#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2isa n LYS 4 N 0.00 -1.54 -3.45 1.43 5.02 -1.26 -4.97 118.16 113.39 2isa n LYS 4 Ca 0.00 0.62 -0.38 0.00 -2.02 0.00 0.00 58.31 56.53 2isa n LYS 4 Cb 0.00 -4.87 -0.06 0.00 -0.02 0.00 0.00 35.03 30.08 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 -2.20 3.99 -0.00 1.97 1.02 -1.26 -5.06 119.74 118.20 2isa s LYS 5 Ca 0.00 0.47 -0.25 0.00 0.02 0.00 0.00 55.97 56.21 2isa s LYS 5 Cb 0.00 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 34.03 2isa s LYS 5 CO 0.00 0.65 0.78 -1.17 -0.92 0.00 0.00 175.35 174.69 2isa s LEU 6 N -0.98 4.39 0.30 3.17 2.96 -1.26 -5.04 118.68 122.21 2isa s LEU 6 Ca 0.25 1.39 0.02 0.00 -0.22 0.00 0.00 54.13 55.57 2isa s LEU 6 Cb -0.17 -3.24 -0.05 0.00 0.50 0.00 0.00 46.19 43.24 2isa s LEU 6 CO 0.14 -0.08 0.11 0.42 -1.32 0.00 0.00 176.35 175.62 2isa s THR 7 N 0.45 0.62 0.79 3.68 -4.23 -1.26 -1.53 115.64 114.16 2isa s THR 7 Ca 0.41 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.80 2isa s THR 7 Cb -0.20 -2.61 0.07 0.00 1.34 0.00 0.00 72.50 71.11 2isa s THR 7 CO 0.22 0.00 1.15 0.42 -0.54 0.00 0.00 174.62 175.87 2isa s THR 8 N -3.58 2.49 0.57 3.99 -4.23 0.22 -4.82 115.64 110.28 2isa s THR 8 Ca 0.36 0.16 0.27 0.00 -1.18 0.00 0.00 61.69 61.29 2isa s THR 8 Cb 0.07 -3.11 0.36 0.00 1.34 0.00 0.00 72.50 71.16 2isa s THR 8 CO 0.15 -0.21 2.08 0.00 -0.54 0.00 0.00 174.62 176.10 2isa h ALA 9 N -1.00 1.96 -0.21 3.99 0.00 -2.00 0.67 119.26 122.67 2isa h ALA 9 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2isa h ALA 9 Cb 1.30 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2isa h ALA 9 CO 0.64 -0.35 0.00 0.00 0.00 0.00 0.00 179.25 179.55 2isa n ALA 10 N -2.41 2.50 -0.68 0.00 0.00 -1.26 -4.94 120.51 113.72 2isa n ALA 10 Ca 0.03 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 52.88 2isa n ALA 10 Cb 0.36 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.76 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 1.17 0.65 3.72 0.00 0.00 0.23 -5.05 105.19 105.91 2isa n GLY 11 Ca 0.16 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2isa n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2isa s PRO 13 N 0.45 3.21 -0.30 0.00 0.02 -1.26 -0.61 135.00 136.50 2isa s PRO 13 Ca 0.54 2.29 -0.10 0.00 0.02 0.00 0.00 61.00 63.75 2isa s PRO 13 Cb -0.29 -2.33 -0.02 0.00 0.02 0.00 0.00 34.50 31.88 2isa s PRO 13 CO 0.32 -1.15 0.17 0.08 -0.33 0.00 0.00 177.00 176.09 2isa s VAL 14 N -1.27 4.89 0.01 3.83 1.01 -0.58 -4.76 120.40 123.52 2isa s VAL 14 Ca 0.70 -0.19 -0.03 0.00 0.00 0.00 0.00 61.98 62.46 2isa s VAL 14 Cb -0.42 -3.43 -0.28 0.00 0.00 0.00 0.00 36.38 32.26 2isa s VAL 14 CO 0.50 0.13 0.90 0.00 0.00 0.00 0.00 175.10 176.63 2isa h ALA 15 N 8.37 0.26 -3.51 5.51 0.00 -1.93 -3.45 119.26 124.50 2isa h ALA 15 Ca -0.34 -1.08 -0.61 0.00 0.00 0.00 0.00 54.91 52.89 2isa h ALA 15 Cb 1.16 0.24 -0.39 0.00 0.00 0.00 0.00 17.79 18.80 2isa h ALA 15 CO 0.60 1.13 -0.77 -1.01 0.00 0.00 0.00 179.25 179.20 2isa s HIS 16 N -2.62 2.37 -0.29 0.00 3.76 -1.26 -4.95 115.29 112.30 2isa s HIS 16 Ca -0.08 -1.89 0.05 0.00 -0.15 0.00 0.00 55.06 52.99 2isa s HIS 16 Cb 0.07 -1.79 0.13 0.00 1.11 0.00 0.00 32.58 32.10 2isa s HIS 16 CO 0.86 -0.81 1.10 -1.71 -0.85 0.00 0.00 174.74 173.33 2isa n ASN 17 N 4.67 2.38 -0.02 1.40 5.15 -1.26 -4.71 115.26 122.86 2isa n ASN 17 Ca -0.07 -2.13 -0.02 0.00 -0.60 0.00 0.00 54.58 51.76 2isa n ASN 17 Cb 0.43 -0.12 -0.02 0.00 -0.53 0.00 0.00 39.78 39.54 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 -0.28 2.76 -4.10 1.20 1.13 -1.26 -5.03 117.38 111.80 2isa n GLN 18 Ca 0.06 0.00 -0.20 0.00 -1.94 0.00 0.00 57.00 54.92 2isa n GLN 18 Cb 0.36 -1.08 -0.16 0.00 0.11 0.00 0.00 30.24 29.47 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 -3.59 1.02 0.66 1.08 0.01 -1.26 -5.15 114.94 107.70 2isa s ASN 19 Ca -0.02 -0.12 -0.12 0.00 -0.71 0.00 0.00 52.86 51.88 2isa s ASN 19 Cb 0.01 -0.44 -0.01 0.00 0.41 0.00 0.00 41.25 41.22 2isa s ASN 19 CO 0.12 -0.07 1.06 0.68 -1.51 0.00 0.00 177.10 177.37 2isa s VAL 20 N 1.06 4.01 -0.03 1.60 -7.23 -1.26 -4.94 120.40 113.61 2isa s VAL 20 Ca -0.09 0.74 -0.30 0.00 -1.81 0.00 0.00 61.98 60.53 2isa s VAL 20 Cb -0.14 -3.42 -0.02 0.00 0.56 0.00 0.00 36.38 33.36 2isa s VAL 20 CO -0.01 -0.77 0.98 -1.58 -0.31 0.00 0.00 175.10 173.42 2isa s GLN 21 N -4.75 4.52 0.18 4.82 0.74 -1.26 -5.02 119.66 118.88 2isa s GLN 21 Ca 0.59 1.40 0.05 0.00 0.05 0.00 0.00 55.36 57.45 2isa s GLN 21 Cb -0.14 -3.48 -0.05 0.00 1.10 0.00 0.00 33.01 30.44 2isa s GLN 21 CO 0.49 -0.13 -0.10 0.95 -0.55 0.00 0.00 175.29 175.96 2isa s THR 22 N 1.30 1.32 -1.30 -0.34 -4.23 -1.26 -1.25 115.64 109.88 2isa s THR 22 Ca 0.50 -2.10 -0.18 0.00 -1.18 0.00 0.00 61.69 58.74 2isa s THR 22 Cb -0.20 -1.98 0.03 0.00 1.34 0.00 0.00 72.50 71.69 2isa s THR 22 CO 0.25 -0.64 1.92 0.00 -0.54 0.00 0.00 174.62 175.60 2isa n ALA 23 N -0.28 3.91 0.00 3.99 0.00 -0.55 -4.83 120.51 122.75 2isa n ALA 23 Ca -0.09 -3.73 0.00 0.00 0.00 0.00 0.00 53.44 49.63 2isa n ALA 23 Cb 0.61 -3.58 0.00 0.00 0.00 0.00 0.00 19.45 16.48 2isa n ALA 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2isa n GLY 24 N 5.01 -0.38 0.21 0.00 0.00 -1.26 -3.38 105.19 105.38 2isa n GLY 24 Ca 0.49 -1.75 -0.03 0.00 0.00 0.00 0.00 46.02 44.74 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 0.35 -0.29 1.61 1.57 -2.00 -2.75 116.57 115.06 2isa h LYS 25 Ca 0.00 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 2isa h LYS 25 Cb 0.00 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 2isa h LYS 25 CO 0.00 0.23 -0.01 0.54 -0.57 0.00 0.00 179.45 179.64 2isa n ARG 26 N -5.01 2.53 -2.74 3.15 5.12 -1.26 -5.04 116.66 113.41 2isa n ARG 26 Ca 0.06 -2.93 -0.22 0.00 -1.93 0.00 0.00 57.85 52.83 2isa n ARG 26 Cb 0.21 -1.83 0.03 0.00 -1.16 0.00 0.00 32.46 29.71 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 -2.14 1.73 0.97 -0.13 0.00 -1.04 -5.06 107.32 101.66 2isa s GLY 27 Ca 0.43 -1.20 -0.11 0.00 0.00 0.00 0.00 44.72 43.83 2isa s GLY 27 CO 0.06 -0.96 1.09 -4.14 0.00 0.00 0.00 173.10 169.15 2isa s PRO 28 N -4.71 0.61 0.38 2.90 0.02 -1.26 -4.35 135.00 128.58 2isa s PRO 28 Ca 0.54 1.01 -0.25 0.00 0.02 0.00 0.00 61.00 62.33 2isa s PRO 28 Cb -0.10 -1.72 -0.09 0.00 0.02 0.00 0.00 34.50 32.61 2isa s PRO 28 CO 0.39 -2.74 1.05 -1.14 -0.33 0.00 0.00 177.00 174.23 2isa s GLN 29 N -4.73 4.26 -0.06 5.54 0.74 -1.26 -1.49 119.66 122.66 2isa s GLN 29 Ca 0.66 1.55 -0.15 0.00 0.05 0.00 0.00 55.36 57.46 2isa s GLN 29 Cb -0.21 -2.66 -0.05 0.00 1.10 0.00 0.00 33.01 31.19 2isa s GLN 29 CO 0.59 -0.06 0.40 -0.51 -0.55 0.00 0.00 175.29 175.16 2isa s LEU 30 N -2.42 4.38 0.37 3.68 1.43 -0.38 -4.86 118.68 120.87 2isa s LEU 30 Ca 0.55 0.83 0.08 0.00 -1.03 0.00 0.00 54.13 54.57 2isa s LEU 30 Cb -0.23 -2.56 0.81 0.00 0.03 0.00 0.00 46.19 44.24 2isa s LEU 30 CO 0.29 0.20 1.91 0.25 0.23 0.00 0.00 176.35 179.24 2isa h LEU 31 N 5.58 0.63 0.00 1.79 5.85 -1.96 -2.82 115.31 124.38 2isa h LEU 31 Ca -0.47 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.27 2isa h LEU 31 Cb 1.20 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.12 2isa h LEU 31 CO 0.67 0.36 0.00 0.00 -0.34 0.00 0.00 178.44 179.14 2isa n GLN 32 N -4.51 0.42 -2.39 1.25 10.64 -1.26 -4.27 117.38 117.25 2isa n GLN 32 Ca 0.14 0.00 -0.37 0.00 -1.83 0.00 0.00 57.00 54.94 2isa n GLN 32 Cb 0.37 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 28.22 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 -2.00 6.09 0.30 2.61 -1.08 -1.07 -4.79 116.67 116.73 2isa s ASP 33 Ca 0.20 -1.49 0.16 0.00 -0.52 0.00 0.00 52.55 50.90 2isa s ASP 33 Cb 0.09 -2.57 0.10 0.00 -1.46 0.00 0.00 42.92 39.08 2isa s ASP 33 CO 0.15 -1.90 1.46 -0.37 0.52 0.00 0.00 175.17 175.04 2isa h VAL 34 N 6.59 0.75 -0.40 1.11 -1.51 -1.91 -3.03 116.25 117.86 2isa h VAL 34 Ca 0.23 -2.06 -0.02 0.00 -1.23 0.00 0.00 66.70 63.62 2isa h VAL 34 Cb 0.97 2.37 -0.02 0.00 -2.13 0.00 0.00 31.29 32.48 2isa h VAL 34 CO 1.36 0.43 0.17 -0.25 -1.23 0.00 0.00 177.57 178.04 2isa h TRP 35 N 0.00 0.59 -0.32 5.19 -0.00 -1.95 -1.65 115.95 117.81 2isa h TRP 35 Ca -0.01 -0.04 0.06 0.00 -0.00 0.00 0.00 58.89 58.90 2isa h TRP 35 Cb 1.34 -0.18 -0.05 0.00 -0.00 0.00 0.00 29.16 30.26 2isa h TRP 35 CO 0.00 0.52 -0.01 0.35 -0.00 0.00 0.00 178.44 179.30 2isa h PHE 36 N 0.50 -0.04 -0.20 2.65 3.57 -1.90 0.23 116.94 121.74 2isa h PHE 36 Ca 0.13 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.66 2isa h PHE 36 Cb 0.17 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 2isa h PHE 36 CO -0.00 -0.07 0.14 -0.07 -2.23 0.00 0.00 178.31 176.07 2isa h LEU 37 N 0.08 0.23 -0.14 0.59 3.38 -1.43 -0.89 115.31 117.13 2isa h LEU 37 Ca 0.16 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2isa h LEU 37 Cb 0.21 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2isa h LEU 37 CO -0.27 0.17 0.05 -0.08 0.09 0.00 0.00 178.44 178.40 2isa h GLU 38 N 0.28 0.21 -0.63 1.13 4.81 -1.04 0.54 114.58 119.89 2isa h GLU 38 Ca 0.07 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 2isa h GLU 38 Cb -0.03 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 2isa h GLU 38 CO -0.02 0.32 0.37 -0.22 -0.73 0.00 0.00 179.01 178.74 2isa h LYS 39 N 0.06 0.85 -0.05 1.92 3.64 -0.44 -1.74 116.57 120.80 2isa h LYS 39 Ca 0.05 -0.08 -0.21 0.00 -1.27 0.00 0.00 60.65 59.14 2isa h LYS 39 Cb 0.19 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.83 2isa h LYS 39 CO -0.00 0.61 -0.82 -0.07 -2.27 0.00 0.00 179.45 176.90 2isa h LEU 40 N 0.85 0.55 -0.84 5.20 -0.00 -1.08 -2.39 115.31 117.59 2isa h LEU 40 Ca 0.22 -0.39 -0.09 0.00 -0.00 0.00 0.00 57.88 57.62 2isa h LEU 40 Cb -0.02 -0.16 -0.02 0.00 -0.00 0.00 0.00 40.66 40.46 2isa h LEU 40 CO -0.04 1.16 -0.10 0.00 -0.00 0.00 0.00 178.44 179.46 2isa h ALA 41 N 0.82 1.02 -0.31 1.53 0.00 -0.67 0.56 119.26 122.20 2isa h ALA 41 Ca -0.05 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.46 2isa h ALA 41 Cb 1.43 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 2isa h ALA 41 CO 0.14 0.59 -0.17 0.45 0.00 0.00 0.00 179.25 180.27 2isa h HIS 42 N 0.69 0.77 -0.62 0.00 3.86 -1.33 -3.17 115.15 115.35 2isa h HIS 42 Ca 0.12 -0.20 0.06 0.00 -1.16 0.00 0.00 60.37 59.19 2isa h HIS 42 Cb 0.57 -0.18 -0.05 0.00 1.06 0.00 0.00 27.41 28.81 2isa h HIS 42 CO 0.03 0.89 0.32 0.35 0.86 0.00 0.00 177.93 180.39 2isa h PHE 43 N 0.43 0.59 0.00 2.45 3.57 -1.21 -1.75 116.94 121.02 2isa h PHE 43 Ca 0.07 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.59 2isa h PHE 43 Cb 0.70 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.26 2isa h PHE 43 CO 0.06 0.28 0.00 -0.25 -2.23 0.00 0.00 178.31 176.17 2isa n ASP 44 N -4.84 0.36 -0.08 0.41 8.00 0.17 -2.61 116.55 117.96 2isa n ASP 44 Ca 0.07 0.63 0.08 0.00 0.71 0.00 0.00 54.79 56.28 2isa n ASP 44 Cb 0.17 -0.69 0.11 0.00 -0.02 0.00 0.00 41.12 40.69 2isa n ASP 44 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2isa n ARG 45 N -1.94 1.45 0.17 -1.24 1.74 -0.67 -4.75 116.66 111.40 2isa n ARG 45 Ca 0.01 -2.34 0.01 0.00 -0.77 0.00 0.00 57.85 54.76 2isa n ARG 45 Cb 0.10 -1.38 0.32 0.00 -1.02 0.00 0.00 32.46 30.48 2isa n ARG 45 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 2isa h GLU 46 N 0.00 0.04 -6.14 5.56 5.08 -1.34 -3.44 114.58 114.34 2isa h GLU 46 Ca 0.00 -0.02 -0.56 0.00 -1.00 0.00 0.00 59.36 57.78 2isa h GLU 46 Cb 0.95 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.15 2isa h GLU 46 CO 0.00 0.43 0.02 0.08 -1.00 0.00 0.00 179.01 178.55 2isa s VAL 47 N -4.13 4.86 0.36 3.13 1.01 -1.26 -5.08 120.40 119.29 2isa s VAL 47 Ca -0.03 1.33 0.08 0.00 0.00 0.00 0.00 61.98 63.36 2isa s VAL 47 Cb 0.14 -3.97 -0.05 0.00 0.00 0.00 0.00 36.38 32.50 2isa s VAL 47 CO 0.74 0.41 0.13 0.27 0.00 0.00 0.00 175.10 176.65 2isa s ILE 48 N -0.21 2.71 0.42 2.22 -4.36 -1.26 -5.10 121.20 115.61 2isa s ILE 48 Ca 0.32 -1.75 -0.27 0.00 -0.26 0.00 0.00 60.65 58.70 2isa s ILE 48 Cb -0.19 -2.94 -0.10 0.00 1.25 0.00 0.00 42.46 40.48 2isa s ILE 48 CO 0.18 -0.13 1.45 -2.84 0.24 0.00 0.00 174.94 173.85 2isa s PRO 49 N -3.84 3.89 0.75 0.37 0.02 -1.26 -4.99 135.00 129.94 2isa s PRO 49 Ca 0.38 2.49 -0.11 0.00 0.02 0.00 0.00 61.00 63.78 2isa s PRO 49 Cb -0.00 -2.80 0.04 0.00 0.02 0.00 0.00 34.50 31.76 2isa s PRO 49 CO 0.22 -0.68 1.08 -1.83 -0.33 0.00 0.00 177.00 175.46 2isa s GLU 50 N -2.28 2.43 0.45 5.54 -1.05 -1.26 -4.96 118.70 117.57 2isa s GLU 50 Ca 0.57 0.92 -0.25 0.00 -0.15 0.00 0.00 54.97 56.06 2isa s GLU 50 Cb -0.45 -1.93 -0.09 0.00 -0.44 0.00 0.00 34.13 31.22 2isa s GLU 50 CO 0.59 -1.45 1.37 0.54 0.95 0.00 0.00 175.26 177.27 2isa n ARG 51 N -3.36 2.11 0.00 -4.83 1.74 -1.26 -5.03 116.66 106.03 2isa n ARG 51 Ca 0.08 0.75 0.02 0.00 -0.77 0.00 0.00 57.85 57.93 2isa n ARG 51 Cb 0.54 -2.54 0.12 0.00 -1.02 0.00 0.00 32.46 29.56 2isa n ARG 51 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2isa n ARG 52 N -0.16 0.34 -1.32 5.56 3.00 -1.26 -4.18 116.66 118.64 2isa n ARG 52 Ca 0.06 0.00 -0.03 0.00 -0.00 0.00 0.00 57.85 57.88 2isa n ARG 52 Cb 0.41 -1.19 -0.01 0.00 0.00 0.00 0.00 32.46 31.67 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 -0.69 -0.25 -0.16 -0.14 8.25 -0.56 -5.07 115.22 116.61 2isa n HIS 54 Ca 0.03 0.05 0.10 0.00 -0.26 0.00 0.00 57.72 57.63 2isa n HIS 54 Cb 0.01 -0.21 0.42 0.00 1.12 0.00 0.00 29.99 31.33 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 1.84 1.85 -2.82 -1.41 0.00 -1.73 -3.41 119.26 113.58 2isa h ALA 55 Ca -0.04 -0.01 -0.61 0.00 0.00 0.00 0.00 54.91 54.25 2isa h ALA 55 Cb 0.18 -0.14 -0.12 0.00 0.00 0.00 0.00 17.79 17.71 2isa h ALA 55 CO 0.06 0.01 -0.20 0.21 0.00 0.00 0.00 179.25 179.32 2isa s LYS 56 N -5.56 4.13 0.16 0.00 2.47 -1.25 -4.58 119.74 115.11 2isa s LYS 56 Ca -0.09 0.16 -0.24 0.00 -1.56 0.00 0.00 55.97 54.24 2isa s LYS 56 Cb 0.20 -3.57 0.07 0.00 -1.46 0.00 0.00 37.83 33.07 2isa s LYS 56 CO 0.77 -0.10 0.99 0.20 0.16 0.00 0.00 175.35 177.36 2isa s GLY 57 N 1.19 -0.14 -0.01 5.54 0.00 -1.26 -1.93 107.32 110.71 2isa s GLY 57 Ca 0.18 0.02 -0.02 0.00 0.00 0.00 0.00 44.72 44.90 2isa s GLY 57 CO 0.08 0.56 0.05 -0.56 0.00 0.00 0.00 173.10 173.23 2isa s SER 58 N -3.06 -0.00 0.11 1.64 0.01 0.84 -4.98 113.70 108.26 2isa s SER 58 Ca 0.15 -0.01 0.02 0.00 1.31 0.00 0.00 55.95 57.42 2isa s SER 58 Cb -0.01 0.12 -0.04 0.00 0.21 0.00 0.00 66.02 66.30 2isa s SER 58 CO 0.03 -0.10 -0.07 -0.83 0.41 0.00 0.00 173.24 172.68 2isa s GLY 59 N -0.34 0.82 0.09 3.44 0.00 -1.26 0.26 107.32 110.33 2isa s GLY 59 Ca -0.04 -1.37 -0.26 0.00 0.00 0.00 0.00 44.72 43.06 2isa s GLY 59 CO 0.00 -1.47 0.66 0.00 0.00 0.00 0.00 173.10 172.29 2isa s ALA 60 N -3.54 -1.67 0.16 3.20 0.00 -0.23 -4.50 121.76 115.18 2isa s ALA 60 Ca 0.12 0.76 -0.03 0.00 0.00 0.00 0.00 51.96 52.81 2isa s ALA 60 Cb 0.05 0.60 -0.05 0.00 0.00 0.00 0.00 23.12 23.71 2isa s ALA 60 CO -0.04 -0.66 0.37 0.71 0.00 0.00 0.00 175.76 176.14 2isa s TYR 61 N -3.06 3.48 0.00 0.00 1.51 0.12 -0.76 117.35 118.65 2isa s TYR 61 Ca -0.01 0.45 0.00 0.00 -1.01 0.00 0.00 57.07 56.50 2isa s TYR 61 Cb -0.01 -1.93 0.00 0.00 -0.11 0.00 0.00 41.96 39.91 2isa s TYR 61 CO -0.07 0.42 0.00 0.41 -1.11 0.00 0.00 175.55 175.20 2isa n GLY 62 N -0.20 3.48 2.95 0.71 0.00 -0.66 -0.85 105.19 110.63 2isa n GLY 62 Ca -0.03 -0.80 -0.13 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.14 -0.06 -0.16 2.61 2.01 -0.26 -2.07 115.64 115.56 2isa s THR 63 Ca 0.00 0.18 -0.10 0.00 0.31 0.00 0.00 61.69 62.08 2isa s THR 63 Cb 0.00 -0.28 -0.05 0.00 0.01 0.00 0.00 72.50 72.18 2isa s THR 63 CO 0.00 0.08 0.17 0.12 -0.69 0.00 0.00 174.62 174.29 2isa s PHE 64 N 1.27 3.48 -0.10 4.92 5.36 0.50 -1.33 117.98 132.07 2isa s PHE 64 Ca -0.08 0.45 0.03 0.00 -0.96 0.00 0.00 56.93 56.37 2isa s PHE 64 Cb -0.11 -2.13 0.01 0.00 -0.34 0.00 0.00 43.02 40.44 2isa s PHE 64 CO -0.07 0.42 -0.20 0.99 -1.46 0.00 0.00 175.22 174.90 2isa s THR 65 N -0.06 1.79 0.10 0.12 2.01 0.33 -0.71 115.64 119.22 2isa s THR 65 Ca 0.12 -0.85 -0.31 0.00 0.31 0.00 0.00 61.69 60.96 2isa s THR 65 Cb -0.12 -1.58 -0.07 0.00 0.01 0.00 0.00 72.50 70.74 2isa s THR 65 CO 0.01 0.50 1.33 -0.69 -0.69 0.00 0.00 174.62 175.08 2isa s VAL 66 N 0.60 3.53 -0.07 3.82 1.01 -0.95 -1.38 120.40 126.97 2isa s VAL 66 Ca -0.14 1.10 0.08 0.00 0.00 0.00 0.00 61.98 