0.00 -0.05 0.00 0.00 57.45 57.01 2isa n PHE 79 Cb 0.61 -0.14 0.29 0.00 -0.94 0.00 0.00 39.48 39.30 2isa n PHE 79 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2isa h SER 80 N 3.55 0.00 -3.70 4.37 4.64 -1.32 -3.43 113.55 117.67 2isa h SER 80 Ca 0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.09 2isa h SER 80 Cb 1.17 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 62.98 2isa h SER 80 CO 0.12 0.47 -0.67 -1.81 -0.87 0.00 0.00 176.83 174.06 2isa s ASP 81 N -6.84 -0.03 0.23 4.97 1.01 -1.26 -4.97 116.67 109.78 2isa s ASP 81 Ca -0.02 0.09 -0.31 0.00 0.71 0.00 0.00 52.55 53.02 2isa s ASP 81 Cb 0.13 0.07 -0.11 0.00 1.01 0.00 0.00 42.92 44.02 2isa s ASP 81 CO 0.73 -0.04 1.62 -0.63 0.21 0.00 0.00 175.17 177.06 2isa s ILE 82 N 0.22 2.25 0.00 0.77 1.01 -1.26 -1.90 121.20 122.28 2isa s ILE 82 Ca -0.02 0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.82 2isa s ILE 82 Cb -0.02 -3.12 0.00 0.00 0.01 0.00 0.00 42.46 39.32 2isa s ILE 82 CO -0.01 0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.56 2isa n GLY 83 N 3.16 1.74 3.71 6.18 0.00 0.27 -4.98 105.19 115.26 2isa n GLY 83 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2isa n GLY 83 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2isa s LYS 84 N -0.73 4.25 -0.01 1.61 2.20 -0.80 -4.72 119.74 121.53 2isa s LYS 84 Ca 0.00 2.24 0.03 0.00 -0.36 0.00 0.00 55.97 57.88 2isa s LYS 84 Cb 0.00 -3.32 -0.03 0.00 -1.51 0.00 0.00 37.83 32.97 2isa s LYS 84 CO 0.00 -0.59 -0.10 0.15 -0.36 0.00 0.00 175.35 174.45 2isa s LYS 85 N 1.60 2.51 -0.04 4.03 1.02 -1.26 -1.87 119.74 125.74 2isa s LYS 85 Ca 0.69 -0.72 -0.00 0.00 0.02 0.00 0.00 55.97 55.96 2isa s LYS 85 Cb -0.40 -2.45 0.03 0.00 -0.52 0.00 0.00 37.83 34.49 2isa s LYS 85 CO 0.31 0.61 0.01 0.99 -0.92 0.00 0.00 175.35 176.35 2isa s THR 86 N -0.90 0.17 0.59 2.17 2.01 -0.12 -4.97 115.64 114.58 2isa s THR 86 Ca 0.15 0.14 -0.19 0.00 0.31 0.00 0.00 61.69 62.10 2isa s THR 86 Cb -0.11 -0.30 -0.04 0.00 0.01 0.00 0.00 72.50 72.07 2isa s THR 86 CO 0.05 0.17 1.21 -1.81 -0.69 0.00 0.00 174.62 173.54 2isa s ASP 87 N 1.33 5.23 0.15 3.53 1.01 -1.26 -0.48 116.67 126.18 2isa s ASP 87 Ca -0.05 2.38 -0.11 0.00 0.71 0.00 0.00 52.55 55.48 2isa s ASP 87 Cb -0.13 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.20 2isa s ASP 87 CO -0.02 -1.57 0.32 0.00 0.21 0.00 0.00 175.17 174.11 2isa s MET 88 N -3.31 1.13 -0.01 8.23 0.23 -0.48 -1.18 119.30 123.91 2isa s MET 88 Ca 0.77 -1.02 0.04 0.00 -1.03 0.00 0.00 55.69 54.45 2isa s MET 88 Cb -0.30 0.41 -0.01 0.00 -1.53 0.00 0.00 34.83 33.40 2isa s MET 88 CO 0.33 -0.42 -0.13 0.12 -2.03 0.00 0.00 175.02 172.88 2isa s PHE 89 N -3.91 1.19 -0.00 3.16 5.36 0.01 -1.46 117.98 122.33 2isa s PHE 89 Ca 0.12 -0.23 0.06 0.00 -0.96 0.00 0.00 56.93 55.91 2isa s PHE 89 Cb 0.03 -0.76 -0.02 0.00 -0.34 0.00 0.00 43.02 41.93 2isa s PHE 89 CO -0.04 -0.02 -0.20 0.00 -1.46 0.00 0.00 175.22 173.51 2isa s ALA 90 N -0.36 1.65 -0.12 11.12 0.00 -0.22 -0.43 121.76 133.40 2isa s ALA 90 Ca 0.05 -0.88 0.02 0.00 0.00 0.00 0.00 51.96 51.14 2isa s ALA 90 Cb -0.05 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.68 2isa s ALA 90 CO -0.00 0.40 -0.16 0.50 0.00 0.00 0.00 175.76 176.49 2isa s ARG 91 N -0.60 2.33 0.10 0.00 3.52 0.27 -1.69 118.95 122.89 2isa s ARG 91 Ca 0.07 -0.60 0.02 0.00 -0.13 0.00 0.00 55.73 55.10 2isa s ARG 91 Cb -0.08 -1.99 -0.04 0.00 -1.56 0.00 0.00 34.95 31.28 2isa s ARG 91 CO -0.00 -0.09 0.17 -0.06 -0.81 0.00 0.00 175.30 174.51 2isa s PHE 92 N 1.05 3.33 0.13 5.12 0.40 0.11 -1.41 117.98 126.72 2isa s PHE 92 Ca -0.05 0.12 -0.24 0.00 -0.60 0.00 0.00 56.93 56.16 2isa s PHE 92 Cb -0.15 -1.65 0.07 0.00 0.51 0.00 0.00 43.02 41.81 2isa s PHE 92 CO -0.03 0.54 0.69 -1.54 0.70 0.00 0.00 175.22 175.58 2isa s SER 93 N -2.72 -0.48 0.58 1.36 1.04 -1.10 0.01 113.70 112.39 2isa s SER 93 Ca 0.32 -0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.68 2isa s SER 93 Cb -0.12 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.56 2isa s SER 93 CO 0.25 -0.92 0.00 0.35 0.98 0.00 0.00 173.24 173.90 2isa n THR 94 N -0.36 0.00 0.02 2.02 -2.24 -0.73 -0.68 114.28 112.30 2isa n THR 94 Ca -0.14 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.63 2isa n THR 94 Cb 0.64 -1.68 -0.00 0.00 -2.10 0.00 0.00 70.33 67.18 2isa n THR 94 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2isa n VAL 95 N -1.43 0.68 0.04 2.28 0.31 -1.25 -4.03 118.33 114.94 2isa n VAL 95 Ca 0.00 0.18 -0.11 0.00 -0.01 0.00 0.00 64.34 64.40 2isa n VAL 95 Cb 0.00 -1.58 -0.13 0.00 -0.91 0.00 0.00 33.84 31.21 2isa n VAL 95 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2isa h ALA 96 N -0.07 0.45 -2.88 3.52 0.00 -1.93 -1.41 119.26 116.95 2isa h ALA 96 Ca -0.02 -1.15 -0.53 0.00 0.00 0.00 0.00 54.91 53.21 2isa h ALA 96 Cb 0.56 0.20 0.08 0.00 0.00 0.00 0.00 17.79 18.62 2isa h ALA 96 CO -0.01 1.31 0.64 0.20 0.00 0.00 0.00 179.25 181.39 2isa s GLY 97 N -4.92 2.96 0.93 0.00 0.00 -1.26 -4.90 107.32 100.12 2isa s GLY 97 Ca -0.04 1.27 -0.16 0.00 0.00 0.00 0.00 44.72 45.79 2isa s GLY 97 CO 0.83 1.90 1.20 1.18 0.00 0.00 0.00 173.10 178.21 2isa n GLU 98 N 0.49 -1.41 -1.68 2.90 4.71 -1.26 -3.69 120.64 120.70 2isa n GLU 98 Ca 0.02 -1.85 -0.45 0.00 -0.01 0.00 0.00 57.16 54.86 2isa n GLU 98 Cb 0.42 -1.29 -0.04 0.00 -1.01 0.00 0.00 31.44 29.53 2isa n GLU 98 CO 0.00 0.00 0.00 -2.13 0.09 0.00 0.00 177.13 175.09 2isa n ARG 99 N -3.71 2.23 0.00 3.49 0.63 -1.26 -1.43 116.66 116.61 2isa n ARG 99 Ca 0.15 0.80 0.00 0.00 -0.92 0.00 0.00 57.85 57.88 2isa n ARG 99 Cb 0.53 -2.56 0.00 0.00 0.45 0.00 0.00 32.46 30.88 2isa n ARG 99 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2isa n GLY 100 N 3.23 3.30 3.69 5.14 0.00 -1.26 -5.04 105.19 114.25 2isa n GLY 100 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 2isa n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2isa s ALA 101 N -2.35 1.75 0.30 4.61 0.00 -0.51 -4.93 121.76 120.62 2isa s ALA 101 Ca 0.00 0.79 -0.30 0.00 0.00 0.00 0.00 51.96 52.45 2isa s ALA 101 Cb 0.00 -3.48 -0.11 0.00 0.00 0.00 0.00 23.12 19.52 2isa s ALA 101 CO 0.00 -2.41 1.57 0.00 0.00 0.00 0.00 175.76 174.92 2isa s ALA 102 N -2.26 3.72 0.20 0.00 0.00 -1.26 -4.89 121.76 117.27 2isa s ALA 102 Ca 0.72 1.55 -0.09 0.00 0.00 0.00 0.00 51.96 54.14 2isa s ALA 102 Cb -0.27 -3.64 0.14 0.00 0.00 0.00 0.00 23.12 19.35 2isa s ALA 102 CO 0.52 -0.97 1.78 -0.44 0.00 0.00 0.00 175.76 176.66 2isa h ASP 103 N 4.70 1.01 -1.22 0.00 3.32 -1.56 -3.36 116.42 119.32 2isa h ASP 103 Ca -0.47 -0.15 -0.64 0.00 0.02 0.00 0.00 57.03 55.79 2isa h ASP 103 Cb 1.22 -0.26 -0.16 0.00 0.22 0.00 0.00 39.33 40.35 2isa h ASP 103 CO 0.78 0.88 1.38 0.00 -1.72 0.00 0.00 179.24 180.56 2isa n ALA 104 N -2.40 6.60 -2.93 3.45 0.00 -1.26 -4.90 120.51 119.06 2isa n ALA 104 Ca 0.06 -3.66 -0.21 0.00 0.00 0.00 0.00 53.44 49.63 2isa n ALA 104 Cb 0.16 -2.43 -0.02 0.00 0.00 0.00 0.00 19.45 17.16 2isa n ALA 104 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2isa s GLU 105 N -1.72 3.44 -0.34 0.00 2.02 -1.26 -4.74 118.70 116.10 2isa s GLU 105 Ca 0.55 -0.72 -0.29 0.00 0.02 0.00 0.00 54.97 54.53 2isa s GLU 105 Cb 0.28 -2.87 0.01 0.00 0.10 0.00 0.00 34.13 31.65 2isa s GLU 105 CO -0.17 0.40 1.25 0.50 0.02 0.00 0.00 175.26 177.26 2isa s ARG 106 N -4.01 3.88 -0.28 1.61 3.52 -1.26 -4.61 118.95 117.80 2isa s ARG 106 Ca 0.35 1.09 -0.33 0.00 -0.13 0.00 0.00 55.73 56.71 2isa s ARG 106 Cb -0.09 -3.87 0.18 0.00 -1.56 0.00 0.00 34.95 29.60 2isa s ARG 106 CO 0.30 -1.17 1.36 0.34 -0.81 0.00 0.00 175.30 175.32 2isa s ASP 107 N 2.67 -0.04 0.61 -2.12 -1.08 -0.55 -5.02 116.67 111.15 2isa s ASP 107 Ca 0.54 0.02 -0.18 0.00 -0.52 0.00 0.00 52.55 52.41 2isa s ASP 107 Cb -0.14 0.03 -0.04 0.00 -1.46 0.00 0.00 42.92 41.31 2isa s ASP 107 CO 0.24 -0.04 1.02 -0.38 0.52 0.00 0.00 175.17 176.52 2isa n ILE 108 N 0.29 3.94 -4.74 4.11 5.41 -1.26 -4.66 119.36 122.45 2isa n ILE 108 Ca 0.02 -0.50 -0.33 0.00 1.00 0.00 0.00 62.75 62.94 2isa n ILE 108 Cb 0.58 -1.20 -0.13 0.00 -0.71 0.00 0.00 39.64 38.17 2isa n ILE 108 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 2isa s ARG 109 N -2.87 3.04 0.42 0.38 1.81 -1.26 -3.84 118.95 116.63 2isa s ARG 109 Ca 0.77 -0.65 -0.24 0.00 -1.72 0.00 0.00 55.73 53.89 2isa s ARG 109 Cb -0.41 -2.58 -0.08 0.00 -0.45 0.00 0.00 34.95 31.43 2isa s ARG 109 CO 0.46 0.42 1.17 0.20 -0.68 0.00 0.00 175.30 176.86 2isa s GLY 110 N -0.17 2.84 -0.42 -3.53 0.00 0.14 -0.58 107.32 105.59 2isa s GLY 110 Ca 0.01 0.95 0.03 0.00 0.00 0.00 0.00 44.72 45.71 2isa s GLY 110 CO 0.03 1.45 0.33 -0.12 0.00 0.00 0.00 173.10 174.78 2isa s PHE 111 N -1.46 1.23 -0.19 1.90 2.19 0.26 -2.70 117.98 119.21 2isa s PHE 111 Ca 0.59 -2.29 -0.05 0.00 0.33 0.00 0.00 56.93 55.52 2isa s PHE 111 Cb -0.30 -1.07 -0.02 0.00 -1.31 0.00 0.00 43.02 40.32 2isa s PHE 111 CO 0.37 -0.81 -0.01 0.45 1.83 0.00 0.00 175.22 177.05 2isa s SER 112 N 0.13 4.76 -0.02 6.13 0.15 -0.50 -0.71 113.70 123.64 2isa s SER 112 Ca 0.29 -0.20 0.05 0.00 0.70 0.00 0.00 55.95 56.79 2isa s SER 112 Cb -0.02 -1.80 -0.01 0.00 -1.71 0.00 0.00 66.02 62.48 2isa s SER 112 CO -0.16 0.08 -0.17 -0.76 1.20 0.00 0.00 173.24 173.44 2isa s LEU 113 N 0.88 2.01 -0.17 3.45 1.43 0.19 -0.57 118.68 125.90 2isa s LEU 113 Ca 0.00 -0.31 0.00 0.00 -1.03 0.00 0.00 54.13 52.80 2isa s LEU 113 Cb -0.14 -0.88 0.03 0.00 0.03 0.00 0.00 46.19 45.23 2isa s LEU 113 CO 0.02 0.20 -0.10 -0.75 0.23 0.00 0.00 176.35 175.94 2isa s LYS 114 N -0.32 1.92 -0.23 1.70 2.20 0.43 -0.21 119.74 125.22 2isa s LYS 114 Ca 0.05 -0.63 -0.07 0.00 -0.36 0.00 0.00 55.97 54.96 2isa s LYS 114 Cb -0.07 -2.15 -0.03 0.00 -1.51 0.00 0.00 37.83 34.06 2isa s LYS 114 CO -0.00 -0.36 0.06 -0.06 -0.36 0.00 0.00 175.35 174.63 2isa s PHE 115 N 1.51 3.11 -1.30 4.03 0.08 0.15 -0.81 117.98 124.74 2isa s PHE 115 Ca 0.02 -0.33 -0.15 0.00 0.12 0.00 0.00 56.93 56.59 2isa s PHE 115 Cb -0.15 -2.20 0.10 0.00 -0.57 0.00 0.00 43.02 40.21 2isa s PHE 115 CO -0.09 -0.25 1.77 0.66 -0.10 0.00 0.00 175.22 177.21 2isa n TYR 116 N 4.61 4.33 -2.22 0.36 4.01 -0.33 -1.24 117.16 126.69 2isa n TYR 116 Ca -0.16 -3.00 -0.26 0.00 -0.16 0.00 0.00 57.90 54.32 2isa n TYR 116 Cb 0.52 -2.43 0.06 0.00 -0.31 0.00 0.00 39.34 37.18 2isa n TYR 116 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2isa s THR 117 N 2.89 2.73 -0.85 -0.72 -4.23 -1.00 -4.57 115.64 109.89 2isa s THR 117 Ca 0.48 -0.13 0.23 0.00 -1.18 0.00 0.00 61.69 61.09 2isa s THR 117 Cb 0.05 -3.16 0.22 0.00 1.34 0.00 0.00 72.50 70.95 2isa s THR 117 CO 0.02 -0.17 1.73 -1.84 -0.54 0.00 0.00 174.62 173.82 2isa n GLU 118 N -2.85 0.09 -0.72 3.99 0.28 -1.26 -2.76 120.64 117.41 2isa n GLU 118 Ca 0.07 0.19 0.01 0.00 -0.16 0.00 0.00 57.16 57.27 2isa n GLU 118 Cb 0.59 -1.63 0.20 0.00 1.43 0.00 0.00 31.44 32.04 2isa n GLU 118 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2isa n GLU 119 N -1.79 1.72 0.00 3.44 1.02 -1.26 -4.73 120.64 119.03 2isa n GLU 119 Ca 0.05 -3.27 0.00 0.00 -0.02 0.00 0.00 57.16 53.92 2isa n GLU 119 Cb 0.29 -1.72 0.00 0.00 -0.02 0.00 0.00 31.44 29.99 2isa n GLU 119 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2isa n GLY 120 N -1.12 2.81 3.67 0.62 0.00 -1.11 -4.57 105.19 105.50 2isa n GLY 120 Ca 0.26 -2.00 -0.43 0.00 0.00 0.00 0.00 46.02 43.86 2isa n GLY 120 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2isa s ASN 121 N 0.00 6.98 -0.40 1.61 0.02 -1.26 -2.36 114.94 119.53 2isa s ASN 121 Ca 0.00 1.76 -0.18 0.00 -1.02 0.00 0.00 52.86 53.41 2isa s ASN 121 Cb 0.00 -2.55 0.01 0.00 0.02 0.00 0.00 41.25 38.74 2isa s ASN 121 CO 0.00 -0.69 0.52 0.86 0.02 0.00 0.00 177.10 177.80 2isa s TRP 122 N 2.97 3.14 -0.23 2.20 -0.00 -0.37 -4.43 118.94 122.22 2isa s TRP 122 Ca 0.56 -0.10 -0.14 0.00 -0.00 0.00 0.00 56.10 56.42 2isa s TRP 122 Cb -0.23 -3.03 -0.04 0.00 -0.00 0.00 0.00 33.47 30.17 2isa s TRP 122 CO 0.18 -0.69 0.32 -0.51 -0.00 0.00 0.00 176.95 176.25 2isa s ASP 123 N 1.85 6.30 -0.35 5.86 1.01 -0.22 -0.67 116.67 130.45 2isa s ASP 123 Ca 0.17 0.34 0.04 0.00 0.71 0.00 0.00 52.55 53.81 2isa s ASP 123 Cb -0.16 -2.19 0.10 0.00 1.01 0.00 0.00 42.92 41.69 2isa s ASP 123 CO 0.15 -0.06 0.07 -0.22 0.21 0.00 0.00 175.17 175.32 2isa s LEU 124 N 1.40 4.57 -0.97 1.23 2.96 0.71 -4.49 118.68 124.09 2isa s LEU 124 Ca 0.15 -2.18 -0.20 0.00 -0.22 0.00 0.00 54.13 51.68 2isa s LEU 124 Cb -0.15 -1.58 0.10 0.00 0.50 0.00 0.00 46.19 45.07 2isa s LEU 124 CO 0.07 -0.37 1.24 0.00 -1.32 0.00 0.00 176.35 175.97 2isa s ALA 125 N 0.87 3.15 0.52 5.97 0.00 -1.26 -0.63 121.76 130.37 2isa s ALA 125 Ca 0.11 -2.60 0.06 0.00 0.00 0.00 0.00 51.96 49.53 2isa s ALA 125 Cb -0.19 -4.22 0.09 0.00 0.00 0.00 0.00 23.12 18.80 2isa s ALA 125 CO -0.09 -3.20 0.68 0.41 0.00 0.00 0.00 175.76 173.57 2isa n GLY 126 N 5.95 1.62 3.47 0.00 0.00 0.11 -4.94 105.19 111.40 2isa n GLY 126 Ca 0.27 -2.16 -0.22 0.00 0.00 0.00 0.00 46.02 43.91 2isa n GLY 126 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2isa s ASN 127 N -3.96 2.53 -0.03 1.61 0.01 -0.81 -0.58 114.94 113.72 2isa s ASN 127 Ca 0.50 -1.37 0.02 0.00 -0.71 0.00 0.00 52.86 51.30 2isa s ASN 127 Cb -0.04 -0.12 0.11 0.00 0.41 0.00 0.00 41.25 41.62 2isa s ASN 127 CO 0.32 -0.59 0.75 -0.46 -1.51 0.00 0.00 177.10 175.62 2isa n ASN 128 N -0.71 1.48 -3.91 -1.22 6.94 0.25 -0.60 115.26 117.49 2isa n ASN 128 Ca -0.03 -2.11 -0.11 0.00 -0.02 0.00 0.00 54.58 52.32 2isa n ASN 128 Cb 0.67 -0.44 -0.12 0.00 -2.36 0.00 0.00 39.78 37.52 2isa n ASN 128 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2isa s THR 129 N -1.37 0.06 -1.23 5.53 -1.32 -1.26 -4.62 115.64 111.43 2isa s THR 129 Ca 0.08 -0.48 0.24 0.00 -1.21 0.00 0.00 61.69 60.32 2isa s THR 129 Cb 0.06 -0.19 0.32 0.00 -1.51 0.00 0.00 72.50 71.17 2isa s THR 129 CO 0.03 -0.26 1.80 -0.81 -2.21 0.00 0.00 174.62 173.16 2isa n PRO 130 N 2.23 0.19 -4.38 7.08 -0.04 -1.26 -4.54 135.00 134.28 2isa n PRO 130 Ca -0.19 0.07 -0.21 0.00 -0.04 0.00 0.00 63.50 63.14 2isa n PRO 130 Cb 0.57 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.45 2isa n PRO 130 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2isa s VAL 131 N -2.77 0.34 0.26 0.52 -7.23 -1.26 -4.37 