#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 2.35 -2.69 1.43 5.02 -1.26 -4.98 118.16 118.02 2isa n LYS 4 Ca 0.00 -2.11 -0.41 0.00 -2.02 0.00 0.00 58.31 53.76 2isa n LYS 4 Cb 0.00 -1.41 -0.04 0.00 -0.02 0.00 0.00 35.03 33.56 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 -1.19 4.69 0.04 1.97 1.02 -1.26 -5.00 119.74 120.01 2isa s LYS 5 Ca 0.32 1.50 -0.29 0.00 0.02 0.00 0.00 55.97 57.52 2isa s LYS 5 Cb 0.18 -3.36 -0.04 0.00 -0.52 0.00 0.00 37.83 34.09 2isa s LYS 5 CO 0.25 0.20 0.92 -1.17 -0.92 0.00 0.00 175.35 174.63 2isa s LEU 6 N -0.09 4.42 0.27 3.17 2.96 -1.26 -5.03 118.68 123.13 2isa s LEU 6 Ca 0.47 1.64 0.05 0.00 -0.22 0.00 0.00 54.13 56.07 2isa s LEU 6 Cb -0.24 -3.49 -0.06 0.00 0.50 0.00 0.00 46.19 42.90 2isa s LEU 6 CO 0.31 -0.14 -0.03 0.42 -1.32 0.00 0.00 176.35 175.59 2isa s THR 7 N 0.50 1.41 0.90 3.68 -4.23 -1.26 -1.48 115.64 115.16 2isa s THR 7 Ca 0.47 -2.08 -0.12 0.00 -1.18 0.00 0.00 61.69 58.78 2isa s THR 7 Cb -0.21 -2.47 0.13 0.00 1.34 0.00 0.00 72.50 71.29 2isa s THR 7 CO 0.27 -0.26 1.13 0.42 -0.54 0.00 0.00 174.62 175.63 2isa s THR 8 N -3.16 2.17 0.59 3.99 -4.23 0.59 -4.83 115.64 110.76 2isa s THR 8 Ca 0.30 0.05 0.34 0.00 -1.18 0.00 0.00 61.69 61.21 2isa s THR 8 Cb 0.05 -2.78 0.38 0.00 1.34 0.00 0.00 72.50 71.49 2isa s THR 8 CO 0.11 -0.07 2.27 0.00 -0.54 0.00 0.00 174.62 176.40 2isa h ALA 9 N -1.47 1.32 -0.01 3.99 0.00 -2.00 0.12 119.26 121.22 2isa h ALA 9 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2isa h ALA 9 Cb 1.32 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2isa h ALA 9 CO 0.61 0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.88 2isa n ALA 10 N -2.24 2.59 -0.54 0.00 0.00 -1.26 -4.95 120.51 114.10 2isa n ALA 10 Ca -0.03 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.00 2isa n ALA 10 Cb 0.10 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.34 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 1.15 0.72 3.72 0.00 0.00 0.43 -5.06 105.19 106.15 2isa n GLY 11 Ca 0.20 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 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 3.44 2.06 -3.60 0.00 -0.02 -1.26 -0.30 135.00 135.33 2isa n PRO 13 Ca 0.06 0.72 -0.39 0.00 -2.02 0.00 0.00 63.50 61.88 2isa n PRO 13 Cb 0.48 -2.29 -0.11 0.00 -0.02 0.00 0.00 33.50 31.56 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 -1.03 5.10 0.00 -1.45 1.01 -0.55 -4.78 120.40 118.71 2isa s VAL 14 Ca 0.56 -0.06 0.08 0.00 0.00 0.00 0.00 61.98 62.56 2isa s VAL 14 Cb -0.58 -3.51 -0.23 0.00 0.00 0.00 0.00 36.38 32.05 2isa s VAL 14 CO 0.61 0.15 0.84 0.00 0.00 0.00 0.00 175.10 176.71 2isa h ALA 15 N 8.39 0.58 -3.44 5.51 0.00 -1.93 -3.45 119.26 124.91 2isa h ALA 15 Ca -0.34 -1.27 -0.62 0.00 0.00 0.00 0.00 54.91 52.68 2isa h ALA 15 Cb 1.17 0.30 -0.40 0.00 0.00 0.00 0.00 17.79 18.87 2isa h ALA 15 CO 0.59 1.43 -0.75 -1.01 0.00 0.00 0.00 179.25 179.51 2isa s HIS 16 N -2.63 2.62 -0.83 0.00 3.76 -1.26 -4.94 115.29 112.01 2isa s HIS 16 Ca -0.04 -2.23 0.10 0.00 -0.15 0.00 0.00 55.06 52.73 2isa s HIS 16 Cb 0.08 -2.16 0.28 0.00 1.11 0.00 0.00 32.58 31.89 2isa s HIS 16 CO 0.82 -0.89 1.24 -1.71 -0.85 0.00 0.00 174.74 173.35 2isa n ASN 17 N 4.59 2.86 -0.02 1.40 5.15 -1.26 -4.71 115.26 123.27 2isa n ASN 17 Ca -0.01 -2.02 -0.02 0.00 -0.60 0.00 0.00 54.58 51.93 2isa n ASN 17 Cb 0.42 -0.22 -0.02 0.00 -0.53 0.00 0.00 39.78 39.43 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 0.41 2.63 -4.32 1.20 1.13 -1.26 -5.03 117.38 112.14 2isa n GLN 18 Ca 0.11 0.00 -0.20 0.00 -1.94 0.00 0.00 57.00 54.97 2isa n GLN 18 Cb 0.42 -1.08 -0.16 0.00 0.11 0.00 0.00 30.24 29.53 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 -3.65 1.09 0.61 1.08 0.01 -1.26 -5.15 114.94 107.66 2isa s ASN 19 Ca -0.03 -0.17 -0.10 0.00 -0.71 0.00 0.00 52.86 51.86 2isa s ASN 19 Cb 0.01 -0.34 -0.03 0.00 0.41 0.00 0.00 41.25 41.30 2isa s ASN 19 CO 0.12 0.04 1.00 0.68 -1.51 0.00 0.00 177.10 177.43 2isa s VAL 20 N 0.33 4.61 0.03 1.60 -7.23 -1.26 -4.93 120.40 113.55 2isa s VAL 20 Ca -0.05 0.73 -0.30 0.00 -1.81 0.00 0.00 61.98 60.55 2isa s VAL 20 Cb -0.09 -3.83 -0.04 0.00 0.56 0.00 0.00 36.38 32.98 2isa s VAL 20 CO 0.00 -1.05 1.02 -1.58 -0.31 0.00 0.00 175.10 173.19 2isa s GLN 21 N -5.13 4.55 0.17 4.82 0.74 -1.26 -5.01 119.66 118.54 2isa s GLN 21 Ca 0.54 1.50 0.03 0.00 0.05 0.00 0.00 55.36 57.48 2isa s GLN 21 Cb -0.11 -3.42 -0.05 0.00 1.10 0.00 0.00 33.01 30.53 2isa s GLN 21 CO 0.52 -0.05 -0.03 0.95 -0.55 0.00 0.00 175.29 176.13 2isa s THR 22 N 0.85 0.87 -1.16 -0.34 -4.23 -1.26 -1.12 115.64 109.24 2isa s THR 22 Ca 0.53 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.86 2isa s THR 22 Cb -0.23 -2.04 0.11 0.00 1.34 0.00 0.00 72.50 71.68 2isa s THR 22 CO 0.29 -0.57 1.49 0.00 -0.54 0.00 0.00 174.62 175.29 2isa s ALA 23 N -3.53 3.45 0.00 3.99 0.00 -0.74 -4.83 121.76 120.11 2isa s ALA 23 Ca 0.21 -2.93 0.00 0.00 0.00 0.00 0.00 51.96 49.24 2isa s ALA 23 Cb 0.05 -4.36 0.00 0.00 0.00 0.00 0.00 23.12 18.81 2isa s ALA 23 CO 0.03 -3.13 0.00 0.41 0.00 0.00 0.00 175.76 173.07 2isa n GLY 24 N 5.24 -1.28 0.36 0.00 0.00 -1.26 -3.50 105.19 104.75 2isa n GLY 24 Ca 0.38 -1.58 0.13 0.00 0.00 0.00 0.00 46.02 44.94 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 0.74 -0.12 1.61 1.57 -2.00 -2.58 116.57 115.80 2isa h LYS 25 Ca 0.00 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.69 2isa h LYS 25 Cb 0.00 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.12 2isa h LYS 25 CO 0.00 0.49 -0.22 0.54 -0.57 0.00 0.00 179.45 179.69 2isa n ARG 26 N -4.71 1.72 -3.08 3.15 5.12 -1.26 -5.05 116.66 112.55 2isa n ARG 26 Ca 0.22 -3.05 -0.18 0.00 -1.93 0.00 0.00 57.85 52.91 2isa n ARG 26 Cb 0.55 -1.67 0.03 0.00 -1.16 0.00 0.00 32.46 30.21 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 -2.83 1.90 0.83 -0.13 0.00 -0.97 -5.07 107.32 101.05 2isa s GLY 27 Ca 0.39 -1.84 -0.11 0.00 0.00 0.00 0.00 44.72 43.15 2isa s GLY 27 CO -0.01 -1.59 1.09 -4.14 0.00 0.00 0.00 173.10 168.45 2isa s PRO 28 N -4.45 1.75 0.37 2.90 0.02 -1.26 -4.41 135.00 129.92 2isa s PRO 28 Ca 0.56 1.02 -0.25 0.00 0.02 0.00 0.00 61.00 62.35 2isa s PRO 28 Cb -0.08 -1.85 -0.09 0.00 0.02 0.00 0.00 34.50 32.50 2isa s PRO 28 CO 0.34 -1.95 1.06 -1.14 -0.33 0.00 0.00 177.00 174.98 2isa s GLN 29 N -4.91 4.29 -0.08 5.54 0.74 -1.26 -1.80 119.66 122.19 2isa s GLN 29 Ca 0.62 1.58 -0.16 0.00 0.05 0.00 0.00 55.36 57.45 2isa s GLN 29 Cb -0.18 -2.71 -0.05 0.00 1.10 0.00 0.00 33.01 31.18 2isa s GLN 29 CO 0.57 -0.04 0.42 -0.51 -0.55 0.00 0.00 175.29 175.17 2isa s LEU 30 N -2.33 4.35 0.45 3.68 1.43 -0.28 -4.89 118.68 121.09 2isa s LEU 30 Ca 0.54 0.82 0.16 0.00 -1.03 0.00 0.00 54.13 54.62 2isa s LEU 30 Cb -0.24 -2.59 1.09 0.00 0.03 0.00 0.00 46.19 44.48 2isa s LEU 30 CO 0.31 0.15 1.98 0.25 0.23 0.00 0.00 176.35 179.26 2isa h LEU 31 N 5.92 0.30 0.00 1.79 5.85 -1.96 -2.82 115.31 124.40 2isa h LEU 31 Ca -0.45 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.28 2isa h LEU 31 Cb 1.19 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.17 2isa h LEU 31 CO 0.70 0.18 0.00 0.00 -0.34 0.00 0.00 178.44 178.98 2isa n GLN 32 N -4.46 0.59 -2.33 1.25 10.64 -1.26 -4.36 117.38 117.45 2isa n GLN 32 Ca 0.10 0.00 -0.35 0.00 -1.83 0.00 0.00 57.00 54.92 2isa n GLN 32 Cb 0.42 -1.37 -0.04 0.00 -0.86 0.00 0.00 30.24 28.39 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 -1.85 5.90 0.16 2.61 -1.08 -1.07 -4.79 116.67 116.56 2isa s ASP 33 Ca 0.21 -1.15 0.10 0.00 -0.52 0.00 0.00 52.55 51.19 2isa s ASP 33 Cb 0.10 -2.57 -0.12 0.00 -1.46 0.00 0.00 42.92 38.87 2isa s ASP 33 CO 0.16 -2.06 1.30 -0.37 0.52 0.00 0.00 175.17 174.73 2isa h VAL 34 N 6.95 1.40 -0.46 1.11 -1.51 -1.91 -2.95 116.25 118.88 2isa h VAL 34 Ca 0.16 -3.00 -0.02 0.00 -1.23 0.00 0.00 66.70 62.62 2isa h VAL 34 Cb 1.00 2.69 -0.02 0.00 -2.13 0.00 0.00 31.29 32.83 2isa h VAL 34 CO 1.33 0.80 0.22 -0.25 -1.23 0.00 0.00 177.57 178.44 2isa h TRP 35 N 0.00 0.66 -0.26 5.19 2.91 -1.96 -0.85 115.95 121.64 2isa h TRP 35 Ca -0.02 -0.03 0.06 0.00 1.13 0.00 0.00 58.89 60.03 2isa h TRP 35 Cb 1.66 -0.20 -0.07 0.00 -0.51 0.00 0.00 29.16 30.04 2isa h TRP 35 CO 0.00 0.53 -0.17 0.35 -1.03 0.00 0.00 178.44 178.13 2isa h PHE 36 N 0.60 -0.41 -0.36 2.65 3.57 -1.90 0.71 116.94 121.79 2isa h PHE 36 Ca 0.16 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.71 2isa h PHE 36 Cb 0.12 0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.06 2isa h PHE 36 CO -0.01 -0.24 0.19 -0.07 -2.23 0.00 0.00 178.31 175.95 2isa h LEU 37 N -0.14 0.29 0.03 0.59 3.38 -1.34 -1.42 115.31 116.69 2isa h LEU 37 Ca 0.14 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 2isa h LEU 37 Cb 0.36 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2isa h LEU 37 CO -0.35 0.21 -0.01 -0.08 0.09 0.00 0.00 178.44 178.29 2isa h GLU 38 N 0.39 -0.04 -0.50 1.13 4.81 -0.83 -1.17 114.58 118.37 2isa h GLU 38 Ca 0.15 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.42 2isa h GLU 38 Cb 0.04 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.39 2isa h GLU 38 CO -0.09 0.17 0.25 -0.22 -0.73 0.00 0.00 179.01 178.38 2isa h LYS 39 N -0.24 0.48 -0.04 1.92 3.64 -0.78 -1.99 116.57 119.56 2isa h LYS 39 Ca -0.00 -0.03 -0.16 0.00 -1.27 0.00 0.00 60.65 59.19 2isa h LYS 39 Cb 0.22 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 2isa h LYS 39 CO 0.01 0.31 -0.70 -0.07 -2.27 0.00 0.00 179.45 176.74 2isa h LEU 40 N 0.49 0.24 -0.45 5.20 -0.00 -1.24 -1.62 115.31 117.93 2isa h LEU 40 Ca 0.22 -0.15 -0.17 0.00 -0.00 0.00 0.00 57.88 57.77 2isa h LEU 40 Cb 0.12 -0.07 -0.00 0.00 -0.00 0.00 0.00 40.66 40.71 2isa h LEU 40 CO -0.15 0.86 -0.54 0.00 -0.00 0.00 0.00 178.44 178.61 2isa h ALA 41 N 1.14 0.62 -0.45 1.53 0.00 -0.95 0.21 119.26 121.36 2isa h ALA 41 Ca -0.02 -0.51 -0.13 0.00 0.00 0.00 0.00 54.91 54.26 2isa h ALA 41 Cb 1.24 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2isa h ALA 41 CO 0.11 0.68 -0.23 0.45 0.00 0.00 0.00 179.25 180.26 2isa h HIS 42 N 0.52 1.05 -0.38 0.00 3.86 -1.39 -3.08 115.15 115.74 2isa h HIS 42 Ca 0.01 -0.25 0.00 0.00 -1.16 0.00 0.00 60.37 58.98 2isa h HIS 42 Cb 1.10 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 29.31 2isa h HIS 42 CO 0.05 1.04 0.25 0.35 0.86 0.00 0.00 177.93 180.49 2isa h PHE 43 N 0.79 0.47 0.00 2.45 3.57 -0.98 -2.29 116.94 120.96 2isa h PHE 43 Ca 0.10 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.61 2isa h PHE 43 Cb 0.78 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.36 2isa h PHE 43 CO 0.05 0.30 0.01 -0.44 -2.23 0.00 0.00 178.31 176.00 2isa h ASP 44 N 0.51 0.00 -0.02 0.41 3.32 -0.57 -2.99 116.42 117.08 2isa h ASP 44 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 2isa h ASP 44 Cb -0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.49 2isa h ASP 44 CO -0.03 0.00 0.00 0.54 -1.72 0.00 0.00 179.24 178.03 2isa n ARG 45 N -2.49 1.94 0.10 3.56 1.74 -0.88 -4.74 116.66 115.88 2isa n ARG 45 Ca -0.02 -2.26 0.02 0.00 -0.77 0.00 0.00 57.85 54.82 2isa n ARG 45 Cb 0.05 -1.36 0.37 0.00 -1.02 0.00 0.00 32.46 30.50 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 0.16 0.27 -6.00 5.56 5.08 -1.35 -3.44 114.58 114.86 2isa h GLU 46 Ca 0.00 -0.06 -0.57 0.00 -1.00 0.00 0.00 59.36 57.73 2isa h GLU 46 Cb 0.87 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 30.02 2isa h GLU 46 CO 0.01 0.40 -0.02 0.08 -1.00 0.00 0.00 179.01 178.49 2isa s VAL 47 N -4.74 5.00 0.30 3.13 1.01 -1.26 -5.09 120.40 118.74 2isa s VAL 47 Ca -0.06 1.23 0.09 0.00 0.00 0.00 0.00 61.98 63.25 2isa s VAL 47 Cb 0.15 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.56 2isa s VAL 47 CO 0.74 0.36 0.00 0.27 0.00 0.00 0.00 175.10 176.47 2isa s ILE 48 N 0.19 3.06 0.31 2.22 -4.36 -1.26 -5.10 121.20 116.26 2isa s ILE 48 Ca 0.31 -1.95 -0.30 0.00 -0.26 0.00 0.00 60.65 58.46 2isa s ILE 48 Cb -0.17 -2.79 -0.12 0.00 1.25 0.00 0.00 42.46 40.63 2isa s ILE 48 CO 0.16 -0.30 1.54 -2.65 0.24 0.00 0.00 174.94 173.93 2isa n PRO 49 N -0.92 2.62 -1.08 0.37 -0.02 -1.26 -4.99 135.00 129.72 2isa n PRO 49 Ca -0.05 0.93 -0.29 0.00 -2.02 0.00 0.00 63.50 62.06 2isa n PRO 49 Cb 0.60 -2.68 0.16 0.00 -0.02 0.00 0.00 33.50 31.57 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 -0.97 0.83 0.55 -0.52 -1.05 -1.26 -4.94 118.70 111.34 2isa s GLU 50 Ca 0.61 0.83 -0.22 0.00 -0.15 0.00 0.00 54.97 56.05 2isa s GLU 50 Cb -0.51 -1.76 -0.05 0.00 -0.44 0.00 0.00 34.13 31.38 2isa s GLU 50 CO 0.53 -2.54 1.37 1.03 0.95 0.00 0.00 175.26 176.60 2isa s ARG 51 N -4.86 3.14 0.00 -4.83 0.52 -1.26 -5.04 118.95 106.62 2isa s ARG 51 Ca 0.65 2.26 0.02 0.00 -0.52 0.00 0.00 55.73 58.14 2isa s ARG 51 Cb -0.19 -2.27 0.13 0.00 0.52 0.00 0.00 34.95 33.14 2isa s ARG 51 CO 0.58 -1.20 0.56 -2.13 0.02 0.00 0.00 175.30 173.13 2isa n ARG 52 N -1.02 0.44 -2.15 3.54 3.00 -1.26 -4.29 116.66 114.92 2isa n ARG 52 Ca 0.10 0.00 -0.09 0.00 -0.00 0.00 0.00 57.85 57.86 2isa n ARG 52 Cb 0.45 -1.08 -0.02 0.00 0.00 0.00 0.00 32.46 31.81 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 -0.58 -0.80 0.15 -0.14 8.25 -0.48 -5.07 115.22 116.55 2isa n HIS 54 Ca 0.02 0.15 0.05 0.00 -0.26 0.00 0.00 57.72 57.68 2isa n HIS 54 Cb 0.01 -0.68 0.50 0.00 1.12 0.00 0.00 29.99 30.94 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 1.48 1.76 -2.74 -1.41 0.00 -1.75 -3.41 119.26 113.19 2isa h ALA 55 Ca -0.13 -0.08 -0.63 0.00 0.00 0.00 0.00 54.91 54.07 2isa h ALA 55 Cb 0.58 -0.07 -0.15 0.00 0.00 0.00 0.00 17.79 18.14 2isa h ALA 55 CO 0.19 0.19 -0.29 0.21 0.00 0.00 0.00 179.25 179.56 2isa s LYS 56 N -5.06 3.97 0.30 0.00 2.47 -1.24 -4.51 119.74 115.67 2isa s LYS 56 Ca -0.06 -0.06 -0.17 0.00 -1.56 0.00 0.00 55.97 54.12 2isa s LYS 56 Cb 0.17 -3.67 0.02 0.00 -1.46 0.00 0.00 37.83 32.89 2isa s LYS 56 CO 0.71 -0.28 0.68 0.20 0.16 0.00 0.00 175.35 176.81 2isa s GLY 57 N 1.67 0.22 -0.03 5.54 0.00 -1.26 -1.88 107.32 111.58 2isa s GLY 57 Ca 0.13 -0.59 -0.03 0.00 0.00 0.00 0.00 44.72 44.24 2isa s GLY 57 CO 0.10 -0.29 0.09 -0.56 0.00 0.00 0.00 173.10 172.44 2isa s SER 58 N -2.99 -0.08 0.13 1.64 0.01 0.85 -4.98 113.70 108.28 2isa s SER 58 Ca 0.15 0.17 0.05 0.00 1.31 0.00 0.00 55.95 57.64 2isa s SER 58 Cb -0.05 0.16 -0.04 0.00 0.21 0.00 0.00 66.02 66.31 2isa s SER 58 CO 0.09 -0.04 -0.12 -0.83 0.41 0.00 0.00 173.24 172.75 2isa s GLY 59 N 0.17 1.06 0.01 3.44 0.00 -1.26 -0.01 107.32 110.73 2isa s GLY 59 Ca -0.01 -1.35 -0.28 0.00 0.00 0.00 0.00 44.72 43.08 2isa s GLY 59 CO -0.00 -1.42 0.65 0.00 0.00 0.00 0.00 173.10 172.32 2isa s ALA 60 N -2.53 -1.70 0.13 3.20 0.00 -0.20 -4.51 121.76 116.15 2isa s ALA 60 Ca 0.11 1.07 -0.04 0.00 0.00 0.00 0.00 51.96 53.10 2isa s ALA 60 Cb -0.02 0.24 -0.05 0.00 0.00 0.00 0.00 23.12 23.28 2isa s ALA 60 CO 0.02 -0.47 0.36 0.71 0.00 0.00 0.00 175.76 176.38 2isa s TYR 61 N -1.87 3.48 0.00 0.00 1.51 0.02 -0.69 117.35 119.80 2isa s TYR 61 Ca -0.08 0.53 0.00 0.00 -1.01 0.00 0.00 57.07 56.51 2isa s TYR 61 Cb -0.00 -1.98 0.00 0.00 -0.11 0.00 0.00 41.96 39.86 2isa s TYR 61 CO 0.04 0.45 0.00 0.41 -1.11 0.00 0.00 175.55 175.34 2isa n GLY 62 N 0.13 3.11 2.99 0.71 0.00 -0.25 -1.23 105.19 110.65 2isa n GLY 62 Ca -0.03 -0.74 -0.13 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.72 -0.04 -0.10 2.61 2.01 -0.81 -0.99 115.64 115.59 2isa s THR 63 Ca 0.00 0.15 -0.12 0.00 0.31 0.00 0.00 61.69 62.03 2isa s THR 63 Cb 0.00 -0.30 -0.05 0.00 0.01 0.00 0.00 72.50 72.16 2isa s THR 63 CO 0.00 0.06 0.28 0.12 -0.69 0.00 0.00 174.62 174.39 2isa s PHE 64 N 1.08 3.59 -0.07 4.92 5.36 0.78 -2.14 117.98 131.49 2isa s PHE 64 Ca -0.08 0.70 0.04 0.00 -0.96 0.00 0.00 56.93 56.62 2isa s PHE 64 Cb -0.10 -2.20 0.00 0.00 -0.34 0.00 0.00 43.02 40.38 2isa s PHE 64 CO -0.06 0.52 -0.18 0.99 -1.46 0.00 0.00 175.22 175.02 2isa s THR 65 N -0.47 1.59 0.01 0.12 2.01 0.42 -1.00 115.64 118.33 2isa s THR 65 Ca 0.18 -0.76 -0.30 0.00 0.31 0.00 0.00 61.69 61.12 2isa s THR 65 Cb -0.14 -1.39 -0.04 0.00 0.01 0.00 0.00 72.50 70.94 2isa s THR 65 CO 0.07 0.45 1.08 -0.69 -0.69 0.00 0.00 174.62 174.84 2isa s VAL 66 N 0.35 4.50 -0.05 3.82 1.01 -0.87 -1.48 120.40 127.67 2isa s VAL 66 Ca -0.13 1.79 0.07 0.00 0.00 0.00 0.00 61.98 63.71 2isa s VAL 66 Cb -0.15 -4.15 -0.11 0.00 0.00 0.00 