63.02 2isa s VAL 66 Cb -0.17 -3.71 -0.11 0.00 0.00 0.00 0.00 36.38 32.40 2isa s VAL 66 CO 0.04 0.09 0.05 0.35 0.00 0.00 0.00 175.10 175.63 2isa n THR 67 N 3.92 0.49 -4.10 3.92 -2.24 -0.31 0.09 114.28 116.05 2isa n THR 67 Ca 0.11 -0.33 -0.08 0.00 -2.27 0.00 0.00 64.05 61.48 2isa n THR 67 Cb 0.44 -0.63 -0.10 0.00 -2.10 0.00 0.00 70.33 67.93 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 -2.26 0.59 -0.38 4.78 3.76 -0.80 -4.82 115.29 116.17 2isa s HIS 68 Ca -0.04 -1.02 -0.17 0.00 -0.15 0.00 0.00 55.06 53.68 2isa s HIS 68 Cb 0.03 -0.41 0.00 0.00 1.11 0.00 0.00 32.58 33.31 2isa s HIS 68 CO 0.34 -0.32 0.43 0.34 -0.85 0.00 0.00 174.74 174.68 2isa s ASP 69 N -2.90 6.22 -0.13 1.40 -1.08 -1.26 -4.80 116.67 114.11 2isa s ASP 69 Ca 0.07 -0.38 0.19 0.00 -0.52 0.00 0.00 52.55 51.91 2isa s ASP 69 Cb 0.07 -2.23 0.31 0.00 -1.46 0.00 0.00 42.92 39.61 2isa s ASP 69 CO -0.09 -0.48 1.17 2.30 0.52 0.00 0.00 175.17 178.59 2isa n ILE 70 N 5.38 1.91 0.26 4.11 -5.35 -1.26 -4.77 119.36 119.65 2isa n ILE 70 Ca -0.07 -2.23 0.07 0.00 -0.27 0.00 0.00 62.75 60.25 2isa n ILE 70 Cb 0.48 -0.23 0.32 0.00 -1.74 0.00 0.00 39.64 38.47 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 -1.36 1.26 0.22 7.28 -2.24 -1.26 -0.61 114.28 117.57 2isa n THR 71 Ca 0.16 0.42 0.05 0.00 -2.27 0.00 0.00 64.05 62.41 2isa n THR 71 Cb 0.66 -1.34 0.48 0.00 -2.10 0.00 0.00 70.33 68.03 2isa n THR 71 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2isa h LYS 72 N 0.00 0.00 0.00 -0.78 3.64 -2.00 -3.32 116.57 114.12 2isa h LYS 72 Ca 0.00 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.20 2isa h LYS 72 Cb 0.15 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.94 2isa h LYS 72 CO 0.00 0.22 -1.90 0.66 -2.27 0.00 0.00 179.45 176.16 2isa n TYR 73 N -4.24 0.00 -3.89 1.91 4.01 0.23 -4.81 117.16 110.37 2isa n TYR 73 Ca -0.02 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.60 2isa n TYR 73 Cb 0.28 -0.60 -0.13 0.00 -0.31 0.00 0.00 39.34 38.58 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 -2.59 0.02 -2.16 -0.72 -1.32 -1.00 -3.05 115.64 104.82 2isa s THR 74 Ca -0.07 -0.16 0.18 0.00 -1.21 0.00 0.00 61.69 60.43 2isa s THR 74 Cb 0.06 -0.07 0.45 0.00 -1.51 0.00 0.00 72.50 71.43 2isa s THR 74 CO 0.61 -0.09 1.42 2.29 -2.21 0.00 0.00 174.62 176.64 2isa n LYS 75 N 2.80 2.13 -1.69 7.08 2.85 -0.44 -4.30 118.16 126.60 2isa n LYS 75 Ca -0.14 -1.74 -0.44 0.00 -1.05 0.00 0.00 58.31 54.94 2isa n LYS 75 Cb 0.59 -1.42 -0.04 0.00 -0.65 0.00 0.00 35.03 33.52 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 0.92 1.95 -0.21 0.58 0.00 -1.22 -4.76 120.51 117.77 2isa n ALA 76 Ca 0.17 0.36 0.07 0.00 0.00 0.00 0.00 53.44 54.05 2isa n ALA 76 Cb 0.44 -2.50 0.35 0.00 0.00 0.00 0.00 19.45 17.73 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 7.55 0.75 -0.47 0.00 1.79 -1.94 -1.59 116.57 122.65 2isa h LYS 77 Ca -0.46 -0.04 0.14 0.00 -2.18 0.00 0.00 60.65 58.11 2isa h LYS 77 Cb 1.23 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 31.70 2isa h LYS 77 CO 0.93 0.49 0.37 0.97 -1.08 0.00 0.00 179.45 181.14 2isa h ILE 78 N 0.77 0.63 -0.45 1.86 2.10 -1.94 -1.90 117.51 118.57 2isa h ILE 78 Ca 0.35 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.29 2isa h ILE 78 Cb 0.34 0.73 0.00 0.00 -1.09 0.00 0.00 36.82 36.80 2isa h ILE 78 CO -0.13 0.00 0.00 0.49 -1.08 0.00 0.00 178.15 177.43 2isa n PHE 79 N -4.18 0.60 0.17 2.19 3.72 -0.60 -4.77 117.46 114.59 2isa n PHE 79 Ca 0.08 -0.40 0.04 0.00 -0.05 0.00 0.00 57.45 57.12 2isa n PHE 79 Cb 0.58 -0.01 0.29 0.00 -0.94 0.00 0.00 39.48 39.40 2isa n PHE 79 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2isa h SER 80 N 3.32 0.00 -3.63 4.37 4.64 -1.30 -3.43 113.55 117.52 2isa h SER 80 Ca 0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.09 2isa h SER 80 Cb 0.85 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 62.64 2isa h SER 80 CO 0.00 0.44 -0.61 -1.81 -0.87 0.00 0.00 176.83 173.97 2isa s ASP 81 N -6.54 -0.09 0.27 4.97 1.01 -1.26 -4.99 116.67 110.03 2isa s ASP 81 Ca -0.00 0.22 -0.30 0.00 0.71 0.00 0.00 52.55 53.17 2isa s ASP 81 Cb 0.11 0.17 -0.12 0.00 1.01 0.00 0.00 42.92 44.09 2isa s ASP 81 CO 0.71 -0.08 1.51 -0.38 0.21 0.00 0.00 175.17 177.13 2isa n ILE 82 N 3.55 1.02 0.00 0.77 5.41 -1.26 -1.81 119.36 127.04 2isa n ILE 82 Ca -0.19 -0.25 0.00 0.00 1.00 0.00 0.00 62.75 63.31 2isa n ILE 82 Cb 0.56 -1.75 0.00 0.00 -0.71 0.00 0.00 39.64 37.73 2isa n ILE 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2isa n GLY 83 N 2.12 2.46 3.71 7.39 0.00 0.11 -4.99 105.19 116.00 2isa n GLY 83 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.00 2.77 -4.37 1.61 4.81 -0.75 -4.69 118.16 115.53 2isa n LYS 84 Ca 0.00 1.00 -0.35 0.00 -0.87 0.00 0.00 58.31 58.09 2isa n LYS 84 Cb 0.00 -2.85 -0.10 0.00 0.02 0.00 0.00 35.03 32.10 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 1.48 3.08 -0.09 1.64 1.02 -1.26 -2.23 119.74 123.38 2isa s LYS 85 Ca 0.77 -0.42 0.00 0.00 0.02 0.00 0.00 55.97 56.34 2isa s LYS 85 Cb -0.51 -2.81 0.02 0.00 -0.52 0.00 0.00 37.83 34.01 2isa s LYS 85 CO 0.33 0.64 -0.08 0.99 -0.92 0.00 0.00 175.35 176.32 2isa s THR 86 N -0.70 0.91 0.61 2.17 2.01 0.11 -4.98 115.64 115.77 2isa s THR 86 Ca 0.11 -0.27 -0.16 0.00 0.31 0.00 0.00 61.69 61.68 2isa s THR 86 Cb -0.12 -0.92 -0.03 0.00 0.01 0.00 0.00 72.50 71.45 2isa s THR 86 CO 0.02 0.33 1.09 -1.81 -0.69 0.00 0.00 174.62 173.56 2isa s ASP 87 N 1.35 5.54 0.24 3.53 1.01 -1.26 -0.37 116.67 126.70 2isa s ASP 87 Ca -0.03 1.94 -0.21 0.00 0.71 0.00 0.00 52.55 54.96 2isa s ASP 87 Cb -0.14 -2.55 0.03 0.00 1.01 0.00 0.00 42.92 41.28 2isa s ASP 87 CO -0.04 -1.33 0.66 0.00 0.21 0.00 0.00 175.17 174.67 2isa s MET 88 N -3.95 1.60 -0.00 8.23 0.23 -0.88 -0.79 119.30 123.74 2isa s MET 88 Ca 0.66 -0.85 0.00 0.00 -1.03 0.00 0.00 55.69 54.47 2isa s MET 88 Cb -0.19 0.59 0.00 0.00 -1.53 0.00 0.00 34.83 33.71 2isa s MET 88 CO 0.37 -0.72 0.00 0.12 -2.03 0.00 0.00 175.02 172.76 2isa s PHE 89 N -3.88 0.02 0.00 3.16 5.36 0.11 -1.66 117.98 121.10 2isa s PHE 89 Ca 0.09 0.02 0.06 0.00 -0.96 0.00 0.00 56.93 56.13 2isa s PHE 89 Cb -0.04 -0.05 -0.02 0.00 -0.34 0.00 0.00 43.02 42.58 2isa s PHE 89 CO 0.01 -0.01 -0.19 0.00 -1.46 0.00 0.00 175.22 173.56 2isa s ALA 90 N 0.16 1.60 -0.10 11.12 0.00 0.06 -0.34 121.76 134.26 2isa s ALA 90 Ca -0.01 -0.88 0.03 0.00 0.00 0.00 0.00 51.96 51.09 2isa s ALA 90 Cb -0.02 -0.37 0.01 0.00 0.00 0.00 0.00 23.12 22.74 2isa s ALA 90 CO -0.00 0.38 -0.18 0.50 0.00 0.00 0.00 175.76 176.46 2isa s ARG 91 N -0.68 2.43 0.08 0.00 3.52 -0.17 -1.07 118.95 123.06 2isa s ARG 91 Ca 0.07 -0.65 0.03 0.00 -0.13 0.00 0.00 55.73 55.05 2isa s ARG 91 Cb -0.08 -1.96 -0.04 0.00 -1.56 0.00 0.00 34.95 31.32 2isa s ARG 91 CO 0.00 0.03 0.07 -0.06 -0.81 0.00 0.00 175.30 174.54 2isa s PHE 92 N 0.71 3.18 0.16 5.12 0.40 0.14 -1.09 117.98 126.59 2isa s PHE 92 Ca -0.12 0.07 -0.20 0.00 -0.60 0.00 0.00 56.93 56.08 2isa s PHE 92 Cb -0.16 -1.62 0.05 0.00 0.51 0.00 0.00 43.02 41.80 2isa s PHE 92 CO 0.03 0.52 0.54 -1.54 0.70 0.00 0.00 175.22 175.47 2isa s SER 93 N -2.37 -0.41 0.64 1.36 1.04 -1.04 -0.11 113.70 112.80 2isa s SER 93 Ca 0.29 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.52 2isa s SER 93 Cb -0.12 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.57 2isa s SER 93 CO 0.22 -0.97 0.00 0.35 0.98 0.00 0.00 173.24 173.81 2isa n THR 94 N -0.34 0.00 0.03 2.02 -2.24 -0.81 -0.45 114.28 112.49 2isa n THR 94 Ca -0.15 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.62 2isa n THR 94 Cb 0.64 -1.75 -0.00 0.00 -2.10 0.00 0.00 70.33 67.12 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 -1.49 1.01 0.09 2.28 0.31 -1.24 -4.04 118.33 115.25 2isa n VAL 95 Ca 0.00 0.31 -0.13 0.00 -0.01 0.00 0.00 64.34 64.51 2isa n VAL 95 Cb 0.00 -1.61 -0.13 0.00 -0.91 0.00 0.00 33.84 31.19 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 -0.06 0.20 -2.98 3.52 0.00 -1.92 -1.48 119.26 116.55 2isa h ALA 96 Ca -0.01 -0.91 -0.54 0.00 0.00 0.00 0.00 54.91 53.45 2isa h ALA 96 Cb 0.26 -0.03 0.12 0.00 0.00 0.00 0.00 17.79 18.14 2isa h ALA 96 CO -0.00 1.09 0.68 0.20 0.00 0.00 0.00 179.25 181.22 2isa s GLY 97 N -4.69 2.92 0.82 0.00 0.00 -1.26 -4.92 107.32 100.17 2isa s GLY 97 Ca -0.02 1.43 -0.14 0.00 0.00 0.00 0.00 44.72 45.99 2isa s GLY 97 CO 0.86 2.03 1.03 1.18 0.00 0.00 0.00 173.10 178.20 2isa n GLU 98 N -0.28 -1.33 -0.13 2.90 4.71 -1.26 -3.87 120.64 121.38 2isa n GLU 98 Ca 0.06 -1.60 0.05 0.00 -0.01 0.00 0.00 57.16 55.65 2isa n GLU 98 Cb 0.42 -1.13 0.10 0.00 -1.01 0.00 0.00 31.44 29.82 2isa n GLU 98 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 2isa n ARG 99 N -3.41 -0.03 -0.16 3.49 1.74 -1.26 -1.83 116.66 115.20 2isa n ARG 99 Ca 0.13 0.57 0.06 0.00 -0.77 0.00 0.00 57.85 57.84 2isa n ARG 99 Cb 0.46 -0.89 0.13 0.00 -1.02 0.00 0.00 32.46 31.15 2isa n ARG 99 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2isa n GLY 100 N -1.20 3.73 3.73 -0.13 0.00 -1.26 -4.78 105.19 105.28 2isa n GLY 100 Ca 0.08 -0.65 -0.32 0.00 0.00 0.00 0.00 46.02 45.14 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 -1.96 2.00 0.28 4.61 0.00 -0.76 -4.93 121.76 121.01 2isa s ALA 101 Ca 0.24 0.54 -0.30 0.00 0.00 0.00 0.00 51.96 52.44 2isa s ALA 101 Cb 0.18 -3.38 -0.11 0.00 0.00 0.00 0.00 23.12 19.82 2isa s ALA 101 CO 0.06 -2.04 1.54 0.00 0.00 0.00 0.00 175.76 175.32 2isa s ALA 102 N -2.55 3.70 0.25 0.00 0.00 -1.26 -4.87 121.76 117.03 2isa s ALA 102 Ca 0.67 1.50 -0.05 0.00 0.00 0.00 0.00 51.96 54.08 2isa s ALA 102 Cb -0.22 -3.62 0.29 0.00 0.00 0.00 0.00 23.12 19.58 2isa s ALA 102 CO 0.52 -0.92 1.87 -0.44 0.00 0.00 0.00 175.76 176.80 2isa h ASP 103 N 4.80 1.03 -1.24 0.00 3.32 -1.22 -3.34 116.42 119.77 2isa h ASP 103 Ca -0.47 -0.10 -0.55 0.00 0.02 0.00 0.00 57.03 55.93 2isa h ASP 103 Cb 1.22 -0.26 -0.20 0.00 0.22 0.00 0.00 39.33 40.31 2isa h ASP 103 CO 0.78 0.84 0.53 0.00 -1.72 0.00 0.00 179.24 179.66 2isa n ALA 104 N -2.42 6.46 -2.63 3.45 0.00 -1.26 -4.91 120.51 119.20 2isa n ALA 104 Ca 0.08 -3.25 -0.23 0.00 0.00 0.00 0.00 53.44 50.04 2isa n ALA 104 Cb 0.11 -2.11 -0.01 0.00 0.00 0.00 0.00 19.45 17.44 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 -2.19 3.40 -0.27 0.00 2.02 -1.26 -4.77 118.70 115.64 2isa s GLU 105 Ca 0.57 -0.43 -0.29 0.00 0.02 0.00 0.00 54.97 54.84 2isa s GLU 105 Cb 0.39 -2.68 -0.01 0.00 0.10 0.00 0.00 34.13 31.94 2isa s GLU 105 CO -0.26 0.11 1.42 0.50 0.02 0.00 0.00 175.26 177.05 2isa s ARG 106 N -4.32 3.88 -0.23 1.61 3.52 -1.26 -4.63 118.95 117.53 2isa s ARG 106 Ca 0.41 1.41 -0.32 0.00 -0.13 0.00 0.00 55.73 57.10 2isa s ARG 106 Cb -0.10 -3.93 0.16 0.00 -1.56 0.00 0.00 34.95 29.52 2isa s ARG 106 CO 0.35 -1.17 1.24 0.34 -0.81 0.00 0.00 175.30 175.25 2isa s ASP 107 N 3.30 -0.13 0.52 -2.12 -1.08 -0.72 -5.03 116.67 111.41 2isa s ASP 107 Ca 0.62 0.08 -0.22 0.00 -0.52 0.00 0.00 52.55 52.51 2isa s ASP 107 Cb -0.20 0.12 -0.06 0.00 -1.46 0.00 0.00 42.92 41.32 2isa s ASP 107 CO 0.25 -0.17 1.21 -0.38 0.52 0.00 0.00 175.17 176.60 2isa n ILE 108 N 0.27 3.42 -4.34 4.11 5.41 -1.26 -4.69 119.36 122.27 2isa n ILE 108 Ca -0.01 -0.50 -0.34 0.00 1.00 0.00 0.00 62.75 62.90 2isa n ILE 108 Cb 0.58 -1.46 -0.11 0.00 -0.71 0.00 0.00 39.64 37.94 2isa n ILE 108 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 2isa s ARG 109 N -2.63 3.53 0.44 0.38 1.81 -1.26 -3.63 118.95 117.58 2isa s ARG 109 Ca 0.70 -0.47 -0.23 0.00 -1.72 0.00 0.00 55.73 54.01 2isa s ARG 109 Cb -0.45 -2.92 -0.08 0.00 -0.45 0.00 0.00 34.95 31.05 2isa s ARG 109 CO 0.51 0.37 1.15 0.20 -0.68 0.00 0.00 175.30 176.85 2isa s GLY 110 N 0.03 2.79 -0.41 -3.53 0.00 0.40 -0.50 107.32 106.09 2isa s GLY 110 Ca 0.02 0.91 0.03 0.00 0.00 0.00 0.00 44.72 45.68 2isa s GLY 110 CO 0.02 1.37 0.32 -0.12 0.00 0.00 0.00 173.10 174.69 2isa s PHE 111 N -1.54 1.11 -0.19 1.90 2.19 0.93 -2.51 117.98 119.88 2isa s PHE 111 Ca 0.62 -2.23 -0.03 0.00 0.33 0.00 0.00 56.93 55.62 2isa s PHE 111 Cb -0.28 -0.99 -0.02 0.00 -1.31 0.00 0.00 43.02 40.42 2isa s PHE 111 CO 0.34 -0.82 -0.05 0.45 1.83 0.00 0.00 175.22 176.98 2isa s SER 112 N 0.21 4.49 -0.07 6.13 0.15 -0.25 -1.12 113.70 123.23 2isa s SER 112 Ca 0.29 -0.28 0.04 0.00 0.70 0.00 0.00 55.95 56.71 2isa s SER 112 Cb -0.02 -1.75 -0.00 0.00 -1.71 0.00 0.00 66.02 62.54 2isa s SER 112 CO -0.15 0.07 -0.22 -0.76 1.20 0.00 0.00 173.24 173.38 2isa s LEU 113 N 0.94 2.00 -0.22 3.45 1.43 0.17 -1.00 118.68 125.46 2isa s LEU 113 Ca -0.00 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.63 2isa s LEU 113 Cb -0.15 -1.26 0.03 0.00 0.03 0.00 0.00 46.19 44.85 2isa s LEU 113 CO 0.01 0.17 -0.14 -0.75 0.23 0.00 0.00 176.35 175.87 2isa s LYS 114 N 0.17 2.74 -0.25 1.70 2.20 0.54 -0.06 119.74 126.78 2isa s LYS 114 Ca -0.11 -1.01 -0.09 0.00 -0.36 0.00 0.00 55.97 54.40 2isa s LYS 114 Cb -0.15 -2.75 -0.04 0.00 -1.51 0.00 0.00 37.83 33.37 2isa s LYS 114 CO 0.06 -0.36 0.11 -0.06 -0.36 0.00 0.00 175.35 174.74 2isa s PHE 115 N 1.24 3.15 -1.29 4.03 0.08 0.17 -0.71 117.98 124.65 2isa s PHE 115 Ca -0.00 -0.18 -0.16 0.00 0.12 0.00 0.00 56.93 56.70 2isa s PHE 115 Cb -0.16 -2.28 0.09 0.00 -0.57 0.00 0.00 43.02 40.11 2isa s PHE 115 CO -0.09 -0.24 1.71 0.66 -0.10 0.00 0.00 175.22 177.17 2isa n TYR 116 N 4.85 4.60 -2.25 0.36 4.01 0.03 -0.93 117.16 127.83 2isa n TYR 116 Ca -0.15 -2.97 -0.26 0.00 -0.16 0.00 0.00 57.90 54.36 2isa n TYR 116 Cb 0.52 -2.51 0.06 0.00 -0.31 0.00 0.00 39.34 37.10 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 3.42 2.45 -1.11 -0.72 -4.23 -0.87 -4.52 115.64 110.05 2isa s THR 117 Ca 0.50 -0.27 0.26 0.00 -1.18 0.00 0.00 61.69 61.01 2isa s THR 117 Cb 0.03 -3.05 0.29 0.00 1.34 0.00 0.00 72.50 71.11 2isa s THR 117 CO 0.05 -0.05 1.86 -1.84 -0.54 0.00 0.00 174.62 174.10 2isa n GLU 118 N -2.85 0.10 -0.81 3.99 0.28 -1.26 -3.02 120.64 117.07 2isa n GLU 118 Ca 0.08 0.04 0.03 0.00 -0.16 0.00 0.00 57.16 57.15 2isa n GLU 118 Cb 0.60 -1.50 0.18 0.00 1.43 0.00 0.00 31.44 32.15 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 -1.44 1.72 0.00 3.44 1.02 -1.26 -4.67 120.64 119.44 2isa n GLU 119 Ca 0.08 -3.33 0.00 0.00 -0.02 0.00 0.00 57.16 53.89 2isa n GLU 119 Cb 0.28 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 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 -0.99 3.24 3.66 0.62 0.00 -1.17 -4.55 105.19 106.01 2isa n GLY 120 Ca 0.21 -1.97 -0.43 0.00 0.00 0.00 0.00 46.02 43.83 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 6.92 -0.39 1.61 0.02 -1.26 -2.05 114.94 119.79 2isa s ASN 121 Ca 0.00 1.78 -0.19 0.00 -1.02 0.00 0.00 52.86 53.43 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 -0.76 0.56 0.86 0.02 0.00 0.00 177.10 177.78 2isa s TRP 122 N 3.42 3.14 -0.21 2.20 -0.00 -0.10 -4.42 118.94 122.96 2isa s TRP 122 Ca 0.57 0.05 -0.14 0.00 -0.00 0.00 0.00 56.10 56.59 2isa s TRP 122 Cb -0.24 -3.09 -0.04 0.00 -0.00 0.00 0.00 33.47 30.10 2isa s TRP 122 CO 0.17 -0.68 0.30 -0.51 -0.00 0.00 0.00 176.95 176.23 2isa s ASP 123 N 1.85 6.32 -0.41 5.86 1.01 0.11 -0.66 116.67 130.76 2isa s ASP 123 Ca 0.20 0.36 0.02 0.00 0.71 0.00 0.00 52.55 53.84 2isa s ASP 123 Cb -0.15 -2.18 0.12 0.00 1.01 0.00 0.00 42.92 41.72 2isa s ASP 123 CO 0.15 -0.01 0.17 -0.22 0.21 0.00 0.00 175.17 175.47 2isa s LEU 124 N 1.17 3.28 -1.15 1.23 2.96 0.92 -4.54 118.68 122.54 2isa s LEU 124 Ca 0.15 -2.38 -0.18 0.00 -0.22 0.00 0.00 54.13 51.50 2isa s LEU 124 Cb -0.14 -1.22 0.11 0.00 0.50 0.00 0.00 46.19 45.44 2isa s LEU 124 CO 0.06 -0.32 1.46 0.00 -1.32 0.00 0.00 176.35 176.24 2isa s ALA 125 N 0.63 3.46 0.60 5.97 0.00 -1.26 -0.66 121.76 130.51 2isa s ALA 125 Ca 0.14 -2.93 0.00 0.00 0.00 0.00 0.00 51.96 49.17 2isa s ALA 125 Cb -0.22 -4.33 0.09 0.00 0.00 0.00 0.00 23.12 18.66 2isa s ALA 125 CO -0.07 -3.11 0.63 0.41 0.00 0.00 0.00 175.76 173.62 2isa n GLY 126 N 5.22 0.74 3.49 0.00 0.00 -0.28 -4.92 105.19 109.45 2isa n GLY 126 Ca 0.37 -2.01 -0.24 0.00 0.00 0.00 0.00 46.02 44.14 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 -3.58 2.63 -0.03 1.61 0.01 -0.79 -0.05 114.94 114.73 2isa s ASN 127 Ca 0.42 -1.49 0.03 0.00 -0.71 0.00 0.00 52.86 51.10 2isa s ASN 127 Cb -0.02 0.15 0.14 0.00 0.41 0.00 0.00 41.25 41.92 2isa s ASN 127 CO 0.28 -0.73 0.78 -0.46 -1.51 0.00 0.00 177.10 175.46 