#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cxt s ALA 2 N 0.00 2.74 0.19 3.04 0.00 -1.26 -4.90 121.76 121.56 2cxt s ALA 2 Ca 0.00 -2.13 -0.15 0.00 0.00 0.00 0.00 51.96 49.68 2cxt s ALA 2 Cb 0.00 0.30 0.17 0.00 0.00 0.00 0.00 23.12 23.60 2cxt s ALA 2 CO 0.00 -0.15 1.67 0.00 0.00 0.00 0.00 175.76 177.28 2cxt h ALA 3 N 2.00 0.40 -0.20 0.00 0.00 -1.95 -1.66 119.26 117.86 2cxt h ALA 3 Ca -0.42 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2cxt h ALA 3 Cb 1.24 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 2cxt h ALA 3 CO 0.74 -0.42 0.09 1.25 0.00 0.00 0.00 179.25 180.91 2cxt h LEU 4 N 0.06 0.27 -0.90 0.00 5.85 -1.85 -2.51 115.31 116.22 2cxt h LEU 4 Ca 0.24 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 2cxt h LEU 4 Cb 0.37 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.33 2cxt h LEU 4 CO -0.45 0.34 -0.08 0.71 -0.34 0.00 0.00 178.44 178.62 2cxt h THR 5 N 0.18 0.16 -0.00 1.05 1.35 -1.88 -2.31 112.91 111.46 2cxt h THR 5 Ca 0.07 -0.87 0.00 0.00 -0.55 0.00 0.00 66.41 65.06 2cxt h THR 5 Cb 0.15 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 2cxt h THR 5 CO -0.01 0.07 -0.18 0.54 -0.25 0.00 0.00 175.52 175.70 2cxt n ARG 6 N -3.16 0.32 -2.67 4.72 1.74 -0.65 -4.74 116.66 112.22 2cxt n ARG 6 Ca 0.02 -0.11 -0.42 0.00 -0.77 0.00 0.00 57.85 56.56 2cxt n ARG 6 Cb 0.42 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.33 2cxt n ARG 6 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2cxt s ASN 7 N -2.76 7.27 0.36 0.55 3.84 -0.87 -4.96 114.94 118.37 2cxt s ASN 7 Ca 0.20 1.61 0.13 0.00 0.21 0.00 0.00 52.86 55.01 2cxt s ASN 7 Cb 0.19 -2.56 0.68 0.00 -0.55 0.00 0.00 41.25 39.01 2cxt s ASN 7 CO 0.55 -0.40 1.79 1.55 -2.79 0.00 0.00 177.10 177.80 2cxt h PRO 8 N 7.02 0.00 -0.23 0.43 0.13 -1.89 -1.37 132.00 136.10 2cxt h PRO 8 Ca -0.35 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.69 2cxt h PRO 8 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2cxt h PRO 8 CO 0.82 0.41 -0.27 1.96 -0.23 0.00 0.00 178.00 180.70 2cxt h GLN 9 N 0.00 0.43 -0.30 0.86 7.50 -1.94 -0.91 115.11 120.76 2cxt h GLN 9 Ca -0.00 -0.16 -0.11 0.00 0.50 0.00 0.00 58.65 58.87 2cxt h GLN 9 Cb 0.75 -0.03 -0.01 0.00 0.05 0.00 0.00 27.48 28.25 2cxt h GLN 9 CO 0.05 0.67 -0.26 0.35 -1.50 0.00 0.00 178.83 178.15 2cxt h PHE 10 N 0.38 0.83 -0.87 2.96 3.57 -1.71 -2.25 116.94 119.86 2cxt h PHE 10 Ca 0.06 -0.24 -0.00 0.00 3.53 0.00 0.00 57.97 61.31 2cxt h PHE 10 Cb 0.67 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 39.19 2cxt h PHE 10 CO 0.02 0.98 0.54 1.96 -2.23 0.00 0.00 178.31 179.58 2cxt h GLN 11 N 0.45 1.17 -0.56 1.11 4.20 -1.06 0.03 115.11 120.45 2cxt h GLN 11 Ca 0.05 -0.10 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 2cxt h GLN 11 Cb 0.82 -0.25 -0.03 0.00 0.30 0.00 0.00 27.48 28.32 2cxt h GLN 11 CO 0.07 0.81 0.29 -0.22 -0.67 0.00 0.00 178.83 179.10 2cxt h LYS 12 N 1.19 0.80 -0.26 1.46 3.64 -1.16 -0.62 116.57 121.61 2cxt h LYS 12 Ca 0.31 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 2cxt h LYS 12 Cb -0.07 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.59 2cxt h LYS 12 CO -0.06 0.64 0.11 1.25 -2.27 0.00 0.00 179.45 179.11 2cxt h LEU 13 N 0.76 0.36 -0.62 5.20 5.85 -0.78 -0.69 115.31 125.38 2cxt h LEU 13 Ca 0.19 -0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 2cxt h LEU 13 Cb 0.09 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 2cxt h LEU 13 CO -0.03 0.42 0.19 0.25 -0.34 0.00 0.00 178.44 178.94 2cxt h LEU 14 N 0.27 0.91 -0.67 2.25 5.85 -0.88 -0.31 115.31 122.73 2cxt h LEU 14 Ca 0.09 -0.21 -0.08 0.00 0.84 0.00 0.00 57.88 58.51 2cxt h LEU 14 Cb 0.18 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 2cxt h LEU 14 CO -0.01 0.88 0.08 -0.08 -0.34 0.00 0.00 178.44 178.98 2cxt h GLU 15 N 0.90 1.11 -0.43 1.25 4.57 -0.99 -1.05 114.58 119.94 2cxt h GLU 15 Ca 0.20 -0.31 -0.01 0.00 -1.18 0.00 0.00 59.36 58.06 2cxt h GLU 15 Cb 0.30 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 2cxt h GLU 15 CO -0.01 1.03 0.22 2.35 -1.18 0.00 0.00 179.01 181.42 2cxt h TRP 16 N 1.03 0.61 -0.36 0.92 7.01 -0.83 -1.68 115.95 122.65 2cxt h TRP 16 Ca 0.20 -0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.20 2cxt h TRP 16 Cb 0.48 -0.19 -0.03 0.00 -2.10 0.00 0.00 29.16 27.31 2cxt h TRP 16 CO 0.03 0.48 0.17 1.25 -2.79 0.00 0.00 178.44 177.59 2cxt h HIS 17 N 0.55 0.32 -0.72 2.65 2.76 -0.80 0.16 115.15 120.08 2cxt h HIS 17 Ca 0.15 0.02 0.04 0.00 -2.20 0.00 0.00 60.37 58.37 2cxt h HIS 17 Cb 0.09 -0.09 -0.05 0.00 1.55 0.00 0.00 27.41 28.91 2cxt h HIS 17 CO -0.02 0.17 0.44 0.00 -1.30 0.00 0.00 177.93 177.22 2cxt h ARG 18 N 0.36 0.82 0.06 5.26 3.08 -0.96 -1.28 114.38 121.72 2cxt h ARG 18 Ca 0.15 -0.05 -0.24 0.00 0.07 0.00 0.00 59.98 59.91 2cxt h ARG 18 Cb 0.07 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 2cxt h ARG 18 CO -0.11 0.55 -1.14 0.00 -1.07 0.00 0.00 179.97 178.20 2cxt h ALA 19 N 1.32 0.24 0.00 0.04 0.00 -0.96 -3.43 119.26 116.47 2cxt h ALA 19 Ca 0.29 -0.92 0.00 0.00 0.00 0.00 0.00 54.91 54.29 2cxt h ALA 19 Cb 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2cxt h ALA 19 CO -0.13 1.13 -0.73 0.09 0.00 0.00 0.00 179.25 179.61 2cxt n ASN 20 N -3.43 3.67 0.05 0.00 3.02 0.53 -4.81 115.26 114.28 2cxt n ASN 20 Ca -0.05 -0.01 0.06 0.00 -0.03 0.00 0.00 54.58 54.56 2cxt n ASN 20 Cb 0.98 0.76 0.49 0.00 -0.61 0.00 0.00 39.78 41.40 2cxt n ASN 20 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2cxt h SER 21 N 0.00 0.34 -0.04 6.41 4.64 -1.34 -0.28 113.55 123.28 2cxt h SER 21 Ca 0.00 -0.01 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 2cxt h SER 21 Cb 0.00 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 62.01 2cxt h SER 21 CO 0.00 0.24 0.06 0.00 -0.87 0.00 0.00 176.83 176.25 2cxt h ALA 22 N 1.79 1.54 0.00 5.18 0.00 -1.88 -1.49 119.26 124.41 2cxt h ALA 22 Ca 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2cxt h ALA 22 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2cxt h ALA 22 CO -0.03 -0.08 -0.14 0.09 0.00 0.00 0.00 179.25 179.09 2cxt n ASN 23 N -3.74 0.66 -4.63 0.00 5.03 -0.12 -4.79 115.26 107.67 2cxt n ASN 23 Ca -0.02 0.44 -0.43 0.00 0.87 0.00 0.00 54.58 55.44 2cxt n ASN 23 Cb 0.14 -0.52 -0.02 0.00 -1.02 0.00 0.00 39.78 38.36 2cxt n ASN 23 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2cxt s LEU 24 N -4.18 3.84 -0.11 3.41 1.43 -0.56 -4.99 118.68 117.52 2cxt s LEU 24 Ca 