0.00 36.38 31.97 2isa s VAL 66 CO 0.05 0.12 0.08 0.35 0.00 0.00 0.00 175.10 175.70 2isa n THR 67 N 4.00 0.33 -4.25 3.92 -2.24 -0.06 -0.44 114.28 115.55 2isa n THR 67 Ca 0.08 -0.27 -0.17 0.00 -2.27 0.00 0.00 64.05 61.41 2isa n THR 67 Cb 0.49 -0.40 -0.11 0.00 -2.10 0.00 0.00 70.33 68.21 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 -2.32 1.39 -0.42 4.78 3.76 -0.80 -4.89 115.29 116.79 2isa s HIS 68 Ca -0.03 -0.60 -0.19 0.00 -0.15 0.00 0.00 55.06 54.09 2isa s HIS 68 Cb 0.03 -0.71 0.02 0.00 1.11 0.00 0.00 32.58 33.03 2isa s HIS 68 CO 0.32 0.15 0.52 0.34 -0.85 0.00 0.00 174.74 175.22 2isa s ASP 69 N -2.69 6.25 -0.20 1.40 -1.08 -1.26 -4.82 116.67 114.26 2isa s ASP 69 Ca 0.12 -0.51 0.14 0.00 -0.52 0.00 0.00 52.55 51.78 2isa s ASP 69 Cb -0.03 -2.26 0.44 0.00 -1.46 0.00 0.00 42.92 39.61 2isa s ASP 69 CO 0.03 -0.65 1.33 2.30 0.52 0.00 0.00 175.17 178.70 2isa n ILE 70 N 5.60 2.24 0.42 4.11 -5.35 -1.26 -4.76 119.36 120.36 2isa n ILE 70 Ca -0.05 -2.42 0.10 0.00 -0.27 0.00 0.00 62.75 60.10 2isa n ILE 70 Cb 0.48 -0.27 0.41 0.00 -1.74 0.00 0.00 39.64 38.52 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 -1.02 0.94 0.17 7.28 -2.24 -1.26 -1.35 114.28 116.79 2isa n THR 71 Ca 0.23 0.26 0.04 0.00 -2.27 0.00 0.00 64.05 62.31 2isa n THR 71 Cb 0.84 -1.12 0.47 0.00 -2.10 0.00 0.00 70.33 68.41 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 0.12 0.00 -0.78 3.64 -2.00 -3.32 116.57 114.24 2isa h LYS 72 Ca 0.00 -0.02 -0.20 0.00 -1.27 0.00 0.00 60.65 59.16 2isa h LYS 72 Cb 0.30 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.06 2isa h LYS 72 CO 0.00 0.25 -2.10 0.66 -2.27 0.00 0.00 179.45 175.99 2isa n TYR 73 N -4.34 0.00 -3.79 1.91 4.01 -0.46 -4.79 117.16 109.71 2isa n TYR 73 Ca -0.01 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.60 2isa n TYR 73 Cb 0.23 -0.71 -0.13 0.00 -0.31 0.00 0.00 39.34 38.42 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 -2.81 -0.02 -2.11 -0.72 -1.32 -1.01 -3.01 115.64 104.64 2isa s THR 74 Ca -0.08 0.06 0.15 0.00 -1.21 0.00 0.00 61.69 60.61 2isa s THR 74 Cb 0.08 -0.25 0.38 0.00 -1.51 0.00 0.00 72.50 71.20 2isa s THR 74 CO 0.77 0.03 1.38 2.29 -2.21 0.00 0.00 174.62 176.87 2isa n LYS 75 N 3.45 1.83 -1.71 7.08 2.85 -0.44 -4.29 118.16 126.93 2isa n LYS 75 Ca -0.18 -1.27 -0.43 0.00 -1.05 0.00 0.00 58.31 55.39 2isa n LYS 75 Cb 0.56 -1.33 -0.03 0.00 -0.65 0.00 0.00 35.03 33.58 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 0.51 2.56 -0.06 0.58 0.00 -1.23 -4.77 120.51 118.10 2isa n ALA 76 Ca 0.14 0.40 0.02 0.00 0.00 0.00 0.00 53.44 54.00 2isa n ALA 76 Cb 0.33 -2.51 0.34 0.00 0.00 0.00 0.00 19.45 17.62 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 6.82 0.66 -0.90 0.00 1.79 -1.94 -2.00 116.57 121.00 2isa h LYS 77 Ca -0.44 -0.06 0.26 0.00 -2.18 0.00 0.00 60.65 58.23 2isa h LYS 77 Cb 1.21 -0.14 -0.04 0.00 -1.58 0.00 0.00 32.23 31.69 2isa h LYS 77 CO 0.95 0.49 0.68 0.97 -1.08 0.00 0.00 179.45 181.45 2isa h ILE 78 N 0.67 0.49 -0.41 1.86 2.10 -1.94 -2.23 117.51 118.04 2isa h ILE 78 Ca 0.17 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.11 2isa h ILE 78 Cb 0.02 0.52 0.00 0.00 -1.09 0.00 0.00 36.82 36.27 2isa h ILE 78 CO -0.03 0.00 0.00 0.49 -1.08 0.00 0.00 178.15 177.53 2isa n PHE 79 N -4.16 0.54 0.43 2.19 3.72 -0.76 -4.80 117.46 114.63 2isa n PHE 79 Ca 0.19 -0.46 0.12 0.00 -0.05 0.00 0.00 57.45 57.25 2isa n PHE 79 Cb 0.99 -0.02 0.24 0.00 -0.94 0.00 0.00 39.48 39.75 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 2.60 0.00 -4.13 4.37 4.64 -1.40 -3.43 113.55 116.20 2isa h SER 80 Ca 0.00 -0.05 -0.35 0.00 -0.47 0.00 0.00 61.79 60.92 2isa h SER 80 Cb 0.78 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 62.60 2isa h SER 80 CO 0.00 0.02 -0.76 -1.81 -0.87 0.00 0.00 176.83 173.41 2isa s ASP 81 N -5.07 0.90 0.32 4.97 1.01 -1.26 -5.02 116.67 112.51 2isa s ASP 81 Ca 0.07 -0.23 -0.29 0.00 0.71 0.00 0.00 52.55 52.82 2isa s ASP 81 Cb 0.10 -0.07 -0.11 0.00 1.01 0.00 0.00 42.92 43.85 2isa s ASP 81 CO 0.67 0.03 1.41 -0.63 0.21 0.00 0.00 175.17 176.86 2isa s ILE 82 N -0.42 2.46 0.00 0.77 1.01 -1.26 -2.62 121.20 121.14 2isa s ILE 82 Ca 0.00 0.44 0.00 0.00 0.00 0.00 0.00 60.65 61.10 2isa s ILE 82 Cb -0.04 -3.28 0.00 0.00 0.01 0.00 0.00 42.46 39.15 2isa s ILE 82 CO -0.00 0.09 0.00 0.61 0.00 0.00 0.00 174.94 175.64 2isa n GLY 83 N 1.15 3.31 3.69 6.18 0.00 0.42 -4.98 105.19 114.96 2isa n GLY 83 Ca 0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.60 2isa n GLY 83 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2isa n LYS 84 N -1.98 2.39 -4.42 1.61 4.81 -1.08 -4.58 118.16 114.90 2isa n LYS 84 Ca 0.00 0.86 -0.34 0.00 -0.87 0.00 0.00 58.31 57.96 2isa n LYS 84 Cb 0.00 -2.65 -0.11 0.00 0.02 0.00 0.00 35.03 32.29 2isa n LYS 84 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 2isa s LYS 85 N 0.83 3.31 -0.08 1.64 1.02 -1.26 -2.05 119.74 123.15 2isa s LYS 85 Ca 0.76 -0.49 0.01 0.00 0.02 0.00 0.00 55.97 56.27 2isa s LYS 85 Cb -0.61 -2.83 0.02 0.00 -0.52 0.00 0.00 37.83 33.90 2isa s LYS 85 CO 0.37 0.46 -0.08 0.99 -0.92 0.00 0.00 175.35 176.17 2isa s THR 86 N -0.22 0.89 0.68 2.17 2.01 -0.17 -4.97 115.64 116.02 2isa s THR 86 Ca 0.04 -0.28 -0.14 0.00 0.31 0.00 0.00 61.69 61.62 2isa s THR 86 Cb -0.13 -0.88 0.01 0.00 0.01 0.00 0.00 72.50 71.51 2isa s THR 86 CO 0.02 0.32 1.11 -1.81 -0.69 0.00 0.00 174.62 173.57 2isa s ASP 87 N 1.19 4.98 0.15 3.53 1.01 -1.26 -0.16 116.67 126.12 2isa s ASP 87 Ca -0.06 1.98 -0.17 0.00 0.71 0.00 0.00 52.55 55.01 2isa s ASP 87 Cb -0.14 -2.55 0.04 0.00 1.01 0.00 0.00 42.92 41.28 2isa s ASP 87 CO -0.02 -1.71 0.46 0.00 0.21 0.00 0.00 175.17 174.11 2isa s MET 88 N -4.23 1.19 -0.03 8.23 0.23 -0.16 -1.07 119.30 123.46 2isa s MET 88 Ca 0.66 -0.74 0.03 0.00 -1.03 0.00 0.00 55.69 54.62 2isa s MET 88 Cb -0.20 0.50 0.00 0.00 -1.53 0.00 0.00 34.83 33.60 2isa s MET 88 CO 0.44 -0.49 -0.12 0.12 -2.03 0.00 0.00 175.02 172.95 2isa s PHE 89 N -3.82 1.18 -0.04 3.16 5.36 0.36 -1.10 117.98 123.09 2isa s PHE 89 Ca 0.05 -0.30 0.05 0.00 -0.96 0.00 0.00 56.93 55.77 2isa s PHE 89 Cb 0.01 -0.82 -0.01 0.00 -0.34 0.00 0.00 43.02 41.86 2isa s PHE 89 CO -0.09 -0.11 -0.20 0.00 -1.46 0.00 0.00 175.22 173.36 2isa s ALA 90 N 0.11 1.70 -0.12 11.12 0.00 0.13 -0.14 121.76 134.56 2isa s ALA 90 Ca -0.03 -0.82 0.02 0.00 0.00 0.00 0.00 51.96 51.14 2isa s ALA 90 Cb -0.09 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.53 2isa s ALA 90 CO 0.01 0.35 -0.19 0.50 0.00 0.00 0.00 175.76 176.43 2isa s ARG 91 N -0.16 2.63 0.12 0.00 3.52 0.36 -1.04 118.95 124.38 2isa s ARG 91 Ca -0.00 -0.71 0.03 0.00 -0.13 0.00 0.00 55.73 54.91 2isa s ARG 91 Cb -0.11 -2.16 -0.04 0.00 -1.56 0.00 0.00 34.95 31.08 2isa s ARG 91 CO 0.02 -0.02 0.19 -0.06 -0.81 0.00 0.00 175.30 174.61 2isa s PHE 92 N 0.86 3.36 0.13 5.12 0.40 0.99 -1.24 117.98 127.60 2isa s PHE 92 Ca -0.08 0.11 -0.24 0.00 -0.60 0.00 0.00 56.93 56.12 2isa s PHE 92 Cb -0.15 -1.64 0.08 0.00 0.51 0.00 0.00 43.02 41.81 2isa s PHE 92 CO -0.01 0.54 0.66 -1.54 0.70 0.00 0.00 175.22 175.56 2isa s SER 93 N -2.87 -0.53 0.88 1.36 1.04 -1.10 -0.11 113.70 112.37 2isa s SER 93 Ca 0.33 -0.00 0.00 0.00 0.48 0.00 0.00 55.95 56.76 2isa s SER 93 Cb -0.11 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.56 2isa s SER 93 CO 0.26 -0.90 0.00 0.35 0.98 0.00 0.00 173.24 173.93 2isa n THR 94 N -0.35 0.00 0.01 2.02 -2.24 -0.78 0.13 114.28 113.06 2isa n THR 94 Ca -0.15 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.61 2isa n THR 94 Cb 0.64 -1.91 -0.00 0.00 -2.10 0.00 0.00 70.33 66.96 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 -1.85 0.51 0.06 2.28 0.31 -1.24 -4.05 118.33 114.35 2isa n VAL 95 Ca 0.00 0.13 -0.14 0.00 -0.01 0.00 0.00 64.34 64.32 2isa n VAL 95 Cb 0.00 -1.56 -0.14 0.00 -0.91 0.00 0.00 33.84 31.23 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 -0.05 0.32 -2.85 3.52 0.00 -1.92 -1.27 119.26 117.00 2isa h ALA 96 Ca -0.02 -1.07 -0.53 0.00 0.00 0.00 0.00 54.91 53.29 2isa h ALA 96 Cb 0.68 0.16 0.09 0.00 0.00 0.00 0.00 17.79 18.72 2isa h ALA 96 CO -0.01 1.19 0.57 0.20 0.00 0.00 0.00 179.25 181.20 2isa s GLY 97 N -4.87 2.88 0.90 0.00 0.00 -1.26 -4.89 107.32 100.08 2isa s GLY 97 Ca -0.05 1.17 -0.15 0.00 0.00 0.00 0.00 44.72 45.69 2isa s GLY 97 CO 0.85 1.70 1.22 1.18 0.00 0.00 0.00 173.10 178.05 2isa n GLU 98 N -0.27 -1.15 -0.23 2.90 4.71 -1.26 -3.70 120.64 121.64 2isa n GLU 98 Ca 0.06 -1.94 0.03 0.00 -0.01 0.00 0.00 57.16 55.30 2isa n GLU 98 Cb 0.45 -1.24 0.13 0.00 -1.01 0.00 0.00 31.44 29.78 2isa n GLU 98 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2isa h ARG 99 N 0.00 0.15 -1.16 3.49 3.08 -1.96 -2.24 114.38 115.75 2isa h ARG 99 Ca -0.39 -0.01 -0.56 0.00 0.07 0.00 0.00 59.98 59.08 2isa h ARG 99 Cb 1.10 -0.03 -0.42 0.00 0.08 0.00 0.00 29.97 30.69 2isa h ARG 99 CO 0.28 0.10 -0.78 0.41 -1.07 0.00 0.00 179.97 178.91 2isa n GLY 100 N -1.37 6.07 3.70 0.04 0.00 -1.26 -4.93 105.19 107.45 2isa n GLY 100 Ca 0.11 -2.68 -0.33 0.00 0.00 0.00 0.00 46.02 43.12 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 -3.56 1.86 0.29 4.61 0.00 -0.84 -4.95 121.76 119.16 2isa s ALA 101 Ca 0.49 0.74 -0.29 0.00 0.00 0.00 0.00 51.96 52.90 2isa s ALA 101 Cb 0.40 -3.46 -0.10 0.00 0.00 0.00 0.00 23.12 19.97 2isa s ALA 101 CO -0.08 -2.25 1.38 0.00 0.00 0.00 0.00 175.76 174.81 2isa s ALA 102 N -2.29 3.56 0.21 0.00 0.00 -1.26 -4.90 121.76 117.08 2isa s ALA 102 Ca 0.71 1.31 -0.07 0.00 0.00 0.00 0.00 51.96 53.90 2isa s ALA 102 Cb -0.26 -3.52 0.16 0.00 0.00 0.00 0.00 23.12 19.49 2isa s ALA 102 CO 0.51 -0.71 1.76 -0.44 0.00 0.00 0.00 175.76 176.88 2isa h ASP 103 N 4.21 1.09 -1.72 0.00 3.32 -1.33 -3.36 116.42 118.64 2isa h ASP 103 Ca -0.47 -0.19 -0.77 0.00 0.02 0.00 0.00 57.03 55.61 2isa h ASP 103 Cb 1.22 -0.28 -0.20 0.00 0.22 0.00 0.00 39.33 40.29 2isa h ASP 103 CO 0.72 0.99 1.68 0.00 -1.72 0.00 0.00 179.24 180.91 2isa n ALA 104 N -2.44 6.43 -2.77 3.45 0.00 -1.26 -4.90 120.51 119.02 2isa n ALA 104 Ca 0.07 -4.34 -0.21 0.00 0.00 0.00 0.00 53.44 48.95 2isa n ALA 104 Cb 0.21 -2.46 -0.03 0.00 0.00 0.00 0.00 19.45 17.17 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 -2.83 3.06 -0.35 0.00 2.02 -1.26 -4.74 118.70 114.61 2isa s GLU 105 Ca 0.46 -1.01 -0.29 0.00 0.02 0.00 0.00 54.97 54.16 2isa s GLU 105 Cb 0.19 -2.67 0.01 0.00 0.10 0.00 0.00 34.13 31.76 2isa s GLU 105 CO -0.12 0.32 1.32 0.50 0.02 0.00 0.00 175.26 177.30 2isa s ARG 106 N -3.95 3.79 -0.19 1.61 3.52 -1.26 -4.56 118.95 117.92 2isa s ARG 106 Ca 0.36 1.10 -0.34 0.00 -0.13 0.00 0.00 55.73 56.72 2isa s ARG 106 Cb -0.08 -3.93 0.14 0.00 -1.56 0.00 0.00 34.95 29.52 2isa s ARG 106 CO 0.27 -1.28 1.19 0.34 -0.81 0.00 0.00 175.30 175.01 2isa s ASP 107 N 3.12 -0.15 0.63 -2.12 -1.08 -0.61 -5.02 116.67 111.44 2isa s ASP 107 Ca 0.57 0.03 -0.18 0.00 -0.52 0.00 0.00 52.55 52.45 2isa s ASP 107 Cb -0.15 0.16 -0.02 0.00 -1.46 0.00 0.00 42.92 41.45 2isa s ASP 107 CO 0.27 -0.24 1.29 -0.63 0.52 0.00 0.00 175.17 176.38 2isa s ILE 108 N -2.20 2.12 -0.15 4.11 1.01 -1.26 -4.65 121.20 120.18 2isa s ILE 108 Ca 0.08 0.08 -0.01 0.00 0.00 0.00 0.00 60.65 60.80 2isa s ILE 108 Cb -0.01 -3.03 -0.02 0.00 0.01 0.00 0.00 42.46 39.41 2isa s ILE 108 CO -0.05 -0.01 -0.10 -0.13 0.00 0.00 0.00 174.94 174.65 2isa s ARG 109 N -3.33 3.45 0.44 2.79 1.81 -1.26 -3.60 118.95 119.25 2isa s ARG 109 Ca 0.81 -0.64 -0.25 0.00 -1.72 0.00 0.00 55.73 53.93 2isa s ARG 109 Cb -0.37 -2.74 -0.08 0.00 -0.45 0.00 0.00 34.95 31.32 2isa s ARG 109 CO 0.39 0.17 1.31 0.20 -0.68 0.00 0.00 175.30 176.69 2isa s GLY 110 N 0.48 2.90 -0.48 -3.53 0.00 0.12 -0.79 107.32 106.02 2isa s GLY 110 Ca -0.07 1.24 0.05 0.00 0.00 0.00 0.00 44.72 45.93 2isa s GLY 110 CO 0.04 1.80 0.42 0.33 0.00 0.00 0.00 173.10 175.69 2isa n PHE 111 N -0.16 0.21 -3.99 1.90 -0.00 0.32 -2.72 117.46 113.03 2isa n PHE 111 Ca 0.05 -3.59 -0.35 0.00 -0.00 0.00 0.00 57.45 53.57 2isa n PHE 111 Cb 0.44 -0.05 -0.11 0.00 -0.00 0.00 0.00 39.48 39.76 2isa n PHE 111 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 2isa s SER 112 N -0.59 5.26 -0.03 -2.13 0.15 -0.37 -1.25 113.70 114.74 2isa s SER 112 Ca 0.32 -0.08 0.06 0.00 0.70 0.00 0.00 55.95 56.95 2isa s SER 112 Cb 0.05 -1.91 -0.01 0.00 -1.71 0.00 0.00 66.02 62.44 2isa s SER 112 CO -0.17 0.09 -0.22 -0.76 1.20 0.00 0.00 173.24 173.38 2isa s LEU 113 N 0.88 2.02 -0.18 3.45 1.43 0.08 -0.49 118.68 125.87 2isa s LEU 113 Ca 0.03 -0.42 -0.01 0.00 -1.03 0.00 0.00 54.13 52.70 2isa s LEU 113 Cb -0.14 -1.16 0.05 0.00 0.03 0.00 0.00 46.19 44.97 2isa s LEU 113 CO 0.02 0.24 -0.03 -0.75 0.23 0.00 0.00 176.35 176.07 2isa s LYS 114 N -0.32 1.24 -0.24 1.70 2.20 0.81 -0.64 119.74 124.50 2isa s LYS 114 Ca 0.03 -0.57 -0.08 0.00 -0.36 0.00 0.00 55.97 54.99 2isa s LYS 114 Cb -0.10 -2.11 -0.04 0.00 -1.51 0.00 0.00 37.83 34.07 2isa s LYS 114 CO 0.01 -0.51 0.09 -0.06 -0.36 0.00 0.00 175.35 174.52 2isa s PHE 115 N 1.65 3.16 -1.28 4.03 0.08 -0.11 -0.49 117.98 125.03 2isa s PHE 115 Ca -0.01 -0.17 -0.12 0.00 0.12 0.00 0.00 56.93 56.75 2isa s PHE 115 Cb -0.16 -2.22 0.14 0.00 -0.57 0.00 0.00 43.02 40.21 2isa s PHE 115 CO -0.07 -0.17 1.74 0.66 -0.10 0.00 0.00 175.22 177.27 2isa n TYR 116 N 4.56 3.97 -1.94 0.36 4.01 -0.23 -1.16 117.16 126.72 2isa n TYR 116 Ca -0.16 -3.03 -0.29 0.00 -0.16 0.00 0.00 57.90 54.27 2isa n TYR 116 Cb 0.52 -2.19 0.09 0.00 -0.31 0.00 0.00 39.34 37.44 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 1.59 2.10 -1.15 -0.72 -4.23 -0.88 -4.49 115.64 107.86 2isa s THR 117 Ca 0.43 -0.02 0.27 0.00 -1.18 0.00 0.00 61.69 61.20 2isa s THR 117 Cb 0.05 -3.02 0.32 0.00 1.34 0.00 0.00 72.50 71.18 2isa s THR 117 CO 0.00 -0.03 1.90 -1.84 -0.54 0.00 0.00 174.62 174.11 2isa n GLU 118 N -3.25 0.14 -1.21 3.99 0.28 -1.26 -3.08 120.64 116.25 2isa n GLU 118 Ca 0.08 0.03 -0.04 0.00 -0.16 0.00 0.00 57.16 57.07 2isa n GLU 118 Cb 0.61 -1.50 0.13 0.00 1.43 0.00 0.00 31.44 32.11 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 -1.42 2.13 0.00 3.44 1.02 -1.26 -4.70 120.64 119.85 2isa n GLU 119 Ca 0.09 -3.50 0.00 0.00 -0.02 0.00 0.00 57.16 53.73 2isa n GLU 119 Cb 0.28 -1.71 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 -0.85 3.12 3.64 0.62 0.00 -1.18 -4.51 105.19 106.04 2isa n GLY 120 Ca 0.26 -1.99 -0.43 0.00 0.00 0.00 0.00 46.02 43.85 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 6.81 -0.38 1.61 0.02 -1.26 -2.07 114.94 119.67 2isa s ASN 121 Ca 0.00 1.43 -0.20 0.00 -1.02 0.00 0.00 52.86 53.07 2isa s ASN 121 Cb 0.00 -2.54 0.01 0.00 0.02 0.00 0.00 41.25 38.74 2isa s ASN 121 CO 0.00 -0.92 0.59 0.86 0.02 0.00 0.00 177.10 177.65 2isa s TRP 122 N 3.94 3.14 -0.27 2.20 -0.00 -0.31 -4.41 118.94 123.22 2isa s TRP 122 Ca 0.55 0.14 -0.13 0.00 -0.00 0.00 0.00 56.10 56.66 2isa s TRP 122 Cb -0.19 -3.11 -0.04 0.00 -0.00 0.00 0.00 33.47 30.13 2isa s TRP 122 CO 0.18 -0.67 0.28 -0.51 -0.00 0.00 0.00 176.95 176.23 2isa s ASP 123 N 1.84 6.15 -0.42 5.86 1.01 -0.09 -0.93 116.67 130.09 2isa s ASP 123 Ca 0.21 0.16 0.01 0.00 0.71 0.00 0.00 52.55 53.64 2isa s ASP 123 Cb -0.15 -2.16 0.12 0.00 1.01 0.00 0.00 42.92 41.73 2isa s ASP 123 CO 0.15 -0.10 0.18 -0.22 0.21 0.00 0.00 175.17 175.40 2isa s LEU 124 N 1.79 4.90 -1.09 1.23 2.96 0.19 -4.52 118.68 124.14 2isa s LEU 124 Ca 0.11 -2.34 -0.17 0.00 -0.22 0.00 0.00 54.13 51.51 2isa s LEU 124 Cb -0.16 -1.72 0.13 0.00 0.50 0.00 0.00 46.19 44.94 2isa s LEU 124 CO 0.10 -0.41 1.36 0.00 -1.32 0.00 0.00 176.35 176.08 2isa s ALA 125 N 0.67 3.51 0.60 5.97 0.00 -1.26 -0.74 121.76 130.50 2isa s ALA 125 Ca 0.12 -2.94 0.01 0.00 0.00 0.00 0.00 51.96 49.16 2isa s ALA 125 Cb -0.21 -4.21 0.10 0.00 0.00 0.00 0.00 23.12 18.79 2isa s ALA 125 CO -0.05 -3.03 0.71 0.41 0.00 0.00 0.00 175.76 173.80 2isa n GLY 126 N 5.16 0.96 3.46 0.00 0.00 -0.38 -4.94 105.19 109.46 2isa n GLY 126 Ca 0.33 -2.05 -0.23 0.00 0.00 0.00 0.00 46.02 44.07 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 -3.93 2.42 -0.06 1.61 0.01 -0.44 -0.52 114.94 114.03 2isa s ASN 127 Ca 0.48 -1.49 0.04 0.00 -0.71 0.00 0.00 52.86 51.18 2isa s ASN 127 Cb -0.03 0.17 0.22 0.00 0.41 0.00 0.00 41.25 42.02 2isa s ASN 127 CO 0.32 -0.75 0.87 -0.46 -1.51 0.00 0.00 177.10 175.57 2isa n