2isa n ASN 128 N -0.93 1.64 -3.92 -1.22 6.94 0.35 -0.95 115.26 117.17 2isa n ASN 128 Ca -0.05 -2.14 -0.13 0.00 -0.02 0.00 0.00 54.58 52.25 2isa n ASN 128 Cb 0.66 -0.46 -0.14 0.00 -2.36 0.00 0.00 39.78 37.49 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 -1.39 0.15 -0.95 5.53 -1.32 -1.26 -4.63 115.64 111.76 2isa s THR 129 Ca 0.09 -0.23 0.18 0.00 -1.21 0.00 0.00 61.69 60.52 2isa s THR 129 Cb 0.07 -0.16 0.15 0.00 -1.51 0.00 0.00 72.50 71.05 2isa s THR 129 CO 0.03 -0.06 1.57 -0.81 -2.21 0.00 0.00 174.62 173.15 2isa n PRO 130 N 2.77 0.02 -3.61 7.08 -0.04 -1.26 -4.54 135.00 135.42 2isa n PRO 130 Ca -0.14 0.22 -0.16 0.00 -0.04 0.00 0.00 63.50 63.37 2isa n PRO 130 Cb 0.59 -1.54 -0.05 0.00 -0.04 0.00 0.00 33.50 32.46 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 -1.57 0.00 -4.03 0.52 0.24 -1.26 -4.36 118.33 107.86 2isa n VAL 131 Ca 0.04 -1.62 -0.10 0.00 -2.04 0.00 0.00 64.34 60.62 2isa n VAL 131 Cb 0.21 0.63 -0.05 0.00 -1.47 0.00 0.00 33.84 33.15 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 -2.65 0.52 0.37 6.34 5.36 -1.00 -4.97 117.98 121.94 2isa s PHE 132 Ca 0.17 -0.86 0.12 0.00 -0.96 0.00 0.00 56.93 55.40 2isa s PHE 132 Cb 0.01 0.10 0.71 0.00 -0.34 0.00 0.00 43.02 43.50 2isa s PHE 132 CO 0.12 -0.99 1.83 0.74 -1.46 0.00 0.00 175.22 175.46 2isa h PHE 133 N 2.27 0.03 -3.63 10.12 -1.00 -1.90 -3.38 116.94 119.46 2isa h PHE 133 Ca -0.27 -0.01 -0.67 0.00 2.81 0.00 0.00 57.97 59.82 2isa h PHE 133 Cb 1.25 -0.01 -0.20 0.00 3.61 0.00 0.00 35.95 40.60 2isa h PHE 133 CO 0.54 0.38 -0.83 -0.51 -1.61 0.00 0.00 178.31 176.29 2isa s LEU 134 N -8.25 2.52 -0.00 1.54 1.43 -1.26 -2.77 118.68 111.89 2isa s LEU 134 Ca -0.03 -0.70 0.21 0.00 -1.03 0.00 0.00 54.13 52.58 2isa s LEU 134 Cb 0.14 -1.35 -0.25 0.00 0.03 0.00 0.00 46.19 44.76 2isa s LEU 134 CO 0.73 0.16 0.55 0.54 0.23 0.00 0.00 176.35 178.56 2isa n ARG 135 N 0.67 0.65 -4.45 1.70 1.74 -1.26 -4.37 116.66 111.34 2isa n ARG 135 Ca -0.15 -0.08 -0.22 0.00 -0.77 0.00 0.00 57.85 56.62 2isa n ARG 135 Cb 0.54 -1.60 -0.16 0.00 -1.02 0.00 0.00 32.46 30.22 2isa n ARG 135 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2isa s ASP 136 N -4.91 1.41 0.49 0.55 -1.08 -1.26 -4.07 116.67 107.81 2isa s ASP 136 Ca -0.07 -0.22 0.33 0.00 -0.52 0.00 0.00 52.55 52.07 2isa s ASP 136 Cb 0.12 -0.53 1.51 0.00 -1.46 0.00 0.00 42.92 42.56 2isa s ASP 136 CO 0.87 0.04 1.98 1.55 0.52 0.00 0.00 175.17 180.13 2isa h PRO 137 N 6.70 0.00 -0.05 4.34 0.13 -1.89 -2.27 132.00 138.95 2isa h PRO 137 Ca -0.33 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.81 2isa h PRO 137 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 2isa h PRO 137 CO 0.48 0.00 0.05 -0.07 -0.23 0.00 0.00 178.00 178.23 2isa h LEU 138 N 0.00 0.00 -0.00 1.56 3.38 -1.96 -2.20 115.31 116.09 2isa h LEU 138 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2isa h LEU 138 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2isa h LEU 138 CO 0.00 0.00 -0.00 0.29 0.09 0.00 0.00 178.44 178.82 2isa n LYS 139 N -4.24 0.38 -0.05 1.13 4.76 -0.85 -4.24 118.16 115.05 2isa n LYS 139 Ca -0.02 -0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.31 2isa n LYS 139 Cb 0.15 -1.50 -0.05 0.00 -1.84 0.00 0.00 35.03 31.79 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 0.28 0.00 2.13 3.57 -1.57 -0.27 116.94 121.08 2isa h PHE 140 Ca 0.00 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 2isa h PHE 140 Cb 0.31 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 38.97 2isa h PHE 140 CO 0.00 0.33 -0.05 -1.35 -2.23 0.00 0.00 178.31 175.02 2isa h PRO 141 N 0.14 0.00 -0.34 6.41 0.11 -1.80 -1.07 132.00 135.45 2isa h PRO 141 Ca 0.06 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.07 2isa h PRO 141 Cb 0.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.28 2isa h PRO 141 CO -0.00 0.05 -0.18 -0.44 -0.21 0.00 0.00 178.00 177.21 2isa h ASP 142 N 0.00 0.75 0.04 -2.05 3.32 -1.64 -1.67 116.42 115.17 2isa h ASP 142 Ca -0.00 -0.41 0.01 0.00 0.02 0.00 0.00 57.03 56.64 2isa h ASP 142 Cb 0.09 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 2isa h ASP 142 CO 0.01 1.00 -0.07 0.25 -1.72 0.00 0.00 179.24 178.71 2isa h LEU 143 N 0.50 -0.18 -0.57 1.55 5.85 -0.49 -0.63 115.31 121.33 2isa h LEU 143 Ca 0.07 0.02 0.11 0.00 0.84 0.00 0.00 57.88 58.92 2isa h LEU 143 Cb 0.72 0.07 -0.11 0.00 0.37 0.00 0.00 40.66 41.71 2isa h LEU 143 CO 0.05 -0.10 -0.28 -1.13 -0.34 0.00 0.00 178.44 176.64 2isa h ASN 144 N -0.14 -0.97 0.70 1.25 -0.73 -1.15 -0.85 115.58 113.70 2isa h ASN 144 Ca 0.01 0.21 -0.04 0.00 1.87 0.00 0.00 56.30 58.35 2isa h ASN 144 Cb 0.15 0.51 -0.01 0.00 0.27 0.00 0.00 38.32 39.24 2isa h ASN 144 CO -0.04 -0.28 -0.20 0.45 -0.37 0.00 0.00 177.43 176.99 2isa h HIS 145 N -0.13 0.00 0.09 0.67 -0.00 -1.00 -1.85 115.15 112.93 2isa h HIS 145 Ca 0.25 0.00 -0.26 0.00 -0.00 0.00 0.00 60.37 60.35 2isa h HIS 145 Cb 0.53 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.93 2isa h HIS 145 CO -0.58 0.20 -1.24 0.00 -0.00 0.00 0.00 177.93 176.31 2isa h ALA 146 N 1.80 0.22 0.00 2.45 0.00 -0.42 -3.37 119.26 119.94 2isa h ALA 146 Ca -0.00 -0.95 0.00 0.00 0.00 0.00 0.00 54.91 53.96 2isa h ALA 146 Cb 0.60 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2isa h ALA 146 CO 0.03 1.10 -0.95 1.33 0.00 0.00 0.00 179.25 180.76 2isa n VAL 147 N -3.45 0.04 -1.15 0.00 0.24 -0.39 -2.99 118.33 110.62 2isa n VAL 147 Ca -0.08 -0.09 0.00 0.00 -2.04 0.00 0.00 64.34 62.13 2isa n VAL 147 Cb 1.01 0.56 0.00 0.00 -1.47 0.00 0.00 33.84 33.93 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 -1.66 3.92 -2.80 7.34 5.02 -0.72 -4.87 118.16 124.39 2isa n LYS 148 Ca 0.03 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.92 2isa n LYS 148 Cb 0.37 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.34 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 3.62 4.63 0.38 1.97 0.52 -1.26 -4.14 118.95 124.67 2isa s ARG 149 Ca 0.00 1.34 -0.28 0.00 -0.52 0.00 0.00 55.73 56.27 2isa s ARG 149 Cb 0.00 -3.37 -0.11 0.00 0.52 0.00 0.00 34.95 31.99 2isa s ARG 149 CO 0.00 0.23 1.47 0.34 0.02 0.00 0.00 175.30 177.36 2isa s ASP 150 N 0.01 6.32 0.41 0.23 -1.08 0.29 -4.82 116.67 118.03 2isa s ASP 150 Ca 0.45 3.02 0.17 0.00 -0.52 0.00 0.00 52.55 55.66 2isa s ASP 150 Cb -0.22 -2.67 1.07 0.00 -1.46 0.00 0.00 42.92 39.64 2isa s ASP 150 CO 0.28 -0.88 1.85 -0.65 0.52 0.00 0.00 175.17 176.28 2isa h PRO 151 N 2.95 0.41 0.00 4.34 0.11 -1.93 -0.62 132.00 137.27 2isa h PRO 151 Ca -0.51 -0.02 -0.37 0.00 0.11 0.00 0.00 66.00 65.21 2isa h PRO 151 Cb 1.24 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 32.20 2isa h PRO 151 CO 0.64 0.27 -2.05 -2.13 -0.21 0.00 0.00 178.00 174.52 2isa n ARG 152 N -4.52 0.58 0.23 1.05 0.63 -1.26 -4.55 116.66 108.82 2isa n ARG 152 Ca 0.19 0.37 0.12 0.00 -0.92 0.00 0.00 57.85 57.61 2isa n ARG 152 Cb 0.69 -1.57 0.37 0.00 0.45 0.00 0.00 32.46 32.40 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 0.21 -2.60 5.15 1.35 -1.96 -3.46 112.91 110.60 2isa h THR 153 Ca -0.56 -1.02 -0.33 0.00 -0.55 0.00 0.00 66.41 63.96 2isa h THR 153 Cb 1.48 1.85 -0.06 0.00 -1.73 0.00 0.00 68.15 69.69 2isa h THR 153 CO -0.34 0.10 -0.38 -3.20 -0.25 0.00 0.00 175.52 171.46 2isa n ASN 154 N -3.17 -4.65 -4.27 5.36 5.15 -0.24 -4.94 115.26 108.50 2isa n ASN 154 Ca 0.02 0.21 -0.16 0.00 -0.60 0.00 0.00 54.58 54.05 2isa n ASN 154 Cb 0.47 -4.02 -0.10 0.00 -0.53 0.00 0.00 39.78 35.59 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 -4.41 1.12 0.64 1.20 -1.94 -1.26 -4.77 119.30 109.87 2isa s MET 155 Ca 0.00 -1.42 -0.18 0.00 -1.71 0.00 0.00 55.69 52.38 2isa s MET 155 Cb 0.00 -0.84 -0.01 0.00 2.01 0.00 0.00 34.83 35.99 2isa s MET 155 CO 0.00 0.13 1.25 1.03 -0.01 0.00 0.00 175.02 177.42 2isa s ARG 156 N -3.38 2.67 -0.13 2.03 0.52 -1.26 -0.55 118.95 118.85 2isa s ARG 156 Ca 0.16 1.93 -0.00 0.00 -0.52 0.00 0.00 55.73 57.29 2isa s ARG 156 Cb -0.01 -1.88 0.03 0.00 0.52 0.00 0.00 34.95 33.61 2isa s ARG 156 CO 0.03 -1.47 -0.09 0.45 0.02 0.00 0.00 175.30 174.23 2isa s SER 157 N -1.56 2.40 0.23 0.23 0.15 -1.26 -4.84 113.70 109.05 2isa s SER 157 Ca 0.79 -0.39 -0.05 0.00 0.70 0.00 0.00 55.95 57.00 2isa s SER 157 Cb -0.34 -0.95 0.22 0.00 -1.71 0.00 0.00 66.02 63.25 2isa s SER 157 CO 0.38 -0.11 1.75 0.00 1.20 0.00 0.00 173.24 176.46 2isa h ALA 158 N 8.13 1.04 0.11 5.45 0.00 -1.93 -2.16 119.26 129.91 2isa h ALA 158 Ca -0.32 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 2isa h ALA 158 Cb 1.13 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2isa h ALA 158 CO 0.44 0.63 -0.05 -0.22 0.00 0.00 0.00 179.25 180.05 2isa h LYS 159 N 0.96 -0.14 -0.36 0.00 3.11 -1.94 -1.35 116.57 116.86 2isa h LYS 159 Ca 0.20 0.01 0.03 0.00 -2.81 0.00 0.00 60.65 58.08 2isa h LYS 159 Cb 0.36 0.03 -0.03 0.00 -1.00 0.00 0.00 32.23 31.59 2isa h LYS 159 CO 0.00 -0.08 0.16 -0.91 -2.81 0.00 0.00 179.45 175.82 2isa h ASN 160 N -0.16 0.22 0.10 4.20 -0.26 -1.84 0.23 115.58 118.08 2isa h ASN 160 Ca -0.01 0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.74 2isa h ASN 160 Cb 0.12 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.37 2isa h ASN 160 CO 0.02 0.17 -0.05 -1.13 -1.06 0.00 0.00 177.43 175.38 2isa h ASN 161 N 0.34 -0.12 0.87 5.81 -0.73 -1.27 -2.39 115.58 118.09 2isa h ASN 161 Ca 0.16 -0.06 -0.20 0.00 1.87 0.00 0.00 56.30 58.07 2isa h ASN 161 Cb 0.09 0.03 -0.02 0.00 0.27 0.00 0.00 38.32 38.68 2isa h ASN 161 CO -0.12 -0.02 -0.93 -0.50 -0.37 0.00 0.00 177.43 175.49 2isa h TRP 162 N -0.21 0.05 -0.40 0.67 4.06 -1.20 -0.94 115.95 117.99 2isa h TRP 162 Ca -0.01 -0.03 0.05 0.00 2.06 0.00 0.00 58.89 60.95 2isa h TRP 162 Cb 0.17 -0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.28 2isa h TRP 162 CO -0.05 0.94 0.14 0.22 -3.56 0.00 0.00 178.44 176.13 2isa h ASP 163 N 0.01 0.15 0.15 -3.49 3.58 -0.95 -0.63 116.42 115.24 2isa h ASP 163 Ca -0.02 0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.47 2isa h ASP 163 Cb 1.62 0.03 0.00 0.00 1.72 0.00 0.00 39.33 42.70 2isa h ASP 163 CO 0.12 0.12 -0.07 0.15 -2.88 0.00 0.00 179.24 176.69 2isa h PHE 164 N 0.30 -0.18 -0.85 0.28 3.57 -1.32 -2.61 116.94 116.13 2isa h PHE 164 Ca 0.18 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 2isa h PHE 164 Cb 0.16 0.06 -0.04 0.00 2.79 0.00 0.00 35.95 38.92 2isa h PHE 164 CO -0.15 0.09 0.50 -1.49 -2.23 0.00 0.00 178.31 175.04 2isa h TRP 165 N -0.46 1.13 0.00 0.41 6.55 -1.11 -1.92 115.95 120.55 2isa h TRP 165 Ca -0.02 -0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.81 2isa h TRP 165 Cb 0.36 -0.37 0.00 0.00 -0.86 0.00 0.00 29.16 28.29 2isa h TRP 165 CO 0.01 0.76 0.00 0.25 -1.05 0.00 0.00 178.44 178.41 2isa n THR 166 N -4.36 0.66 0.82 1.49 -2.24 -0.25 -2.35 114.28 108.05 2isa n THR 166 Ca 0.09 0.05 0.13 0.00 -2.27 0.00 0.00 64.05 62.05 2isa n THR 166 Cb 0.07 -0.86 0.38 0.00 -2.10 0.00 0.00 70.33 67.83 2isa n THR 166 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2isa n SER 167 N -1.99 0.46 -3.84 3.42 7.64 -0.73 -4.53 113.62 114.05 2isa n SER 167 Ca 0.04 0.26 -0.29 0.00 1.01 0.00 0.00 58.87 59.89 2isa n SER 167 Cb 0.29 -0.25 -0.13 0.00 -1.01 0.00 0.00 64.21 63.12 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 -3.63 4.01 0.52 -3.43 1.43 -0.99 -4.97 118.68 111.63 2isa s LEU 168 Ca 0.11 -3.29 0.26 0.00 -1.03 0.00 0.00 54.13 50.17 2isa s LEU 168 Cb 0.16 -1.44 1.39 0.00 0.03 0.00 0.00 46.19 46.33 2isa s LEU 168 CO 0.63 -0.17 1.97 1.55 0.23 0.00 0.00 176.35 180.56 2isa h PRO 169 N 6.02 0.03 -0.08 1.29 0.13 -1.80 0.19 132.00 137.78 2isa h PRO 169 Ca 0.05 -0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.20 2isa h PRO 169 Cb 0.84 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.96 2isa h PRO 169 CO 0.64 0.02 0.07 1.05 -0.23 0.00 0.00 178.00 179.55 2isa h GLU 170 N 0.03 0.00 0.00 0.86 9.09 -1.87 -2.19 114.58 120.51 2isa h GLU 170 Ca 0.29 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.70 2isa h GLU 170 Cb 1.13 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.23 2isa h GLU 170 CO -0.01 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.05 2isa n ALA 171 N -2.44 1.46 -0.30 1.06 0.00 0.67 -3.94 120.51 117.03 2isa n ALA 171 Ca -0.01 -0.03 -0.05 0.00 0.00 0.00 0.00 53.44 53.35 2isa n ALA 171 Cb 0.18 -1.15 0.07 0.00 0.00 0.00 0.00 19.45 18.55 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 1.00 -0.04 0.00 5.85 -1.56 -1.22 115.31 119.34 2isa h LEU 172 Ca 0.00 -0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.67 2isa h LEU 172 Cb 0.15 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.88 2isa h LEU 172 CO 0.00 0.80 -0.20 -0.74 -0.34 0.00 0.00 178.44 177.96 2isa h HIS 173 N 1.13 -0.52 -0.06 1.25 2.76 -1.82 0.21 115.15 118.10 2isa h HIS 173 Ca 0.29 0.02 -0.15 0.00 -2.20 0.00 0.00 60.37 58.33 2isa h HIS 173 Cb 0.00 0.24 -0.01 0.00 1.55 0.00 0.00 27.41 29.18 2isa h HIS 173 CO 0.00 -0.28 -0.64 0.37 -1.30 0.00 0.00 177.93 176.08 2isa h GLN 174 N -0.30 0.22 -0.68 5.26 5.75 -1.75 -2.58 115.11 121.04 2isa h GLN 174 Ca 0.07 -0.16 -0.00 0.00 -0.15 0.00 0.00 58.65 58.41 2isa h GLN 174 Cb 0.39 0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.94 2isa h GLN 174 CO -0.21 0.78 0.42 0.28 -2.65 0.00 0.00 178.83 177.45 2isa h VAL 175 N 0.16 1.19 -0.43 2.39 2.07 -0.93 -0.03 116.25 120.67 2isa h VAL 175 Ca -0.01 -0.39 0.04 0.00 0.82 0.00 0.00 66.70 67.15 2isa h VAL 175 Cb 1.16 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 31.12 2isa h VAL 175 CO 0.10 0.19 0.21 0.74 0.02 0.00 0.00 177.57 178.83 2isa h THR 176 N 0.92 0.96 -0.36 2.57 2.02 -0.80 0.15 112.91 118.37 2isa h THR 176 Ca 0.24 -0.15 -0.06 0.00 0.77 0.00 0.00 66.41 67.22 2isa h THR 176 Cb -0.06 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 2isa h THR 176 CO -0.05 0.08 0.01 0.40 0.37 0.00 0.00 175.52 176.33 2isa h ILE 177 N 0.43 1.26 0.00 3.11 2.04 -1.14 0.30 117.51 123.51 2isa h ILE 177 Ca 0.19 -0.97 -0.12 0.00 1.00 0.00 0.00 64.86 64.96 2isa h ILE 177 Cb 0.10 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 2isa h ILE 177 CO -0.13 0.32 -0.56 1.62 0.00 0.00 0.00 178.15 179.40 2isa h VAL 178 N 0.46 1.29 0.00 1.67 3.04 -0.84 -2.63 116.25 119.23 2isa h VAL 178 Ca 0.10 -1.98 0.00 0.00 -1.01 0.00 0.00 66.70 63.82 2isa h VAL 178 Cb 0.45 2.10 0.00 0.00 -2.01 0.00 0.00 31.29 31.83 2isa h VAL 178 CO 0.02 0.54 -0.15 0.23 -1.01 0.00 0.00 177.57 177.20 2isa n MET 179 N -3.72 0.25 -1.21 4.17 2.81 0.03 -4.06 117.12 115.39 2isa n MET 179 Ca -0.01 0.17 -0.28 0.00 -1.81 0.00 0.00 57.70 55.78 2isa n MET 179 Cb 0.59 -1.76 0.22 0.00 -0.71 0.00 0.00 33.22 31.56 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 -2.18 -1.38 0.29 7.83 3.41 0.08 -4.44 113.62 117.24 2isa n SER 180 Ca 0.05 -1.22 0.16 0.00 -0.26 0.00 0.00 58.87 57.60 2isa n SER 180 Cb 0.43 -0.94 0.89 0.00 -0.26 0.00 0.00 64.21 64.33 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 -2.31 0.00 -0.04 4.04 2.03 -1.86 -2.46 116.42 115.82 2isa h ASP 181 Ca -0.39 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.91 2isa h ASP 181 Cb 1.15 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.65 2isa h ASP 181 CO 0.26 0.05 0.00 0.54 -1.03 0.00 0.00 179.24 179.06 2isa n ARG 182 N -3.49 1.15 0.26 4.15 1.74 -1.26 -3.43 116.66 115.78 2isa n ARG 182 Ca -0.02 -0.23 0.15 0.00 -0.77 0.00 0.00 57.85 56.97 2isa n ARG 182 Cb 0.17 -1.25 0.66 0.00 -1.02 0.00 0.00 32.46 31.01 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 5.45 0.00 -6.94 -0.13 0.00 -1.51 -3.37 103.07 96.57 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 -0.75 -0.42 0.00 0.00 0.00 176.54 175.37 2isa s ILE 184 N -3.77 1.34 0.39 2.60 1.01 -1.22 -1.76 121.20 119.79 2isa s ILE 184 Ca 0.00 -2.58 -0.27 0.00 0.00 0.00 0.00 60.65 57.80 2isa s ILE 184 Cb 0.10 -1.93 -0.11 0.00 0.01 0.00 0.00 42.46 40.53 2isa s ILE 184 CO 0.57 -0.92 1.40 -2.65 0.00 0.00 0.00 174.94 173.33 2isa n PRO 185 N 3.48 2.36 -0.20 2.79 -0.02 -1.26 -0.43 135.00 141.72 2isa n PRO 185 Ca 0.10 0.83 -0.04 0.00 -2.02 0.00 0.00 63.50 62.37 2isa n PRO 185 Cb 0.35 -2.54 0.13 0.00 -0.02 0.00 0.00 33.50 31.43 2isa n PRO 185 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2isa h ALA 186 N 2.61 1.13 -2.70 3.55 0.00 -0.97 -3.42 119.26 119.44 2isa h ALA 186 Ca -0.49 