0.10 1.17 -0.00 0.00 -1.03 0.00 0.00 54.13 54.37 2cxt s LEU 24 Cb 0.14 -3.54 0.02 0.00 0.03 0.00 0.00 46.19 42.84 2cxt s LEU 24 CO 0.62 -1.14 -0.08 -0.54 0.23 0.00 0.00 176.35 175.43 2cxt s LYS 25 N 4.31 1.52 0.19 1.70 3.01 -1.26 -5.05 119.74 124.16 2cxt s LYS 25 Ca 0.58 -0.26 -0.11 0.00 -1.01 0.00 0.00 55.97 55.16 2cxt s LYS 25 Cb -0.17 -1.54 0.20 0.00 -1.01 0.00 0.00 37.83 35.32 2cxt s LYS 25 CO 0.25 -0.23 1.77 -0.07 0.51 0.00 0.00 175.35 177.58 2cxt h LEU 26 N 8.01 0.30 -0.47 3.17 3.38 -1.91 -0.62 115.31 127.17 2cxt h LEU 26 Ca -0.30 0.05 0.08 0.00 0.09 0.00 0.00 57.88 57.81 2cxt h LEU 26 Cb 1.14 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.82 2cxt h LEU 26 CO 0.41 0.20 0.06 -0.09 0.09 0.00 0.00 178.44 179.11 2cxt h ARG 27 N 0.45 0.18 -0.53 1.13 2.43 -1.95 -1.88 114.38 114.21 2cxt h ARG 27 Ca 0.26 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.32 2cxt h ARG 27 Cb 0.25 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 2cxt h ARG 27 CO -0.23 0.12 -0.08 0.93 -1.51 0.00 0.00 179.97 179.20 2cxt h GLU 28 N 0.18 0.98 -0.76 0.20 5.08 -1.79 -1.60 114.58 116.87 2cxt h GLU 28 Ca 0.24 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 2cxt h GLU 28 Cb 0.33 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.47 2cxt h GLU 28 CO -0.34 1.01 0.41 -0.07 -1.00 0.00 0.00 179.01 179.02 2cxt h LEU 29 N 0.88 0.96 -0.30 1.33 3.38 -0.63 -0.36 115.31 120.57 2cxt h LEU 29 Ca 0.14 -0.10 -0.20 0.00 0.09 0.00 0.00 57.88 57.81 2cxt h LEU 29 Cb 0.63 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2cxt h LEU 29 CO 0.04 0.79 -0.75 -0.26 0.09 0.00 0.00 178.44 178.35 2cxt h PHE 30 N 1.06 0.78 -0.30 1.13 -1.00 -1.28 -3.17 116.94 114.17 2cxt h PHE 30 Ca 0.27 -0.35 -0.08 0.00 2.81 0.00 0.00 57.97 60.62 2cxt h PHE 30 Cb 0.05 -0.12 -0.02 0.00 3.61 0.00 0.00 35.95 39.47 2cxt h PHE 30 CO 0.00 1.14 -0.17 0.93 -1.61 0.00 0.00 178.31 178.60 2cxt h GLU 31 N 0.40 0.54 0.00 1.51 4.39 -0.96 -3.09 114.58 117.37 2cxt h GLU 31 Ca -0.04 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.48 2cxt h GLU 31 Cb 1.35 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.95 2cxt h GLU 31 CO 0.14 0.69 0.00 0.00 -1.16 0.00 0.00 179.01 178.68 2cxt h ALA 32 N 1.33 1.00 -2.00 3.43 0.00 -1.09 -3.43 119.26 118.51 2cxt h ALA 32 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.68 2cxt h ALA 32 Cb 0.57 0.00 -0.32 0.00 0.00 0.00 0.00 17.79 18.05 2cxt h ALA 32 CO 0.04 0.00 -0.63 0.34 0.00 0.00 0.00 179.25 179.00 2cxt s ASP 33 N -5.27 1.27 0.31 0.00 2.15 -1.17 -5.00 116.67 108.96 2cxt s ASP 33 Ca 0.08 -0.94 0.24 0.00 0.43 0.00 0.00 52.55 52.36 2cxt s ASP 33 Cb 0.09 0.64 1.13 0.00 -0.30 0.00 0.00 42.92 44.48 2cxt s ASP 33 CO 0.60 -0.34 1.71 1.55 -0.17 0.00 0.00 175.17 178.52 2cxt h PRO 34 N 7.88 0.00 -0.31 4.34 0.13 -1.84 -1.90 132.00 140.30 2cxt h PRO 34 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2cxt h PRO 34 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2cxt h PRO 34 CO 0.28 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.44 2cxt n GLU 35 N -2.30 1.90 0.01 0.86 -0.58 -1.26 -4.54 120.64 114.72 2cxt n GLU 35 Ca 0.00 -1.37 -0.10 0.00 -0.42 0.00 0.00 57.16 55.27 2cxt n GLU 35 Cb 0.13 -1.36 -0.04 0.00 -0.57 0.00 0.00 31.44 29.60 2cxt n GLU 35 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 2cxt h ARG 36 N 2.47 -0.13 -0.51 3.49 2.43 -1.69 0.15 114.38 120.59 2cxt h ARG 36 Ca 0.00 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.23 2cxt h ARG 36 Cb 0.55 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 30.08 2cxt h ARG 36 CO 0.00 -0.09 0.24 0.35 -1.51 0.00 0.00 179.97 178.97 2cxt h PHE 37 N -0.13 0.44 -0.92 2.20 3.57 -1.85 -0.13 116.94 120.12 2cxt h PHE 37 Ca 0.07 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.61 2cxt h PHE 37 Cb 0.23 -0.12 -0.05 0.00 2.79 0.00 0.00 35.95 38.80 2cxt h PHE 37 CO -0.21 0.20 0.61 -0.91 -2.23 0.00 0.00 178.31 175.77 2cxt h ASN 38 N 0.47 1.04 1.65 0.41 2.35 -1.68 -2.82 115.58 117.01 2cxt h ASN 38 Ca 0.23 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 2cxt h ASN 38 Cb 0.17 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.28 2cxt h ASN 38 CO -0.18 0.74 -0.31 0.78 -1.65 0.00 0.00 177.43 176.82 2cxt h ASN 39 N 1.22 0.00 -0.83 5.81 2.35 -0.40 -3.36 115.58 120.38 2cxt h ASN 39 Ca 0.35 -0.01 -0.49 0.00 -0.55 0.00 0.00 56.30 55.60 2cxt h ASN 39 Cb -0.10 0.00 -0.42 0.00 0.05 0.00 0.00 38.32 37.85 2cxt h ASN 39 CO -0.08 0.00 -0.88 0.49 -1.65 0.00 0.00 177.43 175.31 2cxt n PHE 40 N -2.91 2.51 -3.71 1.19 3.01 -0.12 -5.02 117.46 112.42 2cxt n PHE 40 Ca 0.03 -2.37 -0.11 0.00 1.01 0.00 0.00 57.45 56.00 2cxt n PHE 40 Cb 0.53 -0.28 -0.06 0.00 -0.01 0.00 0.00 39.48 39.66 2cxt n PHE 40 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2cxt s SER 41 N -3.61 -0.17 -0.15 4.37 1.04 -1.11 -1.58 113.70 112.49 2cxt s SER 41 Ca 0.45 -0.24 -0.00 0.00 0.48 0.00 0.00 55.95 56.64 2cxt s SER 41 Cb 0.39 0.41 0.03 0.00 0.10 0.00 0.00 66.02 66.96 2cxt s SER 41 CO -0.01 -0.72 -0.09 -0.76 0.98 0.00 0.00 173.24 172.65 2cxt s LEU 42 N -2.38 1.60 -0.60 2.42 1.43 -0.26 -4.96 118.68 115.92 2cxt s LEU 42 Ca -0.01 -0.55 -0.15 0.00 -1.03 0.00 0.00 54.13 52.38 2cxt s LEU 42 Cb 0.01 -1.00 0.15 0.00 0.03 0.00 0.00 46.19 45.38 2cxt s LEU 42 CO -0.07 -0.13 0.56 0.21 0.23 0.00 0.00 176.35 177.15 2cxt s ASN 43 N 1.59 6.31 -0.18 2.29 3.84 -1.26 -0.50 114.94 127.03 2cxt s ASN 43 Ca 0.03 -2.00 -0.21 0.00 0.21 0.00 0.00 52.86 50.89 2cxt s ASN 43 Cb -0.14 -2.21 -0.03 0.00 -0.55 0.00 0.00 41.25 38.33 2cxt s ASN 43 CO -0.09 -0.79 0.61 -0.76 -2.79 0.00 0.00 177.10 173.29 2cxt s LEU 44 N 1.26 4.17 -0.38 3.21 1.43 0.27 -4.94 118.68 123.70 2cxt s LEU 44 Ca 0.06 0.84 -0.13 0.00 -1.03 0.00 0.00 54.13 53.88 2cxt s LEU 44 Cb -0.25 -2.87 0.01 0.00 0.03 0.00 0.00 46.19 43.11 2cxt s LEU 44 CO 0.00 -0.23 0.26 0.21 0.23 0.00 0.00 176.35 176.82 2cxt s ASN 45 N 1.12 5.97 0.00 2.29 2.47 -1.26 -0.82 114.94 124.71 2cxt s ASN 45 Ca 0.29 -0.81 0.27 0.00 0.42 0.00 0.00 52.86 53.03 2cxt s ASN 45 Cb -0.16 -2.11 0.79 0.00 -1.45 0.00 0.00 41.25 38.32 2cxt s ASN 45 CO 0.11 -0.38 1.59 0.35 -3.72 0.00 0.00 177.10 175.05 2cxt n THR 46 N 5.10 0.00 -0.54 -5.21 -2.24 -0.75 -4.91 114.28 105.73 2cxt n THR 46 Ca -0.12 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 2cxt n THR 46 Cb 0.47 0.40 0.00 0.00 -2.10 0.00 0.00 70.33 69.11 2cxt n THR 46 