ASN 128 N -0.90 2.19 -3.90 -1.22 6.94 0.03 0.07 115.26 118.47 2isa n ASN 128 Ca -0.04 -2.23 -0.11 0.00 -0.02 0.00 0.00 54.58 52.18 2isa n ASN 128 Cb 0.66 -0.51 -0.13 0.00 -2.36 0.00 0.00 39.78 37.44 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 -1.51 0.04 -0.78 5.53 -1.32 -1.26 -4.68 115.64 111.66 2isa s THR 129 Ca 0.15 -0.30 0.22 0.00 -1.21 0.00 0.00 61.69 60.55 2isa s THR 129 Cb 0.11 -0.12 0.21 0.00 -1.51 0.00 0.00 72.50 71.20 2isa s THR 129 CO 0.05 -0.17 1.69 -0.81 -2.21 0.00 0.00 174.62 173.17 2isa n PRO 130 N 2.56 0.11 -3.74 7.08 -0.04 -1.26 -4.56 135.00 135.15 2isa n PRO 130 Ca -0.16 0.25 -0.19 0.00 -0.04 0.00 0.00 63.50 63.36 2isa n PRO 130 Cb 0.58 -1.68 -0.05 0.00 -0.04 0.00 0.00 33.50 32.31 2isa n PRO 130 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2isa n VAL 131 N -1.88 0.00 -4.01 0.52 0.24 -1.26 -4.41 118.33 107.52 2isa n VAL 131 Ca 0.04 -1.68 -0.11 0.00 -2.04 0.00 0.00 64.34 60.55 2isa n VAL 131 Cb 0.27 0.53 -0.04 0.00 -1.47 0.00 0.00 33.84 33.13 2isa n VAL 131 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 2isa s PHE 132 N -2.53 0.64 0.11 6.34 5.36 -0.73 -4.98 117.98 122.18 2isa s PHE 132 Ca 0.11 -0.99 0.15 0.00 -0.96 0.00 0.00 56.93 55.23 2isa s PHE 132 Cb 0.01 0.15 0.36 0.00 -0.34 0.00 0.00 43.02 43.20 2isa s PHE 132 CO 0.07 -1.13 1.58 0.74 -1.46 0.00 0.00 175.22 175.03 2isa h PHE 133 N 2.16 0.00 -3.08 10.12 -1.00 -1.88 -3.39 116.94 119.88 2isa h PHE 133 Ca -0.28 0.00 -0.62 0.00 2.81 0.00 0.00 57.97 59.88 2isa h PHE 133 Cb 1.25 0.00 -0.18 0.00 3.61 0.00 0.00 35.95 40.63 2isa h PHE 133 CO 1.00 0.53 -0.80 -0.51 -1.61 0.00 0.00 178.31 176.92 2isa s LEU 134 N -6.97 2.46 -0.13 1.54 1.43 -1.26 -3.07 118.68 112.67 2isa s LEU 134 Ca 0.01 -0.89 0.19 0.00 -1.03 0.00 0.00 54.13 52.41 2isa s LEU 134 Cb 0.10 -1.08 -0.28 0.00 0.03 0.00 0.00 46.19 44.97 2isa s LEU 134 CO 0.73 0.07 0.23 0.54 0.23 0.00 0.00 176.35 178.16 2isa n ARG 135 N 0.15 0.73 -4.50 1.70 1.74 -1.26 -4.46 116.66 110.75 2isa n ARG 135 Ca -0.12 -0.09 -0.24 0.00 -0.77 0.00 0.00 57.85 56.63 2isa n ARG 135 Cb 0.57 -1.50 -0.17 0.00 -1.02 0.00 0.00 32.46 30.34 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 -5.01 1.73 0.21 0.55 -1.08 -1.26 -3.91 116.67 107.90 2isa s ASP 136 Ca -0.09 -0.28 0.18 0.00 -0.52 0.00 0.00 52.55 51.84 2isa s ASP 136 Cb 0.09 -0.80 0.87 0.00 -1.46 0.00 0.00 42.92 41.63 2isa s ASP 136 CO 0.84 0.02 1.56 -0.81 0.52 0.00 0.00 175.17 177.30 2isa n PRO 137 N 3.91 0.12 0.13 4.34 -0.04 -1.26 -1.62 135.00 140.59 2isa n PRO 137 Ca -0.22 0.49 0.04 0.00 -0.04 0.00 0.00 63.50 63.77 2isa n PRO 137 Cb 0.51 -1.81 0.47 0.00 -0.04 0.00 0.00 33.50 32.63 2isa n PRO 137 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2isa h LEU 138 N 0.00 0.21 0.00 1.53 3.38 -1.95 -2.32 115.31 116.16 2isa h LEU 138 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2isa h LEU 138 Cb 0.16 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2isa h LEU 138 CO 0.00 0.26 0.00 0.29 0.09 0.00 0.00 178.44 179.08 2isa n LYS 139 N -4.39 0.07 -0.07 1.13 4.76 -0.64 -4.17 118.16 114.86 2isa n LYS 139 Ca -0.01 0.14 -0.12 0.00 -2.87 0.00 0.00 58.31 55.46 2isa n LYS 139 Cb 0.18 -1.50 -0.05 0.00 -1.84 0.00 0.00 35.03 31.81 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 0.42 -0.13 2.13 3.57 -1.58 0.10 116.94 121.45 2isa h PHE 140 Ca 0.00 -0.08 -0.02 0.00 3.53 0.00 0.00 57.97 61.40 2isa h PHE 140 Cb 0.31 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 2isa h PHE 140 CO 0.00 0.60 0.01 -1.35 -2.23 0.00 0.00 178.31 175.34 2isa h PRO 141 N 0.11 0.18 -0.45 6.41 0.11 -1.78 -1.94 132.00 134.64 2isa h PRO 141 Ca 0.05 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 66.08 2isa h PRO 141 Cb 0.45 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.51 2isa h PRO 141 CO 0.02 0.20 0.01 -0.44 -0.21 0.00 0.00 178.00 177.58 2isa h ASP 142 N 0.18 0.76 -0.22 -2.05 3.32 -1.63 -1.67 116.42 115.12 2isa h ASP 142 Ca 0.05 -0.30 0.04 0.00 0.02 0.00 0.00 57.03 56.84 2isa h ASP 142 Cb 0.12 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.42 2isa h ASP 142 CO 0.00 0.87 -0.04 0.25 -1.72 0.00 0.00 179.24 178.60 2isa h LEU 143 N 0.63 -0.17 -0.51 1.55 5.85 -0.47 -0.54 115.31 121.66 2isa h LEU 143 Ca 0.13 0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.98 2isa h LEU 143 Cb 0.47 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.57 2isa h LEU 143 CO 0.02 -0.06 0.19 -1.13 -0.34 0.00 0.00 178.44 177.12 2isa h ASN 144 N 0.02 0.21 0.66 1.25 -0.73 -1.18 0.21 115.58 116.02 2isa h ASN 144 Ca 0.11 0.06 -0.07 0.00 1.87 0.00 0.00 56.30 58.27 2isa h ASN 144 Cb 0.15 0.03 -0.01 0.00 0.27 0.00 0.00 38.32 38.77 2isa h ASN 144 CO -0.21 0.15 -0.32 0.45 -0.37 0.00 0.00 177.43 177.13 2isa h HIS 145 N 0.38 0.00 0.06 0.67 3.86 -1.02 -1.54 115.15 117.55 2isa h HIS 145 Ca 0.24 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 59.20 2isa h HIS 145 Cb 0.25 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.70 2isa h HIS 145 CO -0.15 0.32 -1.24 0.00 0.86 0.00 0.00 177.93 177.71 2isa h ALA 146 N 1.68 0.29 0.00 2.45 0.00 -0.09 -3.38 119.26 120.21 2isa h ALA 146 Ca -0.00 -0.99 0.00 0.00 0.00 0.00 0.00 54.91 53.92 2isa h ALA 146 Cb 0.73 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2isa h ALA 146 CO 0.04 1.17 -1.22 1.33 0.00 0.00 0.00 179.25 180.57 2isa n VAL 147 N -3.40 0.08 -0.83 0.00 0.24 -0.03 -2.78 118.33 111.60 2isa n VAL 147 Ca -0.07 -0.22 0.00 0.00 -2.04 0.00 0.00 64.34 62.01 2isa n VAL 147 Cb 1.00 0.41 0.00 0.00 -1.47 0.00 0.00 33.84 33.78 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 -1.87 3.84 -2.91 7.34 5.02 -0.59 -4.88 118.16 124.11 2isa n LYS 148 Ca 0.01 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.90 2isa n LYS 148 Cb 0.43 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.39 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 3.72 4.59 0.35 1.97 0.52 -1.26 -4.16 118.95 124.67 2isa s ARG 149 Ca 0.00 1.21 -0.29 0.00 -0.52 0.00 0.00 55.73 56.13 2isa s ARG 149 Cb 0.00 -3.33 -0.11 0.00 0.52 0.00 0.00 34.95 32.03 2isa s ARG 149 CO 0.00 0.37 1.54 -3.47 0.02 0.00 0.00 175.30 173.76 2isa n ASP 150 N 2.33 3.85 -0.25 0.23 -0.08 -0.06 -4.81 116.55 117.77 2isa n ASP 150 Ca -0.02 1.20 0.23 0.00 -1.51 0.00 0.00 54.79 54.69 2isa n ASP 150 Cb 0.49 -1.62 0.58 0.00 2.34 0.00 0.00 41.12 42.92 2isa n ASP 150 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2isa h PRO 151 N 3.67 0.27 0.00 -0.67 0.11 -1.93 -1.33 132.00 132.12 2isa h PRO 151 Ca -0.49 -0.02 -0.19 0.00 0.11 0.00 0.00 66.00 65.41 2isa h PRO 151 Cb 1.23 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2isa h PRO 151 CO 0.70 0.18 -1.30 -2.13 -0.21 0.00 0.00 178.00 175.23 2isa n ARG 152 N -4.46 0.54 0.17 1.05 0.63 -1.26 -4.61 116.66 108.73 2isa n ARG 152 Ca 0.21 0.46 0.13 0.00 -0.92 0.00 0.00 57.85 57.73 2isa n ARG 152 Cb 0.85 -1.64 0.39 0.00 0.45 0.00 0.00 32.46 32.50 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 -1.00 0.00 -3.40 5.15 1.35 -1.95 -3.47 112.91 109.59 2isa h THR 153 Ca -0.29 -0.62 -0.31 0.00 -0.55 0.00 0.00 66.41 64.65 2isa h THR 153 Cb 1.13 1.57 -0.02 0.00 -1.73 0.00 0.00 68.15 69.10 2isa h THR 153 CO -0.18 0.00 -0.39 -3.20 -0.25 0.00 0.00 175.52 171.51 2isa n ASN 154 N -2.66 -4.59 -4.15 5.36 5.15 -0.50 -4.94 115.26 108.93 2isa n ASN 154 Ca 0.04 0.14 -0.12 0.00 -0.60 0.00 0.00 54.58 54.04 2isa n ASN 154 Cb 0.41 -3.88 -0.10 0.00 -0.53 0.00 0.00 39.78 35.68 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 -4.93 0.77 0.63 1.20 -1.94 -1.26 -4.79 119.30 108.98 2isa s MET 155 Ca 0.00 -1.20 -0.18 0.00 -1.71 0.00 0.00 55.69 52.60 2isa s MET 155 Cb 0.00 -0.27 -0.02 0.00 2.01 0.00 0.00 34.83 36.55 2isa s MET 155 CO 0.00 0.01 1.21 0.54 -0.01 0.00 0.00 175.02 176.77 2isa n ARG 156 N 0.34 1.10 -3.96 2.03 1.74 -1.26 -0.88 116.66 115.77 2isa n ARG 156 Ca -0.15 0.43 -0.29 0.00 -0.77 0.00 0.00 57.85 57.07 2isa n ARG 156 Cb 0.59 -2.43 -0.16 0.00 -1.02 0.00 0.00 32.46 29.43 2isa n ARG 156 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2isa s SER 157 N -1.30 3.00 0.22 0.55 0.15 -1.26 -4.84 113.70 110.21 2isa s SER 157 Ca 0.80 -0.70 -0.09 0.00 0.70 0.00 0.00 55.95 56.66 2isa s SER 157 Cb -0.39 -1.10 0.19 0.00 -1.71 0.00 0.00 66.02 63.00 2isa s SER 157 CO 0.43 -0.14 1.88 0.00 1.20 0.00 0.00 173.24 176.61 2isa h ALA 158 N 8.05 1.00 0.04 5.45 0.00 -1.93 -0.75 119.26 131.12 2isa h ALA 158 Ca -0.29 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.59 2isa h ALA 158 Cb 1.11 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 2isa h ALA 158 CO 0.46 0.36 -0.13 -0.22 0.00 0.00 0.00 179.25 179.73 2isa h LYS 159 N 1.02 -0.22 -0.12 0.00 3.11 -1.93 0.14 116.57 118.56 2isa h LYS 159 Ca 0.29 0.02 0.01 0.00 -2.81 0.00 0.00 60.65 58.15 2isa h LYS 159 Cb -0.07 0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 31.20 2isa h LYS 159 CO -0.08 -0.15 0.07 -0.91 -2.81 0.00 0.00 179.45 175.57 2isa h ASN 160 N -0.23 0.11 -0.02 4.20 -0.26 -1.84 0.22 115.58 117.76 2isa h ASN 160 Ca 0.03 0.00 0.02 0.00 -0.56 0.00 0.00 56.30 55.79 2isa h ASN 160 Cb 0.27 -0.02 -0.03 0.00 -1.06 0.00 0.00 38.32 37.48 2isa h ASN 160 CO -0.09 0.08 -0.11 -1.13 -1.06 0.00 0.00 177.43 175.12 2isa h ASN 161 N 0.14 -0.33 0.76 5.81 -0.73 -0.92 -2.52 115.58 117.80 2isa h ASN 161 Ca 0.05 0.05 -0.21 0.00 1.87 0.00 0.00 56.30 58.06 2isa h ASN 161 Cb -0.00 0.14 -0.02 0.00 0.27 0.00 0.00 38.32 38.72 2isa h ASN 161 CO -0.03 -0.16 -0.99 -0.50 -0.37 0.00 0.00 177.43 175.39 2isa h TRP 162 N -0.18 0.20 -0.27 0.67 4.06 -0.65 -1.66 115.95 118.11 2isa h TRP 162 Ca 0.05 -0.13 0.04 0.00 2.06 0.00 0.00 58.89 60.91 2isa h TRP 162 Cb 0.25 -0.01 -0.04 0.00 -1.00 0.00 0.00 29.16 28.35 2isa h TRP 162 CO -0.18 1.03 0.01 0.22 -3.56 0.00 0.00 178.44 175.96 2isa h ASP 163 N 0.05 -0.08 0.39 -3.49 3.58 -0.55 -0.61 116.42 115.71 2isa h ASP 163 Ca -0.05 0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.44 2isa h ASP 163 Cb 1.68 0.10 0.00 0.00 1.72 0.00 0.00 39.33 42.83 2isa h ASP 163 CO 0.14 -0.01 -0.19 0.15 -2.88 0.00 0.00 179.24 176.46 2isa h PHE 164 N 0.10 -0.49 -0.68 0.28 3.57 -1.40 -2.53 116.94 115.78 2isa h PHE 164 Ca 0.13 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.74 2isa h PHE 164 Cb 0.16 0.16 -0.09 0.00 2.79 0.00 0.00 35.95 38.98 2isa h PHE 164 CO -0.20 -0.18 0.25 -1.49 -2.23 0.00 0.00 178.31 174.46 2isa h TRP 165 N -0.79 0.42 0.00 0.41 6.55 -1.27 -1.60 115.95 119.67 2isa h TRP 165 Ca -0.05 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.82 2isa h TRP 165 Cb 0.53 -0.08 0.00 0.00 -0.86 0.00 0.00 29.16 28.75 2isa h TRP 165 CO 0.01 0.06 0.00 1.79 -1.05 0.00 0.00 178.44 179.24 2isa h THR 166 N 0.40 0.00 -0.00 1.49 1.35 -1.10 -2.25 112.91 112.80 2isa h THR 166 Ca 0.36 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.85 2isa h THR 166 Cb 0.52 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.16 2isa h THR 166 CO -0.37 0.00 -0.27 -1.20 -0.25 0.00 0.00 175.52 173.42 2isa n SER 167 N -2.52 0.28 -3.93 5.36 7.64 -0.62 -4.48 113.62 115.36 2isa n SER 167 Ca 0.02 0.08 -0.30 0.00 1.01 0.00 0.00 58.87 59.68 2isa n SER 167 Cb 0.29 -0.09 -0.14 0.00 -1.01 0.00 0.00 64.21 63.26 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 -2.99 4.15 0.54 -3.43 1.43 -0.85 -4.98 118.68 112.55 2isa s LEU 168 Ca 0.13 -2.93 0.21 0.00 -1.03 0.00 0.00 54.13 50.50 2isa s LEU 168 Cb 0.18 -1.57 1.39 0.00 0.03 0.00 0.00 46.19 46.22 2isa s LEU 168 CO 0.62 -0.24 2.12 1.55 0.23 0.00 0.00 176.35 180.63 2isa h PRO 169 N 6.57 0.00 -0.02 1.29 0.13 -1.78 -1.61 132.00 136.57 2isa h PRO 169 Ca -0.07 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.07 2isa h PRO 169 Cb 0.90 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.03 2isa h PRO 169 CO 0.66 0.00 0.08 1.05 -0.23 0.00 0.00 178.00 179.56 2isa h GLU 170 N 0.00 0.00 0.00 0.86 9.09 -1.87 -2.07 114.58 120.60 2isa h GLU 170 Ca 0.07 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.48 2isa h GLU 170 Cb 0.30 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.40 2isa h GLU 170 CO -0.00 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.06 2isa n ALA 171 N -2.11 1.93 -0.36 1.06 0.00 -0.61 -4.00 120.51 116.42 2isa n ALA 171 Ca -0.02 -0.04 -0.01 0.00 0.00 0.00 0.00 53.44 53.37 2isa n ALA 171 Cb 0.15 -1.36 0.13 0.00 0.00 0.00 0.00 19.45 18.38 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 1.06 0.06 0.00 5.85 -1.55 -0.60 115.31 120.13 2isa h LEU 172 Ca 0.00 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.73 2isa h LEU 172 Cb 0.40 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.15 2isa h LEU 172 CO 0.00 0.73 -0.24 -0.74 -0.34 0.00 0.00 178.44 177.85 2isa h HIS 173 N 1.24 -0.65 -0.15 1.25 2.76 -1.82 -0.12 115.15 117.66 2isa h HIS 173 Ca 0.38 0.02 -0.15 0.00 -2.20 0.00 0.00 60.37 58.42 2isa h HIS 173 Cb -0.02 0.28 -0.01 0.00 1.55 0.00 0.00 27.41 29.21 2isa h HIS 173 CO -0.01 -0.34 -0.53 0.37 -1.30 0.00 0.00 177.93 176.13 2isa h GLN 174 N -0.41 0.44 -0.79 5.26 5.75 -1.71 -2.37 115.11 121.28 2isa h GLN 174 Ca 0.05 -0.27 0.03 0.00 -0.15 0.00 0.00 58.65 58.31 2isa h GLN 174 Cb 0.46 0.03 -0.05 0.00 1.07 0.00 0.00 27.48 28.99 2isa h GLN 174 CO -0.18 0.86 0.51 0.28 -2.65 0.00 0.00 178.83 177.65 2isa h VAL 175 N 0.34 1.13 -0.36 2.39 2.07 -0.92 0.20 116.25 121.11 2isa h VAL 175 Ca 0.01 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.19 2isa h VAL 175 Cb 1.04 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 2isa h VAL 175 CO 0.09 0.18 0.23 0.74 0.02 0.00 0.00 177.57 178.84 2isa h THR 176 N 1.00 1.09 -0.35 2.57 2.02 -0.78 -0.27 112.91 118.20 2isa h THR 176 Ca 0.31 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 67.31 2isa h THR 176 Cb -0.01 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 66.97 2isa h THR 176 CO -0.11 0.09 0.19 0.40 0.37 0.00 0.00 175.52 176.47 2isa h ILE 177 N 0.48 1.14 0.00 3.11 2.04 -0.99 -0.60 117.51 122.68 2isa h ILE 177 Ca 0.13 -0.36 -0.06 0.00 1.00 0.00 0.00 64.86 65.57 2isa h ILE 177 Cb -0.05 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 2isa h ILE 177 CO -0.03 0.14 -0.27 1.62 0.00 0.00 0.00 178.15 179.62 2isa h VAL 178 N 0.43 0.63 0.00 1.67 3.04 -0.81 -2.64 116.25 118.57 2isa h VAL 178 Ca 0.12 -1.26 0.00 0.00 -1.01 0.00 0.00 66.70 64.55 2isa h VAL 178 Cb 0.06 1.84 0.00 0.00 -2.01 0.00 0.00 31.29 31.18 2isa h VAL 178 CO -0.02 0.26 -0.36 0.23 -1.01 0.00 0.00 177.57 176.67 2isa n MET 179 N -3.41 0.08 -1.78 4.17 2.81 -0.12 -4.07 117.12 114.80 2isa n MET 179 Ca 0.00 0.04 -0.29 0.00 -1.81 0.00 0.00 57.70 55.64 2isa n MET 179 Cb 0.46 -1.56 0.21 0.00 -0.71 0.00 0.00 33.22 31.62 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 -1.69 -0.16 0.24 7.83 3.41 -0.26 -4.37 113.62 118.62 2isa n SER 180 Ca 0.05 -1.44 0.15 0.00 -0.26 0.00 0.00 58.87 57.37 2isa n SER 180 Cb 0.37 -1.00 0.83 0.00 -0.26 0.00 0.00 64.21 64.14 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 -1.85 0.00 -0.01 4.04 2.03 -1.86 -2.02 116.42 116.76 2isa h ASP 181 Ca -0.42 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.88 2isa h ASP 181 Cb 1.18 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.68 2isa h ASP 181 CO 0.30 0.00 0.00 0.54 -1.03 0.00 0.00 179.24 179.05 2isa n ARG 182 N -3.99 1.06 0.26 4.15 1.74 -1.26 -3.77 116.66 114.84 2isa n ARG 182 Ca -0.01 -0.08 0.13 0.00 -0.77 0.00 0.00 57.85 57.11 2isa n ARG 182 Cb 0.19 -1.41 0.69 0.00 -1.02 0.00 0.00 32.46 30.91 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 5.16 0.00 -7.04 -0.13 0.00 -1.44 -3.36 103.07 96.26 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 -0.73 -0.42 0.00 0.00 0.00 176.54 175.39 2isa s ILE 184 N -4.06 1.48 0.52 2.60 1.01 -1.25 -1.57 121.20 119.93 2isa s ILE 184 Ca -0.02 -2.56 -0.22 0.00 0.00 0.00 0.00 60.65 57.84 2isa s ILE 184 Cb 0.12 -2.04 -0.06 0.00 0.01 0.00 0.00 42.46 40.49 2isa s ILE 184 CO 0.59 -0.87 1.33 -2.84 0.00 0.00 0.00 174.94 173.14 2isa s PRO 185 N 0.36 3.33 0.27 2.79 0.02 -1.26 -0.26 135.00 140.26 2isa s PRO 185 Ca 0.17 2.18 0.03 0.00 0.02 0.00 0.00 61.00 63.39 2isa s PRO 185 Cb -0.24 -2.35 0.39 0.00 0.02 0.00 0.00 34.50 32.32 2isa s PRO 185 CO -0.00 -1.02 1.70 0.00 -0.33 0.00 0.00 177.00 177.35 2isa