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.09 2isa h ALA 186 Cb 1.26 -0.26 -0.12 0.00 0.00 0.00 0.00 17.79 18.68 2isa h ALA 186 CO 0.62 0.60 -0.33 0.95 0.00 0.00 0.00 179.25 181.10 2isa s THR 187 N -5.34 0.02 0.47 0.00 -4.23 -1.26 -4.90 115.64 100.39 2isa s THR 187 Ca -0.11 -1.58 0.17 0.00 -1.18 0.00 0.00 61.69 58.99 2isa s THR 187 Cb 0.15 -2.19 0.22 0.00 1.34 0.00 0.00 72.50 72.03 2isa s THR 187 CO 0.82 -0.09 2.05 1.88 -0.54 0.00 0.00 174.62 178.74 2isa h TYR 188 N 2.45 0.00 0.00 3.99 0.05 -1.88 -2.86 116.97 118.72 2isa h TYR 188 Ca -0.31 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.47 2isa h TYR 188 Cb 1.24 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.98 2isa h TYR 188 CO 0.38 0.13 0.00 0.00 -1.05 0.00 0.00 178.16 177.62 2isa h ARG 189 N 0.00 0.00 -0.62 4.88 3.08 -1.96 -3.32 114.38 116.44 2isa h ARG 189 Ca -0.00 0.00 -0.43 0.00 0.07 0.00 0.00 59.98 59.62 2isa h ARG 189 Cb 0.24 0.00 -0.28 0.00 0.08 0.00 0.00 29.97 30.01 2isa h ARG 189 CO 0.02 0.00 -0.30 0.72 -1.07 0.00 0.00 179.97 179.33 2isa n HIS 190 N -2.65 2.15 -4.18 3.04 8.25 -1.08 -4.48 115.22 116.27 2isa n HIS 190 Ca 0.02 -2.14 -0.11 0.00 -0.26 0.00 0.00 57.72 55.23 2isa n HIS 190 Cb 0.30 -0.57 -0.10 0.00 1.12 0.00 0.00 29.99 30.74 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 -3.52 0.87 0.51 -0.41 0.23 -1.25 -2.45 119.30 113.28 2isa s MET 191 Ca 0.51 -1.35 -0.04 0.00 -1.03 0.00 0.00 55.69 53.78 2isa s MET 191 Cb 0.42 -0.26 -0.01 0.00 -1.53 0.00 0.00 34.83 33.46 2isa s MET 191 CO 0.01 -0.01 0.79 -1.01 -2.03 0.00 0.00 175.02 172.78 2isa s HIS 192 N -3.59 3.33 0.16 3.16 3.76 -1.26 -4.36 115.29 116.49 2isa s HIS 192 Ca 0.13 0.56 0.09 0.00 -0.15 0.00 0.00 55.06 55.68 2isa s HIS 192 Cb 0.05 -2.48 -0.04 0.00 1.11 0.00 0.00 32.58 31.22 2isa s HIS 192 CO -0.04 -0.52 -0.19 0.20 -0.85 0.00 0.00 174.74 173.34 2isa s GLY 193 N -4.22 1.40 -0.10 -2.22 0.00 -0.21 -4.12 107.32 97.86 2isa s GLY 193 Ca 0.50 -1.47 -0.10 0.00 0.00 0.00 0.00 44.72 43.64 2isa s GLY 193 CO 0.43 -1.52 0.29 -1.36 0.00 0.00 0.00 173.10 170.94 2isa s PHE 194 N -1.93 -0.30 0.30 1.90 0.40 -0.12 0.73 117.98 118.96 2isa s PHE 194 Ca 0.15 0.72 0.25 0.00 -0.60 0.00 0.00 56.93 57.45 2isa s PHE 194 Cb -0.06 0.10 1.19 0.00 0.51 0.00 0.00 43.02 44.76 2isa s PHE 194 CO 0.07 -0.18 1.95 0.78 0.70 0.00 0.00 175.22 178.54 2isa h GLY 195 N 5.49 0.00 0.00 4.36 0.00 -1.58 -2.11 103.07 109.23 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 0.33 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.31 2isa n SER 196 N -3.56 0.00 -4.78 0.19 7.64 -1.26 -4.78 113.62 107.07 2isa n SER 196 Ca -0.01 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.54 2isa n SER 196 Cb 0.33 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.56 2isa n SER 196 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 2isa s HIS 197 N 0.00 2.77 0.09 1.43 3.76 -1.26 -4.76 115.29 117.32 2isa s HIS 197 Ca 0.00 1.54 -0.31 0.00 -0.15 0.00 0.00 55.06 56.14 2isa s HIS 197 Cb 0.00 -3.12 -0.08 0.00 1.11 0.00 0.00 32.58 30.48 2isa s HIS 197 CO 0.00 -1.45 1.53 0.99 -0.85 0.00 0.00 174.74 174.96 2isa s THR 198 N -2.30 3.10 0.00 1.30 2.01 -1.26 -4.65 115.64 113.84 2isa s THR 198 Ca 0.66 0.68 0.00 0.00 0.31 0.00 0.00 61.69 63.35 2isa s THR 198 Cb -0.19 -3.44 0.00 0.00 0.01 0.00 0.00 72.50 68.88 2isa s THR 198 CO 0.37 0.03 0.00 0.49 -0.69 0.00 0.00 174.62 174.82 2isa n PHE 199 N 4.74 -0.47 -4.12 4.92 3.01 0.97 -4.13 117.46 122.37 2isa n PHE 199 Ca 0.14 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.47 2isa n PHE 199 Cb 0.41 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.77 2isa n PHE 199 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2isa s SER 200 N -0.29 1.07 -0.06 4.37 1.04 -0.40 -1.56 113.70 117.87 2isa s SER 200 Ca 0.00 -0.76 0.01 0.00 0.48 0.00 0.00 55.95 55.68 2isa s SER 200 Cb 0.00 0.05 -0.03 0.00 0.10 0.00 0.00 66.02 66.14 2isa s SER 200 CO 0.00 -0.31 -0.07 -0.36 0.98 0.00 0.00 173.24 173.48 2isa s PHE 201 N -2.38 2.94 -0.12 5.02 0.08 0.61 -1.04 117.98 123.08 2isa s PHE 201 Ca 0.01 0.02 0.02 0.00 0.12 0.00 0.00 56.93 57.10 2isa s PHE 201 Cb -0.03 -1.70 0.01 0.00 -0.57 0.00 0.00 43.02 40.73 2isa s PHE 201 CO -0.02 0.34 -0.17 0.42 -0.10 0.00 0.00 175.22 175.70 2isa s ILE 202 N -0.83 1.65 0.77 0.64 -1.09 0.19 -1.14 121.20 121.38 2isa s ILE 202 Ca 0.13 -0.72 -0.02 0.00 -2.23 0.00 0.00 60.65 57.81 2isa s ILE 202 Cb -0.11 -1.50 0.15 0.00 -1.58 0.00 0.00 42.46 39.43 2isa s ILE 202 CO 0.02 0.47 1.05 0.54 -1.23 0.00 0.00 174.94 175.80 2isa s ASN 203 N 1.02 4.07 0.58 3.58 2.20 -0.92 -1.33 114.94 124.15 2isa s ASN 203 Ca -0.05 -0.42 0.28 0.00 -0.94 0.00 0.00 52.86 51.73 2isa s ASN 203 Cb -0.15 0.16 1.58 0.00 -2.00 0.00 0.00 41.25 40.85 2isa s ASN 203 CO -0.03 -2.06 2.04 0.28 -2.94 0.00 0.00 177.10 174.39 2isa h SER 204 N -0.71 0.00 -0.54 3.54 0.02 -1.87 -1.24 113.55 112.75 2isa h SER 204 Ca -0.36 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 2isa h SER 204 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 2isa h SER 204 CO 0.37 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.53 2isa n ASP 205 N -3.84 4.80 -2.33 3.07 8.00 -1.26 -4.93 116.55 120.06 2isa n ASP 205 Ca 0.04 -2.64 -0.14 0.00 0.71 0.00 0.00 54.79 52.76 2isa n ASP 205 Cb 0.43 -0.62 -0.01 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 0.74 -4.27 -4.82 -2.24 4.13 -0.47 -4.99 115.26 103.34 2isa n ASN 206 Ca 0.24 0.17 -0.35 0.00 1.68 0.00 0.00 54.58 56.32 2isa n ASN 206 Cb 0.97 -3.64 -0.06 0.00 -1.54 0.00 0.00 39.78 35.51 2isa n ASN 206 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 2isa s GLU 207 N -4.84 4.27 -0.13 3.52 2.02 -1.26 -4.68 118.70 117.60 2isa s GLU 207 Ca 0.00 0.94 -0.05 0.00 0.02 0.00 0.00 54.97 55.89 2isa s GLU 207 Cb 0.00 -2.72 -0.04 0.00 0.10 0.00 0.00 34.13 31.47 2isa s GLU 207 CO 0.00 0.29 0.04 0.50 0.02 0.00 0.00 175.26 176.11 2isa s ARG 208 N -2.28 3.45 -0.02 1.61 3.52 -1.26 -2.16 118.95 121.81 2isa s ARG 208 Ca 0.48 -0.36 0.05 0.00 -0.13 0.00 0.00 55.73 55.77 2isa s ARG 208 Cb -0.15 -3.00 -0.01 0.00 -1.56 0.00 0.00 34.95 30.23 2isa s ARG 208 CO 0.20 0.53 -0.17 0.71 -0.81 0.00 0.00 175.30 175.76 2isa s TYR 209 N -0.37 1.57 0.31 5.12 1.51 -0.29 -3.69 117.35 121.52 2isa s TYR 209 Ca 0.08 -0.33 -0.27 0.00 -1.01 0.00 0.00 57.07 55.55 2isa s TYR 209 Cb -0.12 -1.02 -0.10 0.00 -0.11 0.00 0.00 41.96 40.61 2isa s TYR 209 CO 0.02 -0.05 0.95 -1.58 -1.11 0.00 0.00 175.55 173.77 2isa s TRP 210 N -0.32 3.74 -0.02 2.71 0.52 0.21 -0.28 118.94 125.50 2isa s TRP 210 Ca 0.05 1.81 -0.04 0.00 0.02 0.00 0.00 56.10 57.94 2isa s TRP 210 Cb -0.08 -2.94 0.00 0.00 -1.15 0.00 0.00 33.47 29.31 2isa s TRP 210 CO -0.00 0.24 0.08 0.54 0.02 0.00 0.00 176.95 177.83 2isa s VAL 211 N -1.54 0.04 -0.04 4.03 0.11 -0.60 -0.50 120.40 121.89 2isa s VAL 211 Ca 0.49 -0.30 0.07 0.00 -2.93 0.00 0.00 61.98 59.31 2isa s VAL 211 Cb -0.20 -0.22 -0.02 0.00 -1.53 0.00 0.00 36.38 34.41 2isa s VAL 211 CO 0.25 -0.16 -0.25 -0.54 -3.33 0.00 0.00 175.10 171.07 2isa s LYS 212 N -0.51 2.31 -0.17 1.54 -0.14 -0.81 -0.02 119.74 121.94 2isa s LYS 212 Ca -0.06 -0.91 -0.07 0.00 -1.36 0.00 0.00 55.97 53.57 2isa s LYS 212 Cb -0.04 -2.11 -0.04 0.00 -1.68 0.00 0.00 37.83 33.96 2isa s LYS 212 CO 0.00 0.49 0.07 -0.06 -0.76 0.00 0.00 175.35 175.09 2isa s PHE 213 N -0.44 3.27 -0.03 3.18 0.08 -1.26 -2.00 117.98 120.79 2isa s PHE 213 Ca 0.05 0.12 0.05 0.00 0.12 0.00 0.00 56.93 57.27 2isa s PHE 213 Cb -0.11 -2.05 -0.01 0.00 -0.57 0.00 0.00 43.02 40.27 2isa s PHE 213 CO 0.01 0.22 -0.18 -1.01 -0.10 0.00 0.00 175.22 174.16 2isa s HIS 214 N 0.19 1.67 -0.25 0.36 3.76 0.57 -1.58 115.29 120.00 2isa s HIS 214 Ca 0.05 -0.39 0.03 0.00 -0.15 0.00 0.00 55.06 54.59 2isa s HIS 214 Cb -0.12 -1.10 0.06 0.00 1.11 0.00 0.00 32.58 32.53 2isa s HIS 214 CO 0.00 -0.09 -0.11 -0.06 -0.85 0.00 0.00 174.74 173.63 2isa s PHE 215 N -0.22 3.18 -0.26 1.40 0.40 0.22 -0.51 117.98 122.18 2isa s PHE 215 Ca 0.02 -2.25 -0.14 0.00 -0.60 0.00 0.00 56.93 53.96 2isa s PHE 215 Cb -0.09 -1.90 -0.04 0.00 0.51 0.00 0.00 43.02 41.50 2isa s PHE 215 CO 0.01 -0.87 0.34 0.08 0.70 0.00 0.00 175.22 175.47 2isa s VAL 216 N 1.13 5.21 0.15 -0.44 1.01 -0.15 -1.04 120.40 126.26 2isa s VAL 216 Ca -0.08 0.50 -0.31 0.00 0.00 0.00 0.00 61.98 62.09 2isa s VAL 216 Cb -0.20 -3.67 -0.10 0.00 0.00 0.00 0.00 36.38 32.42 2isa s VAL 216 CO -0.05 0.19 1.63 -0.55 0.00 0.00 0.00 175.10 176.32 2isa s SER 217 N 1.57 6.55 0.00 3.32 0.15 -1.26 -0.99 113.70 123.03 2isa s SER 217 Ca 0.14 2.64 0.29 0.00 0.70 0.00 0.00 55.95 59.71 2isa s SER 217 Cb -0.16 -2.59 1.19 0.00 -1.71 0.00 0.00 66.02 62.76 2isa s SER 217 CO 0.10 -0.87 1.84 0.00 1.20 0.00 0.00 173.24 175.50 2isa n GLN 218 N 4.47 0.66 0.01 5.44 6.02 -0.60 -3.31 117.38 130.07 2isa n GLN 218 Ca 0.15 -0.23 0.11 0.00 -0.01 0.00 0.00 57.00 57.02 2isa n GLN 218 Cb 0.38 -1.50 0.09 0.00 1.02 0.00 0.00 30.24 30.24 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 -0.97 0.07 0.00 -1.09 3.00 -1.26 -5.00 117.38 112.13 2isa n GLN 219 Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.13 2isa n GLN 219 Cb 0.28 -1.52 0.00 0.00 0.00 0.00 0.00 30.24 29.00 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 1.47 -1.00 3.71 1.08 0.00 -1.21 -4.92 105.19 104.32 2isa n GLY 220 Ca 0.04 -1.64 -0.38 0.00 0.00 0.00 0.00 46.02 44.04 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 -2.01 5.18 -0.03 -0.61 -1.09 -1.26 -4.26 121.20 117.12 2isa s ILE 221 Ca 0.00 0.91 -0.01 0.00 -2.23 0.00 0.00 60.65 59.32 2isa s ILE 221 Cb 0.00 -3.80 0.03 0.00 -1.58 0.00 0.00 42.46 37.10 2isa s ILE 221 CO 0.00 0.30 0.07 -0.54 -1.23 0.00 0.00 174.94 173.54 2isa s LYS 222 N 0.83 0.02 0.32 2.79 1.02 -1.03 -5.05 119.74 118.65 2isa s LYS 222 Ca 0.25 0.21 0.05 0.00 0.02 0.00 0.00 55.97 56.49 2isa s LYS 222 Cb -0.15 -0.16 -0.06 0.00 -0.52 0.00 0.00 37.83 36.94 2isa s LYS 222 CO 0.10 -0.13 0.03 -0.80 -0.92 0.00 0.00 175.35 173.63 2isa s ASN 223 N 0.83 2.57 -0.04 2.83 0.01 -1.26 -0.40 114.94 119.48 2isa s ASN 223 Ca -0.07 -1.33 0.07 0.00 -0.71 0.00 0.00 52.86 50.82 2isa s ASN 223 Cb -0.09 -0.13 -0.01 0.00 0.41 0.00 0.00 41.25 41.42 2isa s ASN 223 CO -0.03 -0.54 -0.25 -0.76 -1.51 0.00 0.00 177.10 174.01 2isa s LEU 224 N -3.49 2.06 0.89 0.60 1.43 0.43 -4.59 118.68 116.01 2isa s LEU 224 Ca 0.35 -0.49 -0.12 0.00 -1.03 0.00 0.00 54.13 52.84 2isa s LEU 224 Cb 0.08 -1.34 0.13 0.00 0.03 0.00 0.00 46.19 45.08 2isa s LEU 224 CO 0.15 0.27 1.09 -0.94 0.23 0.00 0.00 176.35 177.15 2isa s SER 225 N -0.35 3.51 0.23 2.29 1.04 -1.26 -4.49 113.70 114.66 2isa s SER 225 Ca 0.02 1.47 -0.06 0.00 0.48 0.00 0.00 55.95 57.86 2isa s SER 225 Cb -0.12 -2.15 0.31 0.00 0.10 0.00 0.00 66.02 64.16 2isa s SER 225 CO 0.02 -2.61 1.83 0.44 0.98 0.00 0.00 173.24 173.89 2isa h ASP 226 N -1.53 0.73 -0.26 7.02 3.32 -1.99 0.22 116.42 123.93 2isa h ASP 226 Ca -0.49 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 56.57 2isa h ASP 226 Cb 1.28 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 2isa h ASP 226 CO 0.55 0.46 0.10 0.00 -1.72 0.00 0.00 179.24 178.63 2isa h ALA 227 N 1.39 0.34 -0.48 3.45 0.00 -1.99 -0.09 119.26 121.88 2isa h ALA 227 Ca 0.35 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 2isa h ALA 227 Cb 0.20 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2isa h ALA 227 CO -0.18 -0.06 0.24 0.93 0.00 0.00 0.00 179.25 180.17 2isa h GLU 228 N 0.27 0.69 -0.63 0.00 5.08 -1.84 -2.42 114.58 115.73 2isa h GLU 228 Ca 0.09 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 2isa h GLU 228 Cb 0.19 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 2isa h GLU 228 CO -0.01 0.57 0.25 0.00 -1.00 0.00 0.00 179.01 178.83 2isa h ALA 229 N 1.08 0.81 -0.80 3.43 0.00 -0.47 -1.75 119.26 121.56 2isa h ALA 229 Ca 0.17 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2isa h ALA 229 Cb 0.10 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 2isa h ALA 229 CO -0.02 0.43 0.34 0.78 0.00 0.00 0.00 179.25 180.78 2isa h GLY 230 N 0.88 1.27 0.96 0.00 0.00 -0.91 0.71 103.07 105.98 2isa h GLY 230 Ca 0.21 -0.67 -0.04 0.00 0.00 0.00 0.00 47.33 46.84 2isa h GLY 230 CO -0.02 0.63 0.16 -2.09 0.00 0.00 0.00 176.54 175.22 2isa h GLU 231 N 1.16 0.73 -0.29 4.80 4.81 -1.26 -1.67 114.58 122.86 2isa h GLU 231 Ca 0.27 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 2isa h GLU 231 Cb 0.18 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 2isa h GLU 231 CO -0.03 0.69 0.10 1.25 -0.73 0.00 0.00 179.01 180.29 2isa h LEU 232 N 0.63 0.42 -0.65 1.64 5.85 -0.99 -2.96 115.31 119.24 2isa h LEU 232 Ca 0.15 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 2isa h LEU 232 Cb 0.25 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 2isa h LEU 232 CO -0.01 0.49 0.40 0.58 -0.34 0.00 0.00 178.44 179.56 2isa h VAL 233 N 0.32 1.19 -0.75 1.05 2.07 -0.82 0.13 116.25 119.44 2isa h VAL 233 Ca 0.10 -0.40 0.18 0.00 0.82 0.00 0.00 66.70 67.39 2isa h VAL 233 Cb 0.22 0.28 -0.04 0.00 -1.52 0.00 0.00 31.29 30.22 2isa h VAL 233 CO -0.01 0.19 0.52 1.23 0.02 0.00 0.00 177.57 179.52 2isa h GLY 234 N 0.88 0.47 0.98 2.17 0.00 -1.25 -2.45 103.07 103.86 2isa h GLY 234 Ca 0.23 -0.11 -0.31 0.00 0.00 0.00 0.00 47.33 47.14 2isa h GLY 234 CO -0.05 0.02 -1.72 3.43 0.00 0.00 0.00 176.54 178.23 2isa h ASN 235 N 0.25 0.18 -0.94 0.19 -0.26 -1.19 -3.48 115.58 110.33 2isa h ASN 235 Ca 0.37 -0.36 0.10 0.00 -0.56 0.00 0.00 56.30 55.86 2isa h ASN 235 Cb 1.08 -0.06 -0.21 0.00 -1.06 0.00 0.00 38.32 38.08 2isa h ASN 235 CO -0.09 1.31 -0.24 -0.62 -1.06 0.00 0.00 177.43 176.74 2isa s ASP 236 N -6.54 -1.31 0.00 5.81 2.15 0.38 -5.00 116.67 112.17 2isa s ASP 236 Ca -0.10 0.83 0.24 0.00 0.43 0.00 0.00 52.55 53.95 2isa s ASP 236 Cb 0.07 2.11 1.04 0.00 -0.30 0.00 0.00 42.92 45.84 2isa s ASP 236 CO 0.81 -0.25 1.78 0.54 -0.17 0.00 0.00 175.17 177.89 2isa n ARG 237 N 5.43 0.00 -0.68 4.34 3.00 -1.25 -3.79 116.66 123.71 2isa n ARG 237 Ca -0.01 0.08 -0.00 0.00 -0.01 0.00 0.00 57.85 57.91 2isa n ARG 237 Cb 0.51 -1.50 0.21 0.00 0.00 0.00 0.00 32.46 31.68 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 -1.51 2.11 -0.30 5.56 -0.58 -1.26 -0.70 120.64 123.97 2isa n GLU 238 Ca 0.06 -3.06 0.02 0.00 -0.42 0.00 0.00 57.16 53.76 2isa n GLU 238 Cb 0.29 -1.82 0.22 0.00 -0.57 0.00 0.00 31.44 29.56 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 1.17 0.94 0.76 1.62 4.64 -1.94 -0.75 113.55 119.99 2isa h SER 239 Ca 0.16 -0.01 -0.25 0.00 -0.47 0.00 0.00 61.79 61.22 2isa h SER 239 Cb 1.59 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 63.45 2isa h SER 239 CO 0.33 0.64 -1.22 0.45 -0.87 0.00 0.00 176.83 176.16 2isa h HIS 240 N 1.09 0.22 -0.35 4.77 3.86 -1.90 -1.81 115.15 121.01 2isa h HIS 240 Ca 0.36 -0.16 -0.01 0.00 -1.16 0.00 0.00 60.37 59.40 2isa h HIS 240 Cb 0.07 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 28.51 2isa h HIS 240 CO -0.00 1.14 0.17 0.37 0.86 0.00 0.00 177.93 180.47 2isa h GLN 241 N 0.03 0.51 -0.56 2.45 5.75 -1.86 -2.31 115.11 119.12 2isa h GLN 241 Ca -0.11 -0.08 0.03 0.00 -0.15 0.00 0.00 58.65 58.34 2isa h GLN 241 Cb 1.89 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 30.31 2isa h GLN 241 CO 0.15 0.47 0.34 -0.09 -2.65 0.00 0.00 178.83 177.05 2isa h ARG 242 N 0.43 0.65 -0.18 1.69 2.43 -1.11 -0.78 114.38 117.51 2isa h ARG 242 Ca 0.12 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.24 2isa h ARG 242 Cb 0.13 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 2isa h ARG 242 CO -0.01 0.43 0.06 0.22 -1.51 0.00 0.00 179.97 179.16 2isa h ASP 243 N 0.67 0.25 -0.08 -3.80 3.58 -1.26 -1.51 116.42 114.27 2isa h ASP 243 Ca 0.23 -0.18 -0.01 0.00 0.42 0.00 0.00 57.03 57.49 2isa h ASP 243 Cb 0.03 -0.06 -0.00 0.00 1.72 0.00 0.00 39.33 41.01 2isa h ASP 243 CO -0.10 0.36 0.01 0.25 -2.88 0.00 0.00 179.24 176.89 2isa h LEU 244 N 0.12 0.13 0.04 2.28 5.85 -1.23 -0.82 115.31 121.68 2isa h LEU 244 Ca 0.06 -0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.54 2isa h LEU 244 Cb 0.20 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 2isa h LEU 244 CO -0.00 0.35 -0.12 0.25 -0.34 0.00 0.00 178.44 178.58 2isa h LEU 245 N -0.10 -0.32 -0.79 2.25 5.85 -1.15 -2.49 115.31 118.56 2isa h LEU 245 Ca 0.02 