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2cxt n ASN 47 N -0.57 0.00 -1.72 3.42 4.05 -1.26 -4.76 115.26 114.42 2cxt n ASN 47 Ca 0.13 0.00 -0.00 0.00 0.45 0.00 0.00 54.58 55.16 2cxt n ASN 47 Cb 0.35 -0.69 0.07 0.00 1.23 0.00 0.00 39.78 40.74 2cxt n ASN 47 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 177.26 175.62 2cxt n HIS 48 N -2.00 0.68 0.00 1.20 8.25 -1.26 -5.09 115.22 117.00 2cxt n HIS 48 Ca 0.00 -1.35 0.00 0.00 -0.26 0.00 0.00 57.72 56.11 2cxt n HIS 48 Cb 0.00 -0.22 0.00 0.00 1.12 0.00 0.00 29.99 30.89 2cxt n HIS 48 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2cxt n GLY 49 N -0.28 3.42 3.77 -1.41 0.00 -1.26 -4.77 105.19 104.66 2cxt n GLY 49 Ca 0.14 -1.90 -0.32 0.00 0.00 0.00 0.00 46.02 43.94 2cxt n GLY 49 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2cxt s HIS 50 N -2.83 3.24 -0.20 1.61 3.76 -1.26 -1.80 115.29 117.81 2cxt s HIS 50 Ca 0.00 0.16 0.01 0.00 -0.15 0.00 0.00 55.06 55.08 2cxt s HIS 50 Cb 0.00 -1.70 0.04 0.00 1.11 0.00 0.00 32.58 32.03 2cxt s HIS 50 CO 0.00 0.53 -0.14 0.42 -0.85 0.00 0.00 174.74 174.70 2cxt s ILE 51 N -1.25 1.88 -0.33 0.60 1.01 -0.00 -1.78 121.20 121.34 2cxt s ILE 51 Ca 0.25 -1.07 -0.14 0.00 0.00 0.00 0.00 60.65 59.69 2cxt s ILE 51 Cb -0.12 -1.85 -0.02 0.00 0.01 0.00 0.00 42.46 40.48 2cxt s ILE 51 CO 0.16 0.29 0.32 -0.22 0.00 0.00 0.00 174.94 175.49 2cxt s LEU 52 N 1.31 4.36 -0.53 2.97 2.96 0.18 -0.56 118.68 129.36 2cxt s LEU 52 Ca 0.00 -0.19 -0.13 0.00 -0.22 0.00 0.00 54.13 53.59 2cxt s LEU 52 Cb -0.15 -2.28 0.13 0.00 0.50 0.00 0.00 46.19 44.39 2cxt s LEU 52 CO -0.09 -0.26 0.46 -0.69 -1.32 0.00 0.00 176.35 174.44 2cxt s VAL 53 N 1.93 4.87 -0.46 1.68 1.01 0.35 -1.19 120.40 128.58 2cxt s VAL 53 Ca 0.10 -1.67 -0.15 0.00 0.00 0.00 0.00 61.98 60.26 2cxt s VAL 53 Cb -0.17 -4.14 0.07 0.00 0.00 0.00 0.00 36.38 32.14 2cxt s VAL 53 CO 0.11 -0.85 0.38 -0.62 0.00 0.00 0.00 175.10 174.13 2cxt s ASP 54 N 3.17 6.14 -0.20 3.32 2.15 0.26 -1.11 116.67 130.40 2cxt s ASP 54 Ca 0.05 -1.28 0.16 0.00 0.43 0.00 0.00 52.55 51.90 2cxt s ASP 54 Cb -0.28 -2.18 0.58 0.00 -0.30 0.00 0.00 42.92 40.74 2cxt s ASP 54 CO 0.01 -0.62 1.48 0.00 -0.17 0.00 0.00 175.17 175.87 2cxt n TYR 55 N 5.19 1.15 0.21 -5.34 0.18 -0.61 -1.31 117.16 116.63 2cxt n TYR 55 Ca -0.12 -0.91 0.09 0.00 1.88 0.00 0.00 57.90 58.84 2cxt n TYR 55 Cb 0.44 -0.36 0.38 0.00 -0.38 0.00 0.00 39.34 39.41 2cxt n TYR 55 CO 0.00 0.00 0.00 0.66 -2.08 0.00 0.00 176.86 175.44 2cxt h SER 56 N 2.07 0.00 -0.36 9.48 4.64 -1.68 -2.97 113.55 124.73 2cxt h SER 56 Ca 0.02 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.14 2cxt h SER 56 Cb 1.56 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.54 2cxt h SER 56 CO 0.29 0.26 0.26 0.29 -0.87 0.00 0.00 176.83 177.05 2cxt n LYS 57 N -3.35 1.50 -4.06 4.77 5.02 -1.26 -4.86 118.16 115.91 2cxt n LYS 57 Ca 0.01 -1.11 -0.26 0.00 -2.02 0.00 0.00 58.31 54.93 2cxt n LYS 57 Cb 0.48 -1.43 -0.05 0.00 -0.02 0.00 0.00 35.03 34.01 2cxt n LYS 57 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2cxt s ASN 58 N 0.32 5.64 -1.49 4.39 -0.87 -1.12 -1.76 114.94 120.05 2cxt s ASN 58 Ca 0.21 -0.09 -0.13 0.00 -1.57 0.00 0.00 52.86 51.28 2cxt s ASN 58 Cb 0.17 -1.51 -0.01 0.00 -0.02 0.00 0.00 41.25 39.89 2cxt s ASN 58 CO 0.03 0.06 2.44 0.18 -2.57 0.00 0.00 177.10 177.24 2cxt n LEU 59 N -0.44 7.35 -3.94 0.60 4.77 -1.26 -4.85 117.00 119.22 2cxt n LEU 59 Ca -0.08 -4.16 -0.11 0.00 -0.03 0.00 0.00 56.01 51.63 2cxt n LEU 59 Cb 0.55 -1.61 -0.12 0.00 -2.33 0.00 0.00 43.42 39.90 2cxt n LEU 59 CO 0.44 1.36 -0.37 0.68 -1.33 0.00 0.00 177.39 178.17 2cxt s VAL 60 N 2.94 0.12 0.47 4.08 -7.23 -1.26 -5.07 120.40 114.45 2cxt s VAL 60 Ca 0.54 -0.52 0.07 0.00 -1.81 0.00 0.00 61.98 60.26 2cxt s VAL 60 Cb 0.15 -0.20 -0.00 0.00 0.56 0.00 0.00 36.38 36.89 2cxt s VAL 60 CO -0.07 -0.25 0.35 -0.94 -0.31 0.00 0.00 175.10 173.88 2cxt s SER 61 N -0.80 4.75 0.24 4.85 1.04 -1.26 -4.99 113.70 117.53 2cxt s SER 61 Ca -0.08 -1.02 -0.05 0.00 0.48 0.00 0.00 55.95 55.29 2cxt s SER 61 Cb -0.06 -0.15 0.46 0.00 0.10 0.00 0.00 66.02 66.37 2cxt s SER 61 CO -0.00 -0.82 1.71 0.50 0.98 0.00 0.00 173.24 175.60 2cxt h LYS 62 N 0.99 0.34 -0.53 4.02 3.64 -2.00 -1.53 116.57 121.49 2cxt h LYS 62 Ca -0.40 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 58.88 2cxt h LYS 62 Cb 1.28 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.00 2cxt h LYS 62 CO 0.60 0.22 0.01 1.49 -2.27 0.00 0.00 179.45 179.50 2cxt h GLU 63 N 0.35 0.90 -0.39 1.90 4.57 -1.99 -0.95 114.58 118.98 2cxt h GLU 63 Ca 0.41 -0.26 -0.02 0.00 -1.18 0.00 0.00 59.36 58.32 2cxt h GLU 63 Cb 0.67 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.14 2cxt h GLU 63 CO -0.45 0.89 0.17 0.28 -1.18 0.00 0.00 179.01 178.72 2cxt h VAL 64 N 0.84 1.18 -0.72 0.32 2.07 -1.76 -0.87 116.25 117.31 2cxt h VAL 64 Ca 0.16 -0.54 -0.03 0.00 0.82 0.00 0.00 66.70 67.10 2cxt h VAL 64 Cb 0.49 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 2cxt h VAL 64 CO 0.02 0.20 0.32 0.24 0.02 0.00 0.00 177.57 178.37 2cxt h MET 65 N 0.48 1.04 -0.32 1.57 2.86 -1.04 -0.39 114.93 119.14 2cxt h MET 65 Ca 0.13 -0.16 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 2cxt h MET 65 Cb 0.16 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 2cxt h MET 65 CO -0.01 0.82 0.17 1.96 1.06 0.00 0.00 176.91 180.90 2cxt h GLN 66 N 1.02 0.45 -0.71 1.72 4.20 -0.94 -0.86 115.11 119.99 2cxt h GLN 66 Ca 0.25 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.86 2cxt h GLN 66 Cb 0.14 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 2cxt h GLN 66 CO -0.03 0.39 0.28 0.52 -0.67 0.00 0.00 178.83 179.32 2cxt h MET 67 N 0.39 1.05 -0.31 1.46 2.86 -0.74 -0.97 114.93 118.66 2cxt h MET 67 Ca 0.11 -0.18 -0.06 0.00 -2.06 0.00 0.00 59.70 57.51 2cxt h MET 67 Cb 0.08 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.55 2cxt h MET 67 CO -0.02 0.86 -0.04 -0.07 1.06 0.00 0.00 176.91 178.70 2cxt h LEU 68 N 1.03 0.58 -0.69 1.22 3.38 -0.83 -1.48 115.31 118.52 2cxt h LEU 68 Ca 0.24 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 2cxt h LEU 68 Cb 0.20 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 2cxt h LEU 68 CO -0.02 0.79 0.26 0.58 0.09 0.00 0.00 178.44 180.14 2cxt h VAL 69 N 0.36 1.25 -0.85 1.22 2.07 -0.98 -1.28 116.25 118.03 2cxt h VAL 69 Ca 0.08 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 2cxt h VAL 69 Cb 0.51 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 