120.40 105.88 2isa s VAL 131 Ca 0.18 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.37 2isa s VAL 131 Cb 0.16 -2.46 -0.04 0.00 0.56 0.00 0.00 36.38 34.60 2isa s VAL 131 CO 0.40 0.00 0.18 0.12 -0.31 0.00 0.00 175.10 175.50 2isa s PHE 132 N -3.46 1.43 0.38 2.82 5.36 -0.61 -4.96 117.98 118.95 2isa s PHE 132 Ca 0.33 -1.47 0.14 0.00 -0.96 0.00 0.00 56.93 54.98 2isa s PHE 132 Cb 0.04 -0.66 0.83 0.00 -0.34 0.00 0.00 43.02 42.89 2isa s PHE 132 CO 0.19 -0.69 1.87 0.74 -1.46 0.00 0.00 175.22 175.87 2isa h PHE 133 N 2.40 0.00 -3.68 10.12 -1.00 -1.89 -3.39 116.94 119.51 2isa h PHE 133 Ca -0.32 0.00 -0.67 0.00 2.81 0.00 0.00 57.97 59.79 2isa h PHE 133 Cb 1.24 0.00 -0.21 0.00 3.61 0.00 0.00 35.95 40.60 2isa h PHE 133 CO 0.89 0.32 -0.85 -0.51 -1.61 0.00 0.00 178.31 176.55 2isa s LEU 134 N -8.16 2.36 -0.03 1.54 1.43 -1.26 -3.23 118.68 111.32 2isa s LEU 134 Ca -0.03 -0.78 0.21 0.00 -1.03 0.00 0.00 54.13 52.49 2isa s LEU 134 Cb 0.14 -1.17 -0.32 0.00 0.03 0.00 0.00 46.19 44.88 2isa s LEU 134 CO 0.71 0.15 0.45 0.54 0.23 0.00 0.00 176.35 178.42 2isa n ARG 135 N 0.71 0.63 -4.13 1.70 1.74 -1.26 -4.44 116.66 111.61 2isa n ARG 135 Ca -0.16 -0.19 -0.18 0.00 -0.77 0.00 0.00 57.85 56.55 2isa n ARG 135 Cb 0.54 -1.49 -0.16 0.00 -1.02 0.00 0.00 32.46 30.33 2isa n ARG 135 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2isa s ASP 136 N -4.40 0.74 0.59 0.55 -1.08 -1.26 -4.15 116.67 107.66 2isa s ASP 136 Ca -0.08 -0.10 0.38 0.00 -0.52 0.00 0.00 52.55 52.23 2isa s ASP 136 Cb 0.13 -0.30 1.82 0.00 -1.46 0.00 0.00 42.92 43.11 2isa s ASP 136 CO 0.86 -0.03 2.14 1.55 0.52 0.00 0.00 175.17 180.21 2isa h PRO 137 N 6.86 0.00 -0.24 4.34 0.13 -1.89 -2.60 132.00 138.59 2isa h PRO 137 Ca -0.37 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.81 2isa h PRO 137 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 2isa h PRO 137 CO 0.48 0.00 0.17 -0.07 -0.23 0.00 0.00 178.00 178.35 2isa h LEU 138 N 0.00 0.10 0.00 1.56 3.38 -1.96 -1.93 115.31 116.45 2isa h LEU 138 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2isa h LEU 138 Cb 0.27 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2isa h LEU 138 CO 0.00 0.07 0.00 0.29 0.09 0.00 0.00 178.44 178.89 2isa n LYS 139 N -4.49 0.52 -0.00 1.13 4.76 -0.98 -4.22 118.16 114.89 2isa n LYS 139 Ca 0.02 0.01 -0.12 0.00 -2.87 0.00 0.00 58.31 55.35 2isa n LYS 139 Cb 0.24 -1.50 -0.08 0.00 -1.84 0.00 0.00 35.03 31.86 2isa n LYS 139 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 2isa h PHE 140 N 0.00 0.08 -0.48 2.13 3.57 -1.53 -0.21 116.94 120.50 2isa h PHE 140 Ca 0.00 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.52 2isa h PHE 140 Cb 0.22 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.91 2isa h PHE 140 CO 0.00 0.28 0.32 -1.35 -2.23 0.00 0.00 178.31 175.33 2isa h PRO 141 N -0.15 0.51 -0.47 6.41 0.11 -1.79 -1.34 132.00 135.28 2isa h PRO 141 Ca 0.01 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.07 2isa h PRO 141 Cb 0.25 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.22 2isa h PRO 141 CO 0.00 0.34 0.18 -0.44 -0.21 0.00 0.00 178.00 177.87 2isa h ASP 142 N 0.53 0.65 -0.10 -2.05 3.32 -1.72 -0.95 116.42 116.09 2isa h ASP 142 Ca 0.19 -0.17 0.01 0.00 0.02 0.00 0.00 57.03 57.08 2isa h ASP 142 Cb 0.11 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 2isa h ASP 142 CO -0.05 0.64 0.01 0.25 -1.72 0.00 0.00 179.24 178.38 2isa h LEU 143 N 0.61 -0.01 -0.47 1.55 5.85 -0.42 0.06 115.31 122.49 2isa h LEU 143 Ca 0.16 0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.98 2isa h LEU 143 Cb 0.20 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.17 2isa h LEU 143 CO -0.01 0.01 -0.06 -1.13 -0.34 0.00 0.00 178.44 176.91 2isa h ASN 144 N 0.05 -0.31 0.47 1.25 -0.73 -1.11 -0.69 115.58 114.50 2isa h ASN 144 Ca 0.04 0.13 -0.08 0.00 1.87 0.00 0.00 56.30 58.26 2isa h ASN 144 Cb 0.04 0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.86 2isa h ASN 144 CO -0.06 -0.11 -0.36 0.45 -0.37 0.00 0.00 177.43 176.97 2isa h HIS 145 N 0.05 0.00 0.09 0.67 3.86 -0.81 -1.29 115.15 117.73 2isa h HIS 145 Ca 0.23 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 59.18 2isa h HIS 145 Cb 0.35 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.83 2isa h HIS 145 CO -0.35 0.36 -1.14 0.00 0.86 0.00 0.00 177.93 177.66 2isa h ALA 146 N 1.64 0.18 0.00 2.45 0.00 -0.54 -3.36 119.26 119.63 2isa h ALA 146 Ca -0.00 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.09 2isa h ALA 146 Cb 0.70 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2isa h ALA 146 CO 0.05 0.90 -0.95 1.33 0.00 0.00 0.00 179.25 180.58 2isa n VAL 147 N -3.62 0.27 -1.30 0.00 0.24 -0.31 -2.75 118.33 110.87 2isa n VAL 147 Ca -0.08 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 61.92 2isa n VAL 147 Cb 0.96 0.03 0.00 0.00 -1.47 0.00 0.00 33.84 33.36 2isa n VAL 147 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2isa n LYS 148 N -2.11 3.54 -2.64 7.34 5.02 -0.50 -4.85 118.16 123.95 2isa n LYS 148 Ca 0.02 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.90 2isa n LYS 148 Cb 0.46 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.42 2isa n LYS 148 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2isa s ARG 149 N 3.40 4.71 0.42 1.97 0.52 -1.26 -4.18 118.95 124.52 2isa s ARG 149 Ca 0.00 1.59 -0.26 0.00 -0.52 0.00 0.00 55.73 56.54 2isa s ARG 149 Cb 0.00 -3.30 -0.09 0.00 0.52 0.00 0.00 34.95 32.09 2isa s ARG 149 CO 0.00 0.26 1.34 0.34 0.02 0.00 0.00 175.30 177.26 2isa s ASP 150 N -0.48 6.18 0.46 0.23 -1.08 -0.37 -4.84 116.67 116.78 2isa s ASP 150 Ca 0.46 2.74 0.17 0.00 -0.52 0.00 0.00 52.55 55.40 2isa s ASP 150 Cb -0.27 -2.64 1.14 0.00 -1.46 0.00 0.00 42.92 39.69 2isa s ASP 150 CO 0.33 -0.95 1.97 -0.65 0.52 0.00 0.00 175.17 176.40 2isa h PRO 151 N 2.58 0.28 0.00 4.34 0.11 -1.93 -1.98 132.00 135.40 2isa h PRO 151 Ca -0.50 -0.02 -0.37 0.00 0.11 0.00 0.00 66.00 65.22 2isa h PRO 151 Cb 1.25 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 32.24 2isa h PRO 151 CO 0.62 0.19 -2.04 -2.13 -0.21 0.00 0.00 178.00 174.42 2isa n ARG 152 N -4.45 0.59 0.20 1.05 0.63 -1.26 -4.60 116.66 108.81 2isa n ARG 152 Ca 0.10 0.38 0.08 0.00 -0.92 0.00 0.00 57.85 57.49 2isa n ARG 152 Cb 0.46 -1.60 0.29 0.00 0.45 0.00 0.00 32.46 32.06 2isa n ARG 152 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 2isa h THR 153 N -0.92 0.58 -3.88 5.15 1.35 -1.96 -3.47 112.91 109.76 2isa h THR 153 Ca -0.56 -1.45 -0.37 0.00 -0.55 0.00 0.00 66.41 63.48 2isa h THR 153 Cb 1.53 2.01 -0.00 0.00 -1.73 0.00 0.00 68.15 69.95 2isa h THR 153 CO -0.31 0.28 -0.50 -3.20 -0.25 0.00 0.00 175.52 171.53 2isa n ASN 154 N -3.29 -5.21 -4.14 5.36 5.15 -0.75 -4.96 115.26 107.41 2isa n ASN 154 Ca 0.01 -0.08 -0.11 0.00 -0.60 0.00 0.00 54.58 53.80 2isa n ASN 154 Cb 0.54 -4.32 -0.10 0.00 -0.53 0.00 0.00 39.78 35.37 2isa n ASN 154 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 2isa s MET 155 N -5.33 0.75 0.57 1.20 -1.94 -1.26 -4.81 119.30 108.49 2isa s MET 155 Ca 0.12 -1.17 -0.21 0.00 -1.71 0.00 0.00 55.69 52.73 2isa s MET 155 Cb -0.06 -0.24 -0.04 0.00 2.01 0.00 0.00 34.83 36.50 2isa s MET 155 CO 0.15 0.01 1.34 1.03 -0.01 0.00 0.00 175.02 177.54 2isa s ARG 156 N -3.17 2.98 -0.20 2.03 0.52 -1.26 -1.23 118.95 118.61 2isa s ARG 156 Ca 0.06 2.18 0.01 0.00 -0.52 0.00 0.00 55.73 57.45 2isa s ARG 156 Cb 0.01 -2.14 0.04 0.00 0.52 0.00 0.00 34.95 33.38 2isa s ARG 156 CO -0.03 -1.30 -0.11 0.45 0.02 0.00 0.00 175.30 174.33 2isa s SER 157 N -1.09 3.50 0.22 0.23 0.15 -1.26 -4.86 113.70 110.58 2isa s SER 157 Ca 0.75 -0.93 -0.08 0.00 0.70 0.00 0.00 55.95 56.39 2isa s SER 157 Cb -0.39 -1.29 0.29 0.00 -1.71 0.00 0.00 66.02 62.91 2isa s SER 157 CO 0.45 -0.14 1.80 0.00 1.20 0.00 0.00 173.24 176.56 2isa h ALA 158 N 7.95 0.96 -0.17 5.45 0.00 -1.92 -1.35 119.26 130.18 2isa h ALA 158 Ca -0.28 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.67 2isa h ALA 158 Cb 1.09 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 2isa h ALA 158 CO 0.49 0.04 0.05 -0.22 0.00 0.00 0.00 179.25 179.61 2isa h LYS 159 N 0.69 0.13 -0.11 0.00 3.11 -1.93 -0.18 116.57 118.28 2isa h LYS 159 Ca 0.33 -0.01 0.01 0.00 -2.81 0.00 0.00 60.65 58.17 2isa h LYS 159 Cb 0.25 -0.03 -0.01 0.00 -1.00 0.00 0.00 32.23 31.44 2isa h LYS 159 CO -0.21 0.09 0.01 -0.91 -2.81 0.00 0.00 179.45 175.62 2isa h ASN 160 N 0.13 -0.01 -0.28 4.20 -0.26 -1.76 -0.06 115.58 117.55 2isa h ASN 160 Ca 0.07 0.02 0.01 0.00 -0.56 0.00 0.00 56.30 55.85 2isa h ASN 160 Cb 0.05 0.03 -0.02 0.00 -1.06 0.00 0.00 38.32 37.31 2isa h ASN 160 CO -0.08 0.01 0.15 -1.13 -1.06 0.00 0.00 177.43 175.32 2isa h ASN 161 N 0.06 0.23 0.66 5.81 -0.73 -1.06 -2.24 115.58 118.30 2isa h ASN 161 Ca 0.05 0.01 -0.27 0.00 1.87 0.00 0.00 56.30 57.96 2isa h ASN 161 Cb 0.05 -0.04 -0.00 0.00 0.27 0.00 0.00 38.32 38.60 2isa h ASN 161 CO -0.07 0.17 -1.24 -0.50 -0.37 0.00 0.00 177.43 175.42 2isa h TRP 162 N 0.31 0.43 -0.26 0.67 4.06 -0.95 -1.11 115.95 119.11 2isa h TRP 162 Ca 0.11 -0.31 0.05 0.00 2.06 0.00 0.00 58.89 60.80 2isa h TRP 162 Cb 0.02 -0.02 -0.05 0.00 -1.00 0.00 0.00 29.16 28.11 2isa h TRP 162 CO -0.09 1.26 -0.06 0.22 -3.56 0.00 0.00 178.44 176.21 2isa h ASP 163 N 0.06 -0.23 0.39 -3.49 3.58 -0.98 0.15 116.42 115.90 2isa h ASP 163 Ca -0.13 0.07 -0.02 0.00 0.42 0.00 0.00 57.03 57.38 2isa h ASP 163 Cb 1.95 0.15 0.00 0.00 1.72 0.00 0.00 39.33 43.16 2isa h ASP 163 CO 0.19 -0.08 -0.19 0.15 -2.88 0.00 0.00 179.24 176.44 2isa h PHE 164 N 0.01 -0.48 -0.68 0.28 3.57 -1.38 -2.68 116.94 115.57 2isa h PHE 164 Ca 0.12 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.69 2isa h PHE 164 Cb 0.18 0.16 -0.06 0.00 2.79 0.00 0.00 35.95 39.02 2isa h PHE 164 CO -0.25 -0.21 0.35 -1.49 -2.23 0.00 0.00 178.31 174.47 2isa h TRP 165 N -0.68 0.63 0.00 0.41 6.55 -1.06 -1.82 115.95 119.98 2isa h TRP 165 Ca -0.05 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.81 2isa h TRP 165 Cb 0.49 -0.18 0.00 0.00 -0.86 0.00 0.00 29.16 28.61 2isa h TRP 165 CO -0.01 0.25 0.00 0.25 -1.05 0.00 0.00 178.44 177.88 2isa n THR 166 N -4.85 0.83 1.07 1.49 -2.24 0.50 -2.00 114.28 109.08 2isa n THR 166 Ca 0.10 0.19 0.13 0.00 -2.27 0.00 0.00 64.05 62.19 2isa n THR 166 Cb 0.24 -1.01 0.38 0.00 -2.10 0.00 0.00 70.33 67.83 2isa n THR 166 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2isa n SER 167 N -1.87 0.45 -3.83 3.42 7.64 -0.69 -4.51 113.62 114.23 2isa n SER 167 Ca 0.03 -0.19 -0.29 0.00 1.01 0.00 0.00 58.87 59.42 2isa n SER 167 Cb 0.22 0.05 -0.13 0.00 -1.01 0.00 0.00 64.21 63.34 2isa n SER 167 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2isa s LEU 168 N -2.89 3.70 0.49 -3.43 1.43 -0.85 -4.97 118.68 112.16 2isa s LEU 168 Ca 0.15 -3.03 0.19 0.00 -1.03 0.00 0.00 54.13 50.41 2isa s LEU 168 Cb 0.18 -1.37 1.24 0.00 0.03 0.00 0.00 46.19 46.27 2isa s LEU 168 CO 0.62 -0.21 2.02 1.55 0.23 0.00 0.00 176.35 180.56 2isa h PRO 169 N 6.34 0.15 -0.07 1.29 0.13 -1.79 0.17 132.00 138.22 2isa h PRO 169 Ca 0.00 -0.01 0.02 0.00 -0.87 0.00 0.00 66.00 65.14 2isa h PRO 169 Cb 0.88 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.97 2isa h PRO 169 CO 0.61 0.10 0.27 1.05 -0.23 0.00 0.00 178.00 179.79 2isa h GLU 170 N 0.15 0.00 0.00 0.86 9.09 -1.88 -2.20 114.58 120.60 2isa h GLU 170 Ca 0.21 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.62 2isa h GLU 170 Cb 0.64 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.74 2isa h GLU 170 CO -0.03 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.03 2isa n ALA 171 N -2.03 1.89 -0.12 1.06 0.00 0.59 -4.03 120.51 117.88 2isa n ALA 171 Ca -0.01 -0.06 0.03 0.00 0.00 0.00 0.00 53.44 53.40 2isa n ALA 171 Cb 0.34 -1.33 0.33 0.00 0.00 0.00 0.00 19.45 18.80 2isa n ALA 171 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2isa h LEU 172 N 0.00 0.67 0.31 0.00 5.85 -1.57 -0.88 115.31 119.70 2isa h LEU 172 Ca 0.00 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 2isa h LEU 172 Cb 0.35 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 2isa h LEU 172 CO 0.00 0.48 -0.20 -0.74 -0.34 0.00 0.00 178.44 177.64 2isa h HIS 173 N 0.79 -0.53 -0.03 1.25 2.76 -1.84 -0.21 115.15 117.35 2isa h HIS 173 Ca 0.22 -0.00 -0.17 0.00 -2.20 0.00 0.00 60.37 58.22 2isa h HIS 173 Cb -0.07 0.19 -0.01 0.00 1.55 0.00 0.00 27.41 29.07 2isa h HIS 173 CO -0.00 -0.31 -0.73 0.37 -1.30 0.00 0.00 177.93 175.95 2isa h GLN 174 N -0.50 0.21 -0.34 5.26 5.75 -1.70 -2.37 115.11 121.42 2isa h GLN 174 Ca -0.03 -0.18 0.03 0.00 -0.15 0.00 0.00 58.65 58.31 2isa h GLN 174 Cb 0.42 0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.98 2isa h GLN 174 CO 0.02 0.85 0.16 0.28 -2.65 0.00 0.00 178.83 177.50 2isa h VAL 175 N 0.14 0.97 -0.64 2.39 2.07 -1.05 -0.66 116.25 119.47 2isa h VAL 175 Ca -0.02 -0.12 0.08 0.00 0.82 0.00 0.00 66.70 67.46 2isa h VAL 175 Cb 1.30 0.61 -0.06 0.00 -1.52 0.00 0.00 31.29 31.61 2isa h VAL 175 CO 0.11 0.06 0.30 0.74 0.02 0.00 0.00 177.57 178.80 2isa h THR 176 N 0.34 0.86 -0.32 2.57 2.02 -0.89 -0.67 112.91 116.81 2isa h THR 176 Ca 0.14 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 2isa h THR 176 Cb 0.06 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 66.73 2isa h THR 176 CO -0.11 0.10 0.16 0.40 0.37 0.00 0.00 175.52 176.44 2isa h ILE 177 N 0.53 1.15 0.00 3.11 2.04 -1.02 -1.16 117.51 122.17 2isa h ILE 177 Ca 0.31 -0.43 -0.10 0.00 1.00 0.00 0.00 64.86 65.64 2isa h ILE 177 Cb 0.31 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 2isa h ILE 177 CO -0.25 0.16 -0.49 1.62 0.00 0.00 0.00 178.15 179.18 2isa h VAL 178 N 0.39 1.13 0.00 1.67 3.04 -0.81 -2.50 116.25 119.16 2isa h VAL 178 Ca 0.11 -1.83 0.00 0.00 -1.01 0.00 0.00 66.70 63.97 2isa h VAL 178 Cb 0.11 2.06 0.00 0.00 -2.01 0.00 0.00 31.29 31.44 2isa h VAL 178 CO -0.01 0.48 -0.21 0.23 -1.01 0.00 0.00 177.57 177.05 2isa n MET 179 N -3.62 0.07 -1.45 4.17 2.81 -0.29 -4.01 117.12 114.80 2isa n MET 179 Ca -0.01 0.04 -0.25 0.00 -1.81 0.00 0.00 57.70 55.68 2isa n MET 179 Cb 0.57 -1.56 0.18 0.00 -0.71 0.00 0.00 33.22 31.70 2isa n MET 179 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 2isa n SER 180 N -1.67 -0.33 0.31 7.83 3.41 -0.45 -4.27 