0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 2isa h LEU 245 Cb 0.27 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 2isa h LEU 245 CO 0.00 -0.17 0.04 0.44 -0.34 0.00 0.00 178.44 178.41 2isa h ASP 246 N -0.22 0.92 -0.27 1.25 3.32 -1.28 -1.10 116.42 119.04 2isa h ASP 246 Ca 0.03 -0.23 0.02 0.00 0.02 0.00 0.00 57.03 56.87 2isa h ASP 246 Cb 0.25 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 2isa h ASP 246 CO -0.08 0.96 0.11 0.28 -1.72 0.00 0.00 179.24 178.78 2isa h SER 247 N 0.89 0.13 -0.30 6.45 0.02 -1.02 0.18 113.55 119.90 2isa h SER 247 Ca 0.17 0.02 -0.08 0.00 -0.84 0.00 0.00 61.79 61.06 2isa h SER 247 Cb 0.47 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 2isa h SER 247 CO 0.02 0.11 -0.12 0.40 -1.14 0.00 0.00 176.83 176.10 2isa h ILE 248 N 0.24 1.29 -0.11 3.27 2.04 -1.33 0.10 117.51 123.00 2isa h ILE 248 Ca 0.12 -1.20 0.02 0.00 1.00 0.00 0.00 64.86 64.80 2isa h ILE 248 Cb 0.07 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 2isa h ILE 248 CO -0.11 0.39 0.08 0.44 0.00 0.00 0.00 178.15 178.95 2isa h ASP 249 N 0.38 0.04 -0.15 1.72 3.32 -0.99 -0.36 116.42 120.38 2isa h ASP 249 Ca 0.07 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 2isa h ASP 249 Cb 0.63 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.17 2isa h ASP 249 CO 0.04 0.03 0.00 0.59 -1.72 0.00 0.00 179.24 178.18 2isa n ASN 250 N -4.51 1.21 -1.99 6.45 5.03 0.62 -4.92 115.26 117.15 2isa n ASN 250 Ca -0.01 -1.71 -0.19 0.00 0.87 0.00 0.00 54.58 53.54 2isa n ASN 250 Cb 0.16 -0.10 -0.03 0.00 -1.02 0.00 0.00 39.78 38.80 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 0.05 -1.47 -3.03 3.52 6.02 -0.15 -4.93 117.38 117.38 2isa n GLN 251 Ca 0.14 1.00 -0.44 0.00 -0.01 0.00 0.00 57.00 57.69 2isa n GLN 251 Cb 0.24 -5.49 0.01 0.00 1.02 0.00 0.00 30.24 26.02 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 -1.50 5.94 -4.65 1.08 4.64 0.30 -5.00 116.55 117.36 2isa n ASP 252 Ca -0.22 -3.24 -0.43 0.00 -1.38 0.00 0.00 54.79 49.53 2isa n ASP 252 Cb 0.66 -1.35 -0.02 0.00 -1.04 0.00 0.00 41.12 39.37 2isa n ASP 252 CO 0.00 0.00 0.00 -0.36 -0.82 0.00 0.00 177.20 176.02 2isa s PHE 253 N -1.72 2.47 0.44 -0.67 2.99 -1.26 -4.40 117.98 115.83 2isa s PHE 253 Ca 0.33 0.71 -0.24 0.00 0.00 0.00 0.00 56.93 57.73 2isa s PHE 253 Cb 0.00 -3.78 -0.08 0.00 0.00 0.00 0.00 43.02 39.16 2isa s PHE 253 CO 0.03 -2.41 1.16 -1.25 -0.00 0.00 0.00 175.22 172.75 2isa s PRO 254 N 4.03 3.88 0.04 0.24 0.04 -1.25 -4.80 135.00 137.19 2isa s PRO 254 Ca 0.63 1.77 0.03 0.00 0.04 0.00 0.00 61.00 63.47 2isa s PRO 254 Cb -0.24 -2.50 -0.02 0.00 0.04 0.00 0.00 34.50 31.78 2isa s PRO 254 CO 0.23 -0.45 -0.09 0.15 0.04 0.00 0.00 177.00 176.88 2isa s LYS 255 N -2.56 0.59 0.00 4.56 1.02 -1.26 -1.53 119.74 120.56 2isa s LYS 255 Ca 0.61 -0.76 0.01 0.00 0.02 0.00 0.00 55.97 55.85 2isa s LYS 255 Cb -0.29 -0.42 -0.01 0.00 -0.52 0.00 0.00 37.83 36.60 2isa s LYS 255 CO 0.35 0.08 -0.04 -1.58 -0.92 0.00 0.00 175.35 173.24 2isa s TRP 256 N -1.27 0.40 -0.25 3.18 0.51 -0.46 -1.56 118.94 119.50 2isa s TRP 256 Ca -0.07 -0.13 -0.15 0.00 -2.12 0.00 0.00 56.10 53.63 2isa s TRP 256 Cb -0.09 -0.25 -0.04 0.00 -0.81 0.00 0.00 33.47 32.27 2isa s TRP 256 CO 0.01 -0.02 0.37 0.99 -0.51 0.00 0.00 176.95 177.79 2isa s THR 257 N -0.27 5.19 -0.09 2.01 2.01 -0.17 -0.64 115.64 123.69 2isa s THR 257 Ca -0.00 0.60 -0.30 0.00 0.31 0.00 0.00 61.69 62.30 2isa s THR 257 Cb -0.03 -3.70 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 2isa s THR 257 CO -0.00 0.19 1.21 -0.22 -0.69 0.00 0.00 174.62 175.11 2isa s LEU 258 N 1.80 4.25 0.09 4.42 2.96 0.13 -0.98 118.68 131.35 2isa s LEU 258 Ca 0.16 1.77 0.07 0.00 -0.22 0.00 0.00 54.13 55.90 2isa s LEU 258 Cb -0.15 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 42.95 2isa s LEU 258 CO 0.09 -0.63 -0.18 -0.54 -1.32 0.00 0.00 176.35 173.77 2isa s LYS 259 N 2.56 1.01 0.10 1.98 1.02 0.33 -0.57 119.74 126.17 2isa s LYS 259 Ca 0.55 -1.06 0.08 0.00 0.02 0.00 0.00 55.97 55.56 2isa s LYS 259 Cb -0.24 -1.17 -0.03 0.00 -0.52 0.00 0.00 37.83 35.87 2isa s LYS 259 CO 0.20 0.27 -0.22 0.14 -0.92 0.00 0.00 175.35 174.82 2isa s VAL 260 N -1.18 1.77 -0.13 3.17 -7.23 0.11 -0.32 120.40 116.60 2isa s VAL 260 Ca 0.03 -1.55 -0.06 0.00 -1.81 0.00 0.00 61.98 58.59 2isa s VAL 260 Cb -0.10 -1.60 -0.04 0.00 0.56 0.00 0.00 36.38 35.20 2isa s VAL 260 CO 0.03 -0.03 0.08 -1.10 -0.31 0.00 0.00 175.10 173.77 2isa s GLN 261 N -1.89 3.47 -0.12 4.82 -0.21 -0.84 0.31 119.66 125.19 2isa s GLN 261 Ca 0.07 -0.27 -0.00 0.00 0.02 0.00 0.00 55.36 55.18 2isa s GLN 261 Cb -0.10 -3.09 0.03 0.00 1.00 0.00 0.00 33.01 30.85 2isa s GLN 261 CO 0.04 0.61 -0.07 0.42 -2.12 0.00 0.00 175.29 174.17 2isa s ILE 262 N -0.59 1.03 -0.21 1.08 1.01 -1.26 -1.93 121.20 120.34 2isa s ILE 262 Ca 0.11 -0.32 -0.01 0.00 0.00 0.00 0.00 60.65 60.43 2isa s ILE 262 Cb -0.12 -1.07 0.02 0.00 0.01 0.00 0.00 42.46 41.30 2isa s ILE 262 CO 0.02 0.34 -0.13 -0.32 0.00 0.00 0.00 174.94 174.85 2isa s MET 263 N 1.70 3.02 0.53 2.79 -2.45 0.34 -4.99 119.30 120.24 2isa s MET 263 Ca 0.04 -0.83 -0.22 0.00 -1.25 0.00 0.00 55.69 53.44 2isa s MET 263 Cb -0.13 -2.76 -0.06 0.00 1.25 0.00 0.00 34.83 33.12 2isa s MET 263 CO -0.08 -0.26 1.22 -2.30 1.05 0.00 0.00 175.02 174.66 2isa n PRO 264 N 4.66 1.52 -0.31 4.11 -0.02 -1.26 -0.62 135.00 143.08 2isa n PRO 264 Ca -0.19 0.56 0.23 0.00 -2.02 0.00 0.00 63.50 62.07 2isa n PRO 264 Cb 0.49 -2.40 0.52 0.00 -0.02 0.00 0.00 33.50 32.10 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 1.34 0.36 -0.29 -0.52 4.81 -1.94 -1.24 114.58 117.10 2isa h GLU 265 Ca -0.49 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 58.63 2isa h GLU 265 Cb 1.32 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.60 2isa h GLU 265 CO 0.56 0.24 -0.19 0.00 -0.73 0.00 0.00 179.01 178.89 2isa h ALA 266 N 1.60 1.13 0.00 2.92 0.00 -1.91 -3.09 119.26 119.91 2isa h ALA 266 Ca 0.57 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2isa h ALA 266 Cb 1.50 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 2isa h ALA 266 CO -0.26 0.55 -0.06 -0.44 0.00 0.00 0.00 179.25 179.03 2isa h ASP 267 N 0.48 0.00 -0.30 0.00 5.19 -1.57 -3.00 116.42 117.22 2isa h ASP 267 Ca 0.08 0.00 0.09 0.00 -0.62 0.00 0.00 57.03 56.58 2isa h ASP 267 Cb 0.60 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.10 2isa h ASP 267 CO 0.04 0.06 0.22 0.00 -3.12 0.00 0.00 179.24 176.45 2isa h ALA 268 N 1.94 2.26 0.00 3.45 0.00 -1.67 -0.02 119.26 125.22 2isa h ALA 268 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2isa h ALA 268 Cb 0.14 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2isa h ALA 268 CO 0.01 -0.38 -0.59 0.00 0.00 0.00 0.00 179.25 178.29 2isa n ALA 269 N -2.58 3.14 -0.03 0.00 0.00 -1.13 -4.35 120.51 115.55 2isa n ALA 269 Ca 0.04 -0.29 0.01 0.00 0.00 0.00 0.00 53.44 53.21 2isa n ALA 269 Cb 0.39 -1.15 -0.10 0.00 0.00 0.00 0.00 19.45 18.59 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 -1.88 0.36 -1.98 0.00 -2.24 -0.19 -5.01 114.28 103.33 2isa n THR 270 Ca 0.04 -0.39 -0.38 0.00 -2.27 0.00 0.00 64.05 61.05 2isa n THR 270 Cb 0.40 -0.18 0.02 0.00 -2.10 0.00 0.00 70.33 68.47 2isa n THR 270 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2isa s VAL 271 N -2.65 2.51 -1.89 2.28 -7.23 -0.24 -4.93 120.40 108.24 2isa s VAL 271 Ca -0.05 0.39 0.31 0.00 -1.81 0.00 0.00 61.98 60.82 2isa s VAL 271 Cb 0.06 -3.20 0.78 0.00 0.56 0.00 0.00 36.38 34.59 2isa s VAL 271 CO 0.53 0.00 2.15 -0.81 -0.31 0.00 0.00 175.10 176.66 2isa n PRO 272 N -0.68 0.90 -5.16 4.82 -0.04 -1.26 -4.71 135.00 128.87 2isa n PRO 272 Ca 0.08 -0.07 -0.31 0.00 -0.04 0.00 0.00 63.50 63.16 2isa n PRO 272 Cb 0.46 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.27 2isa n PRO 272 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 2isa s TYR 273 N -2.14 2.37 -0.20 0.54 -0.85 -1.26 -5.09 117.35 110.72 2isa s TYR 273 Ca 0.42 -0.40 -0.32 0.00 -0.52 0.00 0.00 57.07 56.25 2isa s TYR 273 Cb 0.21 -1.49 -0.09 0.00 0.38 0.00 0.00 41.96 40.98 2isa s TYR 273 CO 0.39 0.03 2.09 -1.71 -1.52 0.00 0.00 175.55 174.83 2isa n ASN 274 N 2.25 3.07 0.00 -0.18 2.85 -1.26 -4.85 115.26 117.15 2isa n ASN 274 Ca -0.16 0.55 0.13 0.00 -0.11 0.00 0.00 54.58 54.99 2isa n ASN 274 Cb 0.51 -1.41 0.70 0.00 1.24 0.00 0.00 39.78 40.82 2isa n ASN 274 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2isa n PRO 275 N 7.85 0.50 -0.21 1.20 -0.04 -1.26 -2.89 135.00 140.14 2isa n PRO 275 Ca 0.30 0.03 0.06 0.00 -0.04 0.00 0.00 63.50 63.85 2isa n PRO 275 Cb 0.33 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.45 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 -1.21 0.50 -3.03 0.54 3.72 -1.26 -4.62 117.46 112.10 2isa n PHE 276 Ca 0.15 -0.62 -0.43 0.00 -0.05 0.00 0.00 57.45 56.50 2isa n PHE 276 Cb 0.18 -0.11 -0.06 0.00 -0.94 0.00 0.00 39.48 38.55 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 -1.32 6.40 0.62 4.37 -1.08 -1.14 -4.32 116.67 120.20 2isa s ASP 277 Ca 0.25 -0.11 0.40 0.00 -0.52 0.00 0.00 52.55 52.57 2isa s ASP 277 Cb 0.17 -2.36 2.03 0.00 -1.46 0.00 0.00 42.92 41.30 2isa s ASP 277 CO 0.11 -0.82 2.23 0.25 0.52 0.00 0.00 175.17 177.46 2isa h LEU 278 N 9.87 0.00 -0.20 -1.34 5.85 -1.89 -0.54 115.31 127.06 2isa h LEU 278 Ca -0.25 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.47 2isa h LEU 278 Cb 1.09 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.12 2isa h LEU 278 CO 0.92 0.01 0.00 0.35 -0.34 0.00 0.00 178.44 179.38 2isa n THR 279 N -3.12 0.04 -4.27 1.05 -2.24 -1.26 -2.39 114.28 102.09 2isa n THR 279 Ca -0.02 -0.06 -0.21 0.00 -2.27 0.00 0.00 64.05 61.49 2isa n THR 279 Cb 0.16 -0.17 -0.12 0.00 -2.10 0.00 0.00 70.33 68.10 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 -1.96 1.10 0.39 -0.78 1.02 -0.21 -4.81 119.74 114.48 2isa s LYS 280 Ca 0.29 -1.21 0.06 0.00 0.02 0.00 0.00 55.97 55.13 2isa s LYS 280 Cb 0.14 -1.20 0.00 0.00 -0.52 0.00 0.00 37.83 36.25 2isa s LYS 280 CO 0.22 0.26 0.54 0.14 -0.92 0.00 0.00 175.35 175.59 2isa s VAL 281 N -1.59 3.57 -0.23 3.17 -7.23 -1.26 -4.86 120.40 111.97 2isa s VAL 281 Ca 0.08 -0.94 -0.16 0.00 -1.81 0.00 0.00 61.98 59.15 2isa s VAL 281 Cb -0.08 -3.23 -0.04 0.00 0.56 0.00 0.00 36.38 33.59 2isa s VAL 281 CO 0.04 -0.10 0.40 0.26 -0.31 0.00 0.00 175.10 175.39 2isa s TRP 282 N -2.31 3.32 0.20 2.82 0.51 -1.26 -5.05 118.94 117.17 2isa s TRP 282 Ca 0.50 0.54 -0.32 0.00 -2.12 0.00 0.00 56.10 54.69 2isa s TRP 282 Cb -0.10 -2.56 -0.14 0.00 -0.81 0.00 0.00 33.47 29.87 2isa s TRP 282 CO 0.33 -0.11 1.44 -2.30 -0.51 0.00 0.00 176.95 175.79 2isa n PRO 283 N 4.88 1.97 0.23 4.98 -0.02 -1.26 -4.82 135.00 140.96 2isa n PRO 283 Ca -0.08 0.70 0.12 0.00 -2.02 0.00 0.00 63.50 62.23 2isa n PRO 283 Cb 0.51 -2.38 0.73 0.00 -0.02 0.00 0.00 33.50 32.34 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 4.69 0.00 -0.93 6.00 3.86 -1.97 -0.90 115.15 125.89 2isa h HIS 284 Ca -0.45 0.00 0.19 0.00 -1.16 0.00 0.00 60.37 58.95 2isa h HIS 284 Cb 1.28 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 29.67 2isa h HIS 284 CO 0.58 0.00 0.60 -0.22 0.86 0.00 0.00 177.93 179.75 2isa h LYS 285 N 0.00 0.54 0.03 2.45 3.64 -2.00 -3.11 116.57 118.11 2isa h LYS 285 Ca 0.04 -0.03 -0.39 0.00 -1.27 0.00 0.00 60.65 59.00 2isa h LYS 285 Cb 0.18 -0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 31.82 2isa h LYS 285 CO -0.00 0.36 -2.36 -0.25 -2.27 0.00 0.00 179.45 174.93 2isa n ASP 286 N -4.58 2.01 -3.69 4.20 8.00 -0.45 -4.84 116.55 117.19 2isa n ASP 286 Ca 0.20 -0.03 -0.30 0.00 0.71 0.00 0.00 54.79 55.37 2isa n ASP 286 Cb 0.63 -0.54 -0.14 0.00 -0.02 0.00 0.00 41.12 41.05 2isa n ASP 286 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2isa s TYR 287 N -2.53 1.72 0.71 1.24 2.02 -0.57 -5.08 117.35 114.85 2isa s TYR 287 Ca -0.32 -2.02 -0.11 0.00 -0.37 0.00 0.00 57.07 54.24 2isa s TYR 287 Cb 0.09 -1.70 0.02 0.00 -0.40 0.00 0.00 41.96 39.96 2isa s TYR 287 CO 0.63 -0.83 1.07 -1.25 -1.57 0.00 0.00 175.55 173.60 2isa s PRO 288 N 1.02 2.77 0.19 -1.71 0.04 -1.18 -4.30 135.00 131.83 2isa s PRO 288 Ca 0.14 1.07 -0.30 0.00 0.04 0.00 0.00 61.00 61.95 2isa s PRO 288 Cb -0.21 -1.96 -0.08 0.00 0.04 0.00 0.00 34.50 32.28 2isa s PRO 288 CO -0.11 -1.24 1.20 -0.51 0.04 0.00 0.00 177.00 176.37 2isa s LEU 289 N -5.52 4.45 -0.21 -3.56 1.02 -1.26 -4.49 118.68 109.11 2isa s LEU 289 Ca 0.60 2.24 0.01 0.00 0.02 0.00 0.00 54.13 57.00 2isa s LEU 289 Cb -0.15 -3.61 0.03 0.00 0.02 0.00 0.00 46.19 42.48 2isa s LEU 289 CO 0.53 -0.37 -0.14 -0.63 0.02 0.00 0.00 176.35 175.76 2isa s ILE 290 N -0.11 2.31 0.23 -0.59 1.01 0.15 -4.87 121.20 119.33 2isa s ILE 290 Ca 0.52 -1.10 -0.30 0.00 0.00 0.00 0.00 60.65 59.78 2isa s ILE 290 Cb -0.33 -2.11 -0.09 0.00 0.01 0.00 0.00 42.46 39.94 2isa s ILE 290 CO 0.37 0.33 1.28 -0.70 0.00 0.00 0.00 174.94 176.23 2isa s GLU 291 N 1.26 4.41 -0.02 2.79 2.12 -1.26 0.07 118.70 128.07 2isa s GLU 291 Ca 0.01 2.05 -0.01 0.00 0.36 0.00 0.00 54.97 57.38 2isa s GLU 291 Cb -0.15 -3.17 -0.01 0.00 0.26 0.00 0.00 34.13 31.06 2isa s GLU 291 CO -0.09 -0.18 -0.03 0.28 -0.54 0.00 0.00 175.26 174.70 2isa n VAL 292 N 2.11 0.11 -3.69 3.70 0.31 0.26 -4.62 118.33 116.53 2isa n VAL 292 Ca 0.04 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 2isa n VAL 292 Cb 0.43 -1.40 0.00 0.00 -0.91 0.00 0.00 33.84 31.96 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 2.94 0.72 3.07 2.92 0.00 -1.16 -1.16 105.19 112.53 2isa n GLY 293 Ca -0.04 -0.80 -0.08 0.00 0.00 0.00 0.00 46.02 45.10 2isa n GLY 293 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2isa s GLU 294 N -1.57 0.55 0.09 1.61 -1.05 -0.48 0.20 118.70 118.05 2isa s GLU 294 Ca 0.00 -1.00 0.08 0.00 -0.15 0.00 0.00 54.97 53.90 2isa s GLU 294 Cb 0.00 0.20 -0.03 0.00 -0.44 0.00 0.00 34.13 33.85 2isa s GLU 294 CO 0.00 -0.11 -0.21 -0.59 0.95 0.00 0.00 175.26 175.30 2isa s PHE 295 N -3.16 1.84 0.09 4.83 -0.12 0.19 -0.52 117.98 121.13 2isa s PHE 295 Ca -0.00 -0.40 0.09 0.00 -0.05 0.00 0.00 56.93 56.57 2isa s PHE 295 Cb 0.02 -1.03 -0.03 0.00 -0.63 0.00 0.00 43.02 41.35 2isa s PHE 295 CO -0.07 0.19 -0.25 -1.83 -0.05 0.00 0.00 175.22 173.21 2isa s GLU 296 N -1.73 1.44 -0.25 1.99 -1.05 -0.44 -1.35 118.70 117.30 2isa s GLU 296 Ca 0.07 -1.19 -0.09 0.00 -0.15 0.00 0.00 54.97 53.60 2isa s GLU 296 Cb -0.10 -1.76 -0.04 0.00 -0.44 0.00 0.00 34.13 31.79 2isa s GLU 296 CO 0.04 0.43 0.13 -0.51 0.95 0.00 0.00 175.26 176.30 2isa s LEU 297 N -1.70 3.84 0.00 1.83 1.43 -0.58 -1.10 118.68 122.40 2isa s LEU 297 Ca 0.11 -0.03 0.00 0.00 -1.03 0.00 0.00 54.13 53.18 2isa s LEU 297 Cb -0.10 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.08 2isa s LEU 297 CO 0.04 0.00 0.26 -0.46 0.23 0.00 0.00 176.35 176.43 2isa n ASN 298 N 4.69 0.14 -3.73 2.29 0.23 -0.03 -3.78 115.26 115.07 2isa n ASN 298 Ca -0.15 -1.04 -0.16 0.00 -0.53 0.00 0.00 54.58 52.69 2isa n ASN 298 Cb 0.52 0.00 -0.16 0.00 -2.08 0.00 0.00 39.78 38.06 2isa n ASN 298 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 2isa s ARG 299 N -0.04 -0.03 0.18 -3.83 0.52 -0.84 -5.00 118.95 109.90 2isa s ARG 299 Ca 0.00 0.30 -0.30 0.00 -0.52 0.00 0.00 55.73 55.21 2isa s ARG 299 Cb 0.00 -0.32 -0.07 0.00 0.52 0.00 0.00 34.95 35.08 2isa s ARG 299 CO 0.00 -0.23 0.95 -0.80 0.02 0.00 0.00 175.30 175.25 2isa s ASN 300 N 1.50 7.58 0.52 0.23 0.02 -1.26 -0.70 114.94 122.82 2isa s ASN 300 Ca -0.04 1.88 -0.22 0.00 -1.02 0.00 0.00 52.86 53.45 2isa s ASN 300 Cb -0.12 -2.60 -0.06 0.00 0.02 0.00 0.00 41.25 38.48 2isa s ASN 300 CO -0.04 0.05 1.29 -2.65 0.02 0.00 0.00 177.10 175.77 2isa n PRO 301 N 2.11 1.67 -0.13 -0.60 -0.02 -1.26 -4.93 135.00 131.84 2isa n PRO 301 Ca 0.00 0.61 -0.11 0.00 -2.02 0.00 0.00 63.50 61.98 2isa n PRO 301 Cb 0.48 -2.48 -0.02 0.00 -0.02 0.00 0.00 33.50 31.46 2isa n PRO 301 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2isa h GLN 302 N 1.51 0.72 -3.88 -0.52 1.08 -2.00 -3.42 115.11 108.60 2isa h GLN 302 Ca -0.50 -0.25 -0.48 0.00 -1.45 0.00 0.00 58.65 55.97 2isa h GLN 302 Cb 1.31 -0.05 -0.38 0.00 -0.05 0.00 0.00 27.48 28.31 2isa h GLN 302 CO 0.57 0.84 -0.78 1.21 -0.95 0.00 0.00 178.83 179.72 2isa s ASN 303 N -6.28 1.95 0.11 1.46 3.84 -1.26 -5.05 114.94 109.71 2isa s ASN 303 Ca -0.13 -0.25 -0.18 0.00 0.21 