h ALA 186 N 1.70 1.06 -2.76 -1.55 0.00 -0.94 -3.42 119.26 113.35 2isa h ALA 186 Ca -0.51 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 53.95 2isa h ALA 186 Cb 1.29 -0.11 -0.11 0.00 0.00 0.00 0.00 17.79 18.86 2isa h ALA 186 CO 0.58 0.58 -0.20 0.95 0.00 0.00 0.00 179.25 181.15 2isa s THR 187 N -4.40 0.02 0.29 0.00 -4.23 -1.26 -4.89 115.64 101.17 2isa s THR 187 Ca -0.07 -1.39 0.33 0.00 -1.18 0.00 0.00 61.69 59.38 2isa s THR 187 Cb 0.13 -2.07 0.36 0.00 1.34 0.00 0.00 72.50 72.26 2isa s THR 187 CO 0.79 -0.09 2.06 1.88 -0.54 0.00 0.00 174.62 178.72 2isa h TYR 188 N 2.36 0.00 0.00 3.99 0.05 -1.88 -2.84 116.97 118.65 2isa h TYR 188 Ca -0.29 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.49 2isa h TYR 188 Cb 1.25 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.99 2isa h TYR 188 CO 0.39 0.06 0.00 0.00 -1.05 0.00 0.00 178.16 177.56 2isa h ARG 189 N 0.00 0.00 -1.13 4.88 3.08 -1.96 -3.32 114.38 115.93 2isa h ARG 189 Ca -0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 2isa h ARG 189 Cb 0.40 0.00 -0.39 0.00 0.08 0.00 0.00 29.97 30.06 2isa h ARG 189 CO 0.01 0.00 -0.31 0.72 -1.07 0.00 0.00 179.97 179.32 2isa n HIS 190 N -2.94 3.04 -4.03 3.04 8.25 -1.07 -4.50 115.22 117.00 2isa n HIS 190 Ca 0.03 -2.61 -0.10 0.00 -0.26 0.00 0.00 57.72 54.77 2isa n HIS 190 Cb 0.41 -0.55 -0.11 0.00 1.12 0.00 0.00 29.99 30.86 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 -3.67 0.45 0.62 -0.41 0.23 -1.25 -2.58 119.30 112.68 2isa s MET 191 Ca 0.53 -0.76 -0.09 0.00 -1.03 0.00 0.00 55.69 54.33 2isa s MET 191 Cb 0.43 -0.04 -0.01 0.00 -1.53 0.00 0.00 34.83 33.67 2isa s MET 191 CO -0.08 -0.02 0.99 -1.01 -2.03 0.00 0.00 175.02 172.87 2isa s HIS 192 N -1.79 3.43 0.13 3.16 0.09 -1.26 -4.40 115.29 114.65 2isa s HIS 192 Ca -0.10 0.99 0.10 0.00 -0.00 0.00 0.00 55.06 56.05 2isa s HIS 192 Cb -0.07 -2.78 -0.04 0.00 -0.00 0.00 0.00 32.58 29.69 2isa s HIS 192 CO -0.02 -0.82 -0.24 0.20 -0.00 0.00 0.00 174.74 173.86 2isa s GLY 193 N -4.26 1.45 -0.03 -2.22 0.00 0.09 -4.22 107.32 98.13 2isa s GLY 193 Ca 0.55 -1.40 -0.04 0.00 0.00 0.00 0.00 44.72 43.83 2isa s GLY 193 CO 0.50 -1.39 0.09 -1.36 0.00 0.00 0.00 173.10 170.94 2isa s PHE 194 N -1.18 -0.06 0.24 1.90 0.40 0.11 0.11 117.98 119.50 2isa s PHE 194 Ca 0.12 0.14 0.22 0.00 -0.60 0.00 0.00 56.93 56.81 2isa s PHE 194 Cb -0.10 0.01 0.97 0.00 0.51 0.00 0.00 43.02 44.41 2isa s PHE 194 CO 0.06 -0.10 1.86 0.78 0.70 0.00 0.00 175.22 178.52 2isa h GLY 195 N 5.64 0.00 0.00 4.36 0.00 -1.66 -1.15 103.07 110.25 2isa h GLY 195 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2isa h GLY 195 CO 0.44 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.42 2isa n SER 196 N -3.56 0.00 -4.70 0.19 7.64 -1.26 -4.77 113.62 107.17 2isa n SER 196 Ca -0.01 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.50 2isa n SER 196 Cb 0.40 0.00 0.07 0.00 -1.01 0.00 0.00 64.21 63.67 2isa n SER 196 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2isa n HIS 197 N 0.00 1.60 -2.00 1.43 8.25 -1.26 -4.79 115.22 118.44 2isa n HIS 197 Ca 0.00 0.42 -0.42 0.00 -0.26 0.00 0.00 57.72 57.46 2isa n HIS 197 Cb 0.00 -2.22 -0.03 0.00 1.12 0.00 0.00 29.99 28.86 2isa n HIS 197 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2isa s THR 198 N -1.46 3.02 0.00 1.59 2.01 -1.26 -4.66 115.64 114.87 2isa s THR 198 Ca 0.81 0.62 0.00 0.00 0.31 0.00 0.00 61.69 63.42 2isa s THR 198 Cb -0.38 -3.40 0.00 0.00 0.01 0.00 0.00 72.50 68.73 2isa s THR 198 CO 0.42 0.02 0.00 0.49 -0.69 0.00 0.00 174.62 174.87 2isa n PHE 199 N 4.74 -0.64 -4.11 4.92 3.01 0.35 -4.05 117.46 121.68 2isa n PHE 199 Ca 0.14 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.45 2isa n PHE 199 Cb 0.40 0.00 -0.12 0.00 -0.01 0.00 0.00 39.48 39.76 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 -0.58 1.04 -0.07 4.37 1.04 -0.67 -1.44 113.70 117.40 2isa s SER 200 Ca 0.00 -0.52 -0.03 0.00 0.48 0.00 0.00 55.95 55.89 2isa s SER 200 Cb 0.00 0.00 -0.04 0.00 0.10 0.00 0.00 66.02 66.08 2isa s SER 200 CO 0.00 -0.14 0.07 -0.36 0.98 0.00 0.00 173.24 173.79 2isa s PHE 201 N -1.21 3.33 -0.12 5.02 0.08 0.41 -0.14 117.98 125.34 2isa s PHE 201 Ca -0.07 0.30 0.03 0.00 0.12 0.00 0.00 56.93 57.31 2isa s PHE 201 Cb -0.09 -1.82 0.01 0.00 -0.57 0.00 0.00 43.02 40.55 2isa s PHE 201 CO 0.01 0.57 -0.23 0.42 -0.10 0.00 0.00 175.22 175.89 2isa s ILE 202 N -1.03 2.04 0.74 0.64 -1.09 -0.40 -0.94 121.20 121.16 2isa s ILE 202 Ca 0.17 -0.99 -0.02 0.00 -2.23 0.00 0.00 60.65 57.58 2isa s ILE 202 Cb -0.12 -1.79 0.15 0.00 -1.58 0.00 0.00 42.46 39.13 2isa s ILE 202 CO 0.07 0.55 1.01 -0.46 -1.23 0.00 0.00 174.94 174.87 2isa n ASN 203 N 3.82 1.17 0.27 3.58 0.23 -0.76 -1.33 115.26 122.25 2isa n ASN 203 Ca -0.20 -2.03 0.17 0.00 -0.53 0.00 0.00 54.58 52.00 2isa n ASN 203 Cb 0.52 -0.67 0.93 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 -0.71 0.00 -0.48 0.53 0.02 -1.88 -0.68 113.55 110.35 2isa h SER 204 Ca -0.33 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 2isa h SER 204 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 2isa h SER 204 CO 0.34 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.50 2isa n ASP 205 N -3.64 3.03 -2.97 3.07 8.00 -1.26 -4.93 116.55 117.85 2isa n ASP 205 Ca -0.01 -2.14 -0.21 0.00 0.71 0.00 0.00 54.79 53.14 2isa n ASP 205 Cb 0.18 -0.40 0.02 0.00 -0.02 0.00 0.00 41.12 40.90 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 0.86 -5.30 -4.85 -2.24 4.13 -0.26 -5.00 115.26 102.59 2isa n ASN 206 Ca 0.17 -0.23 -0.35 0.00 1.68 0.00 0.00 54.58 55.85 2isa n ASN 206 Cb 0.53 -4.34 -0.06 0.00 -1.54 0.00 0.00 39.78 34.37 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 -5.63 3.92 -0.09 3.52 2.02 -1.26 -4.72 118.70 116.45 2isa s GLU 207 Ca 0.26 0.40 -0.00 0.00 0.02 0.00 0.00 54.97 55.65 2isa s GLU 207 Cb -0.12 -2.95 -0.03 0.00 0.10 0.00 0.00 34.13 31.13 2isa s GLU 207 CO 0.32 0.50 -0.06 0.50 0.02 0.00 0.00 175.26 176.54 2isa s ARG 208 N -1.96 3.01 -0.04 1.61 3.52 -1.26 -1.82 118.95 122.02 2isa s ARG 208 Ca 0.37 -0.54 0.05 0.00 -0.13 0.00 0.00 55.73 55.48 2isa s ARG 208 Cb -0.15 -2.68 -0.01 0.00 -1.56 0.00 0.00 34.95 30.56 2isa s ARG 208 CO 0.19 0.54 -0.20 0.71 -0.81 0.00 0.00 175.30 175.73 2isa s TYR 209 N -0.47 1.91 0.38 5.12 1.51 -0.11 -3.38 117.35 122.30 2isa s TYR 209 Ca 0.07 -0.49 -0.25 0.00 -1.01 0.00 0.00 57.07 55.40 2isa s TYR 209 Cb -0.12 -1.26 -0.09 0.00 -0.11 0.00 0.00 41.96 40.38 2isa s TYR 209 CO 0.02 -0.13 1.03 -1.58 -1.11 0.00 0.00 175.55 173.78 2isa s TRP 210 N -0.19 3.37 -0.05 2.71 0.52 -0.38 -0.45 118.94 124.48 2isa s TRP 210 Ca 0.00 1.67 -0.09 0.00 0.02 0.00 0.00 56.10 57.70 2isa s TRP 210 Cb -0.11 -3.08 0.02 0.00 -1.15 0.00 0.00 33.47 29.15 2isa s TRP 210 CO 0.01 -0.43 0.22 0.54 0.02 0.00 0.00 176.95 177.32 2isa s VAL 211 N -1.65 0.04 -0.04 4.03 0.11 -0.52 -0.59 120.40 121.77 2isa s VAL 211 Ca 0.56 -0.30 0.06 0.00 -2.93 0.00 0.00 61.98 59.36 2isa s VAL 211 Cb -0.21 -0.42 -0.02 0.00 -1.53 0.00 0.00 36.38 34.20 2isa s VAL 211 CO 0.27 -0.17 -0.22 -0.54 -3.33 0.00 0.00 175.10 171.11 2isa s LYS 212 N -0.62 2.39 -0.18 1.54 -0.14 -0.76 -0.49 119.74 121.48 2isa s LYS 212 Ca -0.07 -0.86 -0.09 0.00 -1.36 0.00 0.00 55.97 53.60 2isa s LYS 212 Cb -0.04 -2.18 -0.05 0.00 -1.68 0.00 0.00 37.83 33.88 2isa s LYS 212 CO 0.01 0.51 0.11 -0.06 -0.76 0.00 0.00 175.35 175.16 2isa s PHE 213 N -0.47 3.40 -0.06 3.18 0.08 -1.26 -1.64 117.98 121.21 2isa s PHE 213 Ca 0.05 0.30 0.02 0.00 0.12 0.00 0.00 56.93 57.42 2isa s PHE 213 Cb -0.11 -2.10 0.01 0.00 -0.57 0.00 0.00 43.02 40.25 2isa s PHE 213 CO 0.01 0.34 -0.11 -1.01 -0.10 0.00 0.00 175.22 174.35 2isa s HIS 214 N 0.11 1.31 -0.31 0.36 3.76 -0.11 -1.93 115.29 118.48 2isa s HIS 214 Ca 0.08 -0.47 -0.02 0.00 -0.15 0.00 0.00 55.06 54.51 2isa s HIS 214 Cb -0.11 -0.99 0.06 0.00 1.11 0.00 0.00 32.58 32.65 2isa s HIS 214 CO -0.00 -0.26 0.01 -0.06 -0.85 0.00 0.00 174.74 173.58 2isa s PHE 215 N 0.71 3.30 -0.23 1.40 0.40 0.12 -0.95 117.98 122.73 2isa s PHE 215 Ca -0.14 -1.96 -0.19 0.00 -0.60 0.00 0.00 56.93 54.05 2isa s PHE 215 Cb -0.16 -2.21 -0.03 0.00 0.51 0.00 0.00 43.02 41.14 2isa s PHE 215 CO 0.03 -0.82 0.55 0.08 0.70 0.00 0.00 175.22 175.76 2isa s VAL 216 N 1.23 5.06 0.17 -0.44 1.01 -0.01 -0.73 120.40 126.69 2isa s VAL 216 Ca -0.04 0.99 -0.32 0.00 0.00 0.00 0.00 61.98 62.62 2isa s VAL 216 Cb -0.20 -3.87 -0.11 0.00 0.00 0.00 0.00 36.38 32.21 2isa s VAL 216 CO -0.02 0.11 1.66 -0.55 0.00 0.00 0.00 175.10 176.30 2isa s SER 217 N 1.34 6.49 0.00 3.32 0.15 -1.26 -0.79 113.70 122.95 2isa s SER 217 Ca 0.24 2.71 0.29 0.00 0.70 0.00 0.00 55.95 59.90 2isa s SER 217 Cb -0.16 -2.59 1.30 0.00 -1.71 0.00 0.00 66.02 62.86 2isa s SER 217 CO 0.09 -0.90 1.92 0.00 1.20 0.00 0.00 173.24 175.55 2isa n GLN 218 N 4.27 0.39 0.00 5.44 6.02 -0.43 -3.29 117.38 129.78 2isa n GLN 218 Ca 0.15 -0.07 0.12 0.00 -0.01 0.00 0.00 57.00 57.19 2isa n GLN 218 Cb 0.37 -1.50 0.17 0.00 1.02 0.00 0.00 30.24 30.30 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 -1.24 0.49 -0.07 -1.09 3.00 -1.26 -4.99 117.38 112.22 2isa n GLN 219 Ca 0.12 -0.34 0.01 0.00 -0.01 0.00 0.00 57.00 56.78 2isa n GLN 219 Cb 0.28 -1.49 -0.00 0.00 0.00 0.00 0.00 30.24 29.02 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 1.43 -2.24 3.74 1.08 0.00 -1.21 -4.90 105.19 103.10 2isa n GLY 220 Ca 0.08 -1.51 -0.35 0.00 0.00 0.00 0.00 46.02 44.24 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 -0.99 5.41 -0.02 -0.61 -1.09 -1.26 -4.20 121.20 118.43 2isa s ILE 221 Ca 0.00 0.21 0.01 0.00 -2.23 0.00 0.00 60.65 58.63 2isa s ILE 221 Cb 0.00 -3.47 0.02 0.00 -1.58 0.00 0.00 42.46 37.43 2isa s ILE 221 CO 0.00 0.45 -0.01 -0.54 -1.23 0.00 0.00 174.94 173.61 2isa s LYS 222 N 0.29 0.26 0.28 2.79 1.02 -1.06 -5.05 119.74 118.27 2isa s LYS 222 Ca 0.09 0.03 0.05 0.00 0.02 0.00 0.00 55.97 56.16 2isa s LYS 222 Cb -0.11 -0.39 -0.06 0.00 -0.52 0.00 0.00 37.83 36.75 2isa s LYS 222 CO -0.01 -0.08 -0.03 -0.80 -0.92 0.00 0.00 175.35 173.51 2isa s ASN 223 N 0.70 2.51 -0.03 2.83 0.01 -1.26 -0.37 114.94 119.33 2isa s ASN 223 Ca -0.07 -1.23 0.05 0.00 -0.71 0.00 0.00 52.86 50.91 2isa s ASN 223 Cb -0.10 -0.12 -0.03 0.00 0.41 0.00 0.00 41.25 41.42 2isa s ASN 223 CO -0.01 -0.42 -0.18 -0.76 -1.51 0.00 0.00 177.10 174.22 2isa s LEU 224 N -3.42 2.53 0.88 0.60 1.43 0.63 -4.55 118.68 116.79 2isa s LEU 224 Ca 0.30 -0.30 -0.12 0.00 -1.03 0.00 0.00 54.13 52.98 2isa s LEU 224 Cb 0.05 -1.49 0.12 0.00 0.03 0.00 0.00 46.19 44.90 2isa s LEU 224 CO 0.12 0.33 1.10 -0.94 0.23 0.00 0.00 176.35 177.18 2isa s SER 225 N -0.80 3.70 0.22 2.29 1.04 -1.26 -4.51 113.70 114.38 2isa s SER 225 Ca 0.12 1.33 -0.08 0.00 0.48 0.00 0.00 55.95 57.80 2isa s SER 225 Cb -0.10 -2.01 0.31 0.00 0.10 0.00 0.00 66.02 64.31 2isa s SER 225 CO 0.01 -2.47 1.78 0.44 0.98 0.00 0.00 173.24 173.97 2isa h ASP 226 N -1.44 0.45 -0.35 7.02 3.32 -1.98 0.23 116.42 123.67 2isa h ASP 226 Ca -0.49 0.06 -0.11 0.00 0.02 0.00 0.00 57.03 56.51 2isa h ASP 226 Cb 1.29 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.81 2isa h ASP 226 CO 0.57 0.26 -0.20 0.00 -1.72 0.00 0.00 179.24 178.16 2isa h ALA 227 N 1.41 0.49 -0.58 3.45 0.00 -1.99 -0.79 119.26 121.25 2isa h ALA 227 Ca 0.33 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2isa h ALA 227 Cb 0.33 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 2isa h ALA 227 CO -0.25 0.44 0.38 0.93 0.00 0.00 0.00 179.25 180.75 2isa h GLU 228 N 0.53 0.76 -0.43 0.00 5.08 -1.85 -2.30 114.58 116.37 2isa h GLU 228 Ca 0.07 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.35 2isa h GLU 228 Cb 0.75 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.81 2isa h GLU 228 CO 0.06 0.51 0.13 0.00 -1.00 0.00 0.00 179.01 178.70 2isa h ALA 229 N 1.21 0.56 -0.32 3.43 0.00 -0.40 -1.86 119.26 121.88 2isa h ALA 229 Ca 0.21 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.96 2isa h ALA 229 Cb -0.08 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2isa h ALA 229 CO -0.04 0.22 0.17 0.78 0.00 0.00 0.00 179.25 180.37 2isa h GLY 230 N 0.55 0.43 0.78 0.00 0.00 -1.04 0.24 103.07 104.03 2isa h GLY 230 Ca 0.14 -0.12 0.04 0.00 0.00 0.00 0.00 47.33 47.38 2isa h GLY 230 CO -0.00 0.10 0.33 -2.09 0.00 0.00 0.00 176.54 174.88 2isa h GLU 231 N 0.35 0.62 -0.21 4.80 4.81 -1.31 -1.55 114.58 122.09 2isa h GLU 231 Ca 0.13 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2isa h GLU 231 Cb 0.03 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 2isa h GLU 231 CO -0.08 0.41 0.12 1.25 -0.73 0.00 0.00 179.01 179.98 2isa h LEU 232 N 0.64 0.26 -1.05 1.64 5.85 -0.86 -3.02 115.31 118.78 2isa h LEU 232 Ca 0.25 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.87 2isa h LEU 232 Cb 0.10 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.03 2isa h LEU 232 CO -0.14 0.26 0.39 0.58 -0.34 0.00 0.00 178.44 179.19 2isa h VAL 233 N 0.24 1.23 -0.98 1.05 2.07 -0.78 0.28 116.25 119.37 2isa h VAL 233 Ca 0.07 -0.61 0.14 0.00 0.82 0.00 0.00 66.70 67.13 2isa h VAL 233 Cb 0.05 0.23 -0.09 0.00 -1.52 0.00 0.00 31.29 29.96 2isa h VAL 233 CO -0.01 0.27 0.60 1.23 0.02 0.00 0.00 177.57 179.67 2isa h GLY 234 N 1.10 1.64 1.45 2.17 0.00 -1.16 -2.49 103.07 105.78 2isa h GLY 234 Ca 0.26 -0.39 -0.27 0.00 0.00 0.00 0.00 47.33 46.94 2isa h GLY 234 CO -0.04 0.08 -1.38 3.43 0.00 0.00 0.00 176.54 178.63 2isa h ASN 235 N 0.89 0.14 -1.26 0.19 -0.26 -1.27 -3.47 115.58 110.53 2isa h ASN 235 Ca 0.51 -0.19 0.04 0.00 -0.56 0.00 0.00 56.30 56.10 2isa h ASN 235 Cb 0.61 -0.04 -0.23 0.00 -1.06 0.00 0.00 38.32 37.60 2isa h ASN 235 CO -0.31 1.16 -0.30 -0.62 -1.06 0.00 0.00 177.43 176.30 2isa s ASP 236 N -6.63 -1.05 0.00 5.81 2.15 0.92 -4.98 116.67 112.89 2isa s ASP 236 Ca -0.04 0.80 0.29 0.00 0.43 0.00 0.00 52.55 54.03 2isa s ASP 236 Cb 0.08 1.97 1.27 0.00 -0.30 0.00 0.00 42.92 45.94 2isa s ASP 236 CO 0.83 -0.26 1.92 0.54 -0.17 0.00 0.00 175.17 178.03 2isa n ARG 237 N 5.42 0.22 -0.46 4.34 3.00 -1.25 -3.91 116.66 124.01 2isa n ARG 237 Ca -0.02 -0.03 0.05 0.00 -0.01 0.00 0.00 57.85 57.84 2isa n ARG 237 Cb 0.51 -1.50 0.21 0.00 0.00 0.00 0.00 32.46 31.67 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 -1.37 2.04 -0.35 5.56 -0.58 -1.26 -0.92 120.64 123.76 2isa n GLU 238 Ca 0.10 -2.92 0.08 0.00 -0.42 0.00 0.00 57.16 54.00 2isa n GLU 238 Cb 0.30 -1.72 0.26 0.00 -0.57 0.00 0.00 31.44 29.71 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 1.01 0.89 0.46 1.62 4.64 -1.94 -1.19 113.55 119.03 2isa h SER 239 Ca 0.06 0.05 -0.30 0.00 -0.47 0.00 0.00 61.79 61.12 2isa h SER 239 Cb 1.33 -0.13 0.01 0.00 -0.31 0.00 0.00 62.40 63.31 2isa h SER 239 CO 0.18 0.47 -1.40 0.45 -0.87 0.00 0.00 176.83 175.67 2isa h HIS 240 N 0.95 0.66 0.07 4.77 3.86 -1.90 -1.52 115.15 122.04 2isa h HIS 240 Ca 0.49 -0.48 0.01 0.00 -1.16 0.00 0.00 60.37 59.23 2isa h HIS 240 Cb 0.51 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.94 2isa h HIS 240 CO -0.00 1.41 -0.13 0.37 0.86 0.00 0.00 177.93 180.44 2isa h GLN 241 N 0.10 -0.25 -0.56 2.45 5.75 -1.89 -1.83 115.11 118.87 2isa h GLN 241 Ca -0.20 0.02 0.09 0.00 -0.15 0.00 0.00 58.65 58.40 2isa h GLN 241 Cb 2.05 0.06 -0.07 0.00 1.07 0.00 0.00 27.48 30.59 2isa h GLN 241 CO 0.22 -0.17 0.19 -0.09 -2.65 0.00 0.00 178.83 176.34 2isa h ARG 242 N -0.26 0.35 -0.13 1.69 2.43 -1.22 0.25 114.38 117.49 2isa h ARG 242 Ca 0.02 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2isa h ARG 242 Cb 0.28 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 2isa h ARG 242 CO -0.08 0.23 0.05 0.22 -1.51 0.00 0.00 179.97 178.88 2isa h ASP 243 N 0.36 0.19 0.25 -3.80 3.58 -1.20 -1.35 116.42 114.45 2isa h ASP 243 Ca 0.28 -0.17 -0.01 0.00 0.42 0.00 0.00 57.03 57.54 2isa h ASP 243 Cb 0.34 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.35 2isa h ASP 243 CO -0.30 0.31 -0.12 0.25 -2.88 0.00 0.00 179.24 176.50 2isa h LEU 244 N 0.05 -0.29 -0.17 2.28 5.85 -0.98 0.43 115.31 122.49 2isa h LEU 244 Ca 0.04 -0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.74 2isa h LEU 244 Cb 0.19 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 2isa h LEU 244 CO -0.00 -0.11 -0.08 0.25 -0.34 0.00 0.00 178.44 178.15 2isa h LEU 245 N -0.45 -0.27 -0.53 2.25 5.85 -0.97 -2.03 