113.62 118.46 2isa n SER 180 Ca 0.06 -1.33 0.20 0.00 -0.26 0.00 0.00 58.87 57.54 2isa n SER 180 Cb 0.36 -0.85 1.00 0.00 -0.26 0.00 0.00 64.21 64.46 2isa n SER 180 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2isa h ASP 181 N -1.67 0.00 0.62 4.04 2.03 -1.86 -2.36 116.42 117.22 2isa h ASP 181 Ca -0.36 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.94 2isa h ASP 181 Cb 1.01 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.51 2isa h ASP 181 CO 0.25 0.01 0.00 0.54 -1.03 0.00 0.00 179.24 179.01 2isa n ARG 182 N -3.13 0.30 0.29 4.15 1.74 -1.26 -3.84 116.66 114.91 2isa n ARG 182 Ca -0.02 0.03 0.16 0.00 -0.77 0.00 0.00 57.85 57.25 2isa n ARG 182 Cb 0.17 -1.50 0.89 0.00 -1.02 0.00 0.00 32.46 31.00 2isa n ARG 182 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 2isa h GLY 183 N 4.60 0.00 -6.92 -0.13 0.00 -1.49 -3.35 103.07 95.79 2isa h GLY 183 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.72 2isa h GLY 183 CO 0.00 0.00 -0.74 -0.42 0.00 0.00 0.00 176.54 175.38 2isa s ILE 184 N -4.25 1.56 0.42 2.60 1.01 -1.25 -1.48 121.20 119.81 2isa s ILE 184 Ca -0.04 -2.93 -0.26 0.00 0.00 0.00 0.00 60.65 57.43 2isa s ILE 184 Cb 0.13 -2.07 -0.10 0.00 0.01 0.00 0.00 42.46 40.44 2isa s ILE 184 CO 0.53 -0.97 1.37 -2.65 0.00 0.00 0.00 174.94 173.22 2isa n PRO 185 N 3.11 2.19 -0.08 2.79 -0.02 -1.26 -0.77 135.00 140.96 2isa n PRO 185 Ca 0.14 0.77 -0.06 0.00 -2.02 0.00 0.00 63.50 62.34 2isa n PRO 185 Cb 0.37 -2.51 0.13 0.00 -0.02 0.00 0.00 33.50 31.46 2isa n PRO 185 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2isa h ALA 186 N 2.34 0.99 -2.71 3.55 0.00 -0.95 -3.43 119.26 119.06 2isa h ALA 186 Ca -0.49 -0.33 -0.11 0.00 0.00 0.00 0.00 54.91 53.98 2isa h ALA 186 Cb 1.28 -0.16 -0.12 0.00 0.00 0.00 0.00 17.79 18.79 2isa h ALA 186 CO 0.61 0.60 -0.29 0.95 0.00 0.00 0.00 179.25 181.12 2isa s THR 187 N -4.73 0.03 0.32 0.00 -4.23 -1.26 -4.91 115.64 100.86 2isa s THR 187 Ca -0.09 -1.50 0.33 0.00 -1.18 0.00 0.00 61.69 59.25 2isa s THR 187 Cb 0.14 -2.09 0.35 0.00 1.34 0.00 0.00 72.50 72.24 2isa s THR 187 CO 0.82 -0.13 2.07 1.88 -0.54 0.00 0.00 174.62 178.72 2isa h TYR 188 N 2.44 0.00 0.00 3.99 0.05 -1.88 -2.96 116.97 118.61 2isa h TYR 188 Ca -0.30 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.48 2isa h TYR 188 Cb 1.24 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.98 2isa h TYR 188 CO 0.39 0.07 0.00 0.00 -1.05 0.00 0.00 178.16 177.57 2isa h ARG 189 N 0.00 0.00 -0.88 4.88 3.08 -1.96 -3.31 114.38 116.18 2isa h ARG 189 Ca -0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 2isa h ARG 189 Cb 0.38 0.00 -0.37 0.00 0.08 0.00 0.00 29.97 30.06 2isa h ARG 189 CO 0.01 0.00 -0.15 0.72 -1.07 0.00 0.00 179.97 179.48 2isa n HIS 190 N -3.01 2.95 -4.07 3.04 8.25 -1.12 -4.44 115.22 116.82 2isa n HIS 190 Ca 0.03 -2.55 -0.08 0.00 -0.26 0.00 0.00 57.72 54.86 2isa n HIS 190 Cb 0.44 -0.77 -0.10 0.00 1.12 0.00 0.00 29.99 30.68 2isa n HIS 190 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2isa s MET 191 N -3.69 0.56 0.53 -0.41 0.23 -1.25 -2.62 119.30 112.64 2isa s MET 191 Ca 0.56 -1.08 -0.02 0.00 -1.03 0.00 0.00 55.69 54.12 2isa s MET 191 Cb 0.45 0.15 0.01 0.00 -1.53 0.00 0.00 34.83 33.91 2isa s MET 191 CO 0.01 -0.09 0.78 -1.01 -2.03 0.00 0.00 175.02 172.68 2isa s HIS 192 N -3.31 3.17 0.16 3.16 0.09 -1.26 -4.36 115.29 112.94 2isa s HIS 192 Ca 0.02 0.36 0.09 0.00 -0.00 0.00 0.00 55.06 55.52 2isa s HIS 192 Cb 0.04 -2.57 -0.04 0.00 -0.00 0.00 0.00 32.58 30.00 2isa s HIS 192 CO -0.08 -0.65 -0.19 0.20 -0.00 0.00 0.00 174.74 174.03 2isa s GLY 193 N -4.29 1.40 -0.03 -2.22 0.00 -0.10 -4.13 107.32 97.94 2isa s GLY 193 Ca 0.52 -1.48 -0.09 0.00 0.00 0.00 0.00 44.72 43.67 2isa s GLY 193 CO 0.41 -1.53 0.21 -1.36 0.00 0.00 0.00 173.10 170.82 2isa s PHE 194 N -2.00 -0.11 0.30 1.90 0.40 0.23 0.35 117.98 119.06 2isa s PHE 194 Ca 0.15 0.21 0.31 0.00 -0.60 0.00 0.00 56.93 57.00 2isa s PHE 194 Cb -0.06 0.03 1.47 0.00 0.51 0.00 0.00 43.02 44.97 2isa s PHE 194 CO 0.07 -0.25 2.04 0.78 0.70 0.00 0.00 175.22 178.55 2isa h GLY 195 N 4.69 0.00 0.00 4.36 0.00 -1.64 -2.15 103.07 108.33 2isa h GLY 195 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2isa h GLY 195 CO 0.39 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.37 2isa n SER 196 N -3.34 0.00 -4.74 0.19 7.64 -1.26 -4.79 113.62 107.31 2isa n SER 196 Ca -0.01 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.52 2isa n SER 196 Cb 0.27 0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.53 2isa n SER 196 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 2isa s HIS 197 N 0.00 2.28 0.13 1.43 3.76 -1.26 -4.74 115.29 116.88 2isa s HIS 197 Ca 0.00 1.56 -0.31 0.00 -0.15 0.00 0.00 55.06 56.16 2isa s HIS 197 Cb 0.00 -3.43 -0.09 0.00 1.11 0.00 0.00 32.58 30.18 2isa s HIS 197 CO 0.00 -2.31 1.44 0.99 -0.85 0.00 0.00 174.74 174.01 2isa s THR 198 N -1.89 3.11 0.00 1.30 2.01 -1.26 -4.65 115.64 114.26 2isa s THR 198 Ca 0.74 0.79 0.00 0.00 0.31 0.00 0.00 61.69 63.54 2isa s THR 198 Cb -0.28 -3.51 0.00 0.00 0.01 0.00 0.00 72.50 68.72 2isa s THR 198 CO 0.40 0.06 0.00 0.49 -0.69 0.00 0.00 174.62 174.88 2isa n PHE 199 N 3.95 -0.24 -4.15 4.92 3.01 0.05 -4.14 117.46 120.85 2isa n PHE 199 Ca 0.12 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.44 2isa n PHE 199 Cb 0.41 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.77 2isa n PHE 199 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2isa s SER 200 N -0.61 1.34 -0.06 4.37 1.04 -0.78 -0.60 113.70 118.40 2isa s SER 200 Ca 0.00 -0.73 -0.00 0.00 0.48 0.00 0.00 55.95 55.70 2isa s SER 200 Cb 0.00 0.01 -0.03 0.00 0.10 0.00 0.00 66.02 66.10 2isa s SER 200 CO 0.00 -0.23 -0.01 -0.36 0.98 0.00 0.00 173.24 173.62 2isa s PHE 201 N -2.05 3.09 -0.09 5.02 0.08 0.37 -1.12 117.98 123.28 2isa s PHE 201 Ca 0.01 0.13 0.04 0.00 0.12 0.00 0.00 56.93 57.23 2isa s PHE 201 Cb -0.05 -1.74 -0.00 0.00 -0.57 0.00 0.00 43.02 40.66 2isa s PHE 201 CO 0.00 0.44 -0.24 0.42 -0.10 0.00 0.00 175.22 175.75 2isa s ILE 202 N -0.93 2.00 0.52 0.64 -1.09 -0.59 -0.80 121.20 120.95 2isa s ILE 202 Ca 0.15 -1.00 0.05 0.00 -2.23 0.00 0.00 60.65 57.63 2isa s ILE 202 Cb -0.11 -1.73 0.09 0.00 -1.58 0.00 0.00 42.46 39.13 2isa s ILE 202 CO 0.04 0.55 0.71 -0.46 -1.23 0.00 0.00 174.94 174.56 2isa n ASN 203 N 3.41 1.55 -0.04 3.58 0.23 -0.64 -1.43 115.26 121.92 2isa n ASN 203 Ca -0.19 -2.17 0.20 0.00 -0.53 0.00 0.00 54.58 51.89 2isa n ASN 203 Cb 0.53 -0.41 0.67 0.00 -2.08 0.00 0.00 39.78 38.49 2isa n ASN 203 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 2isa h SER 204 N -0.10 0.05 -0.58 0.53 0.02 -1.88 -0.80 113.55 110.78 2isa h SER 204 Ca -0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2isa h SER 204 Cb 1.03 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.56 2isa h SER 204 CO 0.31 0.03 0.00 0.47 -1.14 0.00 0.00 176.83 176.50 2isa n ASP 205 N -4.38 4.21 -1.91 3.07 8.00 -1.26 -4.93 116.55 119.36 2isa n ASP 205 Ca 0.11 -2.36 -0.18 0.00 0.71 0.00 0.00 54.79 53.07 2isa n ASP 205 Cb 0.63 -0.54 -0.02 0.00 -0.02 0.00 0.00 41.12 41.17 2isa n ASP 205 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2isa n ASN 206 N 1.02 -5.17 -4.79 -2.24 4.13 -0.31 -5.01 115.26 102.89 2isa n ASN 206 Ca 0.23 0.06 -0.39 0.00 1.68 0.00 0.00 54.58 56.16 2isa n ASN 206 Cb 0.78 -4.24 -0.06 0.00 -1.54 0.00 0.00 39.78 34.72 2isa n ASN 206 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 2isa s GLU 207 N -4.65 4.46 -0.13 3.52 2.02 -1.26 -4.68 118.70 117.98 2isa s GLU 207 Ca 0.00 1.05 -0.06 0.00 0.02 0.00 0.00 54.97 55.98 2isa s GLU 207 Cb 0.00 -3.18 -0.04 0.00 0.10 0.00 0.00 34.13 31.01 2isa s GLU 207 CO 0.00 0.55 0.08 0.50 0.02 0.00 0.00 175.26 176.41 2isa s ARG 208 N -1.31 3.50 0.03 1.61 3.52 -1.26 -1.63 118.95 123.42 2isa s ARG 208 Ca 0.36 -0.27 0.07 0.00 -0.13 0.00 0.00 55.73 55.76 2isa s ARG 208 Cb -0.21 -3.10 -0.02 0.00 -1.56 0.00 0.00 34.95 30.05 2isa s ARG 208 CO 0.24 0.60 -0.19 0.71 -0.81 0.00 0.00 175.30 175.85 2isa s TYR 209 N -0.54 1.71 0.20 5.12 1.51 0.02 -3.27 117.35 122.10 2isa s TYR 209 Ca 0.11 -0.36 -0.22 0.00 -1.01 0.00 0.00 57.07 55.59 2isa s TYR 209 Cb -0.12 -1.03 -0.08 0.00 -0.11 0.00 0.00 41.96 40.62 2isa s TYR 209 CO 0.02 0.06 0.74 -1.58 -1.11 0.00 0.00 175.55 173.69 2isa s TRP 210 N -0.74 3.73 0.02 2.71 0.52 0.20 -0.48 118.94 124.91 2isa s TRP 210 Ca 0.07 1.47 0.01 0.00 0.02 0.00 0.00 56.10 57.67 2isa s TRP 210 Cb -0.08 -2.67 -0.02 0.00 -1.15 0.00 0.00 33.47 29.55 2isa s TRP 210 CO 0.01 0.39 -0.04 0.54 0.02 0.00 0.00 176.95 177.87 2isa s VAL 211 N -1.40 0.25 -0.07 4.03 0.11 0.23 -0.73 120.40 122.82 2isa s VAL 211 Ca 0.41 -0.75 0.03 0.00 -2.93 0.00 0.00 61.98 58.74 2isa s VAL 211 Cb -0.19 -0.33 -0.02 0.00 -1.53 0.00 0.00 36.38 34.31 2isa s VAL 211 CO 0.22 -0.32 -0.16 -0.54 -3.33 0.00 0.00 175.10 170.97 2isa s LYS 212 N -1.13 2.77 -0.12 1.54 -0.14 -0.81 -0.77 119.74 121.08 2isa s LYS 212 Ca -0.10 -0.73 -0.13 0.00 -1.36 0.00 0.00 55.97 53.65 2isa s LYS 212 Cb -0.08 -2.41 -0.05 0.00 -1.68 0.00 0.00 37.83 33.62 2isa s LYS 212 CO -0.00 0.46 0.29 -0.06 -0.76 0.00 0.00 175.35 175.28 2isa s PHE 213 N -0.31 3.55 -0.04 3.18 0.08 -1.26 -2.00 117.98 121.18 2isa s PHE 213 Ca 0.02 0.67 0.03 0.00 0.12 0.00 0.00 56.93 57.78 2isa s PHE 213 Cb -0.13 -2.25 0.00 0.00 -0.57 0.00 0.00 43.02 40.07 2isa s PHE 213 CO 0.03 0.43 -0.14 -1.01 -0.10 0.00 0.00 175.22 174.43 2isa s HIS 214 N -0.17 1.41 -0.28 0.36 3.76 0.72 -1.75 115.29 119.34 2isa s HIS 214 Ca 0.18 -0.41 0.03 0.00 -0.15 0.00 0.00 55.06 54.71 2isa s HIS 214 Cb -0.14 -0.98 0.07 0.00 1.11 0.00 0.00 32.58 32.65 2isa s HIS 214 CO 0.06 -0.16 -0.06 -0.06 -0.85 0.00 0.00 174.74 173.67 2isa s PHE 215 N 0.19 3.39 -0.30 1.40 0.40 0.15 -0.49 117.98 122.72 2isa s PHE 215 Ca -0.05 -2.46 -0.16 0.00 -0.60 0.00 0.00 56.93 53.66 2isa s PHE 215 Cb -0.11 -2.19 -0.02 0.00 0.51 0.00 0.00 43.02 41.21 2isa s PHE 215 CO 0.02 -0.89 0.44 0.08 0.70 0.00 0.00 175.22 175.57 2isa s VAL 216 N 1.07 5.10 0.15 -0.44 1.01 0.15 -0.92 120.40 126.52 2isa s VAL 216 Ca -0.04 0.48 -0.31 0.00 0.00 0.00 0.00 61.98 62.11 2isa s VAL 216 Cb -0.20 -3.82 -0.10 0.00 0.00 0.00 0.00 36.38 32.25 2isa s VAL 216 CO -0.05 -0.01 1.71 -0.55 0.00 0.00 0.00 175.10 176.20 2isa s SER 217 N 1.67 6.48 0.00 3.32 0.15 -1.26 -0.83 113.70 123.23 2isa s SER 217 Ca 0.17 2.72 0.28 0.00 0.70 0.00 0.00 55.95 59.82 2isa s SER 217 Cb -0.16 -2.58 1.11 0.00 -1.71 0.00 0.00 66.02 62.68 2isa s SER 217 CO 0.11 -0.94 1.81 0.00 1.20 0.00 0.00 173.24 175.43 2isa n GLN 218 N 4.77 0.21 0.06 5.44 6.02 -0.60 -3.09 117.38 130.19 2isa n GLN 218 Ca 0.16 -0.05 0.12 0.00 -0.01 0.00 0.00 57.00 57.22 2isa n GLN 218 Cb 0.38 -1.50 0.25 0.00 1.02 0.00 0.00 30.24 30.38 2isa n GLN 218 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2isa n GLN 219 N -1.35 0.26 0.00 -1.09 3.00 -1.26 -5.00 117.38 111.94 2isa n GLN 219 Ca 0.09 0.11 0.00 0.00 -0.01 0.00 0.00 57.00 57.19 2isa n GLN 219 Cb 0.31 -1.70 0.00 0.00 0.00 0.00 0.00 30.24 28.86 2isa n GLN 219 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2isa n GLY 220 N 1.35 -0.79 3.71 1.08 0.00 -1.18 -4.93 105.19 104.43 2isa n GLY 220 Ca 0.04 -1.71 -0.36 0.00 0.00 0.00 0.00 46.02 44.00 2isa n GLY 220 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2isa s ILE 221 N -1.05 5.35 -0.01 -0.61 -1.09 -1.26 -4.18 121.20 118.34 2isa s ILE 221 Ca 0.00 0.34 0.01 0.00 -2.23 0.00 0.00 60.65 58.77 2isa s ILE 221 Cb 0.00 -3.55 0.01 0.00 -1.58 0.00 0.00 42.46 37.34 2isa s ILE 221 CO 0.00 0.39 -0.03 -0.54 -1.23 0.00 0.00 174.94 173.52 2isa s LYS 222 N 0.64 0.38 0.25 2.79 1.02 -1.08 -5.05 119.74 118.69 2isa s LYS 222 Ca 0.11 -0.10 0.04 0.00 0.02 0.00 0.00 55.97 56.04 2isa s LYS 222 Cb -0.12 -0.41 -0.05 0.00 -0.52 0.00 0.00 37.83 36.73 2isa s LYS 222 CO 0.02 0.03 -0.01 -0.80 -0.92 0.00 0.00 175.35 173.67 2isa s ASN 223 N 0.21 2.04 -0.03 2.83 0.01 -1.26 -0.35 114.94 118.39 2isa s ASN 223 Ca -0.02 -1.22 0.07 0.00 -0.71 0.00 0.00 52.86 50.98 2isa s ASN 223 Cb -0.05 -0.03 -0.02 0.00 0.41 0.00 0.00 41.25 41.56 2isa s ASN 223 CO -0.00 -0.48 -0.25 -0.76 -1.51 0.00 0.00 177.10 174.09 2isa s LEU 224 N -3.34 2.08 0.89 0.60 1.43 0.06 -4.61 118.68 115.78 2isa s LEU 224 Ca 0.29 -0.47 -0.11 0.00 -1.03 0.00 0.00 54.13 52.81 2isa s LEU 224 Cb 0.05 -1.36 0.13 0.00 0.03 0.00 0.00 46.19 45.04 2isa s LEU 224 CO 0.10 0.30 1.10 -0.94 0.23 0.00 0.00 176.35 177.13 2isa s SER 225 N -0.48 3.41 0.25 2.29 1.04 -1.26 -4.50 113.70 114.44 2isa s SER 225 Ca 0.06 1.72 -0.03 0.00 0.48 0.00 0.00 55.95 58.19 2isa s SER 225 Cb -0.11 -2.36 0.49 0.00 0.10 0.00 0.00 66.02 64.14 2isa s SER 225 CO 0.00 -2.72 1.75 0.44 0.98 0.00 0.00 173.24 173.70 2isa h ASP 226 N -1.60 0.45 -0.38 7.02 3.32 -1.99 0.19 116.42 123.43 2isa h ASP 226 Ca -0.48 0.09 -0.08 0.00 0.02 0.00 0.00 57.03 56.58 2isa h ASP 226 Cb 1.27 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.84 2isa h ASP 226 CO 0.51 0.19 -0.08 0.00 -1.72 0.00 0.00 179.24 178.14 2isa h ALA 227 N 1.54 0.53 -0.36 3.45 0.00 -1.99 -0.85 119.26 121.57 2isa h ALA 227 Ca 0.43 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2isa h ALA 227 Cb 0.61 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2isa h ALA 227 CO -0.36 0.37 0.15 0.93 0.00 0.00 0.00 179.25 180.34 2isa h GLU 228 N 0.54 0.54 -0.53 0.00 5.08 -1.86 -1.89 114.58 116.46 2isa h GLU 228 Ca 0.10 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2isa h GLU 228 Cb 0.59 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 2isa h GLU 228 CO 0.04 0.53 0.25 0.00 -1.00 0.00 0.00 179.01 178.82 2isa h ALA 229 N 0.99 0.68 -0.19 3.43 0.00 -0.88 -0.48 119.26 122.81 2isa h ALA 229 Ca 0.12 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2isa h ALA 229 Cb 0.18 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2isa h ALA 229 CO -0.01 0.24 0.02 0.78 0.00 0.00 0.00 179.25 180.29 2isa h GLY 230 N 0.70 0.20 0.54 0.00 0.00 -1.09 0.19 103.07 103.62 2isa h GLY 230 Ca 0.18 -0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.57 2isa h GLY 230 CO -0.02 -0.01 0.16 -2.09 0.00 0.00 0.00 176.54 174.57 2isa h GLU 231 N 0.10 0.32 0.08 4.80 