0.00 0.00 52.86 52.52 2isa s ASN 303 Cb 0.10 -0.60 -0.05 0.00 -0.55 0.00 0.00 41.25 40.15 2isa s ASN 303 CO 0.80 -0.18 1.64 0.22 -2.79 0.00 0.00 177.10 176.79 2isa h TYR 304 N 8.26 0.46 0.03 0.43 5.03 -1.97 -2.27 116.97 126.94 2isa h TYR 304 Ca -0.23 -0.04 0.01 0.00 2.58 0.00 0.00 58.73 61.05 2isa h TYR 304 Cb 1.13 -0.14 -0.02 0.00 1.55 0.00 0.00 36.73 39.25 2isa h TYR 304 CO 0.46 0.47 -0.09 0.35 -1.32 0.00 0.00 178.16 178.03 2isa h PHE 305 N 0.32 -0.22 -0.01 -3.82 3.57 -1.96 0.24 116.94 115.05 2isa h PHE 305 Ca 0.10 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.47 2isa h PHE 305 Cb 0.21 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 2isa h PHE 305 CO -0.00 -0.14 -0.62 0.00 -2.23 0.00 0.00 178.31 175.32 2isa h ALA 306 N 0.79 0.95 0.00 2.41 0.00 -1.97 -1.76 119.26 119.69 2isa h ALA 306 Ca 0.03 -0.56 -0.21 0.00 0.00 0.00 0.00 54.91 54.16 2isa h ALA 306 Cb 0.19 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2isa h ALA 306 CO -0.07 0.77 -1.80 0.39 0.00 0.00 0.00 179.25 178.54 2isa n GLU 307 N -3.81 1.89 -0.10 0.00 1.02 -0.86 -4.37 120.64 114.41 2isa n GLU 307 Ca -0.01 0.01 -0.18 0.00 -0.02 0.00 0.00 57.16 56.95 2isa n GLU 307 Cb 0.62 -1.30 -0.06 0.00 -0.02 0.00 0.00 31.44 30.68 2isa n GLU 307 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2isa n VAL 308 N -2.49 1.30 -0.27 2.62 0.31 0.69 -3.77 118.33 116.71 2isa n VAL 308 Ca -0.20 -0.14 -0.04 0.00 -0.01 0.00 0.00 64.34 63.95 2isa n VAL 308 Cb 0.87 -1.94 0.07 0.00 -0.91 0.00 0.00 33.84 31.92 2isa n VAL 308 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2isa h GLU 309 N -0.80 0.97 -0.00 5.55 4.57 -1.04 -1.95 114.58 121.88 2isa h GLU 309 Ca -0.37 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 57.75 2isa h GLU 309 Cb 1.26 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 29.63 2isa h GLU 309 CO -0.23 0.64 -0.04 1.04 -1.18 0.00 0.00 179.01 179.24 2isa n GLN 310 N -4.58 0.74 -1.74 1.92 6.02 -0.67 -4.88 117.38 114.20 2isa n GLN 310 Ca 0.07 -0.14 -0.42 0.00 -0.01 0.00 0.00 57.00 56.50 2isa n GLN 310 Cb 0.03 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 29.78 2isa n GLN 310 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2isa n ALA 311 N -1.01 2.30 -3.91 -1.58 0.00 -0.74 -4.89 120.51 110.68 2isa n ALA 311 Ca 0.17 0.37 -0.27 0.00 0.00 0.00 0.00 53.44 53.71 2isa n ALA 311 Cb 0.23 -2.43 -0.17 0.00 0.00 0.00 0.00 19.45 17.08 2isa n ALA 311 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2isa s ALA 312 N -0.23 1.42 -0.25 0.00 0.00 -1.26 -5.03 121.76 116.40 2isa s ALA 312 Ca 0.62 -0.65 -0.06 0.00 0.00 0.00 0.00 51.96 51.87 2isa s ALA 312 Cb -0.51 -0.98 -0.01 0.00 0.00 0.00 0.00 23.12 21.61 2isa s ALA 312 CO 0.52 -0.51 0.04 -0.06 0.00 0.00 0.00 175.76 175.75 2isa s PHE 313 N 1.67 3.06 -0.25 0.00 0.40 -1.26 -4.95 117.98 116.65 2isa s PHE 313 Ca 0.04 -0.69 -0.02 0.00 -0.60 0.00 0.00 56.93 55.66 2isa s PHE 313 Cb -0.13 -2.20 0.02 0.00 0.51 0.00 0.00 43.02 41.22 2isa s PHE 313 CO -0.08 -0.46 -0.06 1.21 0.70 0.00 0.00 175.22 176.53 2isa s ASN 314 N 1.55 4.32 0.59 1.36 3.04 -1.26 -4.92 114.94 119.63 2isa s ASN 314 Ca 0.05 -0.80 0.29 0.00 0.04 0.00 0.00 52.86 52.44 2isa s ASN 314 Cb -0.15 -1.68 1.44 0.00 -1.54 0.00 0.00 41.25 39.32 2isa s ASN 314 CO 0.01 -0.12 1.85 -0.65 -3.04 0.00 0.00 177.10 175.16 2isa h PRO 315 N 8.03 0.00 0.00 0.43 0.11 -1.85 0.11 132.00 138.83 2isa h PRO 315 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2isa h PRO 315 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2isa h PRO 315 CO 0.58 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.37 2isa n ALA 316 N -2.32 1.91 -2.64 -0.75 0.00 -1.26 -4.41 120.51 111.04 2isa n ALA 316 Ca 0.09 -0.01 -0.43 0.00 0.00 0.00 0.00 53.44 53.09 2isa n ALA 316 Cb 0.72 -1.38 -0.00 0.00 0.00 0.00 0.00 19.45 18.79 2isa n ALA 316 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2isa s ASN 317 N -3.72 6.85 0.40 0.00 0.02 0.38 -4.94 114.94 113.93 2isa s ASN 317 Ca 0.08 -2.47 0.08 0.00 -1.02 0.00 0.00 52.86 49.53 2isa s ASN 317 Cb 0.12 -2.55 -0.03 0.00 0.02 0.00 0.00 41.25 38.81 2isa s ASN 317 CO 0.42 -1.12 0.32 0.54 0.02 0.00 0.00 177.10 177.28 2isa s VAL 318 N 3.84 2.74 0.15 1.60 0.11 -1.26 -0.71 120.40 126.87 2isa s VAL 318 Ca 0.52 -1.42 0.07 0.00 -2.93 0.00 0.00 61.98 58.21 2isa s VAL 318 Cb 0.03 -3.02 -0.04 0.00 -1.53 0.00 0.00 36.38 31.81 2isa s VAL 318 CO 0.05 -0.03 -0.15 0.68 -3.33 0.00 0.00 175.10 172.32 2isa s VAL 319 N -2.47 1.52 0.16 2.04 -7.23 -1.25 -4.82 120.40 108.35 2isa s VAL 319 Ca 0.45 -1.92 -0.34 0.00 -1.81 0.00 0.00 61.98 58.37 2isa s VAL 319 Cb -0.02 -1.76 -0.16 0.00 0.56 0.00 0.00 36.38 35.00 2isa s VAL 319 CO 0.27 -0.47 1.26 -2.65 -0.31 0.00 0.00 175.10 173.19 2isa n PRO 320 N 0.18 1.32 0.00 4.82 -0.02 -1.26 -0.25 135.00 139.79 2isa n PRO 320 Ca -0.13 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 2isa n PRO 320 Cb 0.58 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 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 2.24 2.60 2.97 -1.23 0.00 -1.26 -3.38 105.19 107.12 2isa n GLY 321 Ca 0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.72 0.82 0.00 -0.61 1.01 0.65 -0.63 121.20 119.72 2isa s ILE 322 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.33 2isa s ILE 322 Cb 0.00 -0.77 0.00 0.00 0.01 0.00 0.00 42.46 41.70 2isa s ILE 322 CO 0.00 0.28 0.00 -0.24 0.00 0.00 0.00 174.94 174.98 2isa n SER 323 N 3.73 0.00 -0.95 3.58 2.88 -0.21 -3.92 113.62 118.73 2isa n SER 323 Ca -0.23 -0.53 0.00 0.00 -1.33 0.00 0.00 58.87 56.78 2isa n SER 323 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 2isa n SER 323 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2isa n PHE 324 N 0.00 -1.14 -3.96 0.66 3.72 -1.26 -1.27 117.46 114.20 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 -0.06 0.00 -0.94 0.00 0.00 39.48 38.48 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 -0.03 0.00 4.37 1.04 -1.26 -3.06 113.70 113.76 2isa s SER 325 Ca 0.00 -0.88 0.00 0.00 0.48 0.00 0.00 55.95 55.55 2isa s SER 325 Cb 0.00 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.62 2isa s SER 325 CO 0.00 -0.99 0.47 -0.81 0.98 0.00 0.00 173.24 172.90 2isa n PRO 326 N -0.29 0.92 -1.58 4.02 -0.04 -1.26 -4.62 135.00 132.16 2isa n PRO 326 Ca -0.05 0.00 -0.46 0.00 -0.04 0.00 0.00 63.50 62.95 2isa n PRO 326 Cb 0.63 -1.45 -0.05 0.00 -0.04 0.00 0.00 33.50 32.59 2isa n PRO 326 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2isa n ASP 327 N 0.05 3.03 -0.25 3.54 -0.08 -1.26 -4.85 116.55 116.73 2isa n ASP 327 Ca 0.00 0.48 0.16 0.00 -1.51 0.00 0.00 54.79 53.92 2isa n ASP 327 Cb 0.24 -1.43 0.45 0.00 2.34 0.00 0.00 41.12 42.72 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 12.70 0.51 -0.23 -0.67 1.57 -1.80 -0.89 116.57 127.76 2isa h LYS 328 Ca -0.39 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.31 2isa h LYS 328 Cb 1.27 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 2isa h LYS 328 CO 0.97 0.34 -0.05 0.52 -0.57 0.00 0.00 179.45 180.66 2isa h MET 329 N 0.52 0.44 -0.79 3.15 2.86 -1.89 -2.17 114.93 117.05 2isa h MET 329 Ca 0.46 -0.17 0.03 0.00 -2.06 0.00 0.00 59.70 57.96 2isa h MET 329 Cb 0.98 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.57 2isa h MET 329 CO -0.20 0.67 0.51 1.25 1.06 0.00 0.00 176.91 180.20 2isa h LEU 330 N 0.18 0.85 -0.35 1.22 5.85 -1.69 -2.71 115.31 118.65 2isa h LEU 330 Ca 0.06 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.81 2isa h LEU 330 Cb 0.51 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 2isa h LEU 330 CO 0.02 0.59 0.12 1.56 -0.34 0.00 0.00 178.44 180.39 2isa h GLN 331 N 1.00 0.25 -0.99 1.25 1.08 -1.00 -2.32 115.11 114.39 2isa h GLN 331 Ca 0.31 -0.02 0.04 0.00 -1.45 0.00 0.00 58.65 57.53 2isa h GLN 331 Cb -0.02 -0.06 -0.06 0.00 -0.05 0.00 0.00 27.48 27.29 2isa h GLN 331 CO -0.10 0.17 0.65 0.78 -0.95 0.00 0.00 178.83 179.38 2isa h GLY 332 N 0.26 1.46 2.00 3.46 0.00 -1.29 -2.47 103.07 106.48 2isa h GLY 332 Ca 0.16 -0.49 -0.03 0.00 0.00 0.00 0.00 47.33 46.97 2isa h GLY 332 CO -0.17 0.42 -0.13 3.21 0.00 0.00 0.00 176.54 179.87 2isa h ARG 333 N 1.25 0.00 0.00 4.80 3.08 -1.10 -2.16 114.38 120.24 2isa h ARG 333 Ca 0.40 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.43 2isa h ARG 333 Cb 0.02 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.06 2isa h ARG 333 CO -0.13 0.13 -0.10 -0.07 -1.07 0.00 0.00 179.97 178.73 2isa h LEU 334 N 0.00 0.00 0.00 3.04 3.38 -1.02 -3.06 115.31 117.65 2isa h LEU 334 Ca -0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 2isa h LEU 334 Cb 0.33 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2isa h LEU 334 CO 0.02 0.10 -0.77 0.15 0.09 0.00 0.00 178.44 178.02 2isa h PHE 335 N 0.00 0.00 -0.21 1.13 3.57 -1.51 -3.44 116.94 116.48 2isa h PHE 335 Ca -0.00 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.44 2isa h PHE 335 Cb 0.29 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 2isa h PHE 335 CO 0.00 0.94 -0.13 0.00 -2.23 0.00 0.00 178.31 176.89 2isa h ALA 336 N -0.57 1.39 0.04 2.41 0.00 -1.38 -3.03 119.26 118.12 2isa h ALA 336 Ca -0.18 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 2isa h ALA 336 Cb 0.96 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2isa h ALA 336 CO -0.11 0.42 -0.02 1.88 0.00 0.00 0.00 179.25 181.42 2isa h TYR 337 N 0.33 -0.05 -0.77 0.00 -1.99 -1.82 0.15 116.97 112.82 2isa h TYR 337 Ca 0.06 -0.00 0.10 0.00 2.00 0.00 0.00 58.73 60.89 2isa h TYR 337 Cb 0.42 0.02 -0.07 0.00 2.00 0.00 0.00 36.73 39.10 2isa h TYR 337 CO 0.01 0.62 0.41 0.78 -0.00 0.00 0.00 178.16 179.99 2isa h GLY 338 N -0.84 1.18 0.64 3.88 0.00 -1.85 0.04 103.07 106.12 2isa h GLY 338 Ca -0.01 -0.27 0.01 0.00 0.00 0.00 0.00 47.33 47.06 2isa h GLY 338 CO 0.01 0.09 -0.27 -1.80 0.00 0.00 0.00 176.54 174.57 2isa h ASP 339 N 0.69 -0.73 -0.73 0.19 3.58 -1.47 -0.81 116.42 117.14 2isa h ASP 339 Ca 0.38 0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.89 2isa h ASP 339 Cb 0.37 0.26 -0.04 0.00 1.72 0.00 0.00 39.33 41.65 2isa h ASP 339 CO -0.26 -0.38 0.43 0.00 -2.88 0.00 0.00 179.24 176.16 2isa h ALA 340 N 0.12 1.37 -0.12 -0.78 0.00 -0.56 -2.97 119.26 116.33 2isa h ALA 340 Ca 0.00 -0.09 -0.21 0.00 0.00 0.00 0.00 54.91 54.61 2isa h ALA 340 Cb 0.52 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2isa h ALA 340 CO -0.09 0.54 -0.77 1.96 0.00 0.00 0.00 179.25 180.88 2isa h GLN 341 N 1.03 0.64 -0.80 0.00 4.20 -0.76 -0.17 115.11 119.25 2isa h GLN 341 Ca 0.27 -0.53 0.03 0.00 0.06 0.00 0.00 58.65 58.47 2isa h GLN 341 Cb -0.02 0.11 -0.05 0.00 0.30 0.00 0.00 27.48 27.83 2isa h GLN 341 CO -0.05 1.15 0.51 0.00 -0.67 0.00 0.00 178.83 179.78 2isa h ARG 342 N 0.43 0.97 0.09 1.46 3.08 -1.11 0.20 114.38 119.51 2isa h ARG 342 Ca -0.05 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 59.94 2isa h ARG 342 Cb 1.39 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 31.22 2isa h ARG 342 CO 0.15 0.64 -0.04 -0.92 -1.07 0.00 0.00 179.97 178.73 2isa h TYR 343 N 1.00 -0.11 -0.19 3.04 3.20 -1.39 -1.04 116.97 121.48 2isa h TYR 343 Ca 0.32 -0.00 -0.13 0.00 3.14 0.00 0.00 58.73 62.06 2isa h TYR 343 Cb 0.00 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 2isa h TYR 343 CO -0.03 0.19 -0.42 -0.09 -1.64 0.00 0.00 178.16 176.17 2isa h ARG 344 N -0.42 0.44 0.00 1.82 2.43 -0.77 -3.36 114.38 114.52 2isa h ARG 344 Ca -0.01 -0.23 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 2isa h ARG 344 Cb 0.35 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 2isa h ARG 344 CO 0.02 0.79 -0.29 1.28 -1.51 0.00 0.00 179.97 180.25 2isa n LEU 345 N -4.02 0.00 0.00 3.80 4.77 0.69 -4.50 117.00 117.74 2isa n LEU 345 Ca -0.02 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.66 2isa n LEU 345 Cb 0.51 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 2isa n LEU 345 CO 0.44 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 2isa n GLY 346 N 1.34 2.27 0.32 -0.72 0.00 -0.39 -4.45 105.19 103.55 2isa n GLY 346 Ca 0.00 -1.76 0.09 0.00 0.00 0.00 0.00 46.02 44.35 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 0.97 -0.68 1.61 3.04 -1.87 -2.57 116.25 116.74 2isa h VAL 347 Ca 0.00 -0.11 -0.24 0.00 -1.01 0.00 0.00 66.70 65.34 2isa h VAL 347 Cb 0.00 0.63 -0.15 0.00 -2.01 0.00 0.00 31.29 29.77 2isa h VAL 347 CO 0.00 0.06 0.31 0.59 -1.01 0.00 0.00 177.57 177.52 2isa n ASN 348 N -4.48 4.23 0.21 3.17 3.02 -1.26 -4.60 115.26 115.56 2isa n ASN 348 Ca 0.05 -3.10 0.14 0.00 -0.03 0.00 0.00 54.58 51.64 2isa n ASN 348 Cb 0.23 -0.73 0.75 0.00 -0.61 0.00 0.00 39.78 39.42 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 1.95 0.00 0.00 3.10 2.07 -1.67 -1.38 115.15 119.22 2isa h HIS 349 Ca 0.30 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.82 2isa h HIS 349 Cb 2.22 0.00 0.00 0.00 2.57 0.00 0.00 27.41 32.20 2isa h HIS 349 CO 1.16 0.00 0.00 1.04 -3.07 0.00 0.00 177.93 177.06 2isa n GLN 350 N -2.49 0.81 0.00 5.12 6.02 -1.26 -1.85 117.38 123.73 2isa n GLN 350 Ca -0.02 0.00 0.13 0.00 -0.01 0.00 0.00 57.00 57.11 2isa n GLN 350 Cb 0.07 -1.50 0.47 0.00 1.02 0.00 0.00 30.24 30.30 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 -1.09 0.00 -2.08 1.08 8.25 -0.52 -3.22 115.22 117.64 2isa n HIS 351 Ca 0.21 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.25 2isa n HIS 351 Cb 0.15 -0.26 -0.03 0.00 1.12 0.00 0.00 29.99 30.98 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 -2.74 3.47 0.29 1.59 1.01 -0.77 -4.85 121.20 119.21 2isa s ILE 352 Ca 0.20 0.82 -0.04 0.00 0.00 0.00 0.00 60.65 61.63 2isa s ILE 352 Cb 0.19 -3.53 0.44 0.00 0.01 0.00 0.00 42.46 39.57 2isa s ILE 352 CO 0.56 -0.02 1.56 -0.65 0.00 0.00 0.00 174.94 176.39 2isa h PRO 353 N 8.38 0.00 -0.51 2.79 0.11 -1.88 0.11 132.00 140.99 2isa h PRO 353 Ca -0.39 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2isa h PRO 353 Cb 1.18 -0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 2isa h PRO 353 CO 0.93 0.00 0.33 -0.24 -0.21 0.00 0.00 178.00 178.81 2isa h VAL 354 N 0.00 1.14 0.00 3.15 3.04 -1.90 -2.25 116.25 119.43 2isa h VAL 354 Ca 0.52 -0.26 0.00 0.00 -1.01 0.00 0.00 66.70 65.95 2isa h VAL 354 Cb 0.92 0.39 0.00 0.00 -2.01 0.00 0.00 31.29 30.59 2isa h VAL 354 CO -0.99 0.13 -0.33 0.59 -1.01 0.00 0.00 177.57 175.96 2isa n ASN 355 N -4.45 0.61 -4.74 3.17 3.02 0.30 -4.92 115.26 108.25 2isa n ASN 355 Ca 0.05 0.26 -0.41 0.00 -0.03 0.00 0.00 54.58 54.45 2isa n ASN 355 Cb 0.06 -0.21 -0.03 0.00 -0.61 0.00 0.00 39.78 38.98 2isa n ASN 355 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2isa s ALA 356 N -3.10 3.44 0.52 5.41 0.00 -0.77 -4.85 121.76 122.40 2isa s ALA 356 Ca 0.09 0.96 -0.20 0.00 0.00 0.00 0.00 51.96 52.81 2isa s ALA 356 Cb 0.14 -3.41 -0.07 0.00 0.00 0.00 0.00 23.12 19.78 2isa s ALA 356 CO 0.65 -0.37 1.10 -2.14 0.00 0.00 0.00 175.76 175.01 2isa s PRO 357 N -0.36 3.54 0.04 0.00 0.02 -1.26 -4.97 135.00 132.01 2isa s PRO 357 Ca 0.52 1.55 0.22 0.00 0.02 0.00 0.00 61.00 63.31 2isa s PRO 357 Cb -0.33 -2.08 -0.17 0.00 0.02 0.00 0.00 34.50 31.94 2isa s PRO 357 CO 0.37 -0.68 0.76 0.54 -0.33 0.00 0.00 177.00 177.67 2isa n ARG 358 N -1.10 0.50 -1.49 5.54 3.00 -1.26 -4.96 116.66 116.89 2isa n ARG 358 Ca 0.10 -0.07 -0.29 0.00 -0.01 0.00 0.00 57.85 57.58 2isa n ARG 358 Cb 0.51 -1.60 0.18 0.00 0.00 0.00 0.00 32.46 31.55 2isa n ARG 358 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2isa n PRO 360 N -4.08 2.11 -4.21 0.00 -0.02 -1.26 -4.99 135.00 122.55 2isa n PRO 360 Ca 0.11 0.76 -0.20 0.00 -2.02 0.00 0.00 63.50 62.14 2isa n PRO 360 Cb 0.59 -2.47 -0.16 0.00 -0.02 0.00 0.00 33.50 31.44 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 0.33 0.59 -0.43 -1.45 0.11 -1.26 -4.91 120.40 113.37 2isa s VAL 361 Ca 0.72 -0.16 0.05 0.00 -2.93 0.00 0.00 61.98 59.66 2isa s VAL 361 Cb -0.65 -0.60 0.17 0.00 -1.53 0.00 0.00 36.38 33.77 2isa s VAL 361 CO 0.45 0.23 0.44 -2.28 -3.33 0.00 0.00 175.10 170.61 2isa s HIS 362 N 0.85 0.27 -2.33 1.54 2.46 -1.26 -5.04 115.29 111.79 2isa s HIS 362 Ca -0.12 -1.74 0.25 0.00 0.47 0.00 0.00 55.06 53.92 2isa s HIS 362 Cb -0.15 -0.56 0.47 0.00 -0.13 0.00 0.00 32.58 32.22 2isa s HIS 362 CO 0.01 -0.96 1.40 -1.13 -2.47 0.00 0.00 174.74 171.59 2isa n SER 363 N 3.01 1.92 0.00 9.88 3.41 -1.26 -4.97 