115.31 119.16 2isa h LEU 245 Ca -0.03 0.07 -0.11 0.00 0.84 0.00 0.00 57.88 58.65 2isa h LEU 245 Cb 0.34 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 2isa h LEU 245 CO 0.06 -0.11 -0.08 0.44 -0.34 0.00 0.00 178.44 178.41 2isa h ASP 246 N -0.06 0.99 -0.23 1.25 3.32 -1.20 -1.24 116.42 119.25 2isa h ASP 246 Ca 0.09 -0.34 0.04 0.00 0.02 0.00 0.00 57.03 56.84 2isa h ASP 246 Cb 0.20 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 2isa h ASP 246 CO -0.21 1.10 0.01 0.28 -1.72 0.00 0.00 179.24 178.70 2isa h SER 247 N 0.87 -0.07 -0.41 6.45 0.02 -0.76 -1.39 113.55 118.26 2isa h SER 247 Ca 0.14 0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 61.07 2isa h SER 247 Cb 0.64 0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.24 2isa h SER 247 CO 0.04 -0.00 -0.03 0.40 -1.14 0.00 0.00 176.83 176.10 2isa h ILE 248 N 0.09 1.27 -0.02 3.27 2.04 -1.25 0.50 117.51 123.41 2isa h ILE 248 Ca 0.11 -1.07 0.01 0.00 1.00 0.00 0.00 64.86 64.91 2isa h ILE 248 Cb 0.13 1.14 -0.00 0.00 -0.74 0.00 0.00 36.82 37.35 2isa h ILE 248 CO -0.17 0.36 0.02 0.44 0.00 0.00 0.00 178.15 178.80 2isa h ASP 249 N 0.56 0.00 -0.49 1.72 3.32 -1.11 -2.55 116.42 117.87 2isa h ASP 249 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2isa h ASP 249 Cb 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.07 2isa h ASP 249 CO 0.03 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.14 2isa n ASN 250 N -3.90 5.01 -3.66 6.45 5.03 -0.54 -4.97 115.26 118.68 2isa n ASN 250 Ca -0.03 -2.87 -0.27 0.00 0.87 0.00 0.00 54.58 52.28 2isa n ASN 250 Cb 0.11 -0.62 0.03 0.00 -1.02 0.00 0.00 39.78 38.28 2isa n ASN 250 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2isa n GLN 251 N 0.35 -5.42 -2.93 3.52 6.02 -0.96 -4.93 117.38 113.03 2isa n GLN 251 Ca 0.25 0.65 -0.38 0.00 -0.01 0.00 0.00 57.00 57.51 2isa n GLN 251 Cb 1.05 -5.53 -0.00 0.00 1.02 0.00 0.00 30.24 26.77 2isa n GLN 251 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2isa n ASP 252 N -2.72 6.17 -4.67 1.08 4.64 0.11 -5.03 116.55 116.13 2isa n ASP 252 Ca 0.01 -3.54 -0.43 0.00 -1.38 0.00 0.00 54.79 49.45 2isa n ASP 252 Cb 0.54 -1.07 -0.02 0.00 -1.04 0.00 0.00 41.12 39.53 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 -3.36 2.69 0.30 -0.67 2.99 -1.26 -4.43 117.98 114.24 2isa s PHE 253 Ca 0.37 0.81 -0.28 0.00 0.00 0.00 0.00 56.93 57.83 2isa s PHE 253 Cb 0.14 -3.62 -0.09 0.00 0.00 0.00 0.00 43.02 39.45 2isa s PHE 253 CO -0.02 -2.28 1.04 -1.25 -0.00 0.00 0.00 175.22 172.72 2isa s PRO 254 N 3.28 4.59 0.09 0.24 0.04 -1.24 -4.83 135.00 137.17 2isa s PRO 254 Ca 0.61 1.64 0.07 0.00 0.04 0.00 0.00 61.00 63.35 2isa s PRO 254 Cb -0.26 -3.05 -0.03 0.00 0.04 0.00 0.00 34.50 31.20 2isa s PRO 254 CO 0.21 0.22 -0.18 0.15 0.04 0.00 0.00 177.00 177.43 2isa s LYS 255 N -1.65 1.01 0.04 4.56 1.02 -1.26 -1.46 119.74 122.00 2isa s LYS 255 Ca 0.47 -1.08 0.04 0.00 0.02 0.00 0.00 55.97 55.42 2isa s LYS 255 Cb -0.28 -1.18 -0.02 0.00 -0.52 0.00 0.00 37.83 35.83 2isa s LYS 255 CO 0.35 0.27 -0.12 -1.58 -0.92 0.00 0.00 175.35 173.35 2isa s TRP 256 N -1.19 1.01 -0.25 3.18 0.51 -0.35 -1.32 118.94 120.54 2isa s TRP 256 Ca 0.03 -0.35 -0.11 0.00 -2.12 0.00 0.00 56.10 53.55 2isa s TRP 256 Cb -0.10 -0.60 -0.05 0.00 -0.81 0.00 0.00 33.47 31.91 2isa s TRP 256 CO 0.03 0.01 0.17 0.99 -0.51 0.00 0.00 176.95 177.64 2isa s THR 257 N -0.88 5.34 -0.10 2.01 2.01 0.03 -1.17 115.64 122.88 2isa s THR 257 Ca -0.01 0.18 -0.30 0.00 0.31 0.00 0.00 61.69 61.88 2isa s THR 257 Cb -0.08 -3.51 -0.01 0.00 0.01 0.00 0.00 72.50 68.91 2isa s THR 257 CO 0.01 0.32 1.00 -0.22 -0.69 0.00 0.00 174.62 175.04 2isa s LEU 258 N 1.26 4.25 0.06 4.42 2.96 0.71 -0.83 118.68 131.53 2isa s LEU 258 Ca 0.08 1.54 0.05 0.00 -0.22 0.00 0.00 54.13 55.58 2isa s LEU 258 Cb -0.14 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 42.97 2isa s LEU 258 CO 0.06 -0.43 -0.15 -0.54 -1.32 0.00 0.00 176.35 173.97 2isa s LYS 259 N 1.94 0.88 0.11 1.98 1.02 -0.12 -1.24 119.74 124.30 2isa s LYS 259 Ca 0.49 -0.92 0.07 0.00 0.02 0.00 0.00 55.97 55.63 2isa s LYS 259 Cb -0.18 -0.91 -0.03 0.00 -0.52 0.00 0.00 37.83 36.18 2isa s LYS 259 CO 0.19 0.21 -0.18 0.14 -0.92 0.00 0.00 175.35 174.79 2isa s VAL 260 N -1.14 1.50 -0.13 3.17 -7.23 0.40 -0.93 120.40 116.04 2isa s VAL 260 Ca -0.00 -1.57 -0.05 0.00 -1.81 0.00 0.00 61.98 58.55 2isa s VAL 260 Cb -0.09 -1.47 -0.04 0.00 0.56 0.00 0.00 36.38 35.34 2isa s VAL 260 CO 0.02 -0.20 0.04 -1.10 -0.31 0.00 0.00 175.10 173.55 2isa s GLN 261 N -2.13 3.43 -0.12 4.82 -0.21 -0.65 -0.41 119.66 124.38 2isa s GLN 261 Ca 0.06 -0.34 0.01 0.00 0.02 0.00 0.00 55.36 55.11 2isa s GLN 261 Cb -0.08 -3.01 0.02 0.00 1.00 0.00 0.00 33.01 30.93 2isa s GLN 261 CO 0.04 0.56 -0.15 0.42 -2.12 0.00 0.00 175.29 174.03 2isa s ILE 262 N -0.44 1.56 -0.19 1.08 1.01 -1.26 -1.82 121.20 121.12 2isa s ILE 262 Ca 0.09 -0.66 -0.00 0.00 0.00 0.00 0.00 60.65 60.08 2isa s ILE 262 Cb -0.12 -1.43 0.01 0.00 0.01 0.00 0.00 42.46 40.94 2isa s ILE 262 CO 0.02 0.45 -0.16 -0.32 0.00 0.00 0.00 174.94 174.94 2isa s MET 263 N 1.10 3.06 0.47 2.79 -2.45 0.24 -4.97 119.30 119.54 2isa s MET 263 Ca -0.04 -0.80 -0.23 0.00 -1.25 0.00 0.00 55.69 53.37 2isa s MET 263 Cb -0.14 -2.70 -0.09 0.00 1.25 0.00 0.00 34.83 33.15 2isa s MET 263 CO -0.04 -0.22 1.07 -2.30 1.05 0.00 0.00 175.02 174.58 2isa n PRO 264 N 4.66 1.40 -0.31 4.11 -0.02 -1.26 -1.25 135.00 142.34 2isa n PRO 264 Ca -0.20 0.51 0.07 0.00 -2.02 0.00 0.00 63.50 61.86 2isa n PRO 264 Cb 0.50 -2.17 0.23 0.00 -0.02 0.00 0.00 33.50 32.04 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 1.43 0.67 -0.47 -0.52 4.81 -1.93 -1.44 114.58 117.14 2isa h GLU 265 Ca -0.46 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 58.78 2isa h GLU 265 Cb 1.33 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.53 2isa h GLU 265 CO 0.56 0.45 0.31 0.00 -0.73 0.00 0.00 179.01 179.60 2isa h ALA 266 N 1.55 1.93 0.00 2.92 0.00 -1.89 -3.03 119.26 120.74 2isa h ALA 266 Ca 0.47 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.34 2isa h ALA 266 Cb 0.63 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 2isa h ALA 266 CO -0.34 -0.01 -0.11 -0.44 0.00 0.00 0.00 179.25 178.36 2isa h ASP 267 N 0.40 0.00 0.21 0.00 5.19 -1.60 -3.01 116.42 117.61 2isa h ASP 267 Ca 0.20 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.60 2isa h ASP 267 Cb 0.29 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.80 2isa h ASP 267 CO -0.05 0.11 -0.08 0.00 -3.12 0.00 0.00 179.24 176.10 2isa h ALA 268 N 1.89 1.42 0.00 3.45 0.00 -1.66 -0.72 119.26 123.64 2isa h ALA 268 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2isa h ALA 268 Cb 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2isa h ALA 268 CO 0.01 0.10 -0.19 0.00 0.00 0.00 0.00 179.25 179.17 2isa n ALA 269 N -2.32 2.59 0.03 0.00 0.00 -1.14 -4.37 120.51 115.31 2isa n ALA 269 Ca -0.02 -0.14 0.01 0.00 0.00 0.00 0.00 53.44 53.29 2isa n ALA 269 Cb 0.18 -1.36 -0.01 0.00 0.00 0.00 0.00 19.45 18.25 2isa n ALA 269 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2isa n THR 270 N -1.89 0.00 -2.12 0.00 -2.24 -0.37 -5.05 114.28 102.61 2isa n THR 270 Ca 0.06 -0.23 -0.38 0.00 -2.27 0.00 0.00 64.05 61.23 2isa n THR 270 Cb 0.39 0.70 -0.00 0.00 -2.10 0.00 0.00 70.33 69.32 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 -1.68 2.78 -1.18 2.28 -7.23 -0.62 -4.94 120.40 109.82 2isa s VAL 271 Ca -0.00 0.64 0.18 0.00 -1.81 0.00 0.00 61.98 60.99 2isa s VAL 271 Cb 0.01 -3.35 0.22 0.00 0.56 0.00 0.00 36.38 33.81 2isa s VAL 271 CO 0.06 0.05 1.55 -0.81 -0.31 0.00 0.00 175.10 175.64 2isa n PRO 272 N -0.22 0.11 -4.34 4.82 -0.04 -1.26 -4.69 135.00 129.37 2isa n PRO 272 Ca 0.06 0.16 -0.29 0.00 -0.04 0.00 0.00 63.50 63.39 2isa n PRO 272 Cb 0.46 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.30 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 -2.82 2.43 -0.16 0.54 -0.85 -1.26 -5.09 117.35 110.15 2isa s TYR 273 Ca 0.12 -0.32 -0.29 0.00 -0.52 0.00 0.00 57.07 56.07 2isa s TYR 273 Cb 0.12 -1.30 -0.05 0.00 0.38 0.00 0.00 41.96 41.11 2isa s TYR 273 CO 0.30 0.37 1.96 1.21 -1.52 0.00 0.00 175.55 177.87 2isa s ASN 274 N -2.14 6.00 0.00 -0.18 2.47 -1.26 -4.86 114.94 114.98 2isa s ASN 274 Ca 0.16 2.00 0.22 0.00 0.42 0.00 0.00 52.86 55.66 2isa s ASN 274 Cb -0.10 -2.52 1.04 0.00 -1.45 0.00 0.00 41.25 38.21 2isa s ASN 274 CO 0.08 -1.51 1.70 -0.81 -3.72 0.00 0.00 177.10 172.85 2isa n PRO 275 N 8.11 0.21 -0.26 0.43 -0.04 -1.26 -2.83 135.00 139.36 2isa n PRO 275 Ca 0.24 0.10 0.06 0.00 -0.04 0.00 0.00 63.50 63.86 2isa n PRO 275 Cb 0.44 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.58 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 -1.36 0.59 -2.93 0.54 3.72 -1.26 -4.67 117.46 112.10 2isa n PHE 276 Ca 0.09 -0.65 -0.43 0.00 -0.05 0.00 0.00 57.45 56.41 2isa n PHE 276 Cb 0.20 -0.13 -0.05 0.00 -0.94 0.00 0.00 39.48 38.56 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 -1.38 6.43 0.30 4.37 -1.08 -1.13 -4.33 116.67 119.84 2isa s ASP 277 Ca 0.29 -0.07 0.21 0.00 -0.52 0.00 0.00 52.55 52.46 2isa s ASP 277 Cb 0.19 -2.40 1.10 0.00 -1.46 0.00 0.00 42.92 40.35 2isa s ASP 277 CO 0.12 -0.96 1.65 -0.11 0.52 0.00 0.00 175.17 176.39 2isa n LEU 278 N 6.85 0.57 -0.59 -1.34 7.94 -1.26 -1.06 117.00 128.11 2isa n LEU 278 Ca 0.03 0.74 0.12 0.00 -1.11 0.00 0.00 56.01 55.78 2isa n LEU 278 Cb 0.48 -0.77 0.40 0.00 0.53 0.00 0.00 43.42 44.06 2isa n LEU 278 CO 0.60 -0.86 0.79 0.35 -1.11 0.00 0.00 177.39 177.17 2isa n THR 279 N -2.23 0.15 -4.35 1.96 -2.24 -1.26 -1.77 114.28 104.55 2isa n THR 279 Ca -0.01 -0.35 -0.25 0.00 -2.27 0.00 0.00 64.05 61.18 2isa n THR 279 Cb 0.07 0.50 -0.13 0.00 -2.10 0.00 0.00 70.33 68.68 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 -1.85 1.19 0.35 -0.78 1.02 -0.22 -4.83 119.74 114.63 2isa s LYS 280 Ca 0.34 -1.15 0.06 0.00 0.02 0.00 0.00 55.97 55.24 2isa s LYS 280 Cb 0.19 -1.47 -0.01 0.00 -0.52 0.00 0.00 37.83 36.03 2isa s LYS 280 CO 0.29 0.35 0.49 0.14 -0.92 0.00 0.00 175.35 175.70 2isa s VAL 281 N -1.10 3.96 -0.28 3.17 -7.23 -1.26 -4.86 120.40 112.80 2isa s VAL 281 Ca 0.07 -0.97 -0.18 0.00 -1.81 0.00 0.00 61.98 59.10 2isa s VAL 281 Cb -0.10 -3.37 -0.02 0.00 0.56 0.00 0.00 36.38 33.45 2isa s VAL 281 CO 0.04 -0.15 0.51 0.26 -0.31 0.00 0.00 175.10 175.45 2isa s TRP 282 N -2.21 3.25 -0.05 2.82 0.51 -1.26 -5.05 118.94 116.94 2isa s TRP 282 Ca 0.46 0.56 -0.39 0.00 -2.12 0.00 0.00 56.10 54.60 2isa s TRP 282 Cb -0.10 -2.75 -0.18 0.00 -0.81 0.00 0.00 33.47 29.63 2isa s TRP 282 CO 0.32 -0.32 1.33 -2.30 -0.51 0.00 0.00 176.95 175.46 2isa n PRO 283 N 5.58 0.63 0.24 4.98 -0.02 -1.26 -4.86 135.00 140.28 2isa n PRO 283 Ca -0.04 0.23 0.07 0.00 -2.02 0.00 0.00 63.50 61.73 2isa n PRO 283 Cb 0.50 -1.81 0.56 0.00 -0.02 0.00 0.00 33.50 32.73 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 4.42 0.00 -0.44 6.00 3.86 -1.97 -1.77 115.15 125.25 2isa h HIS 284 Ca -0.48 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 58.67 2isa h HIS 284 Cb 1.37 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.82 2isa h HIS 284 CO 0.62 0.11 0.05 0.87 0.86 0.00 0.00 177.93 180.43 2isa h LYS 285 N 0.00 0.68 0.06 2.45 1.57 -1.99 -2.23 116.57 117.10 2isa h LYS 285 Ca -0.00 -0.15 -0.12 0.00 -1.87 0.00 0.00 60.65 58.51 2isa h LYS 285 Cb 0.19 -0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.41 2isa h LYS 285 CO 0.01 0.66 -0.50 -0.44 -0.57 0.00 0.00 179.45 178.62 2isa h ASP 286 N 0.65 0.34 -3.18 0.86 3.32 -1.75 -3.42 116.42 113.24 2isa h ASP 286 Ca 0.14 -0.88 -0.61 0.00 0.02 0.00 0.00 57.03 55.70 2isa h ASP 286 Cb 0.34 -0.11 -0.40 0.00 0.22 0.00 0.00 39.33 39.38 2isa h ASP 286 CO 0.01 1.19 -0.77 -0.31 -1.72 0.00 0.00 179.24 177.64 2isa s TYR 287 N -2.71 1.89 0.63 4.55 2.02 -0.74 -5.09 117.35 117.90 2isa s TYR 287 Ca -0.15 -2.43 -0.18 0.00 -0.37 0.00 0.00 57.07 53.94 2isa s TYR 287 Cb 0.01 -1.73 -0.03 0.00 -0.40 0.00 0.00 41.96 39.81 2isa s TYR 287 CO 0.78 -0.77 1.16 -2.30 -1.57 0.00 0.00 175.55 172.85 2isa n PRO 288 N 3.31 1.04 -2.17 -1.71 -0.02 -0.84 -4.49 135.00 130.12 2isa n PRO 288 Ca 0.13 0.41 -0.42 0.00 -2.02 0.00 0.00 63.50 61.60 2isa n PRO 288 Cb 0.37 -2.38 -0.03 0.00 -0.02 0.00 0.00 33.50 31.44 2isa n PRO 288 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2isa s LEU 289 N -3.33 4.39 -0.18 2.45 1.02 -1.26 -4.56 118.68 117.20 2isa s LEU 289 Ca 0.80 2.40 -0.01 0.00 0.02 0.00 0.00 54.13 57.33 2isa s LEU 289 Cb -0.40 -3.60 -0.00 0.00 0.02 0.00 0.00 46.19 42.21 2isa s LEU 289 CO 0.43 -0.60 -0.11 -0.63 0.02 0.00 0.00 176.35 175.46 2isa s ILE 290 N 0.54 2.89 0.37 -0.59 1.01 0.46 -4.90 121.20 120.97 2isa s ILE 290 Ca 0.61 -0.67 -0.26 0.00 0.00 0.00 0.00 60.65 60.32 2isa s ILE 290 Cb -0.37 -2.26 -0.09 0.00 0.01 0.00 0.00 42.46 39.74 2isa s ILE 290 CO 0.35 0.48 1.16 -0.70 0.00 0.00 0.00 174.94 176.23 2isa s GLU 291 N 1.12 4.23 0.00 2.79 2.12 -1.26 -0.46 118.70 127.24 2isa s GLU 291 Ca 0.01 1.84 0.00 0.00 0.36 0.00 0.00 54.97 57.17 2isa s GLU 291 Cb -0.14 -2.82 0.00 0.00 0.26 0.00 0.00 34.13 31.43 2isa s GLU 291 CO -0.03 -0.17 0.00 0.28 -0.54 0.00 0.00 175.26 174.80 2isa n VAL 292 N 0.38 0.00 -3.20 3.70 0.31 -0.37 -4.63 118.33 114.52 2isa n VAL 292 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 2isa n VAL 292 Cb 0.46 -1.01 0.00 0.00 -0.91 0.00 0.00 33.84 32.38 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 2.74 -1.14 3.11 2.92 0.00 -1.17 -0.88 105.19 110.76 2isa n GLY 293 Ca 0.00 -0.85 -0.08 0.00 0.00 0.00 0.00 46.02 45.09 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 -0.41 0.62 0.06 1.61 -1.05 -0.55 -0.21 118.70 118.78 2isa s GLU 294 Ca 0.00 -1.03 0.05 0.00 -0.15 0.00 0.00 54.97 53.84 2isa s GLU 294 Cb 0.00 0.23 -0.03 0.00 -0.44 0.00 0.00 34.13 33.89 2isa s GLU 294 CO 0.00 -0.14 -0.15 -0.59 0.95 0.00 0.00 175.26 175.33 2isa s PHE 295 N -3.45 1.26 0.02 4.83 -0.12 -0.32 -0.43 117.98 119.76 2isa s PHE 295 Ca 0.02 -0.41 0.05 0.00 -0.05 0.00 0.00 56.93 56.55 2isa s PHE 295 Cb 0.04 -0.72 -0.02 0.00 -0.63 0.00 0.00 43.02 41.69 2isa s PHE 295 CO -0.08 0.05 -0.16 -1.83 -0.05 0.00 0.00 175.22 173.16 2isa s GLU 296 N -1.46 1.14 -0.27 1.99 -1.05 -0.91 -1.21 118.70 116.92 2isa s GLU 296 Ca 0.00 -0.68 -0.11 0.00 -0.15 0.00 0.00 54.97 54.03 2isa s GLU 296 Cb -0.09 -1.14 -0.05 0.00 -0.44 0.00 0.00 34.13 32.41 2isa s GLU 296 CO 0.02 0.30 0.18 -0.51 0.95 0.00 0.00 175.26 176.20 2isa s LEU 297 N -0.78 4.00 -0.00 1.83 1.43 -0.54 -1.93 118.68 122.69 2isa s LEU 297 Ca 0.04 -0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.14 2isa s LEU 297 Cb -0.07 -2.11 0.01 0.00 0.03 0.00 0.00 46.19 44.05 2isa s LEU 297 CO 0.00 -0.04 0.63 -0.46 0.23 0.00 0.00 176.35 176.72 2isa n ASN 298 N 4.98 0.25 -3.68 2.29 0.23 -0.36 -3.73 115.26 115.24 2isa n ASN 298 Ca -0.14 -1.28 -0.11 0.00 -0.53 0.00 0.00 54.58 52.52 2isa n ASN 298 Cb 0.52 -0.03 -0.12 0.00 -2.08 0.00 0.00 39.78 38.07 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 -0.16 0.27 0.26 -3.83 3.52 -0.84 -5.01 118.95 113.16 2isa s ARG 299 Ca 0.01 0.79 -0.25 0.00 -0.13 0.00 0.00 55.73 56.14 2isa s ARG 299 Cb 0.01 0.04 -0.09 0.00 -1.56 0.00 0.00 34.95 33.35 2isa s ARG 299 CO 0.00 -0.21 0.86 -0.80 -0.81 0.00 0.00 175.30 174.33 2isa s ASN 300 N 1.93 7.32 0.61 -2.12 0.02 -1.26 -0.80 114.94 120.64 2isa s ASN 300 Ca -0.05 1.71 -0.19 0.00 -1.02 0.00 0.00 52.86 53.32 2isa s ASN 300 Cb -0.11 -2.53 -0.03 0.00 0.02 0.00 0.00 41.25 38.61 2isa s ASN 300 CO -0.11 0.04 1.24 -2.84 0.02 0.00 0.00 177.10 175.45 2isa s PRO 301 N -1.74 2.82 0.08 -0.60 0.02 -1.26 -4.91 135.00 129.40 2isa s PRO 301 Ca 0.44 1.92 -0.12 0.00 0.02 0.00 0.00 61.00 63.26 2isa s PRO 301 Cb -0.20 -1.90 -0.24 0.00 0.02 0.00 0.00 34.50 32.18 2isa s PRO 301 CO 0.25 -1.35 1.17 1.96 -0.33 0.00 0.00 177.00 178.70 2isa h GLN 302 N 0.77 0.59 -4.03 5.54 4.20 -2.00 -3.43 115.11 116.74 2isa h GLN 302 Ca -0.51 -0.72 -0.53 0.00 0.06 0.00 0.00 58.65 56.96 2isa h GLN 302 Cb 1.31 0.22 -0.38 0.00 0.30 0.00 0.00 27.48 28.94 2isa h GLN 302 CO 0.54 1.31 -0.79 1.21 -0.67 0.00 0.00 178.83 180.43 2isa s ASN 303 N -7.31 2.58 0.11 1.46 3.84 -1.26 -5.05 114.94 109.31 2isa s ASN 303 Ca -0.08 -0.55 -0.20 0.00 0.21 0.00 0.00 