4.81 -1.15 -0.89 114.58 122.65 2isa h GLU 231 Ca 0.09 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2isa h GLU 231 Cb 0.09 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.40 2isa h GLU 231 CO -0.13 0.21 -0.04 1.25 -0.73 0.00 0.00 179.01 179.57 2isa h LEU 232 N 0.33 -0.09 -0.81 1.64 5.85 -0.68 -3.00 115.31 118.55 2isa h LEU 232 Ca 0.23 -0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.94 2isa h LEU 232 Cb 0.24 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 2isa h LEU 232 CO -0.24 -0.01 0.51 0.58 -0.34 0.00 0.00 178.44 178.94 2isa h VAL 233 N -0.16 1.09 -0.83 1.05 2.07 -0.29 0.13 116.25 119.31 2isa h VAL 233 Ca -0.01 -0.33 0.15 0.00 0.82 0.00 0.00 66.70 67.32 2isa h VAL 233 Cb 0.13 0.03 -0.06 0.00 -1.52 0.00 0.00 31.29 29.87 2isa h VAL 233 CO 0.02 0.18 0.54 1.23 0.02 0.00 0.00 177.57 179.56 2isa h GLY 234 N 0.97 0.95 1.41 2.17 0.00 -1.11 -2.06 103.07 105.39 2isa h GLY 234 Ca 0.34 -0.24 -0.27 0.00 0.00 0.00 0.00 47.33 47.16 2isa h GLY 234 CO -0.14 0.07 -1.41 3.43 0.00 0.00 0.00 176.54 178.49 2isa h ASN 235 N 0.55 0.12 -0.92 0.19 -0.26 -0.96 -3.48 115.58 110.83 2isa h ASN 235 Ca 0.41 -0.17 0.10 0.00 -0.56 0.00 0.00 56.30 56.08 2isa h ASN 235 Cb 0.80 -0.04 -0.21 0.00 -1.06 0.00 0.00 38.32 37.81 2isa h ASN 235 CO -0.16 1.14 -0.24 -0.62 -1.06 0.00 0.00 177.43 176.50 2isa s ASP 236 N -6.58 -1.30 0.00 5.81 2.15 0.29 -4.99 116.67 112.05 2isa s ASP 236 Ca -0.04 0.73 0.26 0.00 0.43 0.00 0.00 52.55 53.92 2isa s ASP 236 Cb 0.08 2.06 1.38 0.00 -0.30 0.00 0.00 42.92 46.14 2isa s ASP 236 CO 0.83 -0.24 1.87 0.54 -0.17 0.00 0.00 175.17 178.00 2isa n ARG 237 N 5.43 0.54 -0.31 4.34 3.00 -1.24 -3.72 116.66 124.70 2isa n ARG 237 Ca -0.01 0.03 0.08 0.00 -0.01 0.00 0.00 57.85 57.94 2isa n ARG 237 Cb 0.52 -1.50 0.17 0.00 0.00 0.00 0.00 32.46 31.65 2isa n ARG 237 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 2isa n GLU 238 N -1.17 1.47 -0.34 5.56 -0.58 -1.26 -1.46 120.64 122.86 2isa n GLU 238 Ca 0.15 -2.89 0.10 0.00 -0.42 0.00 0.00 57.16 54.10 2isa n GLU 238 Cb 0.16 -1.57 0.29 0.00 -0.57 0.00 0.00 31.44 29.75 2isa n GLU 238 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2isa h SER 239 N 0.48 0.83 0.54 1.62 4.64 -1.95 -0.62 113.55 119.09 2isa h SER 239 Ca 0.01 0.06 -0.29 0.00 -0.47 0.00 0.00 61.79 61.10 2isa h SER 239 Cb 1.04 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 63.02 2isa h SER 239 CO 0.02 0.39 -1.42 0.45 -0.87 0.00 0.00 176.83 175.40 2isa h HIS 240 N 0.86 0.41 -0.16 4.77 3.86 -1.90 -1.48 115.15 121.50 2isa h HIS 240 Ca 0.51 -0.30 -0.00 0.00 -1.16 0.00 0.00 60.37 59.42 2isa h HIS 240 Cb 0.67 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 29.12 2isa h HIS 240 CO -0.00 1.31 0.09 0.37 0.86 0.00 0.00 177.93 180.56 2isa h GLN 241 N 0.06 0.23 -0.35 2.45 5.75 -1.90 -1.71 115.11 119.64 2isa h GLN 241 Ca -0.20 -0.02 0.01 0.00 -0.15 0.00 0.00 58.65 58.28 2isa h GLN 241 Cb 1.99 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 30.47 2isa h GLN 241 CO 0.17 0.22 0.22 -0.09 -2.65 0.00 0.00 178.83 176.70 2isa h ARG 242 N 0.17 0.44 -0.10 1.69 2.43 -1.12 -0.08 114.38 117.82 2isa h ARG 242 Ca 0.06 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2isa h ARG 242 Cb 0.06 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 2isa h ARG 242 CO -0.01 0.29 0.05 0.22 -1.51 0.00 0.00 179.97 179.01 2isa h ASP 243 N 0.45 0.08 0.06 -3.80 3.58 -1.24 -0.09 116.42 115.48 2isa h ASP 243 Ca 0.13 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.58 2isa h ASP 243 Cb -0.04 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.00 2isa h ASP 243 CO -0.04 0.07 -0.03 0.25 -2.88 0.00 0.00 179.24 176.61 2isa h LEU 244 N 0.11 -0.07 -0.08 2.28 5.85 -1.06 -0.35 115.31 121.99 2isa h LEU 244 Ca 0.04 -0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.61 2isa h LEU 244 Cb -0.00 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 2isa h LEU 244 CO -0.02 0.13 -0.09 0.25 -0.34 0.00 0.00 178.44 178.38 2isa h LEU 245 N -0.28 -0.27 -0.65 2.25 5.85 -1.00 -2.52 115.31 118.69 2isa h LEU 245 Ca -0.01 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 2isa h LEU 245 Cb 0.24 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 2isa h LEU 245 CO 0.01 -0.12 0.25 0.44 -0.34 0.00 0.00 178.44 178.69 2isa h ASP 246 N -0.11 0.91 -0.31 1.25 3.32 -0.96 -0.41 116.42 120.09 2isa h ASP 246 Ca 0.06 -0.18 0.04 0.00 0.02 0.00 0.00 57.03 56.98 2isa h ASP 246 Cb 0.20 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.47 2isa h ASP 246 CO -0.15 0.84 0.06 0.28 -1.72 0.00 0.00 179.24 178.55 2isa h SER 247 N 0.92 0.01 -0.50 6.45 0.02 -0.95 -1.06 113.55 118.43 2isa h SER 247 Ca 0.22 0.05 -0.11 0.00 -0.84 0.00 0.00 61.79 61.11 2isa h SER 247 Cb 0.22 0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 2isa h SER 247 CO -0.02 0.04 -0.10 0.40 -1.14 0.00 0.00 176.83 176.02 2isa h ILE 248 N 0.17 1.27 0.00 3.27 2.04 -1.30 -0.36 117.51 122.60 2isa h ILE 248 Ca 0.15 -1.23 0.00 0.00 1.00 0.00 0.00 64.86 64.77 2isa h ILE 248 Cb 0.16 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 2isa h ILE 248 CO -0.19 0.43 0.00 0.47 0.00 0.00 0.00 178.15 178.86 2isa n ASP 249 N -4.21 0.66 -0.74 1.72 8.00 -0.18 -1.81 116.55 119.98 2isa n ASP 249 Ca 0.01 0.71 0.08 0.00 0.71 0.00 0.00 54.79 56.30 2isa n ASP 249 Cb 0.39 -0.83 0.23 0.00 -0.02 0.00 0.00 41.12 40.89 2isa n ASP 249 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2isa n ASN 250 N -2.28 3.57 -3.85 -2.24 4.13 -0.43 -4.99 115.26 109.16 2isa n ASN 250 Ca 0.01 -2.93 -0.29 0.00 1.68 0.00 0.00 54.58 53.05 2isa n ASN 250 Cb 0.17 -0.50 0.03 0.00 -1.54 0.00 0.00 39.78 37.94 2isa n ASN 250 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2isa n GLN 251 N -0.56 -5.87 -3.60 3.52 3.00 -0.75 -4.93 117.38 108.19 2isa n GLN 251 Ca 0.19 0.64 -0.35 0.00 -0.01 0.00 0.00 57.00 57.47 2isa n GLN 251 Cb 0.81 -5.53 -0.07 0.00 0.00 0.00 0.00 30.24 25.46 2isa n GLN 251 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 2isa n ASP 252 N -2.88 4.22 -4.69 1.08 4.64 -0.22 -5.03 116.55 113.67 2isa n ASP 252 Ca 0.01 -3.18 -0.42 0.00 -1.38 0.00 0.00 54.79 49.81 2isa n ASP 252 Cb 0.54 -1.01 -0.03 0.00 -1.04 0.00 0.00 41.12 39.58 2isa n ASP 252 CO 0.00 0.00 0.00 -0.36 -0.82 0.00 0.00 177.20 176.02 2isa s PHE 253 N -1.57 3.30 0.38 -0.67 2.99 -1.26 -4.38 117.98 116.77 2isa s PHE 253 Ca 0.29 1.32 -0.24 0.00 0.00 0.00 0.00 56.93 58.30 2isa s PHE 253 Cb -0.04 -3.36 -0.10 0.00 0.00 0.00 0.00 43.02 39.52 2isa s PHE 253 CO -0.11 -1.04 0.99 -1.25 -0.00 0.00 0.00 175.22 173.81 2isa s PRO 254 N 1.97 4.32 0.14 0.24 0.04 -1.25 -4.84 135.00 135.62 2isa s PRO 254 Ca 0.55 1.37 0.09 0.00 0.04 0.00 0.00 61.00 63.04 2isa s PRO 254 Cb -0.24 -2.56 -0.04 0.00 0.04 0.00 0.00 34.50 31.70 2isa s PRO 254 CO 0.22 0.03 -0.21 0.15 0.04 0.00 0.00 177.00 177.24 2isa s LYS 255 N -2.48 1.25 0.04 4.56 1.02 -1.26 -1.59 119.74 121.27 2isa s LYS 255 Ca 0.56 -1.32 0.04 0.00 0.02 0.00 0.00 55.97 55.27 2isa s LYS 255 Cb -0.18 -1.45 -0.02 0.00 -0.52 0.00 0.00 37.83 35.66 2isa s LYS 255 CO 0.23 0.32 -0.11 -1.58 -0.92 0.00 0.00 175.35 173.29 2isa s TRP 256 N -1.58 0.97 -0.25 3.18 0.51 -0.47 -1.56 118.94 119.74 2isa s TRP 256 Ca 0.12 -0.37 -0.10 0.00 -2.12 0.00 0.00 56.10 53.63 2isa s TRP 256 Cb -0.08 -0.57 -0.04 0.00 -0.81 0.00 0.00 33.47 31.96 2isa s TRP 256 CO 0.06 -0.00 0.14 0.99 -0.51 0.00 0.00 176.95 177.63 2isa s THR 257 N -0.96 5.06 -0.07 2.01 2.01 -0.01 -0.69 115.64 123.00 2isa s THR 257 Ca -0.02 0.08 -0.30 0.00 0.31 0.00 0.00 61.69 61.76 2isa s THR 257 Cb -0.08 -3.37 -0.02 0.00 0.01 0.00 0.00 72.50 69.04 2isa s THR 257 CO 0.01 0.33 1.08 -0.22 -0.69 0.00 0.00 174.62 175.13 2isa s LEU 258 N 1.31 4.27 0.06 4.42 2.96 0.90 -0.67 118.68 131.93 2isa s LEU 258 Ca 0.06 1.66 0.05 0.00 -0.22 0.00 0.00 54.13 55.69 2isa s LEU 258 Cb -0.15 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 42.96 2isa s LEU 258 CO 0.06 -0.49 -0.14 -0.54 -1.32 0.00 0.00 176.35 173.92 2isa s LYS 259 N 2.00 0.84 0.10 1.98 1.02 0.36 -1.33 119.74 124.71 2isa s LYS 259 Ca 0.52 -0.90 0.07 0.00 0.02 0.00 0.00 55.97 55.67 2isa s LYS 259 Cb -0.21 -0.85 -0.03 0.00 -0.52 0.00 0.00 37.83 36.22 2isa s LYS 259 CO 0.20 0.19 -0.18 0.14 -0.92 0.00 0.00 175.35 174.79 2isa s VAL 260 N -1.17 1.52 -0.14 3.17 -7.23 0.44 -0.20 120.40 116.79 2isa s VAL 260 Ca -0.01 -1.55 -0.08 0.00 -1.81 0.00 0.00 61.98 58.53 2isa s VAL 260 Cb -0.09 -1.46 -0.04 0.00 0.56 0.00 0.00 36.38 35.34 2isa s VAL 260 CO 0.02 -0.18 0.13 -1.10 -0.31 0.00 0.00 175.10 173.66 2isa s GLN 261 N -2.07 3.62 -0.16 4.82 -0.21 -0.84 -0.20 119.66 124.62 2isa s GLN 261 Ca 0.06 -0.17 0.00 0.00 0.02 0.00 0.00 55.36 55.27 2isa s GLN 261 Cb -0.09 -3.23 0.03 0.00 1.00 0.00 0.00 33.01 30.72 2isa s GLN 261 CO 0.04 0.65 -0.11 0.42 -2.12 0.00 0.00 175.29 174.16 2isa s ILE 262 N -0.65 1.45 -0.21 1.08 1.01 -1.26 -1.92 121.20 120.69 2isa s ILE 262 Ca 0.13 -0.66 -0.03 0.00 0.00 0.00 0.00 60.65 60.09 2isa s ILE 262 Cb -0.12 -1.44 -0.00 0.00 0.01 0.00 0.00 42.46 40.91 2isa s ILE 262 CO 0.02 0.35 -0.07 -0.32 0.00 0.00 0.00 174.94 174.92 2isa s MET 263 N 1.52 3.29 0.44 2.79 -2.45 0.10 -4.98 119.30 120.01 2isa s MET 263 Ca 0.03 -0.67 -0.24 0.00 -1.25 0.00 0.00 55.69 53.56 2isa s MET 263 Cb -0.14 -2.92 -0.09 0.00 1.25 0.00 0.00 34.83 32.93 2isa s MET 263 CO -0.09 -0.20 1.11 -2.30 1.05 0.00 0.00 175.02 174.58 2isa n PRO 264 N 4.76 1.52 -0.29 4.11 -0.02 -1.26 -0.62 135.00 143.20 2isa n PRO 264 Ca -0.19 0.55 0.09 0.00 -2.02 0.00 0.00 63.50 61.93 2isa n PRO 264 Cb 0.51 -2.20 0.24 0.00 -0.02 0.00 0.00 33.50 32.03 2isa n PRO 264 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2isa h GLU 265 N 1.62 0.48 0.00 -0.52 4.81 -1.91 -1.47 114.58 117.59 2isa h GLU 265 Ca -0.46 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 58.72 2isa h GLU 265 Cb 1.32 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.59 2isa h GLU 265 CO 0.57 0.32 -0.09 0.00 -0.73 0.00 0.00 179.01 179.08 2isa h ALA 266 N 1.61 1.53 0.00 2.92 0.00 -1.89 -2.81 119.26 120.62 2isa h ALA 266 Ca 0.49 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 2isa h ALA 266 Cb 0.79 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 2isa h ALA 266 CO -0.43 0.11 -0.07 -0.44 0.00 0.00 0.00 179.25 178.42 2isa h ASP 267 N 0.00 0.00 0.29 0.00 5.19 -1.61 -3.17 116.42 117.12 2isa h ASP 267 Ca -0.00 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 2isa h ASP 267 Cb 0.21 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.71 2isa h ASP 267 CO 0.01 0.07 -0.11 0.00 -3.12 0.00 0.00 179.24 176.09 2isa h ALA 268 N 1.93 1.37 0.00 3.45 0.00 -1.64 -0.92 119.26 123.45 2isa h ALA 268 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2isa h ALA 268 Cb 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2isa h ALA 268 CO 0.01 0.14 -0.52 0.00 0.00 0.00 0.00 179.25 178.89 2isa h ALA 269 N 1.89 0.70 0.00 0.00 0.00 -1.78 -3.38 119.26 116.69 2isa h ALA 269 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2isa h ALA 269 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2isa h ALA 269 CO 0.01 0.00 -1.23 0.25 0.00 0.00 0.00 179.25 178.29 2isa n THR 270 N -2.50 0.00 -2.35 0.00 -2.24 -0.46 -5.02 114.28 101.72 2isa n THR 270 Ca 0.03 -0.26 -0.35 0.00 -2.27 0.00 0.00 64.05 61.20 2isa n THR 270 Cb 0.49 0.52 -0.01 0.00 -2.10 0.00 0.00 70.33 69.23 2isa n THR 270 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2isa s VAL 271 N -2.69 3.34 -0.86 2.28 -7.23 -0.57 -4.96 120.40 109.72 2isa s VAL 271 Ca -0.01 0.85 0.25 0.00 -1.81 0.00 0.00 61.98 61.26 2isa s VAL 271 Cb 0.09 -3.35 0.23 0.00 0.56 0.00 0.00 36.38 33.91 2isa s VAL 271 CO 0.57 -0.17 1.77 -0.81 -0.31 0.00 0.00 175.10 176.15 2isa n PRO 272 N -1.13 0.10 -4.27 4.82 -0.04 -1.26 -4.76 135.00 128.46 2isa n PRO 272 Ca 0.11 0.16 -0.24 0.00 -0.04 0.00 0.00 63.50 63.49 2isa n PRO 272 Cb 0.51 -1.63 -0.07 0.00 -0.04 0.00 0.00 33.50 32.27 2isa n PRO 272 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 2isa s TYR 273 N -3.07 2.74 -0.31 0.54 -0.85 -1.26 -5.08 117.35 110.06 2isa s TYR 273 Ca 0.10 -0.20 -0.29 0.00 -0.52 0.00 0.00 57.07 56.16 2isa s TYR 273 Cb 0.14 -1.24 -0.01 0.00 0.38 0.00 0.00 41.96 41.23 2isa s TYR 273 CO 0.48 0.59 1.52 1.21 -1.52 0.00 0.00 175.55 177.83 2isa s ASN 274 N -3.49 6.35 0.00 -0.18 3.84 -1.26 -4.89 114.94 115.31 2isa s ASN 274 Ca 0.30 1.26 0.16 0.00 0.21 0.00 0.00 52.86 54.79 2isa s ASN 274 Cb -0.07 -2.53 0.71 0.00 -0.55 0.00 0.00 41.25 38.81 2isa s ASN 274 CO 0.20 -1.34 1.48 -0.81 -2.79 0.00 0.00 177.10 173.84 2isa n PRO 275 N 7.83 0.08 -0.15 0.43 -0.04 -1.26 -2.62 135.00 139.26 2isa n PRO 275 Ca 0.18 0.20 0.05 0.00 -0.04 0.00 0.00 63.50 63.89 2isa n PRO 275 Cb 0.46 -1.50 0.12 0.00 -0.04 0.00 0.00 33.50 32.55 2isa n PRO 275 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2isa n PHE 276 N -1.43 0.36 -2.95 0.54 3.72 -1.26 -4.62 117.46 111.83 2isa n PHE 276 Ca 0.05 -0.59 -0.43 0.00 -0.05 0.00 0.00 57.45 56.44 2isa n PHE 276 Cb 0.16 -0.08 -0.05 0.00 -0.94 0.00 0.00 39.48 38.57 2isa n PHE 276 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2isa s ASP 277 N -1.26 6.46 0.15 4.37 -1.08 -1.08 -4.33 116.67 119.90 2isa s ASP 277 Ca 0.20 0.04 0.17 0.00 -0.52 0.00 0.00 52.55 52.44 2isa s ASP 277 Cb 0.13 -2.40 0.76 0.00 -1.46 0.00 0.00 42.92 39.95 2isa s ASP 277 CO 0.09 -0.88 1.52 -0.11 0.52 0.00 0.00 175.17 176.32 2isa n LEU 278 N 6.69 0.35 -0.68 -1.34 7.94 -1.26 -1.34 117.00 127.35 2isa n LEU 278 Ca 0.03 0.61 0.08 0.00 -1.11 0.00 0.00 56.01 55.62 2isa n LEU 278 Cb 0.48 -0.59 0.25 0.00 0.53 0.00 0.00 43.42 44.10 2isa n LEU 278 CO 0.58 -0.52 0.70 0.35 -1.11 0.00 0.00 177.39 177.39 2isa n THR 279 N -1.91 0.41 -4.25 1.96 -2.24 -1.26 -1.57 114.28 105.41 2isa n THR 279 Ca 0.02 -0.47 -0.19 0.00 -2.27 0.00 0.00 64.05 61.13 2isa n THR 279 Cb 0.14 0.34 -0.13 0.00 -2.10 0.00 0.00 70.33 68.59 2isa n THR 279 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2isa s LYS 280 N -1.59 0.87 0.35 -0.78 1.02 -0.45 -4.82 119.74 114.33 2isa s LYS 280 Ca 0.29 -0.87 0.07 0.00 0.02 0.00 0.00 55.97 55.48 2isa s LYS 280 Cb 0.16 -0.89 -0.01 0.00 -0.52 0.00 