2cxt h VAL 69 CO 0.02 0.31 0.51 -0.33 0.02 0.00 0.00 177.57 178.11 2cxt h GLU 70 N 0.98 1.16 -0.49 1.57 5.08 -1.04 -1.60 114.58 120.23 2cxt h GLU 70 Ca 0.23 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.45 2cxt h GLU 70 Cb 0.23 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2cxt h GLU 70 CO -0.02 0.81 0.17 1.25 -1.00 0.00 0.00 179.01 180.22 2cxt h LEU 71 N 1.18 0.71 -0.54 1.33 5.85 -0.81 -0.90 115.31 122.12 2cxt h LEU 71 Ca 0.31 -0.19 0.05 0.00 0.84 0.00 0.00 57.88 58.88 2cxt h LEU 71 Cb -0.05 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.75 2cxt h LEU 71 CO -0.06 0.71 0.29 0.00 -0.34 0.00 0.00 178.44 179.04 2cxt h ALA 72 N 1.02 0.70 -0.18 1.25 0.00 -0.71 -0.31 119.26 121.04 2cxt h ALA 72 Ca 0.16 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2cxt h ALA 72 Cb 0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2cxt h ALA 72 CO -0.01 -0.05 0.08 0.87 0.00 0.00 0.00 179.25 180.14 2cxt h LYS 73 N 0.55 0.27 0.00 0.00 1.57 -1.13 -2.45 116.57 115.38 2cxt h LYS 73 Ca 0.24 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2cxt h LYS 73 Cb 0.14 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.40 2cxt h LYS 73 CO -0.16 0.31 0.00 -1.13 -0.57 0.00 0.00 179.45 177.90 2cxt n SER 74 N -4.87 0.00 -0.74 0.86 3.41 -0.36 -1.60 113.62 110.32 2cxt n SER 74 Ca -0.04 0.11 0.13 0.00 -0.26 0.00 0.00 58.87 58.80 2cxt n SER 74 Cb 0.10 -0.35 0.25 0.00 -0.26 0.00 0.00 64.21 63.96 2cxt n SER 74 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2cxt n ARG 75 N -1.35 1.98 -1.73 4.33 5.12 -0.16 -4.98 116.66 119.88 2cxt n ARG 75 Ca 0.09 -1.50 0.00 0.00 -1.93 0.00 0.00 57.85 54.52 2cxt n ARG 75 Cb 0.21 -1.47 0.00 0.00 -1.16 0.00 0.00 32.46 30.04 2cxt n ARG 75 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2cxt n GLY 76 N 1.29 0.44 0.24 -0.13 0.00 -0.63 -4.77 105.19 101.63 2cxt n GLY 76 Ca 0.15 -0.88 -0.06 0.00 0.00 0.00 0.00 46.02 45.23 2cxt n GLY 76 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2cxt h VAL 77 N 0.00 1.13 -0.43 1.61 2.07 -1.62 -0.59 116.25 118.41 2cxt h VAL 77 Ca 0.00 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 2cxt h VAL 77 Cb 0.78 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 2cxt h VAL 77 CO 0.00 0.14 0.18 -0.33 0.02 0.00 0.00 177.57 177.58 2cxt h GLU 78 N 0.77 0.64 -0.38 1.57 5.08 -1.87 -0.53 114.58 119.86 2cxt h GLU 78 Ca 0.22 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.42 2cxt h GLU 78 Cb -0.06 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 2cxt h GLU 78 CO -0.06 0.58 0.04 0.00 -1.00 0.00 0.00 179.01 178.57 2cxt h ALA 79 N 1.03 0.50 -0.68 3.43 0.00 -1.91 -2.47 119.26 119.17 2cxt h ALA 79 Ca 0.14 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2cxt h ALA 79 Cb 0.17 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2cxt h ALA 79 CO -0.01 0.23 0.37 0.00 0.00 0.00 0.00 179.25 179.84 2cxt h ALA 80 N 0.90 0.87 -0.06 0.00 0.00 -0.96 -1.55 119.26 118.46 2cxt h ALA 80 Ca 0.11 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2cxt h ALA 80 Cb 0.39 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2cxt h ALA 80 CO 0.01 0.38 -0.09 -0.09 0.00 0.00 0.00 179.25 179.46 2cxt h ARG 81 N 0.93 -0.12 -0.85 0.00 2.43 -1.02 -1.42 114.38 114.34 2cxt h ARG 81 Ca 0.24 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.45 2cxt h ARG 81 Cb 0.04 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.57 2cxt h ARG 81 CO -0.04 -0.08 0.56 -0.44 -1.51 0.00 0.00 179.97 178.46 2cxt h ASP 82 N -0.12 0.92 -0.63 -3.80 3.32 -1.17 -1.75 116.42 113.18 2cxt h ASP 82 Ca 0.06 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.04 2cxt h ASP 82 Cb 0.20 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 2cxt h ASP 82 CO -0.14 0.64 0.21 0.78 -1.72 0.00 0.00 179.24 179.01 2cxt h ASN 83 N 1.07 0.93 -0.07 6.45 -0.26 -0.96 -1.66 115.58 121.07 2cxt h ASN 83 Ca 0.33 -0.16 -0.00 0.00 -0.56 0.00 0.00 56.30 55.91 2cxt h ASN 83 Cb -0.00 -0.24 -0.00 0.00 -1.06 0.00 0.00 38.32 37.01 2cxt h ASN 83 CO -0.09 0.87 0.04 -0.03 -1.06 0.00 0.00 177.43 177.15 2cxt h MET 84 N 0.97 0.11 0.00 0.81 4.05 -0.42 -1.29 114.93 119.16 2cxt h MET 84 Ca 0.22 -0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.60 2cxt h MET 84 Cb 0.27 -0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.05 2cxt h MET 84 CO -0.01 0.20 -0.10 0.74 0.23 0.00 0.00 176.91 177.96 2cxt h PHE 85 N -0.01 0.00 -0.01 1.39 -1.00 -1.20 -2.69 116.94 113.42 2cxt h PHE 85 Ca 0.03 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.81 2cxt h PHE 85 Cb 0.12 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.68 2cxt h PHE 85 CO -0.03 0.10 -0.29 -1.13 -1.61 0.00 0.00 178.31 175.36 2cxt n SER 86 N -3.31 1.64 0.00 2.17 3.41 -0.64 -4.93 113.62 111.95 2cxt n SER 86 Ca -0.00 -1.30 0.00 0.00 -0.26 0.00 0.00 58.87 57.31 2cxt n SER 86 Cb 0.32 0.24 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 2cxt n SER 86 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cxt n GLY 87 N 1.35 0.72 3.74 5.00 0.00 -1.01 -4.28 105.19 110.70 2cxt n GLY 87 Ca 0.12 -0.22 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 2cxt n GLY 87 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cxt s SER 88 N -2.20 4.73 -1.42 1.61 0.01 -0.50 -4.69 113.70 111.24 2cxt s SER 88 Ca 0.00 2.63 -0.10 0.00 1.31 0.00 0.00 55.95 59.79 2cxt s SER 88 Cb 0.00 -2.62 0.06 0.00 0.21 0.00 0.00 66.02 63.67 2cxt s SER 88 CO 0.00 -1.92 2.34 0.29 0.41 0.00 0.00 173.24 174.36 2cxt n LYS 89 N -1.77 3.60 0.10 12.44 5.02 -1.26 -4.14 118.16 132.15 2cxt n LYS 89 Ca 0.15 -2.93 0.12 0.00 -2.02 0.00 0.00 58.31 53.63 2cxt n LYS 89 Cb 0.48 -2.95 0.45 0.00 -0.02 0.00 0.00 35.03 33.00 2cxt n LYS 89 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 2cxt n ILE 90 N 3.60 0.70 -2.59 -0.18 -5.35 -1.14 -3.96 119.36 110.44 2cxt n ILE 90 Ca 0.57 0.04 -0.42 0.00 -0.27 0.00 0.00 62.75 62.67 2cxt n ILE 90 Cb 0.32 -0.90 -0.01 0.00 -1.74 0.00 0.00 39.64 37.31 2cxt n ILE 90 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2cxt s ASN 91 N -4.11 6.74 0.32 7.28 3.84 -0.79 -4.85 114.94 123.38 2cxt s ASN 91 Ca 0.07 -2.16 0.16 0.00 0.21 0.00 0.00 52.86 51.15 2cxt s ASN 91 Cb 0.11 -2.57 0.40 0.00 -0.55 0.00 0.00 41.25 38.64 2cxt s ASN 91 CO 0.46 -1.26 1.60 0.10 -2.79 0.00 0.00 177.10 175.20 2cxt h TYR 92 N 8.25 0.00 0.00 0.43 -0.00 -1.83 0.45 116.97 124.27 2cxt h TYR 92 Ca 0.37 