52.86 52.24 2isa s ASN 303 Cb 0.07 -0.80 -0.08 0.00 -0.55 0.00 0.00 41.25 39.89 2isa s ASN 303 CO 0.92 -0.19 1.71 0.22 -2.79 0.00 0.00 177.10 176.96 2isa h TYR 304 N 8.17 0.27 0.02 0.43 5.03 -1.98 -2.15 116.97 126.77 2isa h TYR 304 Ca -0.23 -0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.09 2isa h TYR 304 Cb 1.12 -0.09 -0.03 0.00 1.55 0.00 0.00 36.73 39.28 2isa h TYR 304 CO 0.44 0.25 -0.16 0.35 -1.32 0.00 0.00 178.16 177.71 2isa h PHE 305 N 0.22 -0.43 -0.20 -3.82 3.57 -1.96 0.29 116.94 114.60 2isa h PHE 305 Ca 0.07 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.50 2isa h PHE 305 Cb 0.06 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 2isa h PHE 305 CO -0.04 -0.24 -0.24 0.00 -2.23 0.00 0.00 178.31 175.56 2isa h ALA 306 N 0.62 1.21 0.00 2.41 0.00 -1.95 -1.81 119.26 119.74 2isa h ALA 306 Ca 0.05 -0.32 -0.31 0.00 0.00 0.00 0.00 54.91 54.33 2isa h ALA 306 Cb 0.34 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 2isa h ALA 306 CO -0.14 0.51 -2.17 0.39 0.00 0.00 0.00 179.25 177.84 2isa n GLU 307 N -4.14 0.66 -0.12 0.00 1.02 -0.82 -4.44 120.64 112.80 2isa n GLU 307 Ca -0.01 0.10 -0.21 0.00 -0.02 0.00 0.00 57.16 57.02 2isa n GLU 307 Cb 0.38 -1.42 -0.07 0.00 -0.02 0.00 0.00 31.44 30.31 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 -3.02 1.52 -0.17 2.62 0.31 0.91 -3.54 118.33 116.95 2isa n VAL 308 Ca -0.35 -0.17 -0.04 0.00 -0.01 0.00 0.00 64.34 63.78 2isa n VAL 308 Cb 0.91 -2.07 0.06 0.00 -0.91 0.00 0.00 33.84 31.83 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 -1.00 0.48 0.00 5.55 4.57 -1.22 -2.44 114.58 120.51 2isa h GLU 309 Ca -0.42 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.73 2isa h GLU 309 Cb 1.35 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.84 2isa h GLU 309 CO -0.25 0.32 0.00 1.04 -1.18 0.00 0.00 179.01 178.93 2isa n GLN 310 N -4.90 0.68 -2.04 1.92 6.02 -0.69 -4.87 117.38 113.50 2isa n GLN 310 Ca 0.05 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.64 2isa n GLN 310 Cb 0.15 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 29.90 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 -2.31 3.52 -0.11 -1.58 0.00 -0.92 -4.89 121.76 115.47 2isa s ALA 311 Ca 0.37 1.33 0.00 0.00 0.00 0.00 0.00 51.96 53.66 2isa s ALA 311 Cb 0.21 -3.51 0.02 0.00 0.00 0.00 0.00 23.12 19.84 2isa s ALA 311 CO 0.41 -0.73 -0.09 0.00 0.00 0.00 0.00 175.76 175.35 2isa s ALA 312 N -1.07 1.37 -0.21 0.00 0.00 -1.26 -5.03 121.76 115.56 2isa s ALA 312 Ca 0.50 -0.56 -0.04 0.00 0.00 0.00 0.00 51.96 51.87 2isa s ALA 312 Cb -0.41 -0.86 -0.01 0.00 0.00 0.00 0.00 23.12 21.84 2isa s ALA 312 CO 0.54 -0.31 -0.05 -0.06 0.00 0.00 0.00 175.76 175.89 2isa s PHE 313 N 1.47 2.95 -0.24 0.00 0.40 -1.26 -4.95 117.98 116.36 2isa s PHE 313 Ca 0.01 -0.87 0.02 0.00 -0.60 0.00 0.00 56.93 55.49 2isa s PHE 313 Cb -0.13 -2.08 0.05 0.00 0.51 0.00 0.00 43.02 41.37 2isa s PHE 313 CO -0.06 -0.49 -0.13 1.21 0.70 0.00 0.00 175.22 176.46 2isa s ASN 314 N 1.32 4.08 0.59 1.36 3.04 -1.26 -4.93 114.94 119.13 2isa s ASN 314 Ca 0.04 -1.13 0.29 0.00 0.04 0.00 0.00 52.86 52.09 2isa s ASN 314 Cb -0.14 -1.55 1.52 0.00 -1.54 0.00 0.00 41.25 39.54 2isa s ASN 314 CO -0.02 -0.13 1.95 -0.65 -3.04 0.00 0.00 177.10 175.21 2isa h PRO 315 N 7.85 0.00 0.00 0.43 0.11 -1.84 0.23 132.00 138.78 2isa h PRO 315 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2isa h PRO 315 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2isa h PRO 315 CO 0.52 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.31 2isa h ALA 316 N 1.55 1.00 -0.95 -0.75 0.00 -1.85 -3.40 119.26 114.86 2isa h ALA 316 Ca 0.19 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 54.46 2isa h ALA 316 Cb 1.01 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.71 2isa h ALA 316 CO -0.00 0.00 1.91 -0.80 0.00 0.00 0.00 179.25 180.35 2isa s ASN 317 N -4.55 6.66 0.49 0.00 0.02 0.81 -4.94 114.94 113.43 2isa s ASN 317 Ca 0.03 -2.04 0.05 0.00 -1.02 0.00 0.00 52.86 49.89 2isa s ASN 317 Cb 0.09 -2.58 -0.00 0.00 0.02 0.00 0.00 41.25 38.78 2isa s ASN 317 CO 0.42 -1.35 0.26 0.54 0.02 0.00 0.00 177.10 176.99 2isa s VAL 318 N 4.70 1.86 0.16 1.60 0.11 -1.26 -0.91 120.40 126.65 2isa s VAL 318 Ca 0.51 -1.63 0.06 0.00 -2.93 0.00 0.00 61.98 57.99 2isa s VAL 318 Cb 0.02 -2.49 -0.04 0.00 -1.53 0.00 0.00 36.38 32.34 2isa s VAL 318 CO 0.01 0.00 -0.12 0.68 -3.33 0.00 0.00 175.10 172.34 2isa s VAL 319 N -2.71 1.35 0.20 2.04 -7.23 -1.26 -4.79 120.40 108.01 2isa s VAL 319 Ca 0.33 -2.06 -0.32 0.00 -1.81 0.00 0.00 61.98 58.12 2isa s VAL 319 Cb 0.00 -1.86 -0.15 0.00 0.56 0.00 0.00 36.38 34.94 2isa s VAL 319 CO 0.19 -0.66 1.26 -2.65 -0.31 0.00 0.00 175.10 172.93 2isa n PRO 320 N -0.15 1.51 0.00 4.82 -0.02 -1.26 -1.29 135.00 138.60 2isa n PRO 320 Ca -0.10 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2isa n PRO 320 Cb 0.60 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 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 2.09 1.25 3.03 -1.23 0.00 -1.26 -3.53 105.19 105.54 2isa n GLY 321 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.33 1.00 0.00 -0.61 1.01 -0.41 -1.28 121.20 118.59 2isa s ILE 322 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.19 2isa s ILE 322 Cb 0.00 -0.89 0.00 0.00 0.01 0.00 0.00 42.46 41.58 2isa s ILE 322 CO 0.00 0.31 0.00 -0.24 0.00 0.00 0.00 174.94 175.01 2isa n SER 323 N 3.38 0.00 -1.72 3.58 2.88 0.80 -4.00 113.62 118.54 2isa n SER 323 Ca -0.19 -0.13 0.00 0.00 -1.33 0.00 0.00 58.87 57.21 2isa n SER 323 Cb 0.53 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 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 -2.58 -4.03 0.66 3.72 -1.26 -1.67 117.46 112.30 2isa n PHE 324 Ca 0.00 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.30 2isa n PHE 324 Cb 0.00 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.46 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 0.08 0.00 4.37 1.04 -1.26 -2.95 113.70 113.98 2isa s SER 325 Ca 0.00 -1.00 0.00 0.00 0.48 0.00 0.00 55.95 55.43 2isa s SER 325 Cb 0.00 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.55 2isa s SER 325 CO 0.00 -0.89 0.64 -2.65 0.98 0.00 0.00 173.24 171.32 2isa n PRO 326 N -0.22 0.66 -1.63 4.02 -0.02 -1.26 -4.54 135.00 132.01 2isa n PRO 326 Ca -0.05 0.00 -0.48 0.00 -2.02 0.00 0.00 63.50 60.95 2isa n PRO 326 Cb 0.63 -1.02 -0.05 0.00 -0.02 0.00 0.00 33.50 33.04 2isa n PRO 326 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2isa n ASP 327 N -0.46 3.18 -0.13 2.55 -0.08 -1.26 -4.84 116.55 115.51 2isa n ASP 327 Ca 0.00 0.75 0.01 0.00 -1.51 0.00 0.00 54.79 54.04 2isa n ASP 327 Cb 0.01 -1.38 0.29 0.00 2.34 0.00 0.00 41.12 42.38 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 10.74 0.82 -0.78 -0.67 1.57 -1.79 -1.35 116.57 125.10 2isa h LYS 328 Ca -0.43 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.25 2isa h LYS 328 Cb 1.28 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 33.38 2isa h LYS 328 CO 0.96 0.58 0.38 0.52 -0.57 0.00 0.00 179.45 181.32 2isa h MET 329 N 0.84 1.13 -0.42 3.15 2.86 -1.89 -2.06 114.93 118.55 2isa h MET 329 Ca 0.22 -0.17 -0.09 0.00 -2.06 0.00 0.00 59.70 57.60 2isa h MET 329 Cb -0.03 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.41 2isa h MET 329 CO -0.04 0.88 -0.10 1.25 1.06 0.00 0.00 176.91 179.95 2isa h LEU 330 N 1.11 0.81 -0.40 1.22 5.85 -1.75 -2.78 115.31 119.37 2isa h LEU 330 Ca 0.27 -0.36 0.07 0.00 0.84 0.00 0.00 57.88 58.70 2isa h LEU 330 Cb 0.12 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 40.86 2isa h LEU 330 CO -0.03 0.99 -0.01 1.56 -0.34 0.00 0.00 178.44 180.60 2isa h GLN 331 N 0.63 0.09 -0.51 1.25 1.08 -1.04 -2.15 115.11 114.46 2isa h GLN 331 Ca 0.11 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.28 2isa h GLN 331 Cb 0.63 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 28.02 2isa h GLN 331 CO 0.04 0.06 0.25 0.78 -0.95 0.00 0.00 178.83 179.01 2isa h GLY 332 N 0.09 0.76 2.00 3.46 0.00 -1.31 -2.28 103.07 105.79 2isa h GLY 332 Ca 0.20 -0.34 -0.05 0.00 0.00 0.00 0.00 47.33 47.14 2isa h GLY 332 CO -0.34 0.33 -0.22 3.21 0.00 0.00 0.00 176.54 179.51 2isa h ARG 333 N 0.71 0.00 -0.05 4.80 3.08 -1.12 -2.74 114.38 119.06 2isa h ARG 333 Ca 0.18 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.24 2isa h ARG 333 Cb 0.07 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 2isa h ARG 333 CO -0.03 0.22 0.05 -0.07 -1.07 0.00 0.00 179.97 179.08 2isa h LEU 334 N 0.00 0.00 0.01 3.04 3.38 -0.90 -2.98 115.31 117.86 2isa h LEU 334 Ca -0.00 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.64 2isa h LEU 334 Cb 0.49 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.20 2isa h LEU 334 CO 0.03 0.00 -1.79 0.33 0.09 0.00 0.00 178.44 177.09 2isa n PHE 335 N -4.00 0.66 -0.32 1.13 7.35 -1.08 -4.75 117.46 116.45 2isa n PHE 335 Ca -0.02 0.26 -0.04 0.00 -0.76 0.00 0.00 57.45 56.90 2isa n PHE 335 Cb 0.15 -1.07 0.10 0.00 0.35 0.00 0.00 39.48 39.01 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 -0.60 1.18 0.01 3.13 0.00 -1.34 -2.97 119.26 118.67 2isa h ALA 336 Ca -0.48 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.29 2isa h ALA 336 Cb 1.49 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2isa h ALA 336 CO -0.26 0.65 -0.00 1.88 0.00 0.00 0.00 179.25 181.52 2isa h TYR 337 N 1.23 -0.01 -0.86 0.00 -1.99 -1.84 0.26 116.97 113.76 2isa h TYR 337 Ca 0.31 -0.00 0.02 0.00 2.00 0.00 0.00 58.73 61.06 2isa h TYR 337 Cb 0.04 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 38.73 2isa h TYR 337 CO 0.01 0.48 0.57 0.78 -0.00 0.00 0.00 178.16 179.99 2isa h GLY 338 N -0.49 1.21 0.92 3.88 0.00 -1.85 0.13 103.07 106.87 2isa h GLY 338 Ca -0.00 -0.44 -0.03 0.00 0.00 0.00 0.00 47.33 46.86 2isa h GLY 338 CO 0.00 0.41 -0.33 -1.80 0.00 0.00 0.00 176.54 174.82 2isa h ASP 339 N 1.13 -0.79 -0.94 0.19 3.58 -1.38 -0.90 116.42 117.30 2isa h ASP 339 Ca 0.32 0.00 0.10 0.00 0.42 0.00 0.00 57.03 57.88 2isa h ASP 339 Cb -0.07 0.20 -0.07 0.00 1.72 0.00 0.00 39.33 41.11 2isa h ASP 339 CO -0.08 -0.51 0.60 0.00 -2.88 0.00 0.00 179.24 176.37 2isa h ALA 340 N -0.78 1.60 -0.15 -0.78 0.00 -0.21 -3.00 119.26 115.92 2isa h ALA 340 Ca -0.10 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.63 2isa h ALA 340 Cb 0.74 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 2isa h ALA 340 CO 0.16 0.20 -0.66 1.96 0.00 0.00 0.00 179.25 180.90 2isa h GLN 341 N 0.93 0.60 -0.84 0.00 4.20 -0.62 0.02 115.11 119.41 2isa h GLN 341 Ca 0.44 -0.44 -0.04 0.00 0.06 0.00 0.00 58.65 58.68 2isa h GLN 341 Cb 0.44 0.08 -0.04 0.00 0.30 0.00 0.00 27.48 28.25 2isa h GLN 341 CO -0.21 1.06 0.38 0.00 -0.67 0.00 0.00 178.83 179.40 2isa h ARG 342 N 0.43 1.22 0.21 1.46 3.08 -1.03 -0.48 114.38 119.27 2isa h ARG 342 Ca -0.02 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 59.83 2isa h ARG 342 Cb 1.25 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 31.09 2isa h ARG 342 CO 0.13 0.95 -0.10 -0.92 -1.07 0.00 0.00 179.97 178.96 2isa h TYR 343 N 1.20 -0.26 -0.35 3.04 3.20 -1.48 -1.61 116.97 120.72 2isa h TYR 343 Ca 0.28 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.09 2isa h TYR 343 Cb 0.15 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 2isa h TYR 343 CO 0.02 0.07 -0.04 -0.09 -1.64 0.00 0.00 178.16 176.47 2isa h ARG 344 N -0.61 0.56 0.00 1.82 2.43 -0.87 -3.36 114.38 114.35 2isa h ARG 344 Ca -0.03 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 2isa h ARG 344 Cb 0.44 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 2isa h ARG 344 CO 0.05 0.62 -0.24 1.28 -1.51 0.00 0.00 179.97 180.17 2isa n LEU 345 N -4.24 0.00 0.00 3.80 4.77 -0.20 -4.44 117.00 116.68 2isa n LEU 345 Ca 0.01 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 2isa n LEU 345 Cb 0.28 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 2isa n LEU 345 CO 0.40 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 2isa n GLY 346 N 1.18 2.35 0.34 -0.72 0.00 -0.60 -4.50 105.19 103.23 2isa n GLY 346 Ca 0.00 -1.75 0.09 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 0.98 -0.55 1.61 3.04 -1.88 -2.83 116.25 116.61 2isa h VAL 347 Ca 0.00 -0.17 -0.03 0.00 -1.01 0.00 0.00 66.70 65.50 2isa h VAL 347 Cb 0.00 0.44 -0.02 0.00 -2.01 0.00 0.00 31.29 29.71 2isa h VAL 347 CO 0.00 0.09 0.03 0.59 -1.01 0.00 0.00 177.57 177.27 2isa n ASN 348 N -4.47 5.29 0.28 3.17 3.02 -1.26 -4.54 115.26 116.75 2isa n ASN 348 Ca 0.08 -2.89 0.19 0.00 -0.03 0.00 0.00 54.58 51.92 2isa n ASN 348 Cb 0.25 -0.68 1.01 0.00 -0.61 0.00 0.00 39.78 39.75 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 3.54 0.00 0.00 3.10 2.07 -1.73 -1.19 115.15 120.94 2isa h HIS 349 Ca 0.03 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.55 2isa h HIS 349 Cb 1.92 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.90 2isa h HIS 349 CO 1.04 0.00 0.00 1.04 -3.07 0.00 0.00 177.93 176.94 2isa n GLN 350 N -2.81 0.52 0.00 5.12 6.02 -1.26 -1.42 117.38 123.55 2isa n GLN 350 Ca -0.02 0.04 0.13 0.00 -0.01 0.00 0.00 57.00 57.13 2isa n GLN 350 Cb 0.07 -1.50 0.38 0.00 1.02 0.00 0.00 30.24 30.22 2isa n GLN 350 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2isa n HIS 351 N -1.15 0.00 -2.06 1.08 8.25 -0.45 -3.28 115.22 117.60 2isa n HIS 351 Ca 0.14 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.18 2isa n HIS 351 Cb 0.13 -0.31 -0.03 0.00 1.12 0.00 0.00 29.99 30.90 2isa n HIS 351 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2isa s ILE 352 N -2.94 3.24 0.24 1.59 1.01 -0.51 -4.85 121.20 118.98 2isa s ILE 352 Ca 0.14 0.75 -0.13 0.00 0.00 0.00 0.00 60.65 61.41 2isa s ILE 352 Cb 0.18 -3.48 0.32 0.00 0.01 0.00 0.00 42.46 39.48 2isa s ILE 352 CO 0.63 0.02 1.57 -0.65 0.00 0.00 0.00 174.94 176.51 2isa h PRO 353 N 7.70 -0.02 -0.19 2.79 0.11 -1.88 0.38 132.00 140.89 2isa h PRO 353 Ca -0.41 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.76 2isa h PRO 353 Cb 1.20 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2isa h PRO 353 CO 0.91 -0.02 0.17 -0.24 -0.21 0.00 0.00 178.00 178.61 2isa h VAL 354 N -0.02 0.66 -0.00 3.15 3.04 -1.89 -1.83 116.25 119.36 2isa h VAL 354 Ca 0.38 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.07 2isa h VAL 354 Cb 0.62 0.87 0.00 0.00 -2.01 0.00 0.00 31.29 30.78 2isa h VAL 354 CO -0.90 0.00 -0.61 0.59 -1.01 0.00 0.00 177.57 175.64 2isa n ASN 355 N -4.11 0.64 -4.78 3.17 3.02 0.13 -4.95 115.26 108.39 2isa n ASN 355 Ca 0.02 -0.45 -0.37 0.00 -0.03 0.00 0.00 54.58 53.74 2isa n ASN 355 Cb 0.30 0.42 -0.05 0.00 -0.61 0.00 0.00 39.78 39.84 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 -2.98 3.20 0.68 5.41 0.00 -0.69 -4.85 121.76 122.53 2isa s ALA 356 Ca 0.11 0.66 -0.13 0.00 0.00 0.00 0.00 51.96 52.60 2isa s ALA 356 Cb 0.17 -3.24 0.01 0.00 0.00 0.00 0.00 23.12 20.06 2isa s ALA 356 CO 0.73 -0.03 1.08 -1.25 0.00 0.00 0.00 175.76 176.29 2isa s PRO 357 N -2.10 2.82 -0.35 0.00 0.04 -1.26 -4.97 135.00 129.18 2isa s PRO 357 Ca 0.52 1.16 0.06 0.00 0.04 0.00 0.00 61.00 62.78 2isa s PRO 357 Cb -0.22 -1.97 0.47 0.00 0.04 0.00 0.00 34.50 32.82 2isa s PRO 357 CO 0.28 -1.21 1.41 0.54 0.04 0.00 0.00 177.00 178.06 2isa n ARG 358 N -2.83 2.86 -4.24 4.56 1.74 -1.26 -4.99 116.66 112.50 2isa n ARG 358 Ca 0.09 -3.72 -0.17 0.00 -0.77 0.00 0.00 57.85 53.29 2isa n ARG 358 Cb 0.53 -2.12 -0.08 0.00 -1.02 0.00 0.00 32.46 29.77 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 -0.50 1.27 -3.92 0.00 -0.02 -1.26 -4.99 135.00 125.58 2isa n PRO 360 Ca 0.05 0.45 -0.14 0.00 -2.02 0.00 0.00 63.50 61.84 2isa n PRO 360 Cb 0.63 -2.01 -0.15 0.00 -0.02 0.00 0.00 33.50 31.96 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 0.00 0.10 -0.49 -1.45 0.11 -1.26 -4.92 120.40 112.49 2isa s VAL 361 Ca 0.75 0.02 0.06 0.00 -2.93 0.00 0.00 61.98 59.89 2isa s VAL 361 Cb -0.85 -0.14 0.19 0.00 -1.53 0.00 0.00 36.38 34.05 2isa s VAL 361 CO 0.50 0.07 0.67 1.57 -3.33 0.00 0.00 175.10 174.58 2isa n HIS 362 N 3.49 -3.17 0.45 1.54 -0.00 -1.26 -5.06 115.22 111.22 2isa n HIS 362 Ca -0.18 -1.82 0.11 0.00 -0.00 0.00 0.00 57.72 55.83 2isa n HIS 362 Cb 0.56 1.22 0.25 0.00 -0.00 0.00 0.00 29.99 32.02 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 2.75 3.10 0.00 0.26 3.41 -1.26 -4.97 113.62 116.92 2isa n SER 363 Ca 0.19 -1.94 0.00 0.00 -0.26 0.00 0.00 58.87 56.86 2isa n SER 363 Cb 0.55 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 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 1.25 0.00 -1.72 7.33 9.36 -1.26 -4.94 117.16 127.18 2isa n TYR 364 Ca 0.19 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.98 2isa n TYR 364 Cb 0.54 0.00 -0.02 0.00 -0.63 0.00 0.00 39.34 39.24 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 2.64 -4.27 2.98 -0.00 -1.26 -4.99 115.22 110.32 2isa n HIS 365 Ca 0.00 0.34 -0.27 0.00 -0.00 0.00 0.00 57.72 57.79 2isa n HIS 365 Cb 0.00 -2.54 -0.09 0.00 -0.00 0.00 0.00 29.99 27.35 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 -0.71 2.08 5.64 -0.41 1.81 -1.26 -4.99 118.95 121.12 2isa s ARG 366 Ca 0.64 -1.22 0.00 0.00 -1.72 0.00 0.00 55.73 53.43 2isa s ARG 366 Cb -0.54 -2.19 0.00 0.00 -0.45 0.00 0.00 34.95 31.77 2isa s ARG 366 CO 0.51 0.45 0.00 -0.25 -0.68 0.00 0.00 175.30 175.33 2isa n ASP 367 N 0.17 0.00 0.00 0.23 8.00 -1.26 -5.04 116.55 118.65 2isa n ASP 367 Ca -0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.39 2isa n ASP 367 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.65 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 -1.89 3.57 0.44 0.00 -1.26 -4.77 105.19 101.27 2isa n GLY 368 Ca 0.00 -1.