0.00 37.83 36.57 2isa s LYS 280 CO 0.22 0.21 0.45 0.14 -0.92 0.00 0.00 175.35 175.44 2isa s VAL 281 N -1.08 3.82 -0.22 3.17 -7.23 -1.26 -4.84 120.40 112.76 2isa s VAL 281 Ca -0.00 -1.07 -0.19 0.00 -1.81 0.00 0.00 61.98 58.91 2isa s VAL 281 Cb -0.09 -3.31 -0.03 0.00 0.56 0.00 0.00 36.38 33.51 2isa s VAL 281 CO 0.02 -0.14 0.54 0.26 -0.31 0.00 0.00 175.10 175.47 2isa s TRP 282 N -2.22 3.33 0.21 2.82 0.51 -1.26 -5.05 118.94 117.27 2isa s TRP 282 Ca 0.45 0.75 -0.32 0.00 -2.12 0.00 0.00 56.10 54.87 2isa s TRP 282 Cb -0.09 -2.72 -0.14 0.00 -0.81 0.00 0.00 33.47 29.71 2isa s TRP 282 CO 0.30 -0.19 1.38 -2.30 -0.51 0.00 0.00 176.95 175.63 2isa n PRO 283 N 5.16 1.83 0.30 4.98 -0.02 -1.26 -4.85 135.00 141.13 2isa n PRO 283 Ca -0.04 0.65 0.15 0.00 -2.02 0.00 0.00 63.50 62.25 2isa n PRO 283 Cb 0.50 -2.29 0.92 0.00 -0.02 0.00 0.00 33.50 32.60 2isa n PRO 283 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2isa h HIS 284 N 4.29 0.00 -0.44 6.00 3.86 -1.97 -1.82 115.15 125.07 2isa h HIS 284 Ca -0.45 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 58.64 2isa h HIS 284 Cb 1.29 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.75 2isa h HIS 284 CO 0.57 0.01 -0.21 0.87 0.86 0.00 0.00 177.93 180.02 2isa h LYS 285 N 0.00 0.88 -0.01 2.45 1.57 -1.99 -2.42 116.57 117.05 2isa h LYS 285 Ca -0.00 -0.36 -0.22 0.00 -1.87 0.00 0.00 60.65 58.20 2isa h LYS 285 Cb 0.02 -0.04 0.02 0.00 0.08 0.00 0.00 32.23 32.31 2isa h LYS 285 CO 0.00 1.01 -0.85 -0.44 -0.57 0.00 0.00 179.45 178.59 2isa h ASP 286 N 0.77 0.77 -2.94 0.86 3.32 -1.72 -3.42 116.42 114.06 2isa h ASP 286 Ca 0.10 -0.74 -0.58 0.00 0.02 0.00 0.00 57.03 55.83 2isa h ASP 286 Cb 0.75 -0.23 -0.40 0.00 0.22 0.00 0.00 39.33 39.67 2isa h ASP 286 CO 0.06 1.41 -0.80 -0.31 -1.72 0.00 0.00 179.24 177.88 2isa s TYR 287 N -3.30 1.12 0.62 4.55 2.02 -0.87 -5.09 117.35 116.41 2isa s TYR 287 Ca -0.11 -1.74 -0.18 0.00 -0.37 0.00 0.00 57.07 54.67 2isa s TYR 287 Cb 0.06 -1.27 -0.02 0.00 -0.40 0.00 0.00 41.96 40.32 2isa s TYR 287 CO 0.88 -0.82 1.18 -2.14 -1.57 0.00 0.00 175.55 173.08 2isa s PRO 288 N 1.11 2.84 0.11 -1.71 0.02 -0.92 -4.37 135.00 132.09 2isa s PRO 288 Ca 0.15 1.72 -0.31 0.00 0.02 0.00 0.00 61.00 62.59 2isa s PRO 288 Cb -0.22 -1.92 -0.09 0.00 0.02 0.00 0.00 34.50 32.29 2isa s PRO 288 CO -0.08 -1.28 1.50 -0.51 -0.33 0.00 0.00 177.00 176.30 2isa s LEU 289 N -4.35 4.36 -0.27 -5.54 1.02 -1.26 -4.56 118.68 108.07 2isa s LEU 289 Ca 0.75 2.44 -0.03 0.00 0.02 0.00 0.00 54.13 57.31 2isa s LEU 289 Cb -0.28 -3.58 0.03 0.00 0.02 0.00 0.00 46.19 42.38 2isa s LEU 289 CO 0.36 -0.76 -0.01 -0.63 0.02 0.00 0.00 176.35 175.32 2isa s ILE 290 N 1.51 3.17 0.32 -0.59 1.01 0.72 -4.91 121.20 122.43 2isa s ILE 290 Ca 0.68 -1.03 -0.28 0.00 0.00 0.00 0.00 60.65 60.02 2isa s ILE 290 Cb -0.39 -2.67 -0.09 0.00 0.01 0.00 0.00 42.46 39.31 2isa s ILE 290 CO 0.31 0.09 1.11 -0.70 0.00 0.00 0.00 174.94 175.75 2isa s GLU 291 N 1.35 4.47 0.00 2.79 2.12 -1.26 -0.42 118.70 127.74 2isa s GLU 291 Ca -0.01 1.77 0.00 0.00 0.36 0.00 0.00 54.97 57.10 2isa s GLU 291 Cb -0.17 -3.00 0.00 0.00 0.26 0.00 0.00 34.13 31.22 2isa s GLU 291 CO -0.02 0.06 0.00 0.28 -0.54 0.00 0.00 175.26 175.04 2isa n VAL 292 N 0.80 0.00 -3.80 3.70 0.31 -0.44 -4.58 118.33 114.31 2isa n VAL 292 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 2isa n VAL 292 Cb 0.46 -1.20 0.00 0.00 -0.91 0.00 0.00 33.84 32.19 2isa n VAL 292 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2isa n GLY 293 N 2.77 0.54 3.14 2.92 0.00 -1.18 -1.10 105.19 112.28 2isa n GLY 293 Ca 0.00 -0.78 -0.09 0.00 0.00 0.00 0.00 46.02 45.14 2isa n GLY 293 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2isa s GLU 294 N -1.60 0.65 0.16 1.61 -1.05 -0.67 -0.07 118.70 117.74 2isa s GLU 294 Ca 0.00 -0.80 0.09 0.00 -0.15 0.00 0.00 54.97 54.11 2isa s GLU 294 Cb 0.00 0.26 -0.04 0.00 -0.44 0.00 0.00 34.13 33.91 2isa s GLU 294 CO 0.00 -0.17 -0.20 -0.59 0.95 0.00 0.00 175.26 175.25 2isa s PHE 295 N -2.89 1.90 0.08 4.83 -0.12 0.14 -0.81 117.98 121.10 2isa s PHE 295 Ca -0.03 -0.44 0.06 0.00 -0.05 0.00 0.00 56.93 56.48 2isa s PHE 295 Cb 0.01 -0.96 -0.03 0.00 -0.63 0.00 0.00 43.02 41.41 2isa s PHE 295 CO -0.06 0.35 -0.17 -1.83 -0.05 0.00 0.00 175.22 173.46 2isa s GLU 296 N -2.68 1.00 -0.29 1.99 -1.05 -0.72 -1.37 118.70 115.58 2isa s GLU 296 Ca 0.16 -1.00 -0.10 0.00 -0.15 0.00 0.00 54.97 53.88 2isa s GLU 296 Cb -0.07 -1.12 -0.03 0.00 -0.44 0.00 0.00 34.13 32.48 2isa s GLU 296 CO 0.07 0.26 0.15 -0.51 0.95 0.00 0.00 175.26 176.19 2isa s LEU 297 N -1.65 3.96 0.00 1.83 1.43 -0.62 -1.79 118.68 121.83 2isa s LEU 297 Ca 0.03 -0.26 0.00 0.00 -1.03 0.00 0.00 54.13 52.86 2isa s LEU 297 Cb -0.10 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.09 2isa s LEU 297 CO 0.03 -0.11 0.62 -0.46 0.23 0.00 0.00 176.35 176.65 2isa n ASN 298 N 5.01 0.69 -3.68 2.29 0.23 -0.23 -3.92 115.26 115.63 2isa n ASN 298 Ca -0.14 -1.32 -0.10 0.00 -0.53 0.00 0.00 54.58 52.49 2isa n ASN 298 Cb 0.51 0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 38.10 2isa n ASN 298 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 2isa s ARG 299 N -0.32 0.37 0.15 -3.83 3.52 -1.01 -5.02 118.95 112.81 2isa s ARG 299 Ca 0.00 0.85 -0.18 0.00 -0.13 0.00 0.00 55.73 56.28 2isa s ARG 299 Cb 0.00 0.07 -0.07 0.00 -1.56 0.00 0.00 34.95 33.38 2isa s ARG 299 CO 0.00 -0.19 0.61 -0.80 -0.81 0.00 0.00 175.30 174.11 2isa s ASN 300 N 1.74 6.98 0.51 -2.12 0.02 -1.26 -0.68 114.94 120.12 2isa s ASN 300 Ca -0.07 1.24 -0.23 0.00 -1.02 0.00 0.00 52.86 52.78 2isa s ASN 300 Cb -0.09 -2.35 -0.06 0.00 0.02 0.00 0.00 41.25 38.77 2isa s ASN 300 CO -0.13 0.14 1.35 -2.84 0.02 0.00 0.00 177.10 175.64 2isa s PRO 301 N -1.68 3.35 0.14 -0.60 0.02 -1.26 -4.92 135.00 130.04 2isa s PRO 301 Ca 0.36 2.21 -0.09 0.00 0.02 0.00 0.00 61.00 63.51 2isa s PRO 301 Cb -0.17 -2.37 -0.05 0.00 0.02 0.00 0.00 34.50 31.93 2isa s PRO 301 CO 0.20 -1.02 1.39 1.96 -0.33 0.00 0.00 177.00 179.20 2isa h GLN 302 N 1.74 0.73 -3.95 5.54 4.20 -2.00 -3.43 115.11 117.93 2isa h GLN 302 Ca -0.51 -0.52 -0.51 0.00 0.06 0.00 0.00 58.65 57.17 2isa h GLN 302 Cb 1.29 0.09 -0.38 0.00 0.30 0.00 0.00 27.48 28.77 2isa h GLN 302 CO 0.58 1.14 -0.78 1.21 -0.67 0.00 0.00 178.83 180.32 2isa s ASN 303 N -7.01 2.29 0.13 1.46 3.84 -1.26 -5.05 114.94 109.35 2isa s ASN 303 Ca -0.09 -0.41 -0.16 0.00 0.21 0.00 0.00 52.86 52.41 2isa s ASN 303 Cb 0.10 -0.70 -0.00 0.00 -0.55 0.00 0.00 41.25 40.09 2isa s ASN 303 CO 0.88 -0.19 1.68 0.22 -2.79 0.00 0.00 177.10 176.90 2isa h TYR 304 N 8.22 0.63 0.07 0.43 5.03 -1.98 -2.07 116.97 127.30 2isa h TYR 304 Ca -0.23 -0.05 0.00 0.00 2.58 0.00 0.00 58.73 61.03 2isa h TYR 304 Cb 1.12 -0.19 -0.00 0.00 1.55 0.00 0.00 36.73 39.21 2isa h TYR 304 CO 0.44 0.56 -0.06 0.35 -1.32 0.00 0.00 178.16 178.13 2isa h PHE 305 N 0.52 -0.15 -0.05 -3.82 3.57 -1.96 0.21 116.94 115.25 2isa h PHE 305 Ca 0.14 -0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.51 2isa h PHE 305 Cb 0.20 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 2isa h PHE 305 CO 0.00 -0.09 -0.55 0.00 -2.23 0.00 0.00 178.31 175.44 2isa h ALA 306 N 0.78 0.98 0.00 2.41 0.00 -1.96 -1.47 119.26 120.00 2isa h ALA 306 Ca -0.00 -0.50 -0.25 0.00 0.00 0.00 0.00 54.91 54.15 2isa h ALA 306 Cb 0.13 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 2isa h ALA 306 CO -0.01 0.69 -1.94 0.39 0.00 0.00 0.00 179.25 178.38 2isa n GLU 307 N -3.90 1.44 -0.13 0.00 1.02 -0.78 -4.39 120.64 113.89 2isa n GLU 307 Ca -0.02 0.02 -0.25 0.00 -0.02 0.00 0.00 57.16 56.89 2isa n GLU 307 Cb 0.57 -1.35 -0.08 0.00 -0.02 0.00 0.00 31.44 30.56 2isa n GLU 307 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2isa n VAL 308 N -2.63 1.48 -0.23 2.62 0.31 0.60 -3.84 118.33 116.64 2isa n VAL 308 Ca -0.24 -0.28 -0.07 0.00 -0.01 0.00 0.00 64.34 63.73 2isa n VAL 308 Cb 0.91 -1.95 0.04 0.00 -0.91 0.00 0.00 33.84 31.92 2isa n VAL 308 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2isa h GLU 309 N -0.97 0.96 -0.00 5.55 4.57 -1.09 -2.42 114.58 121.18 2isa h GLU 309 Ca -0.56 -0.19 0.00 0.00 -1.18 0.00 0.00 59.36 57.43 2isa h GLU 309 Cb 1.49 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.93 2isa h GLU 309 CO -0.34 0.82 -0.02 1.04 -1.18 0.00 0.00 179.01 179.34 2isa n GLN 310 N -4.41 0.99 -1.95 1.92 6.02 -0.56 -4.88 117.38 114.50 2isa n GLN 310 Ca 0.04 -0.19 -0.41 0.00 -0.01 0.00 0.00 57.00 56.43 2isa n GLN 310 Cb 0.18 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 29.93 2isa n GLN 310 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2isa s ALA 311 N -2.14 3.57 -0.13 -1.58 0.00 -0.91 -4.89 121.76 115.67 2isa s ALA 311 Ca 0.41 1.42 -0.00 0.00 0.00 0.00 0.00 51.96 53.79 2isa s ALA 311 Cb 0.21 -3.56 0.03 0.00 0.00 0.00 0.00 23.12 19.81 2isa s ALA 311 CO 0.39 -0.85 -0.07 0.00 0.00 0.00 0.00 175.76 175.23 2isa s ALA 312 N -0.87 1.37 -0.22 0.00 0.00 -1.26 -5.04 121.76 115.74 2isa s ALA 312 Ca 0.53 -0.63 -0.04 0.00 0.00 0.00 0.00 51.96 51.82 2isa s ALA 312 Cb -0.43 -0.97 -0.01 0.00 0.00 0.00 0.00 23.12 21.70 2isa s ALA 312 CO 0.55 -0.52 -0.03 -0.06 0.00 0.00 0.00 175.76 175.70 2isa s PHE 313 N 1.69 2.97 -0.22 0.00 0.40 -1.26 -4.95 117.98 116.61 2isa s PHE 313 Ca 0.04 -0.89 0.01 0.00 -0.60 0.00 0.00 56.93 55.49 2isa s PHE 313 Cb -0.13 -2.11 0.03 0.00 0.51 0.00 0.00 43.02 41.31 2isa s PHE 313 CO -0.08 -0.53 -0.13 1.21 0.70 0.00 0.00 175.22 176.39 2isa s ASN 314 N 1.47 3.80 0.61 1.36 3.04 -1.26 -4.92 114.94 119.04 2isa s ASN 314 Ca 0.06 -0.86 0.29 0.00 0.04 0.00 0.00 52.86 52.38 2isa s ASN 314 Cb -0.14 -1.56 1.53 0.00 -1.54 0.00 0.00 41.25 39.54 2isa s ASN 314 CO -0.03 -0.08 1.93 -0.65 -3.04 0.00 0.00 177.10 175.24 2isa h PRO 315 N 7.93 0.00 0.00 0.43 0.11 -1.85 0.99 132.00 139.61 2isa h PRO 315 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2isa h PRO 315 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2isa h PRO 315 CO 0.58 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.37 2isa h ALA 316 N 1.48 1.00 -0.94 -0.75 0.00 -1.87 -3.39 119.26 114.80 2isa h ALA 316 Ca 0.15 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.44 2isa h ALA 316 Cb 0.96 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.67 2isa h ALA 316 CO -0.00 0.00 1.84 -0.80 0.00 0.00 0.00 179.25 180.28 2isa s ASN 317 N -5.13 6.58 0.46 0.00 0.02 0.34 -4.93 114.94 112.28 2isa s ASN 317 Ca 0.03 -1.96 0.08 0.00 -1.02 0.00 0.00 52.86 49.98 2isa s ASN 317 Cb 0.09 -2.58 0.01 0.00 0.02 0.00 0.00 41.25 38.79 2isa s ASN 317 CO 0.49 -1.43 0.47 0.54 0.02 0.00 0.00 177.10 177.19 2isa s VAL 318 N 4.98 2.50 0.14 1.60 0.11 -1.26 -1.05 120.40 127.42 2isa s VAL 318 Ca 0.52 -1.26 0.05 0.00 -2.93 0.00 0.00 61.98 58.36 2isa s VAL 318 Cb 0.02 -2.76 -0.04 0.00 -1.53 0.00 0.00 36.38 32.06 2isa s VAL 318 CO 0.01 0.00 -0.11 0.68 -3.33 0.00 0.00 175.10 172.34 2isa s VAL 319 N -2.52 1.25 0.13 2.04 -7.23 -1.26 -4.78 120.40 108.03 2isa s VAL 319 Ca 0.49 -1.96 -0.35 0.00 -1.81 0.00 0.00 61.98 58.35 2isa s VAL 319 Cb -0.05 -1.75 -0.15 0.00 0.56 0.00 0.00 36.38 35.00 2isa s VAL 319 CO 0.29 -0.64 1.47 -2.65 -0.31 0.00 0.00 175.10 173.27 2isa n PRO 320 N 0.02 1.74 0.00 4.82 -0.02 -1.26 -0.99 135.00 139.31 2isa n PRO 320 Ca -0.12 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 2isa n PRO 320 Cb 0.59 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 2isa n PRO 320 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2isa n GLY 321 N 3.01 0.21 2.86 -1.23 0.00 -1.26 -3.26 105.19 105.52 2isa n GLY 321 Ca 0.17 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.02 2isa n GLY 321 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2isa s ILE 322 N -2.00 0.29 0.00 -0.61 1.01 -0.16 -1.54 121.20 118.19 2isa s ILE 322 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.63 2isa s ILE 322 Cb 0.00 -0.34 0.00 0.00 0.01 0.00 0.00 42.46 42.13 2isa s ILE 322 CO 0.00 0.15 0.00 -0.24 0.00 0.00 0.00 174.94 174.85 2isa n SER 323 N 3.85 0.00 -0.18 3.58 2.88 -0.27 -4.05 113.62 119.42 2isa n SER 323 Ca -0.24 -0.35 0.00 0.00 -1.33 0.00 0.00 58.87 56.95 2isa n SER 323 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 2isa n SER 323 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2isa n PHE 324 N 0.00 -0.13 -3.86 0.66 3.72 -1.26 -1.86 117.46 114.73 2isa n PHE 324 Ca 0.00 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.31 2isa n PHE 324 Cb 0.00 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.49 2isa n PHE 324 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2isa s SER 325 N -1.00 -0.11 0.00 4.37 1.04 -1.26 -2.69 113.70 114.05 2isa s SER 325 Ca 0.00 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 55.74 2isa s SER 325 Cb 0.00 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.64 2isa s SER 325 CO 0.00 -0.99 0.61 -0.81 0.98 0.00 0.00 173.24 173.03 2isa n PRO 326 N -0.29 0.68 -1.56 4.02 -0.04 -1.26 -4.58 135.00 131.97 2isa n PRO 326 Ca -0.08 0.00 -0.51 0.00 -0.04 0.00 0.00 63.50 62.87 2isa n PRO 326 Cb 0.63 -1.07 -0.06 0.00 -0.04 0.00 0.00 33.50 32.95 2isa n PRO 326 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2isa n ASP 327 N -0.37 2.53 -0.06 3.54 -0.08 -1.26 -4.85 116.55 116.00 2isa n ASP 327 Ca 0.00 0.67 0.04 0.00 -1.51 0.00 0.00 54.79 53.99 2isa n ASP 327 Cb 0.03 -1.27 0.39 0.00 2.34 0.00 0.00 41.12 42.61 2isa n ASP 327 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2isa h LYS 328 N 10.72 0.64 -0.40 -0.67 1.57 -1.81 -0.82 116.57 125.80 2isa h LYS 328 Ca -0.37 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.36 2isa h LYS 328 Cb 1.31 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.45 2isa h LYS 328 CO 0.99 0.42 0.19 0.52 -0.57 0.00 0.00 179.45 181.00 2isa h MET 329 N 0.66 0.58 -0.49 3.15 2.86 -1.89 -1.64 114.93 118.15 2isa h MET 329 Ca 0.19 -0.09 -0.03 0.00 -2.06 0.00 0.00 59.70 57.72 2isa h MET 329 Cb -0.02 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.51 2isa h MET 329 CO -0.05 0.51 0.19 1.25 1.06 0.00 0.00 176.91 179.88 2isa h LEU 330 N 0.51 0.68 -0.48 1.22 5.85 -1.66 -2.78 115.31 118.65 2isa h LEU 330 Ca 0.14 -0.17 0.09 0.00 0.84 0.00 0.00 57.88 58.78 