0.00 -0.09 0.00 0.00 0.00 0.00 58.73 59.01 2cxt h TYR 92 Cb 0.91 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.63 2cxt h TYR 92 CO 1.37 0.48 -0.41 1.79 -0.00 0.00 0.00 178.16 181.40 2cxt h THR 93 N 0.00 0.79 -0.01 -0.90 1.35 -1.93 -3.23 112.91 108.99 2cxt h THR 93 Ca -0.00 -1.81 0.00 0.00 -0.55 0.00 0.00 66.41 64.05 2cxt h THR 93 Cb 1.13 2.16 0.00 0.00 -1.73 0.00 0.00 68.15 69.72 2cxt h THR 93 CO 0.06 0.40 -0.29 -0.62 -0.25 0.00 0.00 175.52 174.82 2cxt n GLU 94 N -3.33 1.93 -3.56 4.72 1.02 -1.14 -5.02 120.64 115.26 2cxt n GLU 94 Ca 0.01 -0.67 -0.26 0.00 -0.02 0.00 0.00 57.16 56.22 2cxt n GLU 94 Cb 0.61 -1.17 0.05 0.00 -0.02 0.00 0.00 31.44 30.91 2cxt n GLU 94 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2cxt n ASP 95 N -0.25 -5.50 -4.16 1.62 2.03 0.07 -5.02 116.55 105.34 2cxt n ASP 95 Ca 0.05 -0.92 -0.18 0.00 0.52 0.00 0.00 54.79 54.26 2cxt n ASP 95 Cb 0.27 -3.95 -0.12 0.00 -0.72 0.00 0.00 41.12 36.60 2cxt n ASP 95 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2cxt s ARG 96 N -5.52 0.82 0.91 -0.67 0.52 -0.69 -5.03 118.95 109.29 2cxt s ARG 96 Ca 0.45 -0.89 -0.12 0.00 -0.52 0.00 0.00 55.73 54.65 2cxt s ARG 96 Cb -0.13 -0.81 0.13 0.00 0.52 0.00 0.00 34.95 34.67 2cxt s ARG 96 CO 0.82 0.18 1.09 0.00 0.02 0.00 0.00 175.30 177.42 2cxt s ALA 97 N -1.18 1.51 -0.35 2.13 0.00 -1.26 -1.88 121.76 120.73 2cxt s ALA 97 Ca -0.02 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 51.80 2cxt s ALA 97 Cb -0.09 -3.16 0.11 0.00 0.00 0.00 0.00 23.12 19.97 2cxt s ALA 97 CO 0.02 -2.38 0.14 0.08 0.00 0.00 0.00 175.76 173.62 2cxt s VAL 98 N -2.97 1.08 -0.29 0.00 1.01 -1.26 -4.39 120.40 113.58 2cxt s VAL 98 Ca 0.64 -1.83 0.16 0.00 0.00 0.00 0.00 61.98 60.95 2cxt s VAL 98 Cb -0.18 -1.79 0.48 0.00 0.00 0.00 0.00 36.38 34.89 2cxt s VAL 98 CO 0.57 -0.76 1.12 0.18 0.00 0.00 0.00 175.10 176.21 2cxt n LEU 99 N 4.37 2.89 0.27 3.92 4.77 -0.40 -4.72 117.00 128.09 2cxt n LEU 99 Ca 0.02 -3.83 0.11 0.00 -0.03 0.00 0.00 56.01 52.29 2cxt n LEU 99 Cb 0.39 0.14 0.75 0.00 -2.33 0.00 0.00 43.42 42.37 2cxt n LEU 99 CO 0.16 1.53 1.10 1.12 -1.33 0.00 0.00 177.39 179.97 2cxt h HIS 100 N 2.51 0.00 -0.02 -1.77 2.07 -1.87 -1.83 115.15 114.24 2cxt h HIS 100 Ca 0.06 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.56 2cxt h HIS 100 Cb 1.32 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.30 2cxt h HIS 100 CO 0.64 0.00 -0.12 -0.39 -3.07 0.00 0.00 177.93 174.99 2cxt h VAL 101 N 0.00 1.10 -0.19 6.12 -1.51 -1.95 -2.39 116.25 117.44 2cxt h VAL 101 Ca 0.01 -0.47 -0.09 0.00 -1.23 0.00 0.00 66.70 64.92 2cxt h VAL 101 Cb 0.04 1.22 -0.01 0.00 -2.13 0.00 0.00 31.29 30.41 2cxt h VAL 101 CO -0.00 0.14 -0.26 0.00 -1.23 0.00 0.00 177.57 176.21 2cxt h ALA 102 N 1.85 1.20 -0.25 5.19 0.00 -1.70 -2.59 119.26 122.96 2cxt h ALA 102 Ca 0.01 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 2cxt h ALA 102 Cb 0.24 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2cxt h ALA 102 CO 0.02 0.52 0.15 -0.07 0.00 0.00 0.00 179.25 179.86 2cxt h LEU 103 N 0.32 0.29 -3.19 0.00 3.38 -1.45 -2.28 115.31 112.38 2cxt h LEU 103 Ca 0.05 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2cxt h LEU 103 Cb 0.64 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2cxt h LEU 103 CO 0.05 0.23 -0.02 -2.11 0.09 0.00 0.00 178.44 176.68 2cxt n ARG 104 N -4.48 2.33 -2.27 1.13 0.00 -1.18 -4.91 116.66 107.28 2cxt n ARG 104 Ca 0.01 -2.82 -0.34 0.00 -0.00 0.00 0.00 57.85 54.70 2cxt n ARG 104 Cb 0.09 -1.75 -0.04 0.00 -0.00 0.00 0.00 32.46 30.76 2cxt n ARG 104 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 2cxt s ASN 105 N -2.29 5.75 0.53 2.89 2.47 -0.86 -4.34 114.94 119.10 2cxt s ASN 105 Ca 0.40 -1.96 0.30 0.00 0.42 0.00 0.00 52.86 52.02 2cxt s ASN 105 Cb 0.33 -2.59 1.48 0.00 -1.45 0.00 0.00 41.25 39.02 2cxt s ASN 105 CO 0.06 -2.32 2.06 0.03 -3.72 0.00 0.00 177.10 173.21 2cxt h ARG 106 N 8.91 0.00 0.00 0.43 2.47 -1.89 -2.28 114.38 122.01 2cxt h ARG 106 Ca 0.31 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 59.02 2cxt h ARG 106 Cb 0.91 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.23 2cxt h ARG 106 CO 1.32 0.10 -0.04 0.66 0.56 0.00 0.00 179.97 182.57 2cxt h SER 107 N 0.00 0.00 -0.73 7.04 4.64 -2.00 -3.47 113.55 119.03 2cxt h SER 107 Ca -0.00 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.00 2cxt h SER 107 Cb 0.38 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.35 2cxt h SER 107 CO 0.01 0.04 -0.29 0.59 -0.87 0.00 0.00 176.83 176.32 2cxt n ASN 108 N -3.15 -5.50 -4.72 4.97 3.02 -0.86 -4.96 115.26 104.07 2cxt n ASN 108 Ca 0.01 0.38 -0.42 0.00 -0.03 0.00 0.00 54.58 54.52 2cxt n ASN 108 Cb 0.35 -4.35 -0.03 0.00 -0.61 0.00 0.00 39.78 35.14 2cxt n ASN 108 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2cxt s THR 109 N -2.36 2.35 0.19 3.41 -1.32 -1.26 -4.89 115.64 111.76 2cxt s THR 109 Ca 0.00 0.24 -0.33 0.00 -1.21 0.00 0.00 61.69 60.39 2cxt s THR 109 Cb 0.00 -3.15 -0.14 0.00 -1.51 0.00 0.00 72.50 67.69 2cxt s THR 109 CO 0.00 0.02 1.39 -2.65 -2.21 0.00 0.00 174.62 171.16 2cxt n PRO 110 N 4.04 1.78 -3.98 7.08 -0.02 -1.26 -4.97 135.00 137.66 2cxt n PRO 110 Ca 0.15 0.64 -0.29 0.00 -2.02 0.00 0.00 63.50 61.97 2cxt n PRO 110 Cb 0.37 -2.28 -0.17 0.00 -0.02 0.00 0.00 33.50 31.40 2cxt n PRO 110 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2cxt s ILE 111 N 0.19 1.42 -0.14 4.25 1.01 -1.26 -5.05 121.20 121.61 2cxt s ILE 111 Ca 0.73 -0.55 -0.07 0.00 0.00 0.00 0.00 60.65 60.77 2cxt s ILE 111 Cb -0.73 -1.36 -0.04 0.00 0.01 0.00 0.00 42.46 40.34 2cxt s ILE 111 CO 0.47 0.42 0.08 -0.54 0.00 0.00 0.00 174.94 175.38 2cxt s LYS 112 N 1.55 3.63 -0.18 2.79 1.02 -1.26 -0.80 119.74 126.49 2cxt s LYS 112 Ca 0.05 -0.27 0.01 0.00 0.02 0.00 0.00 55.97 55.77 2cxt s LYS 112 Cb -0.13 -3.15 0.01 0.00 -0.52 0.00 0.00 37.83 34.05 2cxt s LYS 112 CO -0.10 0.53 -0.18 0.08 -0.92 0.00 0.00 175.35 174.76 2cxt s VAL 113 N -0.34 2.23 -1.33 3.17 1.01 -0.41 -4.37 120.40 120.37 2cxt s VAL 113 Ca 0.10 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.17 2cxt s VAL 113 Cb -0.12 -1.94 0.01 0.00 0.00 0.00 0.00 36.38 34.33 2cxt s VAL 113 CO 0.01 0.53 0.77 0.47 0.00 0.00 0.00 175.10 176.88 2cxt n ASP 114 N 4.55 -1.81 0.00 3.32 10.43 -1.26 -2.30 116.55 129.48 2cxt n ASP 114 Ca -0.20 -0.79 0.00 0.00 2.57 0.00 0.00 54.79 56.36 2cxt n ASP 114 Cb 0.50 -4.15 0.00 0.00 1.84 0.00 0.00 41.12 39.31 2cxt n