113.62 125.61 2isa n SER 363 Ca 0.25 -1.49 0.00 0.00 -0.26 0.00 0.00 58.87 57.37 2isa n SER 363 Cb 0.49 0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.61 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 0.23 0.00 -1.70 7.33 9.36 -1.26 -4.95 117.16 126.17 2isa n TYR 364 Ca 0.13 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.93 2isa n TYR 364 Cb 0.45 0.00 -0.01 0.00 -0.63 0.00 0.00 39.34 39.15 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 2.28 -4.38 2.98 -0.00 -1.26 -4.98 115.22 109.86 2isa n HIS 365 Ca 0.00 0.53 -0.27 0.00 -0.00 0.00 0.00 57.72 57.98 2isa n HIS 365 Cb 0.00 -2.43 -0.11 0.00 -0.00 0.00 0.00 29.99 27.45 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 -1.61 1.70 5.56 -0.41 1.81 -1.26 -4.99 118.95 119.75 2isa s ARG 366 Ca 0.58 -1.43 0.00 0.00 -1.72 0.00 0.00 55.73 53.16 2isa s ARG 366 Cb -0.58 -1.96 0.00 0.00 -0.45 0.00 0.00 34.95 31.96 2isa s ARG 366 CO 0.60 0.41 0.00 -0.25 -0.68 0.00 0.00 175.30 175.38 2isa n ASP 367 N 0.22 0.00 -0.02 0.23 8.00 -1.26 -5.03 116.55 118.69 2isa n ASP 367 Ca -0.12 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.38 2isa n ASP 367 Cb 0.56 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 -2.36 3.76 0.44 0.00 -1.26 -4.77 105.19 101.01 2isa n GLY 368 Ca 0.00 -1.46 -0.39 0.00 0.00 0.00 0.00 46.02 44.16 2isa n GLY 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2isa s ALA 369 N -2.62 3.20 -1.19 4.61 0.00 -1.26 -3.74 121.76 120.76 2isa s ALA 369 Ca 0.00 1.36 -0.09 0.00 0.00 0.00 0.00 51.96 53.23 2isa s ALA 369 Cb 0.00 -3.55 -0.02 0.00 0.00 0.00 0.00 23.12 19.55 2isa s ALA 369 CO 0.00 -1.07 0.78 -1.33 0.00 0.00 0.00 175.76 174.14 2isa n MET 370 N -0.18 -2.93 -2.88 0.00 2.81 -1.26 -4.46 117.12 108.22 2isa n MET 370 Ca 0.05 0.61 -0.43 0.00 -1.81 0.00 0.00 57.70 56.13 2isa n MET 370 Cb 0.43 -4.93 -0.04 0.00 -0.71 0.00 0.00 33.22 27.96 2isa n MET 370 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 2isa s ARG 371 N -5.62 3.33 0.00 0.03 6.06 -1.25 -4.87 118.95 116.64 2isa s ARG 371 Ca 0.28 -0.28 0.04 0.00 -2.50 0.00 0.00 55.73 53.27 2isa s ARG 371 Cb -0.08 -4.04 0.00 0.00 0.06 0.00 0.00 34.95 30.90 2isa s ARG 371 CO 0.81 -1.41 0.44 1.33 -2.50 0.00 0.00 175.30 173.98 2isa n VAL 372 N 6.15 0.00 1.14 7.11 0.24 -1.26 -4.72 118.33 126.99 2isa n VAL 372 Ca 0.01 -0.47 0.13 0.00 -2.04 0.00 0.00 64.34 61.97 2isa n VAL 372 Cb 0.47 1.05 0.35 0.00 -1.47 0.00 0.00 33.84 34.25 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 -0.27 0.68 0.00 -1.34 5.75 -1.26 -4.92 116.55 115.19 2isa n ASP 373 Ca 0.02 -0.50 0.00 0.00 -0.01 0.00 0.00 54.79 54.29 2isa n ASP 373 Cb 0.08 0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.31 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 1.41 1.30 2.43 6.12 0.00 -1.26 -4.72 105.19 110.48 2isa n GLY 374 Ca 0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 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 -5.68 -1.57 1.61 5.15 -1.26 -1.01 115.26 112.50 2isa n ASN 375 Ca 0.00 -0.04 -0.19 0.00 -0.60 0.00 0.00 54.58 53.75 2isa n ASN 375 Cb 0.00 -4.69 -0.07 0.00 -0.53 0.00 0.00 39.78 34.49 2isa n ASN 375 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2isa n PHE 376 N -4.06 -0.17 0.00 1.20 3.01 -1.26 -4.83 117.46 111.34 2isa n PHE 376 Ca -0.22 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.24 2isa n PHE 376 Cb 0.67 -3.27 0.00 0.00 -0.01 0.00 0.00 39.48 36.87 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 -0.74 2.90 0.46 1.37 0.00 -0.18 -1.69 105.19 107.31 2isa n GLY 377 Ca -0.19 0.08 0.12 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 3.03 1.39 -4.66 1.61 7.64 -1.26 -4.94 113.62 116.44 2isa n SER 378 Ca 0.00 -1.58 -0.47 0.00 1.01 0.00 0.00 58.87 57.83 2isa n SER 378 Cb 0.00 -0.06 -0.04 0.00 -1.01 0.00 0.00 64.21 63.10 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 0.12 0.03 -1.33 0.44 -1.04 -0.68 -4.92 114.28 106.90 2isa n THR 379 Ca 0.17 -0.01 -0.36 0.00 -2.04 0.00 0.00 64.05 61.82 2isa n THR 379 Cb 0.30 -1.44 0.09 0.00 -1.82 0.00 0.00 70.33 67.46 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 3.45 3.18 -0.59 -4.42 -0.00 -1.26 -4.96 117.00 112.40 2isa n LEU 380 Ca 0.18 0.65 0.06 0.00 -0.00 0.00 0.00 56.01 56.89 2isa n LEU 380 Cb 0.27 -1.39 0.15 0.00 -0.00 0.00 0.00 43.42 42.46 2isa n LEU 380 CO 0.64 -2.17 0.63 0.61 -0.00 0.00 0.00 177.39 177.10 2isa n GLY 381 N 1.14 3.11 3.40 1.47 0.00 -1.26 -5.01 105.19 108.04 2isa n GLY 381 Ca 0.13 -0.48 -0.28 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.41 2.31 -0.12 1.61 1.13 -1.26 -5.09 117.35 114.51 2isa s TYR 382 Ca 0.24 -0.37 -0.08 0.00 -1.41 0.00 0.00 57.07 55.45 2isa s TYR 382 Cb 0.15 -1.22 0.04 0.00 -1.10 0.00 0.00 41.96 39.84 2isa s TYR 382 CO 0.12 0.39 0.30 -2.00 -2.51 0.00 0.00 175.55 171.85 2isa s GLU 383 N -2.25 0.30 0.57 -3.49 -6.30 -1.26 -4.31 118.70 101.96 2isa s GLU 383 Ca 0.16 0.56 -0.20 0.00 -2.50 0.00 0.00 54.97 52.99 2isa s GLU 383 Cb -0.09 -0.00 -0.04 0.00 0.00 0.00 0.00 34.13 33.99 2isa s GLU 383 CO 0.07 -0.12 1.21 -1.25 0.02 0.00 0.00 175.26 175.19 2isa s PRO 384 N 0.94 3.10 0.21 4.30 0.04 -1.26 -5.20 135.00 137.13 2isa s PRO 384 Ca -0.06 1.85 -0.09 0.00 0.04 0.00 0.00 61.00 62.74 2isa s PRO 384 Cb -0.07 -2.02 -0.01 0.00 0.04 0.00 0.00 34.50 32.44 2isa s PRO 384 CO -0.07 -1.11 0.34 0.54 0.04 0.00 0.00 177.00 176.74 2isa s ASN 385 N -1.51 0.00 -0.11 6.66 2.20 -1.26 -5.06 114.94 115.85 2isa s ASN 385 Ca 0.75 -1.01 0.14 0.00 -0.94 0.00 0.00 52.86 51.80 2isa s ASN 385 Cb -0.31 0.49 0.59 0.00 -2.00 0.00 0.00 41.25 40.03 2isa s ASN 385 CO 0.34 -1.00 1.46 -0.90 -2.94 0.00 0.00 177.10 174.06 2isa n ASP 386 N -0.31 4.08 -0.34 3.54 5.75 -1.26 -4.08 116.55 123.94 2isa n ASP 386 Ca -0.03 -2.44 0.03 0.00 -0.01 0.00 0.00 54.79 52.35 2isa n ASP 386 Cb 0.63 -0.55 0.07 0.00 -1.03 0.00 0.00 41.12 40.24 2isa n ASP 386 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2isa n GLN 387 N 0.77 1.66 -1.35 0.11 6.02 -1.26 -4.98 117.38 118.35 2isa n GLN 387 Ca 0.21 -1.44 -0.12 0.00 -0.01 0.00 0.00 57.00 55.64 2isa n GLN 387 Cb 0.80 -1.15 -0.05 0.00 1.02 0.00 0.00 30.24 30.85 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 0.23 1.25 3.82 1.08 0.00 -1.26 -4.98 105.19 105.34 2isa n GLY 388 Ca 0.06 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 2isa n GLY 388 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2isa s GLN 389 N -2.91 4.21 -1.31 1.61 2.00 -1.26 -3.98 119.66 118.02 2isa s GLN 389 Ca 0.00 0.86 -0.05 0.00 -2.00 0.00 0.00 55.36 54.17 2isa s GLN 389 Cb 0.00 -2.72 0.01 0.00 0.80 0.00 0.00 33.01 31.11 2isa s GLN 389 CO 0.00 0.30 1.03 0.91 -0.50 0.00 0.00 175.29 177.03 2isa n TRP 390 N 0.35 -2.44 -2.34 1.67 7.02 -1.26 -4.78 117.44 115.66 2isa n TRP 390 Ca 0.00 0.95 -0.43 0.00 -1.02 0.00 0.00 57.50 57.01 2isa n TRP 390 Cb 0.52 -4.87 -0.02 0.00 -2.42 0.00 0.00 31.31 24.51 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 -3.38 3.64 1.04 6.99 0.00 -1.26 -5.01 121.76 123.79 2isa s ALA 391 Ca 0.30 0.57 -0.12 0.00 0.00 0.00 0.00 51.96 52.71 2isa s ALA 391 Cb -0.13 -3.64 0.21 0.00 0.00 0.00 0.00 23.12 19.56 2isa s ALA 391 CO 0.75 -1.18 1.07 -1.83 0.00 0.00 0.00 175.76 174.58 2isa s GLU 392 N 3.46 0.07 -0.57 0.00 -1.05 -1.26 -5.00 118.70 114.35 2isa s GLU 392 Ca 0.59 0.92 0.05 0.00 -0.15 0.00 0.00 54.97 56.38 2isa s GLU 392 Cb -0.24 -1.66 0.20 0.00 -0.44 0.00 0.00 34.13 31.98 2isa s GLU 392 CO 0.18 -3.08 0.51 1.04 0.95 0.00 0.00 175.26 174.86 2isa n GLN 393 N -4.48 1.39 0.30 -4.83 6.02 -1.26 -4.96 117.38 109.55 2isa n GLN 393 Ca 0.06 -4.00 0.19 0.00 -0.01 0.00 0.00 57.00 53.24 2isa n GLN 393 Cb 0.54 -1.96 0.92 0.00 1.02 0.00 0.00 30.24 30.76 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 4.97 0.00 -0.33 -1.09 0.13 -2.01 -1.71 132.00 131.96 2isa h PRO 394 Ca 0.18 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 65.41 2isa h PRO 394 Cb 0.79 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.91 2isa h PRO 394 CO 0.61 0.00 0.32 -0.44 -0.23 0.00 0.00 178.00 178.27 2isa h ASP 395 N 0.00 0.00 -0.50 1.44 3.32 -2.04 -1.98 116.42 116.66 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 0.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.81 2isa h ASP 395 CO 0.00 0.00 0.00 0.49 -1.72 0.00 0.00 179.24 178.01 2isa n PHE 396 N -3.90 0.66 -1.74 4.55 3.72 -0.64 -4.96 117.46 115.14 2isa n PHE 396 Ca 0.05 -0.33 -0.42 0.00 -0.05 0.00 0.00 57.45 56.70 2isa n PHE 396 Cb 0.48 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.01 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 1.02 3.87 -4.87 4.37 2.88 -0.75 -4.99 113.62 115.15 2isa n SER 397 Ca 0.18 1.14 -0.31 0.00 -1.33 0.00 0.00 58.87 58.54 2isa n SER 397 Cb 0.44 -1.59 -0.05 0.00 -0.75 0.00 0.00 64.21 62.26 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 -0.42 3.85 0.61 -1.46 2.02 -1.26 -5.06 118.70 116.98 2isa s GLU 398 Ca 0.65 0.42 -0.17 0.00 0.02 0.00 0.00 54.97 55.89 2isa s GLU 398 Cb -0.50 -2.52 -0.02 0.00 0.10 0.00 0.00 34.13 31.19 2isa s GLU 398 CO 0.48 0.18 1.12 -1.25 0.02 0.00 0.00 175.26 175.81 2isa s PRO 399 N -3.14 3.02 0.82 0.39 0.04 -1.26 -5.00 135.00 129.86 2isa s PRO 399 Ca 0.50 1.51 -0.13 0.00 0.04 0.00 0.00 61.00 62.92 2isa s PRO 399 Cb -0.11 -1.97 0.09 0.00 0.04 0.00 0.00 34.50 32.55 2isa s PRO 399 CO 0.23 -1.10 1.18 -2.14 0.04 0.00 0.00 177.00 175.21 2isa s PRO 400 N -3.73 1.61 -0.22 0.56 0.02 -1.26 -5.03 135.00 126.96 2isa s PRO 400 Ca 0.70 1.67 -0.04 0.00 0.02 0.00 0.00 61.00 63.35 2isa s PRO 400 Cb -0.22 -1.78 -0.01 0.00 0.02 0.00 0.00 34.50 32.51 2isa s PRO 400 CO 0.35 -2.21 -0.05 -1.17 -0.33 0.00 0.00 177.00 173.59 2isa s LEU 401 N -5.84 2.88 0.49 -5.54 2.96 -1.26 -5.09 118.68 107.28 2isa s LEU 401 Ca 0.71 -0.39 -0.24 0.00 -0.22 0.00 0.00 54.13 53.99 2isa s LEU 401 Cb -0.26 -1.73 -0.07 0.00 0.50 0.00 0.00 46.19 44.62 2isa s LEU 401 CO 0.52 -0.02 1.40 0.20 -1.32 0.00 0.00 176.35 177.13 2isa s ASN 402 N 1.46 5.65 0.12 3.68 0.02 -1.26 -5.02 114.94 119.59 2isa s ASN 402 Ca 0.06 2.87 0.07 0.00 -1.02 0.00 0.00 52.86 54.83 2isa s ASN 402 Cb -0.14 -2.65 -0.04 0.00 0.02 0.00 0.00 41.25 38.44 2isa s ASN 402 CO -0.03 -1.33 -0.16 -0.76 0.02 0.00 0.00 177.10 174.84 2isa s LEU 403 N -3.02 2.38 -0.15 0.60 1.02 -1.26 -5.15 118.68 113.10 2isa s LEU 403 Ca 0.65 -0.78 -0.08 0.00 0.02 0.00 0.00 54.13 53.94 2isa s LEU 403 Cb -0.43 -0.65 0.05 0.00 0.02 0.00 0.00 46.19 45.18 2isa s LEU 403 CO 0.53 -0.08 0.36 -0.62 0.02 0.00 0.00 176.35 176.56 2isa s ASP 404 N -2.32 -0.44 0.00 2.29 -1.08 -1.26 -5.15 116.67 108.71 2isa s ASP 404 Ca 0.08 0.78 0.00 0.00 -0.52 0.00 0.00 52.55 52.90 2isa s ASP 404 Cb -0.07 0.67 0.00 0.00 -1.46 0.00 0.00 42.92 42.06 2isa s ASP 404 CO 0.04 -0.18 0.00 0.61 0.52 0.00 0.00 175.17 176.16 2isa n GLY 405 N 4.19 2.40 3.80 2.66 0.00 -1.26 -5.08 105.19 111.91 2isa n GLY 405 Ca -0.23 -1.97 -0.31 0.00 0.00 0.00 0.00 46.02 43.50 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 -2.71 2.52 -0.20 4.61 0.00 -1.26 -4.98 121.76 119.75 2isa s ALA 406 Ca 0.00 0.18 -0.29 0.00 0.00 0.00 0.00 51.96 51.84 2isa s ALA 406 Cb 0.00 -3.22 -0.02 0.00 0.00 0.00 0.00 23.12 19.88 2isa s ALA 406 CO 0.00 -1.41 1.48 0.00 0.00 0.00 0.00 175.76 175.82 2isa s ALA 407 N -2.95 3.44 0.24 0.00 0.00 -1.26 -4.97 121.76 116.25 2isa s ALA 407 Ca 0.60 0.46 -0.19 0.00 0.00 0.00 0.00 51.96 52.83 2isa s ALA 407 Cb -0.15 -3.77 0.03 0.00 0.00 0.00 0.00 23.12 19.22 2isa s ALA 407 CO 0.54 -1.65 0.63 0.00 0.00 0.00 0.00 175.76 175.28 2isa s ALA 408 N 4.45 -1.08 -1.09 0.00 0.00 -1.26 -5.07 121.76 117.72 2isa s ALA 408 Ca 0.65 -0.26 -0.17 0.00 0.00 0.00 0.00 51.96 52.18 2isa s ALA 408 Cb -0.24 0.89 0.13 0.00 0.00 0.00 0.00 23.12 23.90 2isa s ALA 408 CO 0.25 -0.93 1.34 -1.01 0.00 0.00 0.00 175.76 175.41 2isa s HIS 409 N -3.90 3.20 0.07 0.00 3.76 -1.26 -5.01 115.29 112.15 2isa s HIS 409 Ca 0.11 -1.67 -0.31 0.00 -0.15 0.00 0.00 55.06 53.04 2isa s HIS 409 Cb -0.04 -4.38 -0.06 0.00 1.11 0.00 0.00 32.58 29.22 2isa s HIS 409 CO 0.03 -1.52 1.21 -1.58 -0.85 0.00 0.00 174.74 172.02 2isa s TRP 410 N 2.57 3.43 -0.34 1.40 0.52 -1.26 -4.96 118.94 120.30 2isa s TRP 410 Ca 0.40 1.29 -0.29 0.00 0.02 0.00 0.00 56.10 57.52 2isa s TRP 410 Cb -0.03 -3.43 0.00 0.00 -1.15 0.00 0.00 33.47 28.86 2isa s TRP 410 CO -0.04 -1.33 1.37 0.34 0.02 0.00 0.00 176.95 177.31 2isa s ASP 411 N 1.00 6.51 0.58 2.95 2.15 -1.26 -4.90 116.67 123.70 2isa s ASP 411 Ca 0.59 1.09 0.36 0.00 0.43 0.00 0.00 52.55 55.02 2isa s ASP 411 Cb -0.30 -2.54 1.71 0.00 -0.30 0.00 0.00 42.92 41.49 2isa s ASP 411 CO 0.30 -1.24 2.12 1.12 -0.17 0.00 0.00 175.17 177.30 2isa h HIS 412 N 9.98 0.00 0.00 -5.34 2.07 -1.96 -2.65 115.15 117.24 2isa h HIS 412 Ca -0.27 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.25 2isa h HIS 412 Cb 1.11 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.09 2isa h HIS 412 CO 0.92 0.02 0.00 0.54 -3.07 0.00 0.00 177.93 176.34 2isa n ARG 413 N -3.16 0.74 0.18 5.12 1.74 -1.26 -1.44 116.66 118.58 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 -1.43 0.61 0.00 -1.02 0.00 0.00 32.46 30.85 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 0.09 -5.25 5.56 4.81 -1.89 -3.35 114.58 114.55 2isa h GLU 414 Ca 0.00 -0.01 -0.66 0.00 -0.13 0.00 0.00 59.36 58.56 2isa h GLU 414 Cb 0.00 -0.02 -0.16 0.00 0.63 0.00 0.00 28.75 29.20 2isa h GLU 414 CO 0.00 0.06 0.21 0.34 -0.73 0.00 0.00 179.01 178.89 2isa s ASP 415 N -6.88 6.26 -0.01 1.04 -1.08 -0.52 -4.92 116.67 110.55 2isa s ASP 415 Ca -0.06 -0.72 0.21 0.00 -0.52 0.00 0.00 52.55 51.46 2isa s ASP 415 Cb 0.17 -2.34 0.62 0.00 -1.46 0.00 0.00 42.92 39.92 2isa s ASP 415 CO 0.69 -0.99 1.52 -0.62 0.52 0.00 0.00 175.17 176.29 2isa n GLU 416 N 6.57 2.71 -2.59 4.34 1.02 -1.26 -4.76 120.64 126.68 2isa n GLU 416 Ca -0.04 -2.52 -0.42 0.00 -0.02 0.00 0.00 57.16 54.16 2isa n GLU 416 Cb 0.46 -1.57 -0.01 0.00 -0.02 0.00 0.00 31.44 30.30 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 -0.99 6.74 -0.01 1.62 -1.08 -1.26 -4.61 116.67 117.07 2isa s ASP 417 Ca 0.47 -2.14 0.22 0.00 -0.52 0.00 0.00 52.55 50.57 2isa s ASP 417 Cb 0.25 -2.57 -0.28 0.00 -1.46 0.00 0.00 42.92 38.86 2isa s ASP 417 CO 0.31 -1.27 0.61 -1.22 0.52 0.00 0.00 175.17 174.12 2isa n TYR 418 N 8.47 0.06 -0.00 -5.34 4.01 -1.26 -4.74 117.16 118.36 2isa n TYR 418 Ca 0.43 0.02 0.00 0.00 -0.16 0.00 0.00 57.90 58.19 2isa n TYR 418 Cb 0.48 -0.43 -0.01 0.00 -0.31 0.00 0.00 39.34 39.07 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 -2.13 0.00 0.01 -0.72 3.72 -1.26 -4.63 117.46 112.45 2isa n PHE 419 Ca -0.02 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.26 2isa n PHE 419 Cb 0.52 -0.03 -0.06 0.00 -0.94 0.00 0.00 39.48 38.97 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 0.06 -0.34 4.37 4.64 -1.88 -1.92 113.55 118.48 2isa h SER 420 Ca -0.01 -0.05 -0.02 0.00 -0.47 0.00 0.00 61.79 61.24 2isa h SER 420 Cb 0.31 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 2isa h SER 420 CO 0.00 0.09 0.12 1.56 -0.87 0.00 0.00 176.83 177.73 2isa h GLN 421 N 0.03 0.52 -0.97 4.77 4.20 -1.91 -0.66 115.11 121.09 2isa h GLN 421 Ca 0.02 -0.11 0.17 0.00 0.06 0.00 0.00 58.65 58.79 2isa h GLN 421 Cb 0.04 -0.08 -0.09 0.00 0.30 0.00 0.00 27.48 27.65 2isa h GLN 421 CO -0.00 0.54 0.61 -1.35 -0.67 0.00 0.00 178.83 177.95 2isa h PRO 422 N 0.40 0.71 -0.50 1.46 0.11 -1.83 -1.60 132.00 130.76 2isa h PRO 422 Ca 0.11 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.13 2isa h PRO 422 Cb 0.22 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 31.15 2isa h PRO 422 CO -0.01 0.47 0.11 0.78 -0.21 0.00 0.00 178.00 179.15 2isa h GLY 423 N 0.73 0.86 0.69 -0.55 0.00 -0.69 -0.65 103.07 103.47 2isa h GLY 423 Ca 0.52 -0.55 0.05 0.00 0.00 0.00 0.00 47.33 47.35 2isa h GLY 423 CO -0.29 0.51 0.22 -0.55 0.00 0.00 0.00 176.54 176.43 2isa h ASP 424 N 0.69 0.29 -0.11 0.19 3.32 -0.62 -0.69 116.42 119.49 2isa h ASP 424 Ca 0.15 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.23 2isa h ASP 424 Cb 0.35 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.88 2isa h ASP 424 CO 0.00 0.21 0.04 0.25 -1.72 0.00 0.00 179.24 178.02 2isa h LEU 425 N 0.43 0.16 -0.50 1.55 5.85 -1.21 -2.81 115.31 118.78 2isa h LEU 425 Ca 