2isa h LEU 330 Cb 0.13 -0.18 -0.08 0.00 0.37 0.00 0.00 40.66 40.90 2isa h LEU 330 CO -0.02 0.67 -0.02 1.56 -0.34 0.00 0.00 178.44 180.29 2isa h GLN 331 N 0.66 0.09 -0.42 1.25 1.08 -1.03 -2.02 115.11 114.71 2isa h GLN 331 Ca 0.16 -0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.32 2isa h GLN 331 Cb 0.20 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.59 2isa h GLN 331 CO -0.01 0.06 0.09 0.78 -0.95 0.00 0.00 178.83 178.80 2isa h GLY 332 N 0.09 0.67 2.00 3.46 0.00 -1.14 -2.47 103.07 105.68 2isa h GLY 332 Ca 0.24 -0.37 -0.05 0.00 0.00 0.00 0.00 47.33 47.16 2isa h GLY 332 CO -0.42 0.35 -0.22 3.21 0.00 0.00 0.00 176.54 179.46 2isa h ARG 333 N 0.61 0.00 -0.01 4.80 3.08 -1.11 -2.57 114.38 119.18 2isa h ARG 333 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 2isa h ARG 333 Cb 0.25 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 2isa h ARG 333 CO -0.00 0.22 0.01 -0.07 -1.07 0.00 0.00 179.97 179.06 2isa h LEU 334 N 0.00 0.00 0.00 3.04 3.38 -0.94 -2.95 115.31 117.84 2isa h LEU 334 Ca -0.00 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.72 2isa h LEU 334 Cb 0.52 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 2isa h LEU 334 CO 0.03 0.00 -1.44 0.33 0.09 0.00 0.00 178.44 177.45 2isa n PHE 335 N -3.72 0.76 0.10 1.13 7.35 -1.00 -4.73 117.46 117.35 2isa n PHE 335 Ca -0.03 0.33 0.01 0.00 -0.76 0.00 0.00 57.45 57.00 2isa n PHE 335 Cb 0.09 -1.02 0.36 0.00 0.35 0.00 0.00 39.48 39.26 2isa n PHE 335 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2isa h ALA 336 N -0.68 1.44 0.23 3.13 0.00 -1.30 -2.97 119.26 119.10 2isa h ALA 336 Ca -0.37 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 2isa h ALA 336 Cb 1.26 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2isa h ALA 336 CO -0.22 0.39 -0.11 1.88 0.00 0.00 0.00 179.25 181.19 2isa h TYR 337 N 0.26 -0.29 -1.00 0.00 -1.99 -1.83 -0.41 116.97 111.72 2isa h TYR 337 Ca 0.05 -0.01 0.16 0.00 2.00 0.00 0.00 58.73 60.93 2isa h TYR 337 Cb 0.42 0.09 -0.09 0.00 2.00 0.00 0.00 36.73 39.15 2isa h TYR 337 CO 0.01 0.05 0.62 0.78 -0.00 0.00 0.00 178.16 179.62 2isa h GLY 338 N -0.96 1.68 0.97 3.88 0.00 -1.85 0.26 103.07 107.04 2isa h GLY 338 Ca -0.03 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 46.90 2isa h GLY 338 CO 0.05 0.05 -0.10 -1.80 0.00 0.00 0.00 176.54 174.74 2isa h ASP 339 N 0.86 -0.23 -0.75 0.19 3.58 -1.49 -0.85 116.42 117.73 2isa h ASP 339 Ca 0.53 -0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.93 2isa h ASP 339 Cb 0.71 0.06 -0.04 0.00 1.72 0.00 0.00 39.33 41.78 2isa h ASP 339 CO -0.32 -0.13 0.37 0.00 -2.88 0.00 0.00 179.24 176.28 2isa h ALA 340 N 0.49 1.21 -0.15 -0.78 0.00 -0.25 -3.00 119.26 116.78 2isa h ALA 340 Ca -0.03 -0.15 -0.18 0.00 0.00 0.00 0.00 54.91 54.55 2isa h ALA 340 Cb 0.24 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2isa h ALA 340 CO 0.05 0.61 -0.65 1.96 0.00 0.00 0.00 179.25 181.21 2isa h GLN 341 N 1.08 0.57 -0.83 0.00 4.20 -0.33 -0.62 115.11 119.18 2isa h GLN 341 Ca 0.26 -0.41 -0.02 0.00 0.06 0.00 0.00 58.65 58.54 2isa h GLN 341 Cb 0.10 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.91 2isa h GLN 341 CO -0.03 1.03 0.44 0.00 -0.67 0.00 0.00 178.83 179.60 2isa h ARG 342 N 0.42 1.17 0.12 1.46 3.08 -1.11 0.95 114.38 120.47 2isa h ARG 342 Ca -0.01 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.88 2isa h ARG 342 Cb 1.22 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 31.05 2isa h ARG 342 CO 0.12 0.87 -0.06 -0.92 -1.07 0.00 0.00 179.97 178.92 2isa h TYR 343 N 1.16 -0.15 -0.40 3.04 3.20 -1.44 -1.84 116.97 120.54 2isa h TYR 343 Ca 0.29 -0.00 -0.12 0.00 3.14 0.00 0.00 58.73 62.04 2isa h TYR 343 Cb 0.05 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 2isa h TYR 343 CO 0.01 0.15 -0.24 -0.09 -1.64 0.00 0.00 178.16 176.34 2isa h ARG 344 N -0.46 0.81 0.00 1.82 2.43 -0.94 -3.37 114.38 114.67 2isa h ARG 344 Ca -0.02 -0.34 0.00 0.00 -0.81 0.00 0.00 59.98 58.81 2isa h ARG 344 Cb 0.37 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 2isa h ARG 344 CO 0.03 0.96 -0.44 1.28 -1.51 0.00 0.00 179.97 180.29 2isa n LEU 345 N -4.10 0.03 0.00 3.80 4.77 0.31 -4.54 117.00 117.27 2isa n LEU 345 Ca -0.00 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.68 2isa n LEU 345 Cb 0.45 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 2isa n LEU 345 CO 0.45 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 2isa n GLY 346 N 1.58 2.36 0.33 -0.72 0.00 -0.69 -4.47 105.19 103.57 2isa n GLY 346 Ca 0.00 -1.76 0.10 0.00 0.00 0.00 0.00 46.02 44.36 2isa n GLY 346 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2isa h VAL 347 N 0.00 0.95 -0.47 1.61 3.04 -1.87 -2.48 116.25 117.04 2isa h VAL 347 Ca 0.00 -0.12 -0.07 0.00 -1.01 0.00 0.00 66.70 65.50 2isa h VAL 347 Cb 0.00 0.58 -0.04 0.00 -2.01 0.00 0.00 31.29 29.82 2isa h VAL 347 CO 0.00 0.06 0.09 0.59 -1.01 0.00 0.00 177.57 177.31 2isa n ASN 348 N -4.47 4.21 0.31 3.17 3.02 -1.26 -4.55 115.26 115.69 2isa n ASN 348 Ca 0.06 -2.76 0.20 0.00 -0.03 0.00 0.00 54.58 52.05 2isa n ASN 348 Cb 0.26 -0.66 1.05 0.00 -0.61 0.00 0.00 39.78 39.83 2isa n ASN 348 CO 0.00 0.00 0.00 1.12 -2.62 0.00 0.00 177.26 175.76 2isa h HIS 349 N 2.41 0.00 0.00 3.10 2.07 -1.66 -0.88 115.15 120.18 2isa h HIS 349 Ca 0.09 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.61 2isa h HIS 349 Cb 1.71 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.69 2isa h HIS 349 CO 0.85 0.00 0.00 1.04 -3.07 0.00 0.00 177.93 176.75 2isa n GLN 350 N -3.25 0.62 0.13 5.12 6.02 -1.26 -1.66 117.38 123.10 2isa n GLN 350 Ca -0.02 0.02 0.12 0.00 -0.01 0.00 0.00 57.00 57.11 2isa n GLN 350 Cb 0.17 -1.50 0.17 0.00 1.02 0.00 0.00 30.24 30.10 2isa n GLN 350 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2isa h HIS 351 N 0.00 0.00 -2.65 1.08 3.86 -1.49 -3.22 115.15 112.74 2isa h HIS 351 Ca 0.00 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.68 2isa h HIS 351 Cb 0.07 0.00 0.04 0.00 1.06 0.00 0.00 27.41 28.58 2isa h HIS 351 CO 0.00 0.00 1.02 0.42 0.86 0.00 0.00 177.93 180.23 2isa s ILE 352 N -3.22 2.61 0.28 2.45 1.01 -0.66 -4.83 121.20 118.85 2isa s ILE 352 Ca 0.06 0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.95 2isa s ILE 352 Cb 0.10 -3.15 0.29 0.00 0.01 0.00 0.00 42.46 39.70 2isa s ILE 352 CO 0.70 0.01 1.66 -0.65 0.00 0.00 0.00 174.94 176.66 2isa h PRO 353 N 7.94 0.24 -0.17 2.79 0.11 -1.88 -0.35 132.00 140.68 2isa h PRO 353 Ca -0.44 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 2isa h PRO 353 Cb 1.21 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2isa h PRO 353 CO 0.94 0.16 0.08 -0.24 -0.21 0.00 0.00 178.00 178.73 2isa h VAL 354 N 0.25 1.07 0.00 3.15 3.04 -1.90 -2.26 116.25 119.59 2isa h VAL 354 Ca 0.52 -0.19 0.00 0.00 -1.01 0.00 0.00 66.70 66.02 2isa h VAL 354 Cb 0.99 0.85 0.00 0.00 -2.01 0.00 0.00 31.29 31.13 2isa h VAL 354 CO -0.61 0.07 -0.38 0.59 -1.01 0.00 0.00 177.57 176.24 2isa n ASN 355 N -4.48 0.45 -4.77 3.17 3.02 -0.17 -4.95 115.26 107.54 2isa n ASN 355 Ca -0.00 0.07 -0.38 0.00 -0.03 0.00 0.00 54.58 54.24 2isa n ASN 355 Cb 0.11 -0.02 -0.06 0.00 -0.61 0.00 0.00 39.78 39.20 2isa n ASN 355 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2isa s ALA 356 N -3.05 3.24 0.74 5.41 0.00 -0.85 -4.85 121.76 122.40 2isa s ALA 356 Ca 0.11 0.60 -0.12 0.00 0.00 0.00 0.00 51.96 52.54 2isa s ALA 356 Cb 0.16 -3.21 0.05 0.00 0.00 0.00 0.00 23.12 20.12 2isa s ALA 356 CO 0.66 0.10 1.12 -1.25 0.00 0.00 0.00 175.76 176.38 2isa s PRO 357 N -1.89 2.29 0.00 0.00 0.04 -1.26 -4.95 135.00 129.23 2isa s PRO 357 Ca 0.49 1.35 0.20 0.00 0.04 0.00 0.00 61.00 63.09 2isa s PRO 357 Cb -0.22 -1.89 -0.15 0.00 0.04 0.00 0.00 34.50 32.28 2isa s PRO 357 CO 0.27 -1.64 0.92 0.54 0.04 0.00 0.00 177.00 177.13 2isa n ARG 358 N -3.13 0.68 -2.62 4.56 1.74 -1.26 -4.98 116.66 111.65 2isa n ARG 358 Ca 0.10 -0.32 -0.23 0.00 -0.77 0.00 0.00 57.85 56.63 2isa n ARG 358 Cb 0.52 -1.45 0.11 0.00 -1.02 0.00 0.00 32.46 30.62 2isa n ARG 358 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2isa n PRO 360 N -2.81 2.35 -4.27 0.00 -0.02 -1.26 -5.01 135.00 123.97 2isa n PRO 360 Ca 0.15 0.84 -0.23 0.00 -2.02 0.00 0.00 63.50 62.25 2isa n PRO 360 Cb 0.61 -2.60 -0.17 0.00 -0.02 0.00 0.00 33.50 31.32 2isa n PRO 360 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2isa s VAL 361 N 0.57 0.84 -0.42 -1.45 0.11 -1.26 -4.92 120.40 113.86 2isa s VAL 361 Ca 0.73 -0.27 0.05 0.00 -2.93 0.00 0.00 61.98 59.56 2isa s VAL 361 Cb -0.60 -0.82 0.19 0.00 -1.53 0.00 0.00 36.38 33.62 2isa s VAL 361 CO 0.41 0.30 0.44 1.57 -3.33 0.00 0.00 175.10 174.50 2isa n HIS 362 N 4.14 -1.20 0.22 1.54 -0.00 -1.26 -5.03 115.22 113.64 2isa n HIS 362 Ca -0.21 -3.11 0.12 0.00 -0.00 0.00 0.00 57.72 54.52 2isa n HIS 362 Cb 0.51 0.30 0.25 0.00 -0.00 0.00 0.00 29.99 31.05 2isa n HIS 362 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 2isa n SER 363 N 2.47 3.45 0.00 0.26 3.41 -1.26 -4.97 113.62 116.98 2isa n SER 363 Ca 0.26 -1.98 0.00 0.00 -0.26 0.00 0.00 58.87 56.89 2isa n SER 363 Cb 0.51 -0.30 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 2isa n SER 363 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2isa n TYR 364 N 1.45 0.00 -1.71 7.33 9.36 -1.26 -4.94 117.16 127.39 2isa n TYR 364 Ca 0.20 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.99 2isa n TYR 364 Cb 0.59 0.00 -0.02 0.00 -0.63 0.00 0.00 39.34 39.28 2isa n TYR 364 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 2isa n HIS 365 N 0.00 2.51 -4.39 2.98 -0.00 -1.26 -4.99 115.22 110.07 2isa n HIS 365 Ca 0.00 0.38 -0.26 0.00 -0.00 0.00 0.00 57.72 57.84 2isa n HIS 365 Cb 0.00 -2.51 -0.10 0.00 -0.00 0.00 0.00 29.99 27.37 2isa n HIS 365 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 2isa s ARG 366 N -0.74 1.76 5.78 -0.41 1.81 -1.26 -4.99 118.95 120.88 2isa s ARG 366 Ca 0.64 -1.53 0.00 0.00 -1.72 0.00 0.00 55.73 53.12 2isa s ARG 366 Cb -0.57 -1.92 0.00 0.00 -0.45 0.00 0.00 34.95 32.01 2isa s ARG 366 CO 0.52 0.38 0.00 -0.25 -0.68 0.00 0.00 175.30 175.27 2isa n ASP 367 N -0.14 0.00 0.00 0.23 8.00 -1.26 -5.03 116.55 118.34 2isa n ASP 367 Ca -0.09 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.41 2isa n ASP 367 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.67 2isa n ASP 367 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2isa n GLY 368 N 0.00 -1.54 3.69 0.44 0.00 -1.26 -4.78 105.19 101.74 2isa n GLY 368 Ca 0.00 -1.54 -0.40 0.00 0.00 0.00 0.00 46.02 44.08 2isa n GLY 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2isa n ALA 369 N -1.07 1.09 -3.63 4.61 0.00 -1.26 -3.63 120.51 116.61 2isa n ALA 369 Ca 0.00 0.18 -0.23 0.00 0.00 0.00 0.00 53.44 53.39 2isa n ALA 369 Cb 0.00 -2.25 0.04 0.00 0.00 0.00 0.00 19.45 17.24 2isa n ALA 369 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2isa n MET 370 N -0.39 -3.38 -2.91 0.00 2.81 -1.26 -4.43 117.12 107.55 2isa n MET 370 Ca 0.09 0.61 -0.43 0.00 -1.81 0.00 0.00 57.70 56.15 2isa n MET 370 Cb 0.42 -4.96 -0.05 0.00 -0.71 0.00 0.00 33.22 27.92 2isa n MET 370 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 2isa s ARG 371 N -5.74 3.32 0.00 0.03 6.06 -1.24 -4.87 118.95 116.51 2isa s ARG 371 Ca 0.21 -0.31 0.03 0.00 -2.50 0.00 0.00 55.73 53.16 2isa s ARG 371 Cb -0.06 -4.03 -0.00 0.00 0.06 0.00 0.00 34.95 30.92 2isa s ARG 371 CO 0.82 -1.36 0.39 1.33 -2.50 0.00 0.00 175.30 173.97 2isa n VAL 372 N 6.10 0.00 0.33 7.11 0.24 -1.26 -4.70 118.33 126.15 2isa n VAL 372 Ca 0.01 -0.47 0.09 0.00 -2.04 0.00 0.00 64.34 61.93 2isa n VAL 372 Cb 0.47 1.04 0.25 0.00 -1.47 0.00 0.00 33.84 34.13 2isa n VAL 372 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2isa n ASP 373 N -0.40 2.90 0.00 -1.34 5.75 -1.26 -4.92 116.55 117.29 2isa n ASP 373 Ca 0.01 -1.98 0.00 0.00 -0.01 0.00 0.00 54.79 52.82 2isa n ASP 373 Cb 0.07 -0.34 0.00 0.00 -1.03 0.00 0.00 41.12 39.82 2isa n ASP 373 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2isa n GLY 374 N 1.37 3.28 2.60 6.12 0.00 -1.26 -4.56 105.19 112.74 2isa n GLY 374 Ca 0.18 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.03 2isa n GLY 374 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2isa n ASN 375 N 0.00 -5.10 -1.66 1.61 5.15 -1.26 -1.53 115.26 112.48 2isa n ASN 375 Ca 0.00 -0.16 -0.20 0.00 -0.60 0.00 0.00 54.58 53.62 2isa n ASN 375 Cb 0.00 -4.03 -0.08 0.00 -0.53 0.00 0.00 39.78 35.14 2isa n ASN 375 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2isa n PHE 376 N -4.18 -0.14 -0.20 1.20 3.01 -1.26 -4.81 117.46 111.08 2isa n PHE 376 Ca -0.13 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.33 2isa n PHE 376 Cb 0.61 -3.43 0.00 0.00 -0.01 0.00 0.00 39.48 36.65 2isa n PHE 376 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2isa n GLY 377 N -0.43 3.31 0.44 1.37 0.00 -0.58 -1.93 105.19 107.36 2isa n GLY 377 Ca -0.20 -0.08 0.14 0.00 0.00 0.00 0.00 46.02 45.87 2isa n GLY 377 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2isa n SER 378 N 3.77 1.37 -4.66 1.61 7.64 -1.26 -4.94 113.62 117.15 2isa n SER 378 Ca 0.00 -1.45 -0.50 0.00 1.01 0.00 0.00 58.87 57.93 2isa n SER 378 Cb 0.00 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.15 2isa n SER 378 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2isa n THR 379 N 0.07 0.20 -1.05 0.44 -1.04 -0.82 -4.93 114.28 107.15 2isa n THR 379 Ca 0.19 -0.04 -0.35 0.00 -2.04 0.00 0.00 64.05 61.82 2isa n THR 379 Cb 0.33 -1.36 0.09 0.00 -1.82 0.00 0.00 70.33 67.56 2isa n THR 379 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2isa n LEU 380 N 4.33 -0.32 -0.42 -4.42 -0.00 -1.26 -4.96 117.00 109.95 2isa n LEU 380 Ca 0.21 0.45 0.05 0.00 -0.00 0.00 0.00 56.01 56.71 2isa n LEU 380 Cb 0.23 -1.16 0.06 0.00 -0.00 0.00 0.00 43.42 42.55 2isa n LEU 380 CO 0.69 -3.63 0.45 0.61 -0.00 0.00 0.00 177.39 175.51 2isa n GLY 381 N 1.78 0.29 3.46 1.47 0.00 -1.26 -5.02 105.19 105.90 2isa n GLY 381 Ca 0.08 -0.28 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 2isa n GLY 381 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2isa s TYR 382 N -0.84 2.48 -0.11 1.61 1.13 -1.26 -5.10 117.35 115.26 2isa s TYR 382 Ca 0.13 -0.29 -0.07 0.00 -1.41 0.00 