ASP 114 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2cxt n GLY 115 N -1.56 0.57 3.32 0.44 0.00 -1.26 -4.98 105.19 101.72 2cxt n GLY 115 Ca -0.25 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 2cxt n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cxt s LYS 116 N -0.43 3.35 0.11 1.61 1.02 -0.97 -5.00 119.74 119.42 2cxt s LYS 116 Ca 0.00 -0.68 -0.31 0.00 0.02 0.00 0.00 55.97 55.01 2cxt s LYS 116 Cb 0.00 -2.77 -0.10 0.00 -0.52 0.00 0.00 37.83 34.44 2cxt s LYS 116 CO 0.00 0.02 1.86 0.34 -0.92 0.00 0.00 175.35 176.65 2cxt s ASP 117 N 0.86 6.43 0.13 2.83 2.15 -1.26 -1.29 116.67 126.52 2cxt s ASP 117 Ca -0.03 2.75 0.26 0.00 0.43 0.00 0.00 52.55 55.95 2cxt s ASP 117 Cb -0.15 -2.56 0.65 0.00 -0.30 0.00 0.00 42.92 40.56 2cxt s ASP 117 CO 0.00 -1.01 1.58 1.33 -0.17 0.00 0.00 175.17 176.90 2cxt n VAL 118 N 4.88 0.38 -0.21 1.11 0.24 0.02 -4.40 118.33 120.35 2cxt n VAL 118 Ca 0.18 -0.23 -0.08 0.00 -2.04 0.00 0.00 64.34 62.18 2cxt n VAL 118 Cb 0.39 -0.32 0.03 0.00 -1.47 0.00 0.00 33.84 32.46 2cxt n VAL 118 CO 0.00 0.00 0.00 0.24 -2.14 0.00 0.00 176.83 174.93 2cxt h MET 119 N 0.00 0.90 -0.91 7.34 2.86 -1.91 -1.91 114.93 121.30 2cxt h MET 119 Ca 0.00 -0.18 0.10 0.00 -2.06 0.00 0.00 59.70 57.57 2cxt h MET 119 Cb 0.69 -0.14 -0.08 0.00 0.06 0.00 0.00 31.60 32.14 2cxt h MET 119 CO 0.00 0.79 0.55 -1.35 1.06 0.00 0.00 176.91 177.95 2cxt h PRO 120 N 0.83 0.87 -0.10 -0.22 0.11 -1.98 -0.20 132.00 131.30 2cxt h PRO 120 Ca 0.19 -0.05 -0.19 0.00 0.11 0.00 0.00 66.00 66.06 2cxt h PRO 120 Cb 0.24 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 31.16 2cxt h PRO 120 CO -0.01 0.57 -0.74 0.93 -0.21 0.00 0.00 178.00 178.54 2cxt h GLU 121 N 0.89 0.52 -0.20 1.05 4.39 -1.79 -0.02 114.58 119.43 2cxt h GLU 121 Ca 0.44 -0.42 0.02 0.00 0.34 0.00 0.00 59.36 59.75 2cxt h GLU 121 Cb 0.41 0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.12 2cxt h GLU 121 CO -0.25 1.05 0.05 0.28 -1.16 0.00 0.00 179.01 178.97 2cxt h VAL 122 N 0.35 0.92 -0.03 3.13 2.07 -0.98 -2.32 116.25 119.40 2cxt h VAL 122 Ca -0.04 -0.04 -0.11 0.00 0.82 0.00 0.00 66.70 67.33 2cxt h VAL 122 Cb 1.33 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 2cxt h VAL 122 CO 0.13 0.02 -0.51 0.78 0.02 0.00 0.00 177.57 178.02 2cxt h ASN 123 N 0.13 0.07 -0.23 0.57 2.35 -0.98 -1.87 115.58 115.63 2cxt h ASN 123 Ca 0.09 -0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2cxt h ASN 123 Cb 0.08 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 2cxt h ASN 123 CO -0.11 0.57 0.12 -0.09 -1.65 0.00 0.00 177.43 176.27 2cxt h ARG 124 N 0.05 0.32 -0.51 0.81 2.43 -0.79 -0.73 114.38 115.96 2cxt h ARG 124 Ca -0.00 -0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 59.01 2cxt h ARG 124 Cb 0.93 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.40 2cxt h ARG 124 CO 0.07 0.29 -0.15 0.28 -1.51 0.00 0.00 179.97 178.95 2cxt h VAL 125 N 0.26 1.27 -0.82 0.20 2.07 -1.29 -1.59 116.25 116.34 2cxt h VAL 125 Ca 0.08 -1.30 0.01 0.00 0.82 0.00 0.00 66.70 66.31 2cxt h VAL 125 Cb 0.07 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 2cxt h VAL 125 CO -0.01 0.45 0.54 -0.07 0.02 0.00 0.00 177.57 178.50 2cxt h LEU 126 N 0.87 0.93 -0.84 2.57 3.38 -1.23 0.18 115.31 121.17 2cxt h LEU 126 Ca 0.13 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 2cxt h LEU 126 Cb 0.71 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 2cxt h LEU 126 CO 0.05 0.67 0.41 0.44 0.09 0.00 0.00 178.44 180.10 2cxt h ASP 127 N 1.10 1.10 -0.59 -0.43 3.32 -0.87 -0.22 116.42 119.83 2cxt h ASP 127 Ca 0.31 -0.13 -0.04 0.00 0.02 0.00 0.00 57.03 57.19 2cxt h ASP 127 Cb -0.10 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.14 2cxt h ASP 127 CO -0.08 0.92 0.22 0.50 -1.72 0.00 0.00 179.24 179.09 2cxt h LYS 128 N 1.20 0.90 -0.48 3.56 3.64 -0.80 -1.71 116.57 122.87 2cxt h LYS 128 Ca 0.29 -0.17 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2cxt h LYS 128 Cb 0.11 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 2cxt h LYS 128 CO -0.04 0.78 0.27 0.52 -2.27 0.00 0.00 179.45 178.72 2cxt h MET 129 N 0.83 0.67 -0.51 1.90 2.86 -0.52 -1.35 114.93 118.81 2cxt h MET 129 Ca 0.20 -0.07 0.01 0.00 -2.06 0.00 0.00 59.70 57.77 2cxt h MET 129 Cb 0.23 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 2cxt h MET 129 CO -0.01 0.52 0.33 -0.22 1.06 0.00 0.00 176.91 178.59 2cxt h LYS 130 N 0.64 0.66 -0.53 1.72 3.64 -0.84 0.19 116.57 122.06 2cxt h LYS 130 Ca 0.17 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.45 2cxt h LYS 130 Cb 0.03 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.68 2cxt h LYS 130 CO -0.03 0.44 0.11 1.03 -2.27 0.00 0.00 179.45 178.73 2cxt h SER 131 N 0.68 0.82 -0.67 4.20 0.87 -1.14 -1.87 113.55 116.44 2cxt h SER 131 Ca 0.19 -0.25 -0.06 0.00 -1.23 0.00 0.00 61.79 60.45 2cxt h SER 131 Cb -0.07 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 61.64 2cxt h SER 131 CO -0.04 0.86 0.20 0.15 -0.53 0.00 0.00 176.83 177.46 2cxt h PHE 132 N 0.75 1.09 -0.83 2.24 3.57 -1.00 -1.85 116.94 120.91 2cxt h PHE 132 Ca 0.16 -0.12 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 2cxt h PHE 132 Cb 0.37 -0.31 -0.04 0.00 2.79 0.00 0.00 35.95 38.76 2cxt h PHE 132 CO 0.03 0.88 0.42 0.00 -2.23 0.00 0.00 178.31 177.40 2cxt h GLN 134 N 1.17 0.04 -0.60 0.00 -0.00 -1.05 -0.17 115.11 114.49 2cxt h GLN 134 Ca 0.29 -0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.93 2cxt h GLN 134 Cb 0.09 -0.01 -0.03 0.00 0.00 0.00 0.00 27.48 27.53 2cxt h GLN 134 CO -0.04 0.02 0.37 0.00 0.00 0.00 0.00 178.83 179.18 2cxt h ARG 135 N 0.04 0.81 0.01 1.69 2.47 -1.04 -1.58 114.38 116.78 2cxt h ARG 135 Ca 0.02 -0.07 -0.00 0.00 -1.26 0.00 0.00 59.98 58.67 2cxt h ARG 135 Cb 0.01 -0.17 0.00 0.00 -1.65 0.00 0.00 29.97 28.16 2cxt h ARG 135 CO -0.02 0.57 -0.01 0.28 0.56 0.00 0.00 179.97 181.35 2cxt h VAL 136 N 0.81 1.51 -0.19 2.04 2.07 -1.14 0.73 116.25 122.07 2cxt h VAL 136 Ca 0.21 -1.68 -0.08 0.00 0.82 0.00 0.00 66.70 65.97 2cxt h VAL 136 Cb -0.03 2.62 -0.01 0.00 -1.52 0.00 0.00 31.29 32.35 2cxt h VAL 136 CO -0.04 0.43 -0.23 0.03 0.02 0.00 0.00 177.57 177.77 2cxt h ARG 137 N -0.76 0.34 0.00 1.57 3.08 -1.04 -2.58 114.38 115.00 2cxt h ARG 137 Ca -0.00 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 2cxt h ARG 137 Cb 0.71 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.73 2cxt h ARG 137 CO 0.00 0.56 -0.05 0.66 -1.07 0.00 0.00 179.97 