0.21 -0.17 0.09 0.00 0.84 0.00 0.00 57.88 58.85 2isa h LEU 425 Cb 0.15 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.07 2isa h LEU 425 CO -0.17 0.28 0.05 0.15 -0.34 0.00 0.00 178.44 178.42 2isa h PHE 426 N 0.02 0.07 -0.01 1.25 3.57 -1.01 -2.57 116.94 118.25 2isa h PHE 426 Ca 0.04 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.57 2isa h PHE 426 Cb 0.18 0.04 -0.00 0.00 2.79 0.00 0.00 35.95 38.96 2isa h PHE 426 CO -0.01 -0.06 0.02 0.78 -2.23 0.00 0.00 178.31 176.80 2isa h GLY 427 N 0.18 0.00 0.87 2.40 0.00 -0.92 -2.35 103.07 103.24 2isa h GLY 427 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 2isa h GLY 427 CO -0.37 0.00 -0.73 1.04 0.00 0.00 0.00 176.54 176.48 2isa n LEU 428 N -3.71 0.62 -4.78 3.11 4.77 -0.98 -4.91 117.00 111.13 2isa n LEU 428 Ca -0.03 0.04 -0.36 0.00 -0.03 0.00 0.00 56.01 55.63 2isa n LEU 428 Cb 0.10 -0.17 -0.02 0.00 -2.33 0.00 0.00 43.42 41.00 2isa n LEU 428 CO 0.26 0.05 0.78 -0.04 -1.33 0.00 0.00 177.39 177.11 2isa s MET 429 N -3.12 3.87 0.94 3.23 -1.94 -0.89 -5.05 119.30 116.35 2isa s MET 429 Ca 0.07 1.61 -0.12 0.00 -1.71 0.00 0.00 55.69 55.54 2isa s MET 429 Cb 0.15 -2.38 0.16 0.00 2.01 0.00 0.00 34.83 34.77 2isa s MET 429 CO 0.75 -0.42 1.09 0.95 -0.01 0.00 0.00 175.02 177.38 2isa s THR 430 N -1.66 2.36 0.37 2.05 -4.23 -1.26 -4.80 115.64 108.47 2isa s THR 430 Ca 0.63 0.12 0.05 0.00 -1.18 0.00 0.00 61.69 61.30 2isa s THR 430 Cb -0.24 -2.63 0.27 0.00 1.34 0.00 0.00 72.50 71.24 2isa s THR 430 CO 0.30 -0.15 2.01 0.00 -0.54 0.00 0.00 174.62 176.23 2isa h ALA 431 N -1.70 1.64 -0.39 3.99 0.00 -1.98 -0.77 119.26 120.06 2isa h ALA 431 Ca -0.52 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.28 2isa h ALA 431 Cb 1.31 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2isa h ALA 431 CO 0.56 0.30 -0.08 1.49 0.00 0.00 0.00 179.25 181.53 2isa h GLU 432 N 0.75 0.74 0.00 0.00 4.57 -1.99 -1.93 114.58 116.72 2isa h GLU 432 Ca 0.24 -0.28 -0.14 0.00 -1.18 0.00 0.00 59.36 58.00 2isa h GLU 432 Cb 0.03 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.55 2isa h GLU 432 CO -0.06 0.87 -0.67 0.87 -1.18 0.00 0.00 179.01 178.84 2isa h LYS 433 N 0.55 0.00 -0.44 1.92 1.57 -1.79 -1.72 116.57 116.66 2isa h LYS 433 Ca 0.10 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.79 2isa h LYS 433 Cb 0.59 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 2isa h LYS 433 CO 0.04 0.67 -0.08 1.96 -0.57 0.00 0.00 179.45 181.46 2isa h GLN 434 N 0.00 0.83 -0.62 3.15 4.20 -1.17 -1.21 115.11 120.30 2isa h GLN 434 Ca -0.01 -0.31 -0.06 0.00 0.06 0.00 0.00 58.65 58.34 2isa h GLN 434 Cb 1.19 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.89 2isa h GLN 434 CO 0.09 0.93 0.16 0.00 -0.67 0.00 0.00 178.83 179.34 2isa h ALA 435 N 0.87 1.12 -0.47 3.87 0.00 -1.16 -0.76 119.26 122.73 2isa h ALA 435 Ca 0.11 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2isa h ALA 435 Cb 0.61 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2isa h ALA 435 CO 0.04 0.60 0.20 0.82 0.00 0.00 0.00 179.25 180.91 2isa h ILE 436 N 0.92 1.20 -0.31 0.00 2.04 -1.18 -1.20 117.51 118.99 2isa h ILE 436 Ca 0.20 -0.60 0.03 0.00 1.00 0.00 0.00 64.86 65.48 2isa h ILE 436 Cb 0.31 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.08 2isa h ILE 436 CO -0.00 0.23 0.13 0.25 0.00 0.00 0.00 178.15 178.76 2isa h LEU 437 N 0.62 0.18 -0.47 1.44 6.46 -0.82 -0.16 115.31 122.55 2isa h LEU 437 Ca 0.16 0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.94 2isa h LEU 437 Cb 0.17 -0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 40.07 2isa h LEU 437 CO -0.02 0.14 0.30 -0.26 -0.62 0.00 0.00 178.44 177.98 2isa h PHE 438 N 0.28 0.62 -0.17 1.25 0.05 -0.95 -2.02 116.94 115.99 2isa h PHE 438 Ca 0.13 0.00 -0.04 0.00 3.82 0.00 0.00 57.97 61.89 2isa h PHE 438 Cb 0.07 -0.20 -0.01 0.00 2.00 0.00 0.00 35.95 37.81 2isa h PHE 438 CO -0.11 0.42 -0.03 0.22 -0.18 0.00 0.00 178.31 178.62 2isa h ASP 439 N 0.64 0.32 -0.47 2.17 3.58 -0.99 -0.14 116.42 121.53 2isa h ASP 439 Ca 0.17 -0.36 0.04 0.00 0.42 0.00 0.00 57.03 57.30 2isa h ASP 439 Cb -0.03 -0.09 -0.04 0.00 1.72 0.00 0.00 39.33 40.89 2isa h ASP 439 CO -0.03 0.60 0.24 0.78 -2.88 0.00 0.00 179.24 177.94 2isa h ASN 440 N 0.04 0.34 0.17 2.28 -0.26 -0.96 -1.63 115.58 115.56 2isa h ASN 440 Ca 0.04 0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.80 2isa h ASN 440 Cb 0.46 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.68 2isa h ASN 440 CO 0.02 0.24 -0.08 0.74 -1.06 0.00 0.00 177.43 177.29 2isa h THR 441 N 0.47 0.92 -0.94 2.81 2.02 -1.31 -0.77 112.91 116.11 2isa h THR 441 Ca 0.20 -0.40 0.06 0.00 0.77 0.00 0.00 66.41 67.04 2isa h THR 441 Cb 0.11 1.17 -0.06 0.00 -1.74 0.00 0.00 68.15 67.62 2isa h THR 441 CO -0.14 0.09 0.60 0.00 0.37 0.00 0.00 175.52 176.44 2isa h ALA 442 N 0.38 1.30 -0.08 6.16 0.00 -0.92 -1.37 119.26 124.73 2isa h ALA 442 Ca -0.02 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.69 2isa h ALA 442 Cb 0.33 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2isa h ALA 442 CO 0.04 0.39 -0.69 0.00 0.00 0.00 0.00 179.25 178.99 2isa h ARG 443 N 1.11 0.35 -0.02 0.00 3.08 -1.24 -2.80 114.38 114.85 2isa h ARG 443 Ca 0.40 -0.27 -0.00 0.00 0.07 0.00 0.00 59.98 60.18 2isa h ARG 443 Cb 0.14 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 2isa h ARG 443 CO -0.17 0.91 -0.01 -0.97 -1.07 0.00 0.00 179.97 178.66 2isa h ASN 444 N 0.24 0.02 -0.04 7.04 -0.73 -0.74 -2.54 115.58 118.83 2isa h ASN 444 Ca -0.02 -0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.15 2isa h ASN 444 Cb 1.25 -0.01 0.00 0.00 0.27 0.00 0.00 38.32 39.83 2isa h ASN 444 CO 0.12 0.04 0.00 0.18 -0.37 0.00 0.00 177.43 177.39 2isa n LEU 445 N -4.51 0.96 -4.69 0.34 4.77 -0.55 -4.89 117.00 108.43 2isa n LEU 445 Ca -0.03 -0.35 -0.42 0.00 -0.03 0.00 0.00 56.01 55.18 2isa n LEU 445 Cb 0.11 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.15 2isa n LEU 445 CO 0.34 0.17 1.47 0.21 -1.33 0.00 0.00 177.39 178.26 2isa s ASN 446 N -1.86 6.44 0.00 -1.43 3.04 -0.96 -1.36 114.94 118.81 2isa s ASN 446 Ca 0.38 2.73 0.00 0.00 0.04 0.00 0.00 52.86 56.01 2isa s ASN 446 Cb 0.19 -2.56 0.00 0.00 -1.54 0.00 0.00 41.25 37.34 2isa s ASN 446 CO 0.31 -1.00 0.00 0.61 -3.04 0.00 0.00 177.10 173.98 2isa n GLY 447 N 4.25 1.30 3.72 1.21 0.00 -1.26 -4.99 105.19 109.42 2isa n GLY 447 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2isa n GLY 447 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2isa s VAL 448 N -3.68 4.56 0.27 1.61 1.01 -0.46 -4.88 120.40 118.83 2isa s VAL 448 Ca 0.00 1.95 -0.28 0.00 0.00 0.00 0.00 61.98 63.64 2isa s VAL 448 Cb 0.00 -4.25 -0.14 0.00 0.00 0.00 0.00 36.38 31.99 2isa s VAL 448 CO 0.00 0.21 1.00 -2.65 0.00 0.00 0.00 175.10 173.66 2isa n PRO 449 N 3.42 1.27 -0.35 2.72 -0.02 -1.26 -4.66 135.00 136.13 2isa n PRO 449 Ca 0.05 0.45 0.10 0.00 -2.02 0.00 0.00 63.50 62.07 2isa n PRO 449 Cb 0.49 -1.81 0.28 0.00 -0.02 0.00 0.00 33.50 32.45 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 2.08 0.86 -0.25 -0.52 3.64 -1.97 -1.54 116.57 118.88 2isa h LYS 450 Ca -0.39 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 58.91 2isa h LYS 450 Cb 1.35 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.96 2isa h LYS 450 CO 0.61 0.57 0.03 1.05 -2.27 0.00 0.00 179.45 179.45 2isa h GLU 451 N 0.89 0.36 -0.08 1.90 9.09 -2.00 0.13 114.58 124.88 2isa h GLU 451 Ca 0.52 -0.05 -0.11 0.00 0.05 0.00 0.00 59.36 59.76 2isa h GLU 451 Cb 0.64 -0.06 0.00 0.00 -1.65 0.00 0.00 28.75 27.68 2isa h GLU 451 CO -0.29 0.36 -0.38 0.82 0.05 0.00 0.00 179.01 179.57 2isa h ILE 452 N 0.36 1.40 -0.54 -1.06 2.04 -1.64 -2.75 117.51 115.32 2isa h ILE 452 Ca 0.09 -1.75 0.10 0.00 1.00 0.00 0.00 64.86 64.30 2isa h ILE 452 Cb 0.19 2.26 -0.08 0.00 -0.74 0.00 0.00 36.82 38.45 2isa h ILE 452 CO 0.00 0.51 0.07 1.56 0.00 0.00 0.00 178.15 180.29 2isa h GLN 453 N -0.05 0.18 -0.76 2.37 4.20 -1.02 -2.53 115.11 117.51 2isa h GLN 453 Ca -0.02 -0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.62 2isa h GLN 453 Cb 1.03 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.73 2isa h GLN 453 CO 0.08 0.12 0.26 1.25 -0.67 0.00 0.00 178.83 179.87 2isa h LEU 454 N 0.19 1.07 -0.73 1.46 5.85 -1.01 -1.62 115.31 120.52 2isa h LEU 454 Ca 0.28 -0.19 0.09 0.00 0.84 0.00 0.00 57.88 58.91 2isa h LEU 454 Cb 0.42 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 41.09 2isa h LEU 454 CO -0.40 0.98 0.38 0.03 -0.34 0.00 0.00 178.44 179.08 2isa h ARG 455 N 1.11 0.62 -0.20 1.25 2.47 -1.16 -0.17 114.38 118.31 2isa h ARG 455 Ca 0.25 -0.04 -0.05 0.00 -1.26 0.00 0.00 59.98 58.88 2isa h ARG 455 Cb 0.27 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 28.44 2isa h ARG 455 CO -0.01 0.41 -0.09 1.25 0.56 0.00 0.00 179.97 182.09 2isa h HIS 456 N 0.64 0.46 -0.74 3.04 2.76 -1.01 -2.65 115.15 117.64 2isa h HIS 456 Ca 0.36 -0.11 -0.01 0.00 -2.20 0.00 0.00 60.37 58.41 2isa h HIS 456 Cb 0.36 -0.11 -0.04 0.00 1.55 0.00 0.00 27.41 29.18 2isa h HIS 456 CO -0.10 0.69 0.44 0.28 -1.30 0.00 0.00 177.93 177.95 2isa h VAL 457 N 0.10 1.21 -0.20 5.26 2.07 -0.97 -0.77 116.25 122.95 2isa h VAL 457 Ca 0.04 -0.47 0.02 0.00 0.82 0.00 0.00 66.70 67.12 2isa h VAL 457 Cb 0.57 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 2isa h VAL 457 CO 0.03 0.22 0.04 0.74 0.02 0.00 0.00 177.57 178.62 2isa h THR 458 N 1.02 0.92 -0.26 2.57 2.02 -1.03 -0.50 112.91 117.65 2isa h THR 458 Ca 0.27 -0.04 0.02 0.00 0.77 0.00 0.00 66.41 67.43 2isa h THR 458 Cb -0.03 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 67.13 2isa h THR 458 CO -0.05 0.02 0.10 0.45 0.37 0.00 0.00 175.52 176.41 2isa h HIS 459 N 0.13 0.18 -0.97 3.16 3.86 -1.02 -1.79 115.15 118.71 2isa h HIS 459 Ca 0.09 0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.33 2isa h HIS 459 Cb 0.08 -0.05 -0.05 0.00 1.06 0.00 0.00 27.41 28.46 2isa h HIS 459 CO -0.14 0.09 0.64 0.00 0.86 0.00 0.00 177.93 179.38 2isa h TYR 461 N 1.29 1.13 -0.78 0.00 3.20 -0.67 -0.64 116.97 120.50 2isa h TYR 461 Ca 0.36 -0.12 -0.03 0.00 3.14 0.00 0.00 58.73 62.09 2isa h TYR 461 Cb -0.11 -0.33 -0.04 0.00 1.54 0.00 0.00 36.73 37.80 2isa h TYR 461 CO -0.00 0.91 0.36 0.87 -1.64 0.00 0.00 178.16 178.66 2isa h LYS 462 N 1.04 1.12 -0.04 1.82 1.57 -0.84 -2.20 116.57 119.04 2isa h LYS 462 Ca 0.22 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2isa h LYS 462 Cb 0.32 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 2isa h LYS 462 CO -0.00 0.87 0.02 0.00 -0.57 0.00 0.00 179.45 179.77 2isa h ALA 463 N 1.29 0.05 -1.70 3.86 0.00 -0.92 -3.46 119.26 118.39 2isa h ALA 463 Ca 0.27 -0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.22 2isa h ALA 463 Cb 0.13 -0.02 -0.23 0.00 0.00 0.00 0.00 17.79 17.67 2isa h ALA 463 CO -0.03 -0.41 0.13 0.34 0.00 0.00 0.00 179.25 179.28 2isa s ASP 464 N -5.31 -0.80 0.34 0.00 -1.08 -0.29 -4.20 116.67 105.33 2isa s ASP 464 Ca -0.13 1.20 0.13 0.00 -0.52 0.00 0.00 52.55 53.23 2isa s ASP 464 Cb 0.06 1.56 1.05 0.00 -1.46 0.00 0.00 42.92 44.13 2isa s ASP 464 CO 0.67 -0.18 1.67 -0.65 0.52 0.00 0.00 175.17 177.20 2isa h PRO 465 N 7.00 0.33 0.00 4.34 0.11 -1.67 0.47 132.00 142.57 2isa h PRO 465 Ca -0.25 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.74 2isa h PRO 465 Cb 1.17 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2isa h PRO 465 CO 0.15 0.22 -0.47 0.00 -0.21 0.00 0.00 178.00 177.69 2isa h ALA 466 N 1.84 0.86 0.35 -0.75 0.00 -1.90 -0.53 119.26 119.12 2isa h ALA 466 Ca 0.72 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 2isa h ALA 466 Cb 1.61 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.32 2isa h ALA 466 CO -0.60 0.59 -0.17 -0.92 0.00 0.00 0.00 179.25 178.15 2isa h TYR 467 N 0.00 -0.44 -0.87 0.00 3.20 -1.17 -0.91 116.97 116.79 2isa h TYR 467 Ca -0.00 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.89 2isa h TYR 467 Cb 1.11 0.14 -0.05 0.00 1.54 0.00 0.00 36.73 39.47 2isa h TYR 467 CO 0.00 -0.10 0.56 0.78 -1.64 0.00 0.00 178.16 177.76 2isa h GLY 468 N -0.84 1.27 1.13 1.82 0.00 -1.40 -2.82 103.07 102.23 2isa h GLY 468 Ca -0.05 -0.42 -0.12 0.00 0.00 0.00 0.00 47.33 46.74 2isa h GLY 468 CO 0.08 0.36 -0.14 -2.09 0.00 0.00 0.00 176.54 174.75 2isa h GLU 469 N 1.08 1.01 -0.74 4.80 4.81 -1.13 0.81 114.58 125.21 2isa h GLU 469 Ca 0.35 -0.39 0.10 0.00 -0.13 0.00 0.00 59.36 59.29 2isa h GLU 469 Cb 0.02 -0.06 -0.08 0.00 0.63 0.00 0.00 28.75 29.26 2isa h GLU 469 CO -0.12 1.07 0.37 0.78 -0.73 0.00 0.00 179.01 180.38 2isa h GLY 470 N 0.92 1.12 0.76 1.92 0.00 -0.91 0.51 103.07 107.40 2isa h GLY 470 Ca 0.13 -0.23 -0.18 0.00 0.00 0.00 0.00 47.33 47.06 2isa h GLY 470 CO 0.05 0.04 -0.75 -2.22 0.00 0.00 0.00 176.54 173.66 2isa h ILE 471 N 0.61 1.46 -0.70 2.60 2.04 -1.42 -3.28 117.51 118.82 2isa h ILE 471 Ca 0.37 -2.34 0.12 0.00 1.00 0.00 0.00 64.86 64.01 2isa h ILE 471 Cb 0.42 2.92 -0.09 0.00 -0.74 0.00 0.00 36.82 39.33 2isa h ILE 471 CO -0.29 0.67 0.26 1.23 0.00 0.00 0.00 178.15 180.02 2isa h GLY 472 N -0.22 1.01 0.63 5.37 0.00 -0.51 -1.89 103.07 107.46 2isa h GLY 472 Ca -0.12 -0.13 0.04 0.00 0.00 0.00 0.00 47.33 47.13 2isa h GLY 472 CO 0.14 -0.07 0.00 0.50 0.00 0.00 0.00 176.54 177.11 2isa h LYS 473 N 0.42 0.07 0.00 4.80 1.57 -1.03 -0.58 116.57 121.81 2isa h LYS 473 Ca 0.37 -0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 59.10 2isa h LYS 473 Cb 0.53 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 2isa h LYS 473 CO -0.37 0.05 -0.23 -0.07 -0.57 0.00 0.00 179.45 178.25 2isa h LEU 474 N 0.08 0.00 -0.20 2.94 3.38 -1.44 -2.32 115.31 117.74 2isa h LEU 474 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2isa h LEU 474 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2isa h LEU 474 CO -0.19 0.23 -0.34 0.18 0.09 0.00 0.00 178.44 178.41 2isa n LEU 475 N -4.23 0.65 0.00 1.67 4.77 -0.78 -4.95 117.00 114.13 2isa n LEU 475 Ca -0.02 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 2isa n LEU 475 Cb 0.29 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2isa n LEU 475 CO 0.37 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 2isa n GLY 476 N 1.42 0.49 3.85 -0.72 0.00 -0.59 -5.06 105.19 104.59 2isa n GLY 476 Ca 0.09 -0.87 -0.35 0.00 0.00 0.00 0.00 46.02 44.88 2isa n GLY 476 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2isa s PHE 477 N -2.00 3.61 0.30 1.61 2.99 -0.33 -5.03 117.98 119.13 2isa s PHE 477 Ca 0.00 0.96 -0.28 0.00 0.00 0.00 0.00 56.93 57.60 2isa s PHE 477 Cb 0.00 -2.28 -0.09 0.00 0.00 0.00 0.00 43.02 40.64 2isa s PHE 477 CO 0.00 0.48 1.03 -0.51 -0.00 0.00 0.00 175.22 176.22 2isa s ASP 478 N -1.67 7.28 0.33 1.36 1.01 -1.26 -4.41 116.67 119.31 2isa s ASP 478 Ca 0.35 2.09 0.12 0.00 0.71 0.00 0.00 52.55 55.82 2isa s ASP 478 Cb -0.15 -2.61 0.97 0.00 1.01 0.00 0.00 42.92 42.14 2isa s ASP 478 CO 0.18 -0.12 1.71 -0.29 0.21 0.00 0.00 175.17 176.86 2isa h ILE 479 N 2.88 0.46 0.00 0.77 2.10 -1.98 -0.07 117.51 121.68 2isa h ILE 479 Ca -0.47 -0.17 0.00 0.00 1.08 0.00 0.00 64.86 65.31 2isa h ILE 479 Cb 1.21 -0.07 0.00 0.00 -1.09 0.00 0.00 36.82 36.87 2isa h ILE 479 CO 0.66 0.09 0.00 0.77 -1.08 0.00 0.00 178.15 178.59 2isa h SER 480 N 0.49 0.00 1.66 2.19 4.64 -1.98 -2.48 113.55 118.07 2isa h SER 480 Ca 0.67 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.99 2isa h SER 480 Cb 1.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.49 2isa h SER 480 CO -0.50 0.00 0.00 -0.33 -0.87 0.00 0.00 176.83 175.13 2isa h GLU 481 N 0.00 0.00 0.00 4.77 5.08 -1.39 -3.33 114.58 119.71 2isa h GLU 481 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2isa h GLU 481 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2isa h GLU 481 CO 0.00 0.00 -0.29 2.48 -1.00 0.00 0.00 179.01 180.20 2isa n TYR 482 N -2.76 0.00 -1.78 4.33 0.18 -0.97 -5.00 117.16 111.16 2isa n TYR 482 Ca 0.04 -0.21 -0.42 0.00 1.88 0.00 0.00 57.90 59.20 2isa n TYR 482 Cb 0.46 -0.06 -0.02 0.00 -0.38 0.00 0.00 39.34 39.34 2isa n TYR 482 CO 0.00 0.00 0.00 1.21 -2.08 0.00 0.00 176.86 175.99 2isa s ASN 483 N -1.14 6.39 0.00 9.48 3.84 -0.97 -4.38 114.94 128.16 2isa s ASN 483 Ca 0.06 2.91 0.00 0.00 0.21 0.00 0.00 52.86 56.04 2isa s ASN 483 Cb 0.05 -2.63 0.00 0.00 -0.55 0.00 0.00 41.25 38.12 2isa s ASN 483 CO 0.01 -0.92 0.00 -1.20 -2.79 0.00 0.00 177.10 172.20