0.00 57.07 55.43 2isa s TYR 382 Cb 0.08 -1.35 0.04 0.00 -1.10 0.00 0.00 41.96 39.64 2isa s TYR 382 CO 0.12 0.34 0.27 -2.00 -2.51 0.00 0.00 175.55 171.77 2isa s GLU 383 N -1.96 0.25 0.48 -3.49 -6.30 -1.26 -4.17 118.70 102.24 2isa s GLU 383 Ca 0.16 0.51 -0.24 0.00 -2.50 0.00 0.00 54.97 52.91 2isa s GLU 383 Cb -0.10 -0.04 -0.07 0.00 0.00 0.00 0.00 34.13 33.92 2isa s GLU 383 CO 0.08 -0.13 1.33 -1.25 0.02 0.00 0.00 175.26 175.32 2isa s PRO 384 N 0.97 3.55 0.15 4.30 0.04 -1.26 -5.19 135.00 137.55 2isa s PRO 384 Ca -0.07 2.19 -0.04 0.00 0.04 0.00 0.00 61.00 63.13 2isa s PRO 384 Cb -0.08 -2.48 -0.03 0.00 0.04 0.00 0.00 34.50 31.95 2isa s PRO 384 CO -0.07 -0.85 0.14 0.54 0.04 0.00 0.00 177.00 176.80 2isa s ASN 385 N -0.86 0.20 -0.00 6.66 2.20 -1.26 -5.06 114.94 116.83 2isa s ASN 385 Ca 0.65 -1.10 0.10 0.00 -0.94 0.00 0.00 52.86 51.56 2isa s ASN 385 Cb -0.39 0.35 0.28 0.00 -2.00 0.00 0.00 41.25 39.50 2isa s ASN 385 CO 0.48 -0.80 1.24 -0.90 -2.94 0.00 0.00 177.10 174.18 2isa n ASP 386 N -0.15 1.73 -0.64 3.54 5.68 -1.26 -3.70 116.55 121.74 2isa n ASP 386 Ca -0.06 -2.00 0.08 0.00 -0.50 0.00 0.00 54.79 52.31 2isa n ASP 386 Cb 0.64 -0.22 0.09 0.00 -1.14 0.00 0.00 41.12 40.48 2isa n ASP 386 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2isa n GLN 387 N 0.44 1.36 -1.33 0.11 6.02 -1.26 -4.97 117.38 117.75 2isa n GLN 387 Ca 0.11 -1.53 -0.11 0.00 -0.01 0.00 0.00 57.00 55.45 2isa n GLN 387 Cb 0.27 -1.30 -0.05 0.00 1.02 0.00 0.00 30.24 30.18 2isa n GLN 387 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2isa n GLY 388 N 0.85 1.23 3.79 1.08 0.00 -1.24 -4.99 105.19 105.92 2isa n GLY 388 Ca 0.10 -0.32 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 2isa n GLY 388 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2isa s GLN 389 N -2.86 4.39 -1.24 1.61 2.00 -1.26 -3.87 119.66 118.42 2isa s GLN 389 Ca 0.00 1.31 -0.07 0.00 -2.00 0.00 0.00 55.36 54.60 2isa s GLN 389 Cb 0.00 -2.56 0.01 0.00 0.80 0.00 0.00 33.01 31.26 2isa s GLN 389 CO 0.00 0.10 1.08 0.91 -0.50 0.00 0.00 175.29 176.87 2isa n TRP 390 N 0.07 -2.58 -2.40 1.67 7.02 -1.26 -4.74 117.44 115.22 2isa n TRP 390 Ca 0.04 0.94 -0.42 0.00 -1.02 0.00 0.00 57.50 57.03 2isa n TRP 390 Cb 0.51 -4.78 -0.03 0.00 -2.42 0.00 0.00 31.31 24.59 2isa n TRP 390 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2isa s ALA 391 N -3.30 3.56 0.94 6.99 0.00 -1.25 -5.01 121.76 123.68 2isa s ALA 391 Ca 0.46 0.63 -0.11 0.00 0.00 0.00 0.00 51.96 52.93 2isa s ALA 391 Cb -0.20 -3.57 0.16 0.00 0.00 0.00 0.00 23.12 19.51 2isa s ALA 391 CO 0.68 -0.92 1.09 -1.83 0.00 0.00 0.00 175.76 174.78 2isa s GLU 392 N 2.66 0.88 -0.68 0.00 -1.05 -1.26 -5.01 118.70 114.25 2isa s GLU 392 Ca 0.57 0.95 0.05 0.00 -0.15 0.00 0.00 54.97 56.39 2isa s GLU 392 Cb -0.25 -1.76 0.18 0.00 -0.44 0.00 0.00 34.13 31.86 2isa s GLU 392 CO 0.21 -2.53 0.53 1.04 0.95 0.00 0.00 175.26 175.45 2isa n GLN 393 N -4.10 1.82 0.29 -4.83 6.02 -1.26 -4.97 117.38 110.36 2isa n GLN 393 Ca 0.07 -4.42 0.19 0.00 -0.01 0.00 0.00 57.00 52.83 2isa n GLN 393 Cb 0.54 -2.23 0.99 0.00 1.02 0.00 0.00 30.24 30.57 2isa n GLN 393 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 2isa h PRO 394 N 5.20 0.00 0.00 -1.09 0.13 -2.01 -1.28 132.00 132.94 2isa h PRO 394 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2isa h PRO 394 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 2isa h PRO 394 CO 0.71 0.00 0.00 -0.44 -0.23 0.00 0.00 178.00 178.04 2isa h ASP 395 N 0.00 0.00 -0.52 1.44 3.32 -2.04 -2.07 116.42 116.54 2isa h ASP 395 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2isa h ASP 395 Cb 0.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.78 2isa h ASP 395 CO -0.00 0.00 0.00 0.49 -1.72 0.00 0.00 179.24 178.01 2isa n PHE 396 N -2.93 0.77 -1.92 4.55 3.72 -0.48 -4.97 117.46 116.20 2isa n PHE 396 Ca -0.01 -0.37 -0.42 0.00 -0.05 0.00 0.00 57.45 56.61 2isa n PHE 396 Cb 0.19 -0.03 -0.02 0.00 -0.94 0.00 0.00 39.48 38.68 2isa n PHE 396 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2isa s SER 397 N -0.96 6.55 0.45 4.37 0.15 -0.78 -5.01 113.70 118.47 2isa s SER 397 Ca 0.35 2.74 -0.20 0.00 0.70 0.00 0.00 55.95 59.54 2isa s SER 397 Cb 0.19 -2.62 -0.10 0.00 -1.71 0.00 0.00 66.02 61.78 2isa s SER 397 CO 0.23 -0.80 0.98 -1.61 1.20 0.00 0.00 173.24 173.24 2isa s GLU 398 N 0.04 4.08 0.64 5.44 2.02 -1.26 -5.06 118.70 124.61 2isa s GLU 398 Ca 0.64 1.17 -0.16 0.00 0.02 0.00 0.00 54.97 56.64 2isa s GLU 398 Cb -0.44 -2.15 -0.01 0.00 0.10 0.00 0.00 34.13 31.62 2isa s GLU 398 CO 0.41 -0.16 1.12 -1.25 0.02 0.00 0.00 175.26 175.40 2isa s PRO 399 N -3.28 2.88 0.80 0.39 0.04 -1.26 -5.01 135.00 129.57 2isa s PRO 399 Ca 0.63 1.46 -0.14 0.00 0.04 0.00 0.00 61.00 63.00 2isa s PRO 399 Cb -0.11 -1.96 0.08 0.00 0.04 0.00 0.00 34.50 32.55 2isa s PRO 399 CO 0.17 -1.20 1.22 -2.14 0.04 0.00 0.00 177.00 175.08 2isa s PRO 400 N -3.91 1.65 -0.20 0.56 0.02 -1.26 -5.04 135.00 126.82 2isa s PRO 400 Ca 0.69 1.79 -0.06 0.00 0.02 0.00 0.00 61.00 63.44 2isa s PRO 400 Cb -0.22 -1.77 -0.03 0.00 0.02 0.00 0.00 34.50 32.50 2isa s PRO 400 CO 0.39 -2.21 0.03 -1.17 -0.33 0.00 0.00 177.00 173.70 2isa s LEU 401 N -5.65 3.48 0.50 -5.54 2.96 -1.26 -5.10 118.68 108.07 2isa s LEU 401 Ca 0.74 -0.10 -0.21 0.00 -0.22 0.00 0.00 54.13 54.34 2isa s LEU 401 Cb -0.30 -1.88 -0.06 0.00 0.50 0.00 0.00 46.19 44.45 2isa s LEU 401 CO 0.50 0.10 1.18 0.20 -1.32 0.00 0.00 176.35 177.00 2isa s ASN 402 N 0.82 5.87 0.06 3.68 0.02 -1.26 -5.04 114.94 119.09 2isa s ASN 402 Ca 0.02 2.32 0.05 0.00 -1.02 0.00 0.00 52.86 54.23 2isa s ASN 402 Cb -0.14 -2.60 -0.03 0.00 0.02 0.00 0.00 41.25 38.50 2isa s ASN 402 CO 0.02 -1.12 -0.14 -0.76 0.02 0.00 0.00 177.10 175.12 2isa s LEU 403 N -3.39 2.24 -0.10 0.60 1.02 -1.26 -5.15 118.68 112.65 2isa s LEU 403 Ca 0.68 -0.57 -0.05 0.00 0.02 0.00 0.00 54.13 54.22 2isa s LEU 403 Cb -0.28 -0.55 0.05 0.00 0.02 0.00 0.00 46.19 45.42 2isa s LEU 403 CO 0.33 -0.04 0.23 -0.62 0.02 0.00 0.00 176.35 176.28 2isa s ASP 404 N -1.55 -0.20 0.00 2.29 -1.08 -1.26 -5.14 116.67 109.73 2isa s ASP 404 Ca -0.01 0.50 0.00 0.00 -0.52 0.00 0.00 52.55 52.52 2isa s ASP 404 Cb -0.09 0.40 0.00 0.00 -1.46 0.00 0.00 42.92 41.76 2isa s ASP 404 CO 0.02 -0.17 0.00 0.61 0.52 0.00 0.00 175.17 176.15 2isa n GLY 405 N 4.31 2.43 3.84 2.66 0.00 -1.26 -5.08 105.19 112.09 2isa n GLY 405 Ca -0.24 -2.05 -0.32 0.00 0.00 0.00 0.00 46.02 43.41 2isa n GLY 405 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2isa s ALA 406 N -2.36 2.99 -0.06 4.61 0.00 -1.26 -5.00 121.76 120.68 2isa s ALA 406 Ca 0.00 0.13 -0.30 0.00 0.00 0.00 0.00 51.96 51.79 2isa s ALA 406 Cb 0.00 -3.13 -0.06 0.00 0.00 0.00 0.00 23.12 19.93 2isa s ALA 406 CO 0.00 -0.55 1.81 0.00 0.00 0.00 0.00 175.76 177.02 2isa s ALA 407 N -2.80 3.48 0.10 0.00 0.00 -1.26 -4.94 121.76 116.34 2isa s ALA 407 Ca 0.58 0.99 -0.26 0.00 0.00 0.00 0.00 51.96 53.27 2isa s ALA 407 Cb -0.12 -3.82 0.08 0.00 0.00 0.00 0.00 23.12 19.26 2isa s ALA 407 CO 0.41 -1.66 0.97 0.00 0.00 0.00 0.00 175.76 175.48 2isa s ALA 408 N 4.72 -1.74 -1.18 0.00 0.00 -1.26 -5.07 121.76 117.24 2isa s ALA 408 Ca 0.81 0.39 -0.11 0.00 0.00 0.00 0.00 51.96 53.05 2isa s ALA 408 Cb -0.35 0.56 0.22 0.00 0.00 0.00 0.00 23.12 23.55 2isa s ALA 408 CO 0.34 -0.95 1.40 0.72 0.00 0.00 0.00 175.76 177.27 2isa n HIS 409 N -0.41 4.51 -2.04 0.00 8.25 -1.26 -5.02 115.22 119.25 2isa n HIS 409 Ca -0.07 -3.38 -0.42 0.00 -0.26 0.00 0.00 57.72 53.59 2isa n HIS 409 Cb 0.61 -1.91 -0.03 0.00 1.12 0.00 0.00 29.99 29.78 2isa n HIS 409 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2isa s TRP 410 N 0.03 3.12 -0.29 4.41 0.52 -1.26 -4.94 118.94 120.53 2isa s TRP 410 Ca 0.37 0.76 -0.29 0.00 0.02 0.00 0.00 56.10 56.96 2isa s TRP 410 Cb -0.03 -3.82 -0.00 0.00 -1.15 0.00 0.00 33.47 28.47 2isa s TRP 410 CO -0.01 -2.99 1.38 0.34 0.02 0.00 0.00 176.95 175.69 2isa s ASP 411 N 1.18 6.59 0.54 2.95 -1.08 -1.26 -4.89 116.67 120.69 2isa s ASP 411 Ca 0.68 1.28 0.35 0.00 -0.52 0.00 0.00 52.55 54.34 2isa s ASP 411 Cb -0.41 -2.54 1.69 0.00 -1.46 0.00 0.00 42.92 40.21 2isa s ASP 411 CO 0.31 -1.14 2.06 1.12 0.52 0.00 0.00 175.17 178.04 2isa h HIS 412 N 9.69 0.00 0.00 -5.34 2.07 -1.97 -2.86 115.15 116.74 2isa h HIS 412 Ca -0.28 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.24 2isa h HIS 412 Cb 1.11 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.09 2isa h HIS 412 CO 0.89 0.00 0.00 0.54 -3.07 0.00 0.00 177.93 176.29 2isa n ARG 413 N -2.90 0.67 -0.08 5.12 1.74 -1.26 -1.55 116.66 118.40 2isa n ARG 413 Ca -0.01 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 57.15 2isa n ARG 413 Cb 0.18 -1.46 0.44 0.00 -1.02 0.00 0.00 32.46 30.60 2isa n ARG 413 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2isa h GLU 414 N 0.00 0.53 -5.29 5.56 4.81 -1.92 -3.34 114.58 114.93 2isa h GLU 414 Ca 0.00 -0.03 -0.65 0.00 -0.13 0.00 0.00 59.36 58.55 2isa h GLU 414 Cb 0.00 -0.12 -0.16 0.00 0.63 0.00 0.00 28.75 29.10 2isa h GLU 414 CO 0.00 0.35 0.35 0.34 -0.73 0.00 0.00 179.01 179.32 2isa s ASP 415 N -6.38 6.23 -0.14 1.04 -1.08 -0.59 -4.90 116.67 110.84 2isa s ASP 415 Ca -0.08 -0.90 0.16 0.00 -0.52 0.00 0.00 52.55 51.20 2isa s ASP 415 Cb 0.19 -2.37 0.69 0.00 -1.46 0.00 0.00 42.92 39.97 2isa s ASP 415 CO 0.75 -1.20 1.59 -0.62 0.52 0.00 0.00 175.17 176.20 2isa n GLU 416 N 7.03 3.82 -2.48 4.34 1.02 -1.26 -4.74 120.64 128.38 2isa n GLU 416 Ca -0.04 -2.71 -0.42 0.00 -0.02 0.00 0.00 57.16 53.97 2isa n GLU 416 Cb 0.45 -1.95 -0.00 0.00 -0.02 0.00 0.00 31.44 29.92 2isa n GLU 416 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2isa n ASP 417 N 0.91 4.73 0.04 1.62 -0.08 -1.26 -4.64 116.55 117.86 2isa n ASP 417 Ca 0.24 -2.90 0.07 0.00 -1.51 0.00 0.00 54.79 50.70 2isa n ASP 417 Cb 0.91 -1.74 -0.08 0.00 2.34 0.00 0.00 41.12 42.55 2isa n ASP 417 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 2isa n TYR 418 N 8.62 0.60 0.02 -0.67 4.01 -1.26 -4.70 117.16 123.78 2isa n TYR 418 Ca 0.49 0.18 0.01 0.00 -0.16 0.00 0.00 57.90 58.42 2isa n TYR 418 Cb 0.45 -0.85 -0.01 0.00 -0.31 0.00 0.00 39.34 38.62 2isa n TYR 418 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2isa n PHE 419 N -2.60 0.00 -0.17 -0.72 3.72 -1.26 -4.68 117.46 111.75 2isa n PHE 419 Ca -0.06 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.24 2isa n PHE 419 Cb 0.67 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 39.18 2isa n PHE 419 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2isa h SER 420 N 0.00 0.94 -0.21 4.37 4.64 -1.88 -0.44 113.55 120.97 2isa h SER 420 Ca 0.00 -0.34 -0.13 0.00 -0.47 0.00 0.00 61.79 60.85 2isa h SER 420 Cb 0.07 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 61.91 2isa h SER 420 CO 0.00 1.06 -0.38 1.56 -0.87 0.00 0.00 176.83 178.19 2isa h GLN 421 N 0.80 0.62 -0.63 4.77 4.20 -1.91 0.23 115.11 123.19 2isa h GLN 421 Ca 0.13 -0.40 0.09 0.00 0.06 0.00 0.00 58.65 58.54 2isa h GLN 421 Cb 0.62 0.05 -0.07 0.00 0.30 0.00 0.00 27.48 28.38 2isa h GLN 421 CO 0.04 1.01 0.27 -1.35 -0.67 0.00 0.00 178.83 178.13 2isa h PRO 422 N 0.31 0.47 -0.53 1.46 0.11 -1.83 -1.30 132.00 130.70 2isa h PRO 422 Ca 0.01 -0.03 0.10 0.00 0.11 0.00 0.00 66.00 66.19 2isa h PRO 422 Cb 0.98 -0.11 -0.08 0.00 0.11 0.00 0.00 31.00 31.90 2isa h PRO 422 CO 0.09 0.31 0.04 0.78 -0.21 0.00 0.00 178.00 179.01 2isa h GLY 423 N 0.48 0.59 0.94 -0.55 0.00 -0.84 -0.40 103.07 103.29 2isa h GLY 423 Ca 0.31 0.04 -0.02 0.00 0.00 0.00 0.00 47.33 47.66 2isa h GLY 423 CO -0.28 -0.13 0.17 -0.55 0.00 0.00 0.00 176.54 175.75 2isa h ASP 424 N 0.16 0.54 0.16 0.19 3.32 -0.58 -0.30 116.42 119.90 2isa h ASP 424 Ca 0.27 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.17 2isa h ASP 424 Cb 0.41 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 2isa h ASP 424 CO -0.41 0.55 -0.14 0.25 -1.72 0.00 0.00 179.24 177.76 2isa h LEU 425 N 0.49 -0.38 -0.55 1.55 5.85 -1.00 -2.57 115.31 118.70 2isa h LEU 425 Ca 0.13 0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.98 2isa h LEU 425 Cb 0.17 0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.26 2isa h LEU 425 CO -0.01 -0.22 0.15 0.15 -0.34 0.00 0.00 178.44 178.17 2isa h PHE 426 N -0.32 0.25 -0.00 1.25 3.57 -0.97 -2.40 116.94 118.32 2isa h PHE 426 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2isa h PHE 426 Cb 0.30 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.01 2isa h PHE 426 CO -0.12 0.03 0.00 0.78 -2.23 0.00 0.00 178.31 176.77 2isa h GLY 427 N 0.30 0.00 0.40 2.40 0.00 -0.80 -1.88 103.07 103.50 2isa h GLY 427 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.61 2isa h GLY 427 CO -0.33 0.00 -0.34 1.04 0.00 0.00 0.00 176.54 176.91 2isa n LEU 428 N -3.91 0.91 -4.76 3.11 4.77 -0.91 -4.89 117.00 111.32 2isa n LEU 428 Ca -0.03 -0.21 -0.40 0.00 -0.03 0.00 0.00 56.01 55.34 2isa n LEU 428 Cb 0.08 -0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 40.97 2isa n LEU 428 CO 0.28 0.18 0.73 -0.04 -1.33 0.00 0.00 177.39 177.21 2isa s MET 429 N -2.64 4.65 1.07 3.23 -1.94 -0.71 -5.06 119.30 117.90 2isa s MET 429 Ca 0.20 1.65 -0.12 0.00 -1.71 0.00 0.00 55.69 55.71 2isa s MET 429 Cb 0.19 -3.13 0.23 0.00 2.01 0.00 0.00 34.83 34.13 2isa s MET 429 CO 0.58 0.27 1.06 0.95 -0.01 0.00 0.00 175.02 177.87 2isa s THR 430 N -1.25 2.13 0.33 2.05 -4.23 -1.26 -4.76 115.64 108.65 2isa s THR 430 Ca 0.45 0.04 0.02 0.00 -1.18 0.00 0.00 61.69 61.02 2isa s THR 430 Cb -0.28 -2.26 0.22 0.00 1.34 0.00 0.00 72.50 71.51 2isa s THR 430 CO 0.36 -0.05 1.94 0.00 -0.54 0.00 0.00 174.62 176.32 2isa h ALA 431 N -2.23 1.43 -0.58 3.99 0.00 -1.98 -1.14 119.26 118.75 2isa h ALA 431 Ca -0.57 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.18 2isa h ALA 431 Cb 1.32 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 2isa h ALA 431 CO 0.52 0.45 0.15 1.49 0.00 0.00 0.00 179.25 181.86 2isa h GLU 432 N 0.76 0.92 -0.40 0.00 4.57 -1.99 -1.19 114.58 117.24 2isa h GLU 432 Ca 0.19 -0.21 -0.11 0.00 -1.18 0.00 0.00 59.36 58.04 2isa h GLU 432 Cb 0.09 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.54 2isa h GLU 432 CO -0.02 0.84 -0.20 0.87 -1.18 0.00 0.00 179.01 179.32 2isa h LYS 433 N 