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.15 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 -1.13 -0.33 -3.72 4.61 0.00 -1.26 -3.39 120.51 115.29 2isa n ALA 369 Ca 0.00 0.23 -0.23 0.00 0.00 0.00 0.00 53.44 53.44 2isa n ALA 369 Cb 0.00 -1.99 0.03 0.00 0.00 0.00 0.00 19.45 17.49 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 0.30 -3.99 -2.80 0.00 2.81 -1.26 -4.53 117.12 107.65 2isa n MET 370 Ca 0.10 0.57 -0.43 0.00 -1.81 0.00 0.00 57.70 56.13 2isa n MET 370 Cb 0.38 -4.95 -0.04 0.00 -0.71 0.00 0.00 33.22 27.90 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 -6.00 3.54 0.00 0.03 6.06 -1.22 -4.87 118.95 116.50 2isa s ARG 371 Ca 0.09 0.18 0.02 0.00 -2.50 0.00 0.00 55.73 53.52 2isa s ARG 371 Cb -0.03 -3.93 -0.00 0.00 0.06 0.00 0.00 34.95 31.05 2isa s ARG 371 CO 0.83 -1.24 0.33 1.33 -2.50 0.00 0.00 175.30 174.05 2isa n VAL 372 N 6.46 0.00 0.49 7.11 0.24 -1.26 -4.73 118.33 126.64 2isa n VAL 372 Ca 0.07 -0.47 0.10 0.00 -2.04 0.00 0.00 64.34 61.99 2isa n VAL 372 Cb 0.49 1.03 0.27 0.00 -1.47 0.00 0.00 33.84 34.15 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 -0.47 2.82 0.00 -1.34 5.75 -1.26 -4.93 116.55 117.13 2isa n ASP 373 Ca 0.01 -1.93 0.00 0.00 -0.01 0.00 0.00 54.79 52.86 2isa n ASP 373 Cb 0.05 -0.27 0.00 0.00 -1.03 0.00 0.00 41.12 39.87 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 1.36 2.59 2.41 6.12 0.00 -1.26 -4.61 105.19 111.80 2isa n GLY 374 Ca 0.18 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 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 -5.93 -1.58 1.61 5.15 -1.26 -1.06 115.26 112.18 2isa n ASN 375 Ca 0.00 -0.01 -0.21 0.00 -0.60 0.00 0.00 54.58 53.77 2isa n ASN 375 Cb 0.00 -4.95 -0.09 0.00 -0.53 0.00 0.00 39.78 34.22 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 -3.97 0.00 0.00 1.20 3.01 -1.26 -4.81 117.46 111.62 2isa n PHE 376 Ca -0.25 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.21 2isa n PHE 376 Cb 0.69 -3.47 0.00 0.00 -0.01 0.00 0.00 39.48 36.69 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 -0.37 3.36 0.15 1.37 0.00 -0.23 -1.73 105.19 107.75 2isa n GLY 377 Ca -0.21 0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.03 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 4.83 0.64 -4.63 1.61 7.64 -1.26 -4.94 113.62 117.51 2isa n SER 378 Ca 0.00 -0.66 -0.50 0.00 1.01 0.00 0.00 58.87 58.72 2isa n SER 378 Cb 0.00 -0.01 -0.05 0.00 -1.01 0.00 0.00 64.21 63.13 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 -0.87 0.04 -1.42 0.44 -1.04 -0.71 -4.92 114.28 105.81 2isa n THR 379 Ca 0.14 -0.01 -0.36 0.00 -2.04 0.00 0.00 64.05 61.78 2isa n THR 379 Cb 0.30 -1.14 0.08 0.00 -1.82 0.00 0.00 70.33 67.74 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 3.17 3.31 -0.64 -4.42 -0.00 -1.26 -4.97 117.00 112.19 2isa n LEU 380 Ca 0.18 0.69 0.06 0.00 -0.00 0.00 0.00 56.01 56.95 2isa n LEU 380 Cb 0.23 -1.38 0.15 0.00 -0.00 0.00 0.00 43.42 42.41 2isa n LEU 380 CO 0.64 -2.10 0.62 0.61 -0.00 0.00 0.00 177.39 177.15 2isa n GLY 381 N 1.20 2.50 3.51 1.47 0.00 -1.26 -5.00 105.19 107.60 2isa n GLY 381 Ca 0.13 -0.38 -0.29 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.00 2.58 -0.08 1.61 1.13 -1.26 -5.08 117.35 115.25 2isa s TYR 382 Ca 0.23 -0.24 -0.05 0.00 -1.41 0.00 0.00 57.07 55.60 2isa s TYR 382 Cb 0.12 -1.37 0.03 0.00 -1.10 0.00 0.00 41.96 39.65 2isa s TYR 382 CO 0.16 0.39 0.19 -2.00 -2.51 0.00 0.00 175.55 171.78 2isa s GLU 383 N -2.14 0.17 0.60 -3.49 -6.30 -1.26 -4.36 118.70 101.92 2isa s GLU 383 Ca 0.19 0.36 -0.19 0.00 -2.50 0.00 0.00 54.97 52.83 2isa s GLU 383 Cb -0.11 -0.05 -0.03 0.00 0.00 0.00 0.00 34.13 33.95 2isa s GLU 383 CO 0.11 -0.11 1.23 -1.25 0.02 0.00 0.00 175.26 175.26 2isa s PRO 384 N 0.75 2.89 0.13 4.30 0.04 -1.26 -5.19 135.00 136.65 2isa s PRO 384 Ca -0.05 1.89 -0.11 0.00 0.04 0.00 0.00 61.00 62.76 2isa s PRO 384 Cb -0.07 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.56 2isa s PRO 384 CO -0.04 -1.29 0.29 0.54 0.04 0.00 0.00 177.00 176.54 2isa s ASN 385 N -1.53 -0.01 0.00 6.66 2.20 -1.26 -5.05 114.94 115.94 2isa s ASN 385 Ca 0.79 -0.64 0.07 0.00 -0.94 0.00 0.00 52.86 52.14 2isa s ASN 385 Cb -0.32 0.42 0.27 0.00 -2.00 0.00 0.00 41.25 39.61 2isa s ASN 385 CO 0.35 -0.83 1.20 -0.90 -2.94 0.00 0.00 177.10 173.98 2isa n ASP 386 N -0.17 0.90 -0.48 3.54 5.68 -1.26 -3.29 116.55 121.48 2isa n ASP 386 Ca -0.12 -1.94 0.07 0.00 -0.50 0.00 0.00 54.79 52.30 2isa n ASP 386 Cb 0.63 -0.11 0.04 0.00 -1.14 0.00 0.00 41.12 40.54 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 -0.03 1.31 -1.56 0.11 6.02 -1.26 -4.97 117.38 116.99 2isa n GLN 387 Ca 0.07 -1.13 -0.14 0.00 -0.01 0.00 0.00 57.00 55.79 2isa n GLN 387 Cb 0.15 -1.25 -0.05 0.00 1.02 0.00 0.00 30.24 30.11 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 0.90 1.21 3.81 1.08 0.00 -1.21 -4.99 105.19 105.98 2isa n GLY 388 Ca 0.07 -0.33 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 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 -3.47 3.73 -1.44 1.61 2.00 -1.26 -3.82 119.66 117.00 2isa s GLN 389 Ca 0.00 1.24 -0.05 0.00 -2.00 0.00 0.00 55.36 54.55 2isa s GLN 389 Cb 0.00 -2.09 0.04 0.00 0.80 0.00 0.00 33.01 31.76 2isa s GLN 389 CO 0.00 -0.48 0.64 0.91 -0.50 0.00 0.00 175.29 175.86 2isa n TRP 390 N -1.31 -1.84 -2.39 1.67 7.02 -1.26 -4.78 117.44 114.55 2isa n TRP 390 Ca 0.09 0.81 -0.42 0.00 -1.02 0.00 0.00 57.50 56.95 2isa n TRP 390 Cb 0.53 -3.85 -0.03 0.00 -2.42 0.00 0.00 31.31 25.55 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 -3.68 3.50 1.04 6.99 0.00 -1.25 -5.01 121.76 123.34 2isa s ALA 391 Ca 0.21 0.74 -0.12 0.00 0.00 0.00 0.00 51.96 52.79 2isa s ALA 391 Cb -0.11 -3.52 0.21 0.00 0.00 0.00 0.00 23.12 19.70 2isa s ALA 391 CO 0.86 -0.73 1.07 -1.83 0.00 0.00 0.00 175.76 175.13 2isa s GLU 392 N 2.01 0.09 -0.65 0.00 -1.05 -1.26 -5.00 118.70 112.84 2isa s GLU 392 Ca 0.58 0.79 0.05 0.00 -0.15 0.00 0.00 54.97 56.25 2isa s GLU 392 Cb -0.27 -1.68 0.19 0.00 -0.44 0.00 0.00 34.13 31.93 2isa s GLU 392 CO 0.25 -3.03 0.54 1.04 0.95 0.00 0.00 175.26 175.00 2isa n GLN 393 N -4.43 1.77 0.29 -4.83 6.02 -1.26 -4.96 117.38 109.99 2isa n GLN 393 Ca 0.05 -4.35 0.15 0.00 -0.01 0.00 0.00 57.00 52.85 2isa n GLN 393 Cb 0.55 -2.18 0.90 0.00 1.02 0.00 0.00 30.24 30.53 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 5.09 0.00 0.00 -1.09 0.13 -2.01 -1.45 132.00 132.66 2isa h PRO 394 Ca 0.17 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.30 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 0.70 0.03 -0.01 -0.44 -0.23 0.00 0.00 178.00 178.05 2isa h ASP 395 N 0.00 0.00 -0.24 1.44 3.32 -2.04 -2.34 116.42 116.55 2isa h ASP 395 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2isa h ASP 395 Cb 0.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.63 2isa h ASP 395 CO 0.00 0.01 0.00 0.49 -1.72 0.00 0.00 179.24 178.02 2isa n PHE 396 N -3.31 0.31 -1.70 4.55 3.72 -0.55 -4.97 117.46 115.52 2isa n PHE 396 Ca -0.03 -0.16 -0.43 0.00 -0.05 0.00 0.00 57.45 56.79 2isa n PHE 396 Cb 0.09 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.62 2isa n PHE 396 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2isa n SER 397 N 0.53 3.02 -4.88 4.37 2.88 -0.88 -4.99 113.62 113.66 2isa n SER 397 Ca 0.16 1.18 -0.30 0.00 -1.33 0.00 0.00 58.87 58.58 2isa n SER 397 Cb 0.36 -1.50 -0.03 0.00 -0.75 0.00 0.00 64.21 62.30 2isa n SER 397 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2isa s GLU 398 N -1.25 3.76 0.66 -1.46 2.02 -1.26 -5.07 118.70 116.09 2isa s GLU 398 Ca 0.60 0.46 -0.14 0.00 0.02 0.00 0.00 54.97 55.92 2isa s GLU 398 Cb -0.57 -2.38 -0.01 0.00 0.10 0.00 0.00 34.13 31.27 2isa s GLU 398 CO 0.57 -0.06 1.08 -1.25 0.02 0.00 0.00 175.26 175.61 2isa s PRO 399 N -3.95 2.96 0.78 0.39 0.04 -1.26 -5.01 135.00 128.95 2isa s PRO 399 Ca 0.51 1.19 -0.14 0.00 0.04 0.00 0.00 61.00 62.61 2isa s PRO 399 Cb -0.10 -1.98 0.07 0.00 0.04 0.00 0.00 34.50 32.52 2isa s PRO 399 CO 0.33 -1.10 1.20 -2.14 0.04 0.00 0.00 177.00 175.33 2isa s PRO 400 N -4.40 1.81 -0.20 0.56 0.02 -1.26 -5.02 135.00 126.52 2isa s PRO 400 Ca 0.63 1.74 -0.04 0.00 0.02 0.00 0.00 61.00 63.34 2isa s PRO 400 Cb -0.17 -1.80 -0.02 0.00 0.02 0.00 0.00 34.50 32.53 2isa s PRO 400 CO 0.44 -2.08 -0.02 -1.17 -0.33 0.00 0.00 177.00 173.84 2isa s LEU 401 N -5.54 3.12 0.36 -5.54 2.96 -1.26 -5.09 118.68 107.69 2isa s LEU 401 Ca 0.73 -0.25 -0.27 0.00 -0.22 0.00 0.00 54.13 54.11 2isa s LEU 401 Cb -0.28 -1.78 -0.10 0.00 0.50 0.00 0.00 46.19 44.53 2isa s LEU 401 CO 0.49 0.06 1.28 0.20 -1.32 0.00 0.00 176.35 177.06 2isa s ASN 402 N 1.02 6.60 0.08 3.68 0.02 -1.26 -5.03 114.94 120.05 2isa s ASN 402 Ca 0.01 2.62 0.08 0.00 -1.02 0.00 0.00 52.86 54.55 2isa s ASN 402 Cb -0.14 -2.64 -0.03 0.00 0.02 0.00 0.00 41.25 38.45 2isa s ASN 402 CO 0.01 -0.64 -0.21 -0.76 0.02 0.00 0.00 177.10 175.52 2isa s LEU 403 N -2.08 2.24 -0.09 0.60 1.02 -1.26 -5.14 118.68 113.97 2isa s LEU 403 Ca 0.52 -0.61 -0.04 0.00 0.02 0.00 0.00 54.13 54.02 2isa s LEU 403 Cb -0.38 -0.91 0.05 0.00 0.02 0.00 0.00 46.19 44.97 2isa s LEU 403 CO 0.50 0.10 0.20 -0.62 0.02 0.00 0.00 176.35 176.54 2isa s ASP 404 N -1.59 0.17 0.00 2.29 -1.08 -1.26 -5.15 116.67 110.05 2isa s ASP 404 Ca 0.07 0.43 0.00 0.00 -0.52 0.00 0.00 52.55 52.53 2isa s ASP 404 Cb -0.09 0.38 0.00 0.00 -1.46 0.00 0.00 42.92 41.74 2isa s ASP 404 CO 0.03 -0.20 0.00 0.61 0.52 0.00 0.00 175.17 176.13 2isa n GLY 405 N 4.75 2.74 3.78 2.66 0.00 -1.26 -5.08 105.19 112.77 2isa n GLY 405 Ca -0.16 -1.98 -0.31 0.00 0.00 0.00 0.00 46.02 43.57 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 -2.80 2.34 -0.29 4.61 0.00 -1.26 -4.98 121.76 119.37 2isa s ALA 406 Ca 0.00 0.22 -0.29 0.00 0.00 0.00 0.00 51.96 51.89 2isa s ALA 406 Cb 0.00 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.87 2isa s ALA 406 CO 0.00 -1.66 1.31 0.00 0.00 0.00 0.00 175.76 175.40 2isa s ALA 407 N -2.93 3.37 0.21 0.00 0.00 -1.26 -4.96 121.76 116.19 2isa s ALA 407 Ca 0.60 0.13 -0.23 0.00 0.00 0.00 0.00 51.96 52.46 2isa s ALA 407 Cb -0.16 -3.77 0.04 0.00 0.00 0.00 0.00 23.12 19.23 2isa s ALA 407 CO 0.56 -1.75 0.78 0.00 0.00 0.00 0.00 175.76 175.35 2isa s ALA 408 N 4.35 -1.42 -1.18 0.00 0.00 -1.26 -5.07 121.76 117.18 2isa s ALA 408 Ca 0.56 -0.01 -0.14 0.00 0.00 0.00 0.00 51.96 52.37 2isa s ALA 408 Cb -0.17 0.77 0.17 0.00 0.00 0.00 0.00 23.12 23.89 2isa s ALA 408 CO 0.23 -0.99 1.40 -1.01 0.00 0.00 0.00 175.76 175.40 2isa s HIS 409 N -3.67 3.48 0.11 0.00 3.76 -1.26 -5.00 115.29 112.71 2isa s HIS 409 Ca 0.10 -2.09 -0.31 0.00 -0.15 0.00 0.00 55.06 52.61 2isa s HIS 409 Cb -0.04 -4.30 -0.08 0.00 1.11 0.00 0.00 32.58 29.27 2isa s HIS 409 CO 0.02 -1.40 1.38 -1.58 -0.85 0.00 0.00 174.74 172.31 2isa s TRP 410 N 1.62 3.26 -0.27 1.40 0.52 -1.26 -4.94 118.94 119.27 2isa s TRP 410 Ca 0.42 0.98 -0.29 0.00 0.02 0.00 0.00 56.10 57.22 2isa s TRP 410 Cb -0.03 -3.66 0.00 0.00 -1.15 0.00 0.00 33.47 28.63 2isa s TRP 410 CO -0.01 -2.31 1.25 0.34 0.02 0.00 0.00 176.95 176.25 2isa s ASP 411 N 1.10 6.78 0.59 2.95 2.15 -1.26 -4.90 116.67 124.08 2isa s ASP 411 Ca 0.64 1.29 0.37 0.00 0.43 0.00 0.00 52.55 55.28 2isa s ASP 411 Cb -0.36 -2.54 1.71 0.00 -0.30 0.00 0.00 42.92 41.42 2isa s ASP 411 CO 0.30 -0.98 2.11 1.12 -0.17 0.00 0.00 175.17 177.55 2isa h HIS 412 N 8.85 0.00 0.00 -5.34 2.07 -1.97 -3.01 115.15 115.75 2isa h HIS 412 Ca -0.25 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.27 2isa h HIS 412 Cb 1.09 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.07 2isa h HIS 412 CO 0.85 0.00 0.00 0.54 -3.07 0.00 0.00 177.93 176.25 2isa n ARG 413 N -3.08 0.59 -0.16 5.12 1.74 -1.26 -1.96 116.66 117.64 2isa n ARG 413 Ca -0.01 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 57.16 2isa n ARG 413 Cb 0.23 -1.32 0.40 0.00 -1.02 0.00 0.00 32.46 30.75 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 0.62 -5.29 5.56 4.81 -1.95 -3.35 114.58 114.99 2isa h GLU 414 Ca 0.00 -0.04 -0.65 0.00 -0.13 0.00 0.00 59.36 58.54 2isa h GLU 414 Cb 0.00 -0.14 -0.16 0.00 0.63 0.00 0.00 28.75 29.08 2isa h GLU 414 CO 0.00 0.41 0.28 0.34 -0.73 0.00 0.00 179.01 179.31 2isa s ASP 415 N -6.16 6.25 -0.12 1.04 -1.08 -0.83 -4.91 116.67 110.86 2isa s ASP 415 Ca -0.09 -0.78 0.18 0.00 -0.52 0.00 0.00 52.55 51.34 2isa s ASP 415 Cb 0.20 -2.35 0.70 0.00 -1.46 0.00 0.00 42.92 40.01 2isa s ASP 415 CO 0.77 -1.09 1.62 -0.62 0.52 0.00 0.00 175.17 176.37 2isa n GLU 416 N 6.79 3.72 -2.61 4.34 1.02 -1.26 -4.77 120.64 127.87 2isa n GLU 416 Ca -0.04 -2.87 -0.43 0.00 -0.02 0.00 0.00 57.16 53.80 2isa n GLU 416 Cb 0.46 -1.88 -0.00 0.00 -0.02 0.00 0.00 31.44 29.99 2isa n GLU 416 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2isa s ASP 417 N -0.96 6.82 -0.00 1.62 -1.08 -1.26 -4.65 116.67 117.16 2isa s ASP 417 Ca 0.50 -2.39 0.21 0.00 -0.52 0.00 0.00 52.55 50.35 2isa s ASP 417 Cb 0.33 -2.56 -0.25 0.00 -1.46 0.00 0.00 42.92 38.98 2isa s ASP 417 CO 0.23 -1.17 0.56 -1.22 0.52 0.00 0.00 175.17 174.10 2isa n TYR 418 N 8.18 0.26 0.01 -5.34 4.01 -1.26 -4.72 117.16 118.30 2isa n TYR 418 Ca 0.46 0.08 0.03 0.00 -0.16 0.00 0.00 57.90 58.30 2isa n TYR 418 Cb 0.46 -0.69 -0.04 0.00 -0.31 0.00 0.00 39.34 38.76 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 -2.45 0.00 -0.05 -0.72 3.72 -1.26 -4.61 117.46 112.08 2isa n PHE 419 Ca -0.07 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.22 2isa n PHE 419 Cb 0.66 -0.12 -0.05 0.00 -0.94 0.00 0.00 39.48 39.03 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 0.27 -0.33 4.37 4.64 -1.88 -1.45 113.55 119.17 2isa h SER 420 Ca 0.00 -0.20 -0.13 0.00 -0.47 0.00 0.00 61.79 60.99 2isa h SER 420 Cb 0.25 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 2isa h SER 420 CO 0.00 0.40 -0.31 1.56 -0.87 0.00 0.00 176.83 177.61 2isa h GLN 421 N 0.13 0.79 -0.97 4.77 4.20 -1.91 0.36 115.11 122.48 2isa h GLN 421 Ca 0.06 -0.41 0.09 0.00 0.06 0.00 0.00 58.65 58.45 2isa h GLN 421 Cb 0.23 0.01 -0.07 0.00 0.30 0.00 0.00 27.48 27.94 2isa h GLN 421 CO -0.00 1.04 0.62 -1.35 -0.67 0.00 0.00 178.83 178.47 2isa h PRO 422 N 0.57 0.99 -0.41 1.46 0.11 -1.82 -0.75 132.00 132.15 2isa h PRO 422 Ca 0.06 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 2isa h PRO 422 Cb 0.88 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 2isa h PRO 422 CO 0.08 0.66 0.23 0.78 -0.21 0.00 0.00 178.00 179.53 2isa h GLY 423 N 1.02 0.61 0.58 -0.55 0.00 -0.73 -0.19 103.07 103.80 2isa h GLY 423 Ca 0.45 -0.27 0.06 0.00 0.00 0.00 0.00 47.33 47.57 2isa h GLY 423 CO -0.21 0.26 0.11 -0.55 0.00 0.00 0.00 176.54 176.15 2isa h ASP 424 N 0.53 0.07 -0.27 0.19 3.32 -0.59 -1.05 116.42 118.63 2isa h ASP 424 Ca 0.14 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 2isa h ASP 424 Cb 0.04 0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 2isa h ASP 424 CO -0.02 0.08 0.13 0.25 -1.72 0.00 0.00 179.24 177.95 