0.82 0.78 -0.59 1.92 1.57 -1.83 -1.55 116.57 117.69 2isa h LYS 433 Ca 0.18 -0.31 -0.09 0.00 -1.87 0.00 0.00 60.65 58.56 2isa h LYS 433 Cb 0.33 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 2isa h LYS 433 CO -0.00 0.92 -0.00 1.96 -0.57 0.00 0.00 179.45 181.76 2isa h GLN 434 N 0.69 1.04 -0.55 3.15 4.20 -1.07 -1.41 115.11 121.16 2isa h GLN 434 Ca 0.10 -0.32 -0.11 0.00 0.06 0.00 0.00 58.65 58.38 2isa h GLN 434 Cb 0.71 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.37 2isa h GLN 434 CO 0.05 1.02 -0.08 0.00 -0.67 0.00 0.00 178.83 179.14 2isa h ALA 435 N 1.03 0.81 -0.34 3.87 0.00 -1.09 -0.05 119.26 123.49 2isa h ALA 435 Ca 0.17 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.75 2isa h ALA 435 Cb 0.55 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2isa h ALA 435 CO 0.03 0.67 0.20 0.82 0.00 0.00 0.00 179.25 180.97 2isa h ILE 436 N 0.91 1.04 0.03 0.00 2.04 -1.16 -0.23 117.51 120.14 2isa h ILE 436 Ca 0.15 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.89 2isa h ILE 436 Cb 0.64 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 2isa h ILE 436 CO 0.04 0.08 -0.18 0.25 0.00 0.00 0.00 178.15 178.34 2isa h LEU 437 N 0.42 -0.51 -0.17 1.44 6.46 -0.96 0.35 115.31 122.33 2isa h LEU 437 Ca 0.13 0.07 0.04 0.00 -0.12 0.00 0.00 57.88 58.00 2isa h LEU 437 Cb -0.00 0.21 -0.04 0.00 -0.73 0.00 0.00 40.66 40.09 2isa h LEU 437 CO -0.06 -0.25 -0.08 -0.26 -0.62 0.00 0.00 178.44 177.17 2isa h PHE 438 N -0.31 -0.19 -0.51 1.25 0.05 -0.81 -1.63 116.94 114.79 2isa h PHE 438 Ca 0.05 0.02 -0.04 0.00 3.82 0.00 0.00 57.97 61.81 2isa h PHE 438 Cb 0.36 0.11 -0.02 0.00 2.00 0.00 0.00 35.95 38.40 2isa h PHE 438 CO -0.21 -0.13 0.15 0.22 -0.18 0.00 0.00 178.31 178.15 2isa h ASP 439 N -0.06 0.75 -0.37 2.17 3.58 -0.88 -0.96 116.42 120.65 2isa h ASP 439 Ca 0.09 -0.22 -0.01 0.00 0.42 0.00 0.00 57.03 57.32 2isa h ASP 439 Cb 0.20 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.04 2isa h ASP 439 CO -0.21 0.77 0.18 0.78 -2.88 0.00 0.00 179.24 177.87 2isa h ASN 440 N 0.69 0.48 0.09 2.28 -0.26 -0.77 -1.89 115.58 116.20 2isa h ASN 440 Ca 0.16 -0.12 -0.00 0.00 -0.56 0.00 0.00 56.30 55.78 2isa h ASN 440 Cb 0.29 -0.12 0.00 0.00 -1.06 0.00 0.00 38.32 37.43 2isa h ASN 440 CO -0.00 0.46 -0.04 0.74 -1.06 0.00 0.00 177.43 177.53 2isa h THR 441 N 0.46 1.04 -0.58 2.81 2.02 -1.23 -0.40 112.91 117.02 2isa h THR 441 Ca 0.13 -0.48 0.05 0.00 0.77 0.00 0.00 66.41 66.88 2isa h THR 441 Cb 0.11 1.34 -0.05 0.00 -1.74 0.00 0.00 68.15 67.82 2isa h THR 441 CO -0.02 0.12 0.31 0.00 0.37 0.00 0.00 175.52 176.30 2isa h ALA 442 N 0.54 0.76 -0.23 6.16 0.00 -1.17 -0.07 119.26 125.24 2isa h ALA 442 Ca -0.01 0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 2isa h ALA 442 Cb 0.29 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2isa h ALA 442 CO 0.02 -0.02 -0.47 0.00 0.00 0.00 0.00 179.25 178.78 2isa h ARG 443 N 0.59 0.61 -0.36 0.00 3.08 -1.33 -2.81 114.38 114.16 2isa h ARG 443 Ca 0.26 -0.35 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 2isa h ARG 443 Cb 0.15 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.20 2isa h ARG 443 CO -0.17 0.95 0.12 -0.97 -1.07 0.00 0.00 179.97 178.84 2isa h ASN 444 N 0.49 0.46 -0.10 7.04 -0.73 -0.59 -2.54 115.58 119.61 2isa h ASN 444 Ca 0.03 -0.05 0.00 0.00 1.87 0.00 0.00 56.30 58.15 2isa h ASN 444 Cb 1.00 -0.12 0.00 0.00 0.27 0.00 0.00 38.32 39.47 2isa h ASN 444 CO 0.09 0.44 0.00 0.18 -0.37 0.00 0.00 177.43 177.78 2isa n LEU 445 N -4.37 0.70 -4.71 0.34 4.77 -0.08 -4.90 117.00 108.73 2isa n LEU 445 Ca 0.02 -0.32 -0.42 0.00 -0.03 0.00 0.00 56.01 55.26 2isa n LEU 445 Cb 0.16 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.15 2isa n LEU 445 CO 0.37 0.16 1.22 0.21 -1.33 0.00 0.00 177.39 178.02 2isa s ASN 446 N -1.30 6.62 0.00 -1.43 3.84 -0.96 -2.36 114.94 119.35 2isa s ASN 446 Ca 0.20 2.55 0.00 0.00 0.21 0.00 0.00 52.86 55.82 2isa s ASN 446 Cb 0.10 -2.59 0.00 0.00 -0.55 0.00 0.00 41.25 38.21 2isa s ASN 446 CO 0.15 -0.81 0.00 0.61 -2.79 0.00 0.00 177.10 174.26 2isa n GLY 447 N 3.76 1.50 3.73 1.21 0.00 -1.26 -4.97 105.19 109.15 2isa n GLY 447 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2isa n GLY 447 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2isa s VAL 448 N -3.39 3.96 0.31 1.61 1.01 -0.99 -4.90 120.40 118.01 2isa s VAL 448 Ca 0.00 1.61 -0.27 0.00 0.00 0.00 0.00 61.98 63.31 2isa s VAL 448 Cb 0.00 -4.03 -0.14 0.00 0.00 0.00 0.00 36.38 32.22 2isa s VAL 448 CO 0.00 0.23 0.98 -2.65 0.00 0.00 0.00 175.10 173.67 2isa n PRO 449 N 2.80 1.30 -0.29 2.72 -0.02 -1.26 -4.69 135.00 135.56 2isa n PRO 449 Ca 0.04 0.46 0.09 0.00 -2.02 0.00 0.00 63.50 62.07 2isa n PRO 449 Cb 0.46 -1.84 0.32 0.00 -0.02 0.00 0.00 33.50 32.43 2isa n PRO 449 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2isa h LYS 450 N 1.87 0.79 -0.37 -0.52 3.64 -1.97 -1.58 116.57 118.43 2isa h LYS 450 Ca -0.40 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 58.91 2isa h LYS 450 Cb 1.34 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.97 2isa h LYS 450 CO 0.60 0.53 0.11 1.05 -2.27 0.00 0.00 179.45 179.47 2isa h GLU 451 N 0.82 0.53 -0.15 1.90 9.09 -1.99 0.71 114.58 125.48 2isa h GLU 451 Ca 0.45 -0.08 -0.11 0.00 0.05 0.00 0.00 59.36 59.67 2isa h GLU 451 Cb 0.56 -0.10 0.00 0.00 -1.65 0.00 0.00 28.75 27.57 2isa h GLU 451 CO -0.21 0.47 -0.33 0.82 0.05 0.00 0.00 179.01 179.81 2isa h ILE 452 N 0.53 1.36 -0.65 -1.06 2.04 -1.65 -2.55 117.51 115.52 2isa h ILE 452 Ca 0.13 -1.59 0.08 0.00 1.00 0.00 0.00 64.86 64.48 2isa h ILE 452 Cb 0.17 1.99 -0.06 0.00 -0.74 0.00 0.00 36.82 38.17 2isa h ILE 452 CO -0.01 0.48 0.32 1.56 0.00 0.00 0.00 178.15 180.50 2isa h GLN 453 N 0.12 0.55 -0.77 2.37 4.20 -0.93 -2.52 115.11 118.14 2isa h GLN 453 Ca 0.00 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.63 2isa h GLN 453 Cb 0.93 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.55 2isa h GLN 453 CO 0.07 0.36 0.27 1.25 -0.67 0.00 0.00 178.83 180.12 2isa h LEU 454 N 0.57 1.09 -0.64 1.46 5.85 -0.87 -1.17 115.31 121.60 2isa h LEU 454 Ca 0.31 -0.19 0.10 0.00 0.84 0.00 0.00 57.88 58.94 2isa h LEU 454 Cb 0.30 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 40.97 2isa h LEU 454 CO -0.24 0.99 0.25 0.03 -0.34 0.00 0.00 178.44 179.13 2isa h ARG 455 N 1.13 0.43 -0.20 1.25 2.47 -1.04 0.11 114.38 118.53 2isa h ARG 455 Ca 0.25 -0.03 -0.08 0.00 -1.26 0.00 0.00 59.98 58.86 2isa h ARG 455 Cb 0.27 -0.10 -0.00 0.00 -1.65 0.00 0.00 29.97 28.49 2isa h ARG 455 CO -0.01 0.28 -0.20 1.25 0.56 0.00 0.00 179.97 181.85 2isa h HIS 456 N 0.44 0.59 -0.94 3.04 2.76 -1.09 -2.36 115.15 117.59 2isa h HIS 456 Ca 0.32 -0.17 0.04 0.00 -2.20 0.00 0.00 60.37 58.36 2isa h HIS 456 Cb 0.39 -0.12 -0.06 0.00 1.55 0.00 0.00 27.41 29.17 2isa h HIS 456 CO -0.16 0.84 0.61 0.28 -1.30 0.00 0.00 177.93 178.20 2isa h VAL 457 N 0.16 1.14 -0.20 5.26 2.07 -0.99 -0.75 116.25 122.95 2isa h VAL 457 Ca 0.03 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.15 2isa h VAL 457 Cb 0.74 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 2isa h VAL 457 CO 0.05 0.21 0.13 0.74 0.02 0.00 0.00 177.57 178.72 2isa h THR 458 N 1.17 1.06 -0.71 2.57 2.02 -0.75 0.52 112.91 118.80 2isa h THR 458 Ca 0.38 -0.12 0.01 0.00 0.77 0.00 0.00 66.41 67.46 2isa h THR 458 Cb 0.03 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 67.17 2isa h THR 458 CO -0.13 0.06 0.46 0.45 0.37 0.00 0.00 175.52 176.73 2isa h HIS 459 N 0.27 0.88 -0.49 3.16 3.86 -1.01 -1.22 115.15 120.59 2isa h HIS 459 Ca 0.07 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.29 2isa h HIS 459 Cb -0.02 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.13 2isa h HIS 459 CO -0.06 0.54 0.24 0.00 0.86 0.00 0.00 177.93 179.51 2isa h TYR 461 N 0.65 0.79 0.00 0.00 3.20 -0.62 -1.21 116.97 119.78 2isa h TYR 461 Ca 0.17 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.01 2isa h TYR 461 Cb 0.11 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.12 2isa h TYR 461 CO -0.01 0.38 -0.28 0.87 -1.64 0.00 0.00 178.16 177.48 2isa h LYS 462 N 0.78 0.00 0.21 1.82 1.57 -0.77 -2.49 116.57 117.69 2isa h LYS 462 Ca 0.33 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.10 2isa h LYS 462 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 2isa h LYS 462 CO -0.18 0.28 -0.10 0.00 -0.57 0.00 0.00 179.45 178.88 2isa h ALA 463 N 1.72 -0.28 -1.99 3.86 0.00 -0.40 -3.46 119.26 118.71 2isa h ALA 463 Ca -0.00 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.77 2isa h ALA 463 Cb 0.54 0.11 -0.21 0.00 0.00 0.00 0.00 17.79 18.23 2isa h ALA 463 CO 0.04 -0.53 0.03 0.34 0.00 0.00 0.00 179.25 179.13 2isa s ASP 464 N -5.16 -0.93 0.33 0.00 -1.08 -0.54 -4.16 116.67 105.12 2isa s ASP 464 Ca -0.15 1.50 0.08 0.00 -0.52 0.00 0.00 52.55 53.47 2isa s ASP 464 Cb 0.03 1.39 0.80 0.00 -1.46 0.00 0.00 42.92 43.68 2isa s ASP 464 CO 0.61 -0.24 1.80 -0.65 0.52 0.00 0.00 175.17 177.20 2isa h PRO 465 N 6.90 0.69 0.00 4.34 0.11 -1.72 0.04 132.00 142.36 2isa h PRO 465 Ca -0.30 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.73 2isa h PRO 465 Cb 1.23 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 2isa h PRO 465 CO 0.16 0.45 -0.17 0.00 -0.21 0.00 0.00 178.00 178.23 2isa h ALA 466 N 1.63 1.20 0.09 -0.75 0.00 -1.91 -1.50 119.26 118.02 2isa h ALA 466 Ca 0.55 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.30 2isa h ALA 466 Cb 0.94 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2isa h ALA 466 CO -0.33 0.22 -0.04 -0.92 0.00 0.00 0.00 179.25 178.17 2isa h TYR 467 N 0.00 -0.11 -0.06 0.00 3.20 -1.24 -0.74 116.97 118.03 2isa h TYR 467 Ca -0.00 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.89 2isa h TYR 467 Cb 0.49 0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.77 2isa h TYR 467 CO 0.00 0.43 -0.09 0.78 -1.64 0.00 0.00 178.16 177.64 2isa h GLY 468 N -0.80 -0.05 1.19 1.82 0.00 -1.38 -2.87 103.07 100.98 2isa h GLY 468 Ca -0.01 0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.42 2isa h GLY 468 CO 0.02 -0.10 0.50 -2.09 0.00 0.00 0.00 176.54 174.87 2isa h GLU 469 N -0.13 1.08 -0.61 4.80 4.81 -1.37 0.68 114.58 123.84 2isa h GLU 469 Ca 0.05 -0.09 0.07 0.00 -0.13 0.00 0.00 59.36 59.27 2isa h GLU 469 Cb 0.20 -0.23 -0.06 0.00 0.63 0.00 0.00 28.75 29.29 2isa h GLU 469 CO -0.13 0.74 0.30 0.78 -0.73 0.00 0.00 179.01 179.97 2isa h GLY 470 N 1.11 0.88 1.01 1.92 0.00 -0.91 0.12 103.07 107.20 2isa h GLY 470 Ca 0.29 -0.20 -0.26 0.00 0.00 0.00 0.00 47.33 47.16 2isa h GLY 470 CO -0.06 0.09 -1.14 -2.22 0.00 0.00 0.00 176.54 173.21 2isa h ILE 471 N 0.55 1.38 -0.52 2.60 2.04 -1.28 -3.28 117.51 119.01 2isa h ILE 471 Ca 0.29 -2.55 0.10 0.00 1.00 0.00 0.00 64.86 63.70 2isa h ILE 471 Cb 0.24 3.01 -0.09 0.00 -0.74 0.00 0.00 36.82 39.25 2isa h ILE 471 CO -0.22 0.75 -0.07 1.23 0.00 0.00 0.00 178.15 179.84 2isa h GLY 472 N -0.04 0.44 0.86 5.37 0.00 0.63 -2.21 103.07 108.13 2isa h GLY 472 Ca -0.19 0.13 0.02 0.00 0.00 0.00 0.00 47.33 47.29 2isa h GLY 472 CO 0.21 -0.18 0.17 0.50 0.00 0.00 0.00 176.54 177.24 2isa h LYS 473 N 0.04 0.34 -0.60 4.80 1.57 -0.90 -1.31 116.57 120.51 2isa h LYS 473 Ca 0.26 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 59.08 2isa h LYS 473 Cb 0.39 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.59 2isa h LYS 473 CO -0.49 0.22 0.40 -0.07 -0.57 0.00 0.00 179.45 178.94 2isa h LEU 474 N 0.35 0.49 -0.01 2.94 3.38 -1.49 -2.48 115.31 118.49 2isa h LEU 474 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2isa h LEU 474 Cb 0.04 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2isa h LEU 474 CO -0.09 0.32 -0.47 0.18 0.09 0.00 0.00 178.44 178.47 2isa n LEU 475 N -4.48 0.48 0.00 1.67 4.77 -0.88 -4.96 117.00 113.61 2isa n LEU 475 Ca 0.09 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 2isa n LEU 475 Cb 0.25 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 2isa n LEU 475 CO 0.34 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 2isa n GLY 476 N 1.50 0.66 3.81 -0.72 0.00 -0.73 -5.05 105.19 104.65 2isa n GLY 476 Ca 0.06 -0.73 -0.36 0.00 0.00 0.00 0.00 46.02 44.99 2isa n GLY 476 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2isa s PHE 477 N -2.00 3.63 0.28 1.61 2.99 -0.57 -5.03 117.98 118.89 2isa s PHE 477 Ca 0.00 1.49 -0.29 0.00 0.00 0.00 0.00 56.93 58.13 2isa s PHE 477 Cb 0.00 -2.70 -0.09 0.00 0.00 0.00 0.00 43.02 40.23 2isa s PHE 477 CO 0.00 0.27 1.01 0.34 -0.00 0.00 0.00 175.22 176.84 2isa s ASP 478 N -1.71 7.38 0.47 1.36 -1.08 -1.26 -4.57 116.67 117.26 2isa s ASP 478 Ca 0.46 2.06 0.19 0.00 -0.52 0.00 0.00 52.55 54.75 2isa s ASP 478 Cb -0.16 -2.61 1.20 0.00 -1.46 0.00 0.00 42.92 39.89 2isa s ASP 478 CO 0.21 -0.05 1.97 -0.29 0.52 0.00 0.00 175.17 177.53 2isa h ILE 479 N 2.96 0.79 0.00 4.11 2.10 -1.96 -1.26 117.51 124.24 2isa h ILE 479 Ca -0.46 -0.08 -0.03 0.00 1.08 0.00 0.00 64.86 65.37 2isa h ILE 479 Cb 1.20 0.54 -0.00 0.00 -1.09 0.00 0.00 36.82 37.47 2isa h ILE 479 CO 0.67 0.04 -0.15 0.77 -1.08 0.00 0.00 178.15 178.40 2isa h SER 480 N 0.23 0.00 0.30 2.19 4.64 -1.97 0.13 113.55 119.07 2isa h SER 480 Ca 0.30 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.59 2isa h SER 480 Cb 0.85 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.94 2isa h SER 480 CO -0.06 0.15 -0.13 -0.33 -0.87 0.00 0.00 176.83 175.59 2isa h GLU 481 N 0.00 0.00 0.00 4.77 5.08 -1.62 -3.27 114.58 119.54 2isa h GLU 481 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2isa h GLU 481 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2isa h GLU 481 CO 0.02 0.13 0.00 2.48 -1.00 0.00 0.00 179.01 180.64 2isa n TYR 482 N -3.81 0.00 -0.24 4.33 0.18 -1.05 -4.82 117.16 111.76 2isa n TYR 482 Ca -0.02 -0.02 0.21 0.00 1.88 0.00 0.00 57.90 59.95 2isa n TYR 482 Cb 0.23 -0.00 0.54 0.00 -0.38 0.00 0.00 39.34 39.73 2isa n TYR 482 CO 0.00 0.00 0.00 -0.97 -2.08 0.00 0.00 176.86 173.81 2isa h ASN 483 N 0.00 0.35 0.00 9.48 -0.73 -0.80 -3.42 115.58 120.46 2isa h ASN 483 Ca 0.00 0.04 0.00 0.00 1.87 0.00 0.00 56.30 58.21 2isa h ASN 483 Cb 0.30 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 38.86 2isa h ASN 483 CO 0.00 0.13 0.00 -1.54 -0.37 0.00 0.00 177.43 175.65