2isa h LEU 425 N 0.25 0.35 -0.82 1.55 5.85 -0.95 -2.02 115.31 119.52 2isa h LEU 425 Ca 0.19 -0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.84 2isa h LEU 425 Cb 0.20 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.08 2isa h LEU 425 CO -0.22 0.37 0.51 0.15 -0.34 0.00 0.00 178.44 178.91 2isa h PHE 426 N 0.30 0.94 -0.15 1.25 3.57 -0.89 -2.44 116.94 119.52 2isa h PHE 426 Ca 0.09 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.56 2isa h PHE 426 Cb 0.12 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.54 2isa h PHE 426 CO -0.02 0.49 -0.18 0.78 -2.23 0.00 0.00 178.31 177.14 2isa h GLY 427 N 0.94 0.28 1.82 2.40 0.00 -0.82 -2.47 103.07 105.21 2isa h GLY 427 Ca 0.35 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.49 2isa h GLY 427 CO -0.16 0.17 0.00 1.04 0.00 0.00 0.00 176.54 177.59 2isa n LEU 428 N -4.22 0.00 -4.79 3.11 4.77 -0.79 -4.84 117.00 110.24 2isa n LEU 428 Ca -0.01 0.41 -0.37 0.00 -0.03 0.00 0.00 56.01 56.02 2isa n LEU 428 Cb 0.31 -0.41 -0.06 0.00 -2.33 0.00 0.00 43.42 40.93 2isa n LEU 428 CO 0.39 -0.06 0.60 -0.04 -1.33 0.00 0.00 177.39 176.95 2isa s MET 429 N -2.82 4.50 0.87 3.23 -1.94 -0.93 -5.07 119.30 117.14 2isa s MET 429 Ca 0.17 1.22 -0.11 0.00 -1.71 0.00 0.00 55.69 55.26 2isa s MET 429 Cb 0.17 -2.79 0.12 0.00 2.01 0.00 0.00 34.83 34.34 2isa s MET 429 CO 0.43 0.29 1.09 0.95 -0.01 0.00 0.00 175.02 177.77 2isa s THR 430 N -1.62 2.78 0.47 2.05 -4.23 -1.26 -4.77 115.64 109.05 2isa s THR 430 Ca 0.49 0.25 0.18 0.00 -1.18 0.00 0.00 61.69 61.43 2isa s THR 430 Cb -0.18 -2.70 0.34 0.00 1.34 0.00 0.00 72.50 71.31 2isa s THR 430 CO 0.23 -0.33 2.00 0.00 -0.54 0.00 0.00 174.62 175.97 2isa h ALA 431 N -1.49 2.17 -0.09 3.99 0.00 -1.97 -0.08 119.26 121.78 2isa h ALA 431 Ca -0.48 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.36 2isa h ALA 431 Cb 1.27 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2isa h ALA 431 CO 0.53 -0.30 -0.18 1.49 0.00 0.00 0.00 179.25 180.79 2isa h GLU 432 N 0.24 0.28 -0.18 0.00 4.57 -1.99 -2.09 114.58 115.42 2isa h GLU 432 Ca 0.25 -0.18 -0.12 0.00 -1.18 0.00 0.00 59.36 58.12 2isa h GLU 432 Cb 0.65 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.25 2isa h GLU 432 CO -0.05 0.77 -0.42 0.87 -1.18 0.00 0.00 179.01 179.00 2isa h LYS 433 N -0.17 0.42 -0.83 1.92 1.57 -1.79 -1.82 116.57 115.87 2isa h LYS 433 Ca 0.00 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.56 2isa h LYS 433 Cb 0.76 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.03 2isa h LYS 433 CO 0.04 0.77 0.48 1.96 -0.57 0.00 0.00 179.45 182.13 2isa h GLN 434 N 0.34 1.13 -0.15 3.15 4.20 -1.03 -1.26 115.11 121.50 2isa h GLN 434 Ca 0.03 -0.12 -0.12 0.00 0.06 0.00 0.00 58.65 58.50 2isa h GLN 434 Cb 0.89 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 2isa h GLN 434 CO 0.07 0.81 -0.45 0.00 -0.67 0.00 0.00 178.83 178.60 2isa h ALA 435 N 1.26 0.97 -0.55 3.87 0.00 -0.99 -0.55 119.26 123.26 2isa h ALA 435 Ca 0.29 -0.45 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 2isa h ALA 435 Cb -0.01 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2isa h ALA 435 CO -0.05 0.63 0.17 0.82 0.00 0.00 0.00 179.25 180.82 2isa h ILE 436 N 0.29 1.24 -0.18 0.00 2.04 -1.11 -1.67 117.51 118.11 2isa h ILE 436 Ca 0.02 -0.81 0.02 0.00 1.00 0.00 0.00 64.86 65.10 2isa h ILE 436 Cb 0.90 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 2isa h ILE 436 CO 0.07 0.30 0.04 0.25 0.00 0.00 0.00 178.15 178.81 2isa h LEU 437 N 0.76 0.02 -0.02 1.44 6.46 -0.83 -0.91 115.31 122.23 2isa h LEU 437 Ca 0.18 0.03 0.02 0.00 -0.12 0.00 0.00 57.88 57.98 2isa h LEU 437 Cb 0.29 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.22 2isa h LEU 437 CO -0.00 0.04 -0.10 -0.26 -0.62 0.00 0.00 178.44 177.49 2isa h PHE 438 N 0.12 -0.26 0.09 1.25 0.05 -1.05 -1.97 116.94 115.16 2isa h PHE 438 Ca 0.08 0.01 0.00 0.00 3.82 0.00 0.00 57.97 61.88 2isa h PHE 438 Cb 0.07 0.12 -0.01 0.00 2.00 0.00 0.00 35.95 38.13 2isa h PHE 438 CO -0.13 -0.16 -0.09 0.22 -0.18 0.00 0.00 178.31 177.97 2isa h ASP 439 N -0.17 -0.25 -0.38 2.17 3.58 -1.19 -0.81 116.42 119.38 2isa h ASP 439 Ca 0.05 0.03 0.05 0.00 0.42 0.00 0.00 57.03 57.57 2isa h ASP 439 Cb 0.23 0.09 -0.04 0.00 1.72 0.00 0.00 39.33 41.32 2isa h ASP 439 CO -0.12 -0.15 0.12 0.78 -2.88 0.00 0.00 179.24 177.00 2isa h ASN 440 N -0.21 0.11 -0.03 2.28 -0.26 -1.17 -1.72 115.58 114.60 2isa h ASN 440 Ca 0.01 0.05 -0.00 0.00 -0.56 0.00 0.00 56.30 55.79 2isa h ASN 440 Cb 0.20 0.04 -0.00 0.00 -1.06 0.00 0.00 38.32 37.50 2isa h ASN 440 CO -0.03 0.10 0.01 0.74 -1.06 0.00 0.00 177.43 177.19 2isa h THR 441 N 0.27 1.15 -0.41 2.81 2.02 -1.25 0.15 112.91 117.65 2isa h THR 441 Ca 0.18 -0.43 0.01 0.00 0.77 0.00 0.00 66.41 66.94 2isa h THR 441 Cb 0.17 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 2isa h THR 441 CO -0.19 0.12 0.26 0.00 0.37 0.00 0.00 175.52 176.07 2isa h ALA 442 N 0.83 0.51 -0.11 6.16 0.00 -1.03 -0.60 119.26 125.03 2isa h ALA 442 Ca 0.01 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 2isa h ALA 442 Cb 0.18 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2isa h ALA 442 CO -0.00 -0.06 -0.45 0.00 0.00 0.00 0.00 179.25 178.75 2isa h ARG 443 N 0.52 0.26 0.00 0.00 3.08 -1.27 -2.35 114.38 114.63 2isa h ARG 443 Ca 0.15 -0.13 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 2isa h ARG 443 Cb -0.03 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 2isa h ARG 443 CO -0.05 0.66 -0.17 -0.97 -1.07 0.00 0.00 179.97 178.37 2isa h ASN 444 N 0.22 0.00 -0.03 7.04 -0.73 -0.32 -2.44 115.58 119.32 2isa h ASN 444 Ca 0.02 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.19 2isa h ASN 444 Cb 0.88 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.47 2isa h ASN 444 CO 0.07 0.17 0.00 0.18 -0.37 0.00 0.00 177.43 177.48 2isa n LEU 445 N -3.86 1.18 -4.68 0.34 4.77 -0.29 -4.90 117.00 109.56 2isa n LEU 445 Ca -0.02 -0.42 -0.46 0.00 -0.03 0.00 0.00 56.01 55.08 2isa n LEU 445 Cb 0.27 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.30 2isa n LEU 445 CO 0.33 0.21 1.39 -3.20 -1.33 0.00 0.00 177.39 174.79 2isa n ASN 446 N -0.06 3.44 0.00 -1.43 4.05 -0.92 -1.89 115.26 118.45 2isa n ASN 446 Ca 0.19 1.01 0.00 0.00 0.45 0.00 0.00 54.58 56.23 2isa n ASN 446 Cb 0.29 -1.42 0.00 0.00 1.23 0.00 0.00 39.78 39.88 2isa n ASN 446 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2isa n GLY 447 N 4.05 2.83 3.72 8.20 0.00 -1.26 -4.96 105.19 117.76 2isa n GLY 447 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.06 2.97 0.12 1.61 1.01 -0.79 -4.92 120.40 118.33 2isa s VAL 448 Ca 0.00 0.71 -0.34 0.00 0.00 0.00 0.00 61.98 62.35 2isa s VAL 448 Cb 0.00 -3.45 -0.17 0.00 0.00 0.00 0.00 36.38 32.75 2isa s VAL 448 CO 0.00 0.06 1.00 -2.65 0.00 0.00 0.00 175.10 173.51 2isa n PRO 449 N 3.71 0.56 -0.31 2.72 -0.02 -1.26 -4.66 135.00 135.74 2isa n PRO 449 Ca 0.12 0.20 0.14 0.00 -2.02 0.00 0.00 63.50 61.93 2isa n PRO 449 Cb 0.41 -1.59 0.32 0.00 -0.02 0.00 0.00 33.50 32.61 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 2.78 0.44 0.00 -0.52 3.64 -1.97 -0.58 116.57 120.36 2isa h LYS 450 Ca -0.42 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 58.88 2isa h LYS 450 Cb 1.39 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.10 2isa h LYS 450 CO 0.66 0.29 -0.26 1.05 -2.27 0.00 0.00 179.45 178.92 2isa h GLU 451 N 0.45 0.00 0.01 1.90 9.09 -1.99 -0.91 114.58 123.14 2isa h GLU 451 Ca 0.57 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.88 2isa h GLU 451 Cb 1.07 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 28.18 2isa h GLU 451 CO -0.51 0.26 -0.41 0.82 0.05 0.00 0.00 179.01 179.22 2isa h ILE 452 N 0.00 1.52 -0.59 -1.06 2.04 -1.46 -2.59 117.51 115.37 2isa h ILE 452 Ca -0.00 -2.07 0.11 0.00 1.00 0.00 0.00 64.86 63.90 2isa h ILE 452 Cb 0.46 2.79 -0.09 0.00 -0.74 0.00 0.00 36.82 39.24 2isa h ILE 452 CO 0.03 0.58 0.09 1.56 0.00 0.00 0.00 178.15 180.41 2isa h GLN 453 N -0.38 0.20 -0.22 2.37 4.20 -1.07 -1.81 115.11 118.40 2isa h GLN 453 Ca -0.06 -0.01 -0.09 0.00 0.06 0.00 0.00 58.65 58.56 2isa h GLN 453 Cb 1.18 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.90 2isa h GLN 453 CO 0.08 0.13 -0.24 1.25 -0.67 0.00 0.00 178.83 179.39 2isa h LEU 454 N 0.21 0.41 -0.71 1.46 5.85 -1.22 -0.63 115.31 120.68 2isa h LEU 454 Ca 0.31 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 2isa h LEU 454 Cb 0.47 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 2isa h LEU 454 CO -0.43 0.65 0.43 0.03 -0.34 0.00 0.00 178.44 178.78 2isa h ARG 455 N 0.37 0.97 -0.20 1.25 2.47 -0.93 -1.02 114.38 117.29 2isa h ARG 455 Ca 0.06 -0.09 -0.07 0.00 -1.26 0.00 0.00 59.98 58.62 2isa h ARG 455 Cb 0.62 -0.20 -0.00 0.00 -1.65 0.00 0.00 29.97 28.73 2isa h ARG 455 CO 0.04 0.69 -0.14 1.25 0.56 0.00 0.00 179.97 182.37 2isa h HIS 456 N 0.97 0.54 -0.87 3.04 2.76 -0.74 -2.53 115.15 118.31 2isa h HIS 456 Ca 0.26 -0.15 0.01 0.00 -2.20 0.00 0.00 60.37 58.28 2isa h HIS 456 Cb -0.03 -0.12 -0.04 0.00 1.55 0.00 0.00 27.41 28.77 2isa h HIS 456 CO -0.01 0.78 0.57 0.28 -1.30 0.00 0.00 177.93 178.24 2isa h VAL 457 N 0.14 1.23 -0.31 5.26 2.07 -1.04 -1.45 116.25 122.15 2isa h VAL 457 Ca 0.04 -0.43 0.02 0.00 0.82 0.00 0.00 66.70 67.14 2isa h VAL 457 Cb 0.66 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 2isa h VAL 457 CO 0.04 0.22 0.16 0.74 0.02 0.00 0.00 177.57 178.76 2isa h THR 458 N 1.19 1.00 -0.48 2.57 2.02 -1.15 0.35 112.91 118.42 2isa h THR 458 Ca 0.32 -0.12 -0.00 0.00 0.77 0.00 0.00 66.41 67.38 2isa h THR 458 Cb -0.12 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 66.90 2isa h THR 458 CO -0.07 0.06 0.29 0.45 0.37 0.00 0.00 175.52 176.62 2isa h HIS 459 N 0.34 0.63 -0.68 3.16 3.86 -1.02 -1.28 115.15 120.16 2isa h HIS 459 Ca 0.13 -0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.31 2isa h HIS 459 Cb 0.03 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.26 2isa h HIS 459 CO -0.09 0.43 0.32 0.00 0.86 0.00 0.00 177.93 179.46 2isa h TYR 461 N 0.96 0.99 0.00 0.00 3.20 -0.58 -0.94 116.97 120.60 2isa h TYR 461 Ca 0.24 -0.18 -0.10 0.00 3.14 0.00 0.00 58.73 61.83 2isa h TYR 461 Cb 0.11 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 2isa h TYR 461 CO 0.01 0.92 -0.47 0.87 -1.64 0.00 0.00 178.16 177.85 2isa h LYS 462 N 0.82 0.00 -0.09 1.82 1.57 -0.73 -2.13 116.57 117.82 2isa h LYS 462 Ca 0.14 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 2isa h LYS 462 Cb 0.58 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.89 2isa h LYS 462 CO 0.04 0.47 -0.02 0.00 -0.57 0.00 0.00 179.45 179.36 2isa h ALA 463 N 1.53 0.13 -1.70 3.86 0.00 -1.00 -3.46 119.26 118.62 2isa h ALA 463 Ca -0.00 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 54.78 2isa h ALA 463 Cb 0.87 -0.03 -0.22 0.00 0.00 0.00 0.00 17.79 18.41 2isa h ALA 463 CO 0.06 -0.14 0.07 0.34 0.00 0.00 0.00 179.25 179.59 2isa s ASP 464 N -5.77 -0.86 0.44 0.00 -1.08 -0.38 -4.25 116.67 104.77 2isa s ASP 464 Ca -0.15 1.26 0.23 0.00 -0.52 0.00 0.00 52.55 53.37 2isa s ASP 464 Cb 0.04 1.74 1.23 0.00 -1.46 0.00 0.00 42.92 44.48 2isa s ASP 464 CO 0.71 -0.18 1.78 -0.65 0.52 0.00 0.00 175.17 177.34 2isa h PRO 465 N 7.30 0.27 -0.02 4.34 0.11 -1.63 0.14 132.00 142.52 2isa h PRO 465 Ca -0.22 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 65.73 2isa h PRO 465 Cb 1.15 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2isa h PRO 465 CO 0.13 0.18 -0.66 0.00 -0.21 0.00 0.00 178.00 177.44 2isa h ALA 466 N 1.57 0.86 0.53 -0.75 0.00 -1.90 -1.12 119.26 118.46 2isa h ALA 466 Ca 0.58 -0.59 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2isa h ALA 466 Cb 1.70 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 19.40 2isa h ALA 466 CO -0.22 0.80 -0.25 -0.92 0.00 0.00 0.00 179.25 178.66 2isa h TYR 467 N 0.06 -0.65 -0.46 0.00 3.20 -0.97 -1.51 116.97 116.63 2isa h TYR 467 Ca -0.01 -0.02 0.09 0.00 3.14 0.00 0.00 58.73 61.93 2isa h TYR 467 Cb 1.17 0.22 -0.07 0.00 1.54 0.00 0.00 36.73 39.59 2isa h TYR 467 CO 0.01 -0.33 0.01 0.78 -1.64 0.00 0.00 178.16 176.98 2isa h GLY 468 N -0.92 0.48 1.64 1.82 0.00 -1.41 -2.90 103.07 101.78 2isa h GLY 468 Ca -0.07 0.05 -0.09 0.00 0.00 0.00 0.00 47.33 47.22 2isa h GLY 468 CO 0.12 -0.12 -0.25 -2.09 0.00 0.00 0.00 176.54 174.20 2isa h GLU 469 N 0.12 0.43 -0.93 4.80 4.81 -1.21 -0.49 114.58 122.11 2isa h GLU 469 Ca 0.23 -0.15 0.06 0.00 -0.13 0.00 0.00 59.36 59.37 2isa h GLU 469 Cb 0.34 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.63 2isa h GLU 469 CO -0.38 0.65 0.59 0.78 -0.73 0.00 0.00 179.01 179.92 2isa h GLY 470 N 1.01 1.40 0.73 1.92 0.00 -1.06 -0.37 103.07 106.70 2isa h GLY 470 Ca 0.06 -0.43 -0.20 0.00 0.00 0.00 0.00 47.33 46.76 2isa h GLY 470 CO 0.05 0.30 -0.91 -2.22 0.00 0.00 0.00 176.54 173.75 2isa h ILE 471 N 1.07 1.46 -0.61 2.60 2.04 -1.44 -3.29 117.51 119.33 2isa h ILE 471 Ca 0.40 -2.55 0.10 0.00 1.00 0.00 0.00 64.86 63.81 2isa h ILE 471 Cb 0.17 3.16 -0.07 0.00 -0.74 0.00 0.00 36.82 39.34 2isa h ILE 471 CO -0.17 0.73 0.22 1.23 0.00 0.00 0.00 178.15 180.15 2isa h GLY 472 N -0.30 0.85 0.62 5.37 0.00 -0.89 -2.00 103.07 106.72 2isa h GLY 472 Ca -0.16 -0.11 0.03 0.00 0.00 0.00 0.00 47.33 47.09 2isa h GLY 472 CO 0.16 -0.03 -0.09 0.50 0.00 0.00 0.00 176.54 177.08 2isa h LYS 473 N 0.39 -0.09 -0.27 4.80 1.57 -1.21 -0.52 116.57 121.24 2isa h LYS 473 Ca 0.31 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.10 2isa h LYS 473 Cb 0.40 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 2isa h LYS 473 CO -0.32 -0.06 0.17 -0.07 -0.57 0.00 0.00 179.45 178.60 2isa h LEU 474 N -0.10 0.32 -0.36 2.94 3.38 -1.47 -0.68 115.31 119.34 2isa h LEU 474 Ca 0.08 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2isa h LEU 474 Cb 0.21 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2isa h LEU 474 CO -0.18 0.24 -0.12 0.18 0.09 0.00 0.00 178.44 178.65 2isa n LEU 475 N -4.48 0.69 -0.33 1.67 4.77 -0.81 -4.93 117.00 113.56 2isa n LEU 475 Ca 0.01 -0.11 -0.04 0.00 -0.03 0.00 0.00 56.01 55.83 2isa n LEU 475 Cb 0.08 -0.13 -0.02 0.00 -2.33 0.00 0.00 43.42 41.02 2isa n LEU 475 CO 0.35 0.12 -0.04 0.61 -1.33 0.00 0.00 177.39 177.10 2isa n GLY 476 N 1.26 0.72 3.81 -0.72 0.00 -0.26 -5.03 105.19 104.97 2isa n GLY 476 Ca 0.15 -0.79 -0.33 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.14 3.19 0.25 1.61 2.99 -0.29 -5.01 117.98 118.58 2isa s PHE 477 Ca 0.00 1.56 -0.30 0.00 0.00 0.00 0.00 56.93 58.19 2isa s PHE 477 Cb 0.00 -2.93 -0.09 0.00 0.00 0.00 0.00 43.02 40.00 2isa s PHE 477 CO 0.00 -0.53 0.94 -0.51 -0.00 0.00 0.00 175.22 175.12 2isa s ASP 478 N -2.38 7.62 0.52 1.36 1.01 -1.26 -4.53 116.67 119.01 2isa s ASP 478 Ca 0.63 1.94 0.25 0.00 0.71 0.00 0.00 52.55 56.09 2isa s ASP 478 Cb -0.13 -2.61 1.38 0.00 1.01 0.00 0.00 42.92 42.58 2isa s ASP 478 CO 0.22 0.14 1.97 -0.29 0.21 0.00 0.00 175.17 177.42 2isa h ILE 479 N 3.10 0.71 0.00 0.77 2.10 -1.96 0.11 117.51 122.34 2isa h ILE 479 Ca -0.45 -0.01 -0.00 0.00 1.08 0.00 0.00 64.86 65.47 2isa h ILE 479 Cb 1.20 0.67 -0.00 0.00 -1.09 0.00 0.00 36.82 37.60 2isa h ILE 479 CO 0.68 0.01 -0.01 0.77 -1.08 0.00 0.00 178.15 178.52 2isa h SER 480 N 0.04 0.00 1.05 2.19 4.64 -1.98 -2.00 113.55 117.48 2isa h SER 480 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 2isa h SER 480 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 2isa h SER 480 CO -0.01 0.01 0.00 -0.62 -0.87 0.00 0.00 176.83 175.33 2isa n GLU 481 N -3.11 0.19 -0.12 4.77 1.02 0.03 -3.59 120.64 119.83 2isa n GLU 481 Ca -0.01 0.29 0.00 0.00 -0.02 0.00 0.00 57.16 57.42 2isa n GLU 481 Cb 0.20 -1.79 0.00 0.00 -0.02 0.00 0.00 31.44 29.83 2isa n GLU 481 CO 0.00 0.00 0.00 2.48 1.18 0.00 0.00 177.13 180.79 2isa n TYR 482 N -2.14 0.00 0.21 -0.32 0.18 -1.10 -4.91 117.16 109.08 2isa n TYR 482 Ca 0.04 0.00 0.07 0.00 1.88 0.00 0.00 57.90 59.89 2isa n TYR 482 Cb 0.32 0.01 0.46 0.00 -0.38 0.00 0.00 39.34 39.75 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 0.00 0.00 9.48 -0.73 -1.42 -3.43 115.58 119.48 2isa h ASN 483 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2isa h ASN 483 Cb 1.09 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.68 2isa h ASN 483 CO 0.00 0.29 0.00 -1.54 -0.37 0.00 0.00 177.43 175.81