180.08 2cxt h SER 138 N 0.31 0.00 0.00 7.04 4.64 -1.40 -3.47 113.55 120.67 2cxt h SER 138 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2cxt h SER 138 Cb 0.58 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 2cxt h SER 138 CO 0.04 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.66 2cxt n GLY 139 N 0.31 0.65 0.24 -0.77 0.00 -0.97 -4.96 105.19 99.69 2cxt n GLY 139 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.98 2cxt n GLY 139 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2cxt h ASP 140 N 0.00 0.60 -2.90 1.61 3.45 -1.64 -3.41 116.42 114.13 2cxt h ASP 140 Ca 0.00 -0.22 -0.57 0.00 0.43 0.00 0.00 57.03 56.67 2cxt h ASP 140 Cb 0.00 -0.16 -0.03 0.00 -0.56 0.00 0.00 39.33 38.57 2cxt h ASP 140 CO 0.00 0.85 1.12 0.86 -1.57 0.00 0.00 179.24 180.50 2cxt s TRP 141 N -4.47 2.19 -0.01 4.55 -0.11 0.19 -5.00 118.94 116.28 2cxt s TRP 141 Ca -0.08 0.63 -0.02 0.00 1.22 0.00 0.00 56.10 57.86 2cxt s TRP 141 Cb 0.13 -4.05 -0.04 0.00 -1.50 0.00 0.00 33.47 28.01 2cxt s TRP 141 CO 0.81 -2.58 0.14 0.15 -4.62 0.00 0.00 176.95 170.85 2cxt s LYS 142 N 4.82 3.28 0.96 5.86 -0.14 -1.26 -3.87 119.74 129.38 2cxt s LYS 142 Ca 0.69 -0.39 -0.16 0.00 -1.36 0.00 0.00 55.97 54.75 2cxt s LYS 142 Cb -0.21 -3.00 0.23 0.00 -1.68 0.00 0.00 37.83 33.17 2cxt s LYS 142 CO 0.30 0.66 1.09 0.41 -0.76 0.00 0.00 175.35 177.05 2cxt n GLY 143 N 1.06 -1.99 0.31 -3.33 0.00 0.64 -4.84 105.19 97.04 2cxt n GLY 143 Ca -0.12 -1.62 0.21 0.00 0.00 0.00 0.00 46.02 44.49 2cxt n GLY 143 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2cxt h TYR 144 N -2.06 0.00 -0.56 1.61 -0.00 -1.88 0.19 116.97 114.28 2cxt h TYR 144 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.36 2cxt h TYR 144 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.81 2cxt h TYR 144 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 178.16 178.41 2cxt n THR 145 N -3.04 0.84 -0.59 -0.90 -2.24 -1.26 -4.97 114.28 102.11 2cxt n THR 145 Ca -0.02 -0.92 0.00 0.00 -2.27 0.00 0.00 64.05 60.84 2cxt n THR 145 Cb 0.15 0.65 0.00 0.00 -2.10 0.00 0.00 70.33 69.03 2cxt n THR 145 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cxt n GLY 146 N 1.39 0.66 3.89 3.38 0.00 0.06 -5.07 105.19 109.49 2cxt n GLY 146 Ca 0.20 -0.41 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 2cxt n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cxt s LYS 147 N -0.89 3.28 0.59 1.61 1.02 -1.26 -4.74 119.74 119.34 2cxt s LYS 147 Ca 0.00 -0.60 -0.19 0.00 0.02 0.00 0.00 55.97 55.21 2cxt s LYS 147 Cb 0.00 -2.91 -0.04 0.00 -0.52 0.00 0.00 37.83 34.36 2cxt s LYS 147 CO 0.00 0.55 1.18 -1.12 -0.92 0.00 0.00 175.35 175.05 2cxt s SER 148 N -2.83 5.30 0.09 2.83 0.01 -1.26 -0.26 113.70 117.58 2cxt s SER 148 Ca 0.33 2.31 -0.30 0.00 1.31 0.00 0.00 55.95 59.61 2cxt s SER 148 Cb -0.12 -2.59 -0.06 0.00 0.21 0.00 0.00 66.02 63.46 2cxt s SER 148 CO 0.27 -1.51 1.11 -0.63 0.41 0.00 0.00 173.24 172.88 2cxt s ILE 149 N -1.69 4.18 -0.04 1.44 -1.09 -1.25 -4.73 121.20 118.03 2cxt s ILE 149 Ca 0.76 1.67 0.05 0.00 -2.23 0.00 0.00 60.65 60.90 2cxt s ILE 149 Cb -0.28 -4.07 -0.08 0.00 -1.58 0.00 0.00 42.46 36.45 2cxt s ILE 149 CO 0.32 0.19 0.13 0.35 -1.23 0.00 0.00 174.94 174.70 2cxt n THR 150 N 3.35 0.00 -4.09 2.92 -2.24 0.00 -4.85 114.28 109.37 2cxt n THR 150 Ca 0.06 -0.16 -0.17 0.00 -2.27 0.00 0.00 64.05 61.51 2cxt n THR 150 Cb 0.47 0.46 -0.16 0.00 -2.10 0.00 0.00 70.33 69.01 2cxt n THR 150 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2cxt s ASP 151 N -2.46 0.64 -0.10 3.42 1.11 -0.99 -1.61 116.67 116.68 2cxt s ASP 151 Ca -0.01 -0.08 0.01 0.00 0.18 0.00 0.00 52.55 52.65 2cxt s ASP 151 Cb 0.03 -0.24 -0.02 0.00 1.07 0.00 0.00 42.92 43.77 2cxt s ASP 151 CO 0.22 -0.02 -0.14 -0.63 1.18 0.00 0.00 175.17 175.78 2cxt s ILE 152 N 0.55 3.04 -0.26 0.77 -1.09 0.89 -0.68 121.20 124.43 2cxt s ILE 152 Ca -0.06 -0.69 0.02 0.00 -2.23 0.00 0.00 60.65 57.68 2cxt s ILE 152 Cb -0.10 -2.24 0.06 0.00 -1.58 0.00 0.00 42.46 38.61 2cxt s ILE 152 CO -0.00 0.55 -0.06 -0.63 -1.23 0.00 0.00 174.94 173.57 2cxt s ILE 153 N -0.03 1.79 -0.17 2.92 1.09 0.18 -0.37 121.20 126.60 2cxt s ILE 153 Ca -0.03 -1.47 -0.27 0.00 -1.10 0.00 0.00 60.65 57.78 2cxt s ILE 153 Cb -0.14 -2.03 -0.01 0.00 -1.06 0.00 0.00 42.46 39.22 2cxt s ILE 153 CO 0.04 -0.14 0.93 0.21 -0.10 0.00 0.00 174.94 175.87 2cxt s ASN 154 N 1.26 7.06 -0.21 3.58 2.47 0.06 -0.28 114.94 128.87 2cxt s ASN 154 Ca -0.05 1.31 -0.03 0.00 0.42 0.00 0.00 52.86 54.50 2cxt s ASN 154 Cb -0.19 -2.50 -0.01 0.00 -1.45 0.00 0.00 41.25 37.10 2cxt s ASN 154 CO -0.07 -0.48 -0.06 -0.63 -3.72 0.00 0.00 177.10 172.14 2cxt s ILE 155 N 2.41 3.27 0.00 -5.21 1.01 0.10 -0.80 121.20 121.97 2cxt s ILE 155 Ca 0.42 -0.53 0.00 0.00 0.00 0.00 0.00 60.65 60.54 2cxt s ILE 155 Cb -0.17 -2.48 0.00 0.00 0.01 0.00 0.00 42.46 39.83 2cxt s ILE 155 CO 0.12 0.43 0.00 0.61 0.00 0.00 0.00 174.94 176.10 2cxt n GLY 156 N 4.75 1.29 3.23 6.18 0.00 -0.82 -0.29 105.19 119.52 2cxt n GLY 156 Ca -0.18 -0.78 -0.16 0.00 0.00 0.00 0.00 46.02 44.89 2cxt n GLY 156 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2cxt s ILE 157 N -2.00 1.20 0.00 -0.61 2.07 -1.26 -4.01 121.20 116.59 2cxt s ILE 157 Ca 0.00 -1.80 0.00 0.00 -1.41 0.00 0.00 60.65 57.44 2cxt s ILE 157 Cb 0.00 -1.58 0.00 0.00 0.13 0.00 0.00 42.46 41.01 2cxt s ILE 157 CO 0.00 -0.54 0.00 0.61 -1.91 0.00 0.00 174.94 173.10 2cxt n GLY 158 N 0.33 4.06 0.32 1.50 0.00 -1.26 -1.77 105.19 108.38 2cxt n GLY 158 Ca -0.14 0.15 0.20 0.00 0.00 0.00 0.00 46.02 46.23 2cxt n GLY 158 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2cxt h GLY 159 N 0.00 0.00 -1.47 -0.02 0.00 -1.97 0.14 103.07 99.75 2cxt h GLY 159 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2cxt h GLY 159 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.98 2cxt n SER 160 N -3.33 2.29 0.03 0.19 7.64 -0.73 -4.50 113.62 115.22 2cxt n SER 160 Ca -0.03 -1.91 0.00 0.00 1.01 0.00 0.00 58.87 57.94 2cxt n SER 160 Cb 0.09 -0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.06 2cxt n SER 160 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2cxt n ASP 161 N 0.74 0.11 -0.24 6.43 2.03 -0.23 -4.40 116.55 120.99 2cxt n ASP 161 Ca 0.16 0.10 -0.06 0.00 0.52 0.00 0.00 54.79 55.50 2cxt n ASP 161 Cb 0.39 0.03 0.04 0.00 -0.72 0.00 0.00 41.12 40.86 2cxt n ASP 161 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2cxt h LEU 162 N 0.00 0.88 0.64 -2.67 3.38 -1.04 -1.23 115.31 115.27 2cxt h LEU 162 Ca 0.00 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 2cxt h LEU 162 Cb 0.31 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.84 2cxt h LEU 162 CO 0.00 0.77 -0.31 1.23 0.09 0.00 0.00 178.44 180.22 2cxt h GLY 163 N 0.92 -0.89 0.66 0.83 0.00 -1.79 0.07 103.07 102.87 2cxt h GLY 163 Ca 0.23 0.33 0.07 0.00 0.00 0.00 0.00 47.33 47.96 2cxt h GLY 163 CO -0.03 -0.32 0.54 -2.55 0.00 0.00 0.00 176.54 174.18 2cxt h PRO 164 N -1.08 0.93 0.17 4.80 0.11 -1.86 -0.17 132.00 134.91 2cxt h PRO 164 Ca -0.09 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.96 2cxt h PRO 164 Cb 0.70 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.60 2cxt h PRO 164 CO 0.14 0.61 -0.08 1.25 -0.21 0.00 0.00 178.00 179.71 2cxt h LEU 165 N 0.95 -0.19 -0.66 2.35 5.85 -1.23 -1.57 115.31 120.81 2cxt h LEU 165 Ca 0.40 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 59.03 2cxt h LEU 165 Cb 0.24 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 2cxt h LEU 165 CO -0.20 -0.04 0.40 -0.03 -0.34 0.00 0.00 178.44 178.24 2cxt h MET 166 N -0.33 0.90 -0.22 1.25 4.05 -0.60 -1.32 114.93 118.65 2cxt h MET 166 Ca -0.02 -0.08 -0.13 0.00 -0.28 0.00 0.00 59.70 59.18 2cxt h MET 166 Cb 0.26 -0.19 -0.00 0.00 -0.80 0.00 0.00 31.60 30.87 2cxt h MET 166 CO 0.04 0.64 -0.37 0.28 0.23 0.00 0.00 176.91 177.73 2cxt h VAL 167 N 0.90 1.32 -0.46 -5.77 2.07 -1.04 -0.35 116.25 112.93 2cxt h VAL 167 Ca 0.24 -1.58 -0.05 0.00 0.82 0.00 0.00 66.70 66.12 2cxt h VAL 167 Cb -0.03 1.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 2cxt h VAL 167 CO -0.05 0.50 0.07 0.71 0.02 0.00 0.00 177.57 178.82 2cxt h THR 168 N 0.35 1.22 -0.29 2.57 1.35 -1.20 0.36 112.91 117.27 2cxt h THR 168 Ca 0.02 -0.83 -0.02 0.00 -0.55 0.00 0.00 66.41 65.02 2cxt h THR 168 Cb 0.96 0.79 -0.01 0.00 -1.73 0.00 0.00 68.15 68.17 2cxt h THR 168 CO 0.08 0.30 0.08 -0.33 -0.25 0.00 0.00 175.52 175.41 2cxt h GLU 169 N 0.69 0.45 -0.05 4.72 4.39 -1.13 -2.55 114.58 121.09 2cxt h GLU 169 Ca 0.15 -0.10 -0.07 0.00 0.34 0.00 0.00 59.36 59.68 2cxt h GLU 169 Cb 0.33 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 2cxt h GLU 169 CO 0.01 0.51 -0.29 0.00 -1.16 0.00 0.00 179.01 178.08 2cxt h ALA 170 N 0.92 1.42 -0.39 3.43 0.00 -0.59 -3.11 119.26 120.94 2cxt h ALA 170 Ca 0.09 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.63 2cxt h ALA 170 Cb 0.25 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 2cxt h ALA 170 CO -0.00 0.42 0.04 1.28 0.00 0.00 0.00 179.25 180.99 2cxt n LEU 171 N -4.16 4.45 -0.31 0.00 4.77 0.07 -4.74 117.00 117.09 2cxt n LEU 171 Ca -0.02 -3.21 0.15 0.00 -0.03 0.00 0.00 56.01 52.90 2cxt n LEU 171 Cb 0.36 -0.61 0.32 0.00 -2.33 0.00 0.00 43.42 41.16 2cxt n LEU 171 CO 0.39 0.82 1.01 0.50 -1.33 0.00 0.00 177.39 178.78 2cxt h LYS 172 N 1.90 0.30 0.00 3.23 1.63 -1.38 0.21 116.57 122.47 2cxt h LYS 172 Ca 0.10 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.88 2cxt h LYS 172 Cb 1.69 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 33.25 2cxt h LYS 172 CO 0.37 0.20 0.00 -1.35 -3.45 0.00 0.00 179.45 175.22 2cxt h PRO 173 N 0.31 0.00 -0.65 1.90 0.11 -1.89 -2.41 132.00 129.38 2cxt h PRO 173 Ca 0.58 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.69 2cxt h PRO 173 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2cxt h PRO 173 CO -0.59 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 177.86 2cxt n TYR 174 N -2.33 1.21 -0.32 0.65 4.02 0.06 -4.45 117.16 116.01 2cxt n TYR 174 Ca -0.01 -0.51 0.09 0.00 -0.01 0.00 0.00 57.90 57.46 2cxt n TYR 174 Cb 0.06 -0.16 0.25 0.00 -0.02 0.00 0.00 39.34 39.48 2cxt n TYR 174 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2cxt n SER 175 N 1.14 3.57 -4.70 7.72 3.41 -0.91 -4.46 113.62 119.40 2cxt n SER 175 Ca 0.23 -2.04 -0.44 0.00 -0.26 0.00 0.00 58.87 56.36 2cxt n SER 175 Cb 0.74 -0.39 -0.03 0.00 -0.26 0.00 0.00 64.21 64.27 2cxt n SER 175 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2cxt n LYS 176 N 1.11 2.46 -0.75 4.33 4.81 -1.26 -1.39 118.16 127.46 2cxt n LYS 176 Ca 0.19 0.88 0.00 0.00 -0.87 0.00 0.00 58.31 58.52 2cxt n LYS 176 Cb 0.56 -2.67 0.00 0.00 0.02 0.00 0.00 35.03 32.94 2cxt n LYS 176 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2cxt n GLY 177 N 3.19 0.93 3.95 3.14 0.00 -1.26 -4.99 105.19 110.15 2cxt n GLY 177 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 2cxt n GLY 177 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2cxt s GLY 178 N -1.78 1.58 0.63 -0.02 0.00 -0.49 -4.90 107.32 102.34 2cxt s GLY 178 Ca 0.00 -1.01 -0.16 0.00 0.00 0.00 0.00 44.72 43.55 2cxt s GLY 178 CO 0.00 -1.00 1.11 2.56 0.00 0.00 0.00 173.10 175.78 2cxt s PRO 179 N -3.54 2.93 0.52 2.90 0.04 -1.26 -5.00 135.00 131.60 2cxt s PRO 179 Ca 0.36 1.44 -0.23 0.00 0.04 0.00 0.00 61.00 62.61 2cxt s PRO 179 Cb -0.10 -1.96 -0.06 0.00 0.04 0.00 0.00 34.50 32.41 2cxt s PRO 179 CO 0.29 -1.15 1.37 1.03 0.04 0.00 0.00 177.00 178.58 2cxt s ARG 180 N -3.92 3.31 -0.04 4.56 0.52 -0.63 -4.68 118.95 118.07 2cxt s ARG 180 Ca 0.68 2.27 0.07 0.00 -0.52 0.00 0.00 55.73 58.22 2cxt s ARG 180 Cb -0.21 -2.37 -0.01 0.00 0.52 0.00 0.00 34.95 32.88 2cxt s ARG 180 CO 0.38 -1.07 -0.24 0.54 0.02 0.00 0.00 175.30 174.94 2cxt s VAL 181 N -1.28 1.92 0.06 3.52 0.11 -1.26 -0.07 120.40 123.39 2cxt s VAL 181 Ca 0.68 -1.01 0.06 0.00 -2.93 0.00 0.00 61.98 58.79 2cxt s VAL 181 Cb -0.41 -1.61 -0.03 0.00 -1.53 0.00 0.00 36.38 32.81 2cxt s VAL 181 CO 0.49 0.54 -0.18 0.26 -3.33 0.00 0.00 175.10 172.88 2cxt s TRP 182 N -0.34 1.55 -0.19 1.54 0.52 0.50 -4.96 118.94 117.56 2cxt s TRP 182 Ca 0.03 -0.39 0.00 0.00 0.02 0.00 0.00 56.10 55.76 2cxt s TRP 182 Cb -0.11 -0.89 0.04 0.00 -1.15 0.00 0.00 33.47 31.36 2cxt s TRP 182 CO 0.01 0.10 -0.08 -0.06 0.02 0.00 0.00 176.95 176.94 2cxt s PHE 183 N -0.98 2.23 -0.19 -1.98 0.40 -1.26 -0.76 117.98 115.44 2cxt s PHE 183 Ca 0.04 -1.48 -0.05 0.00 -0.60 0.00 0.00 56.93 54.84 2cxt s PHE 183 Cb -0.09 -1.55 -0.03 0.00 0.51 0.00 0.00 43.02 41.86 2cxt s PHE 183 CO 0.02 -0.71 0.01 0.08 0.70 0.00 0.00 175.22 175.32 2cxt s VAL 184 N 1.46 4.10 0.00 -0.44 1.01 0.02 -4.96 120.40 121.59 2cxt s VAL 184 Ca -0.01 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 61.70 2cxt s VAL 184 Cb -0.16 -2.85 0.00 0.00 0.00 0.00 0.00 36.38 33.37 2cxt s VAL 184 CO -0.08 0.44 0.00 -1.54 0.00 0.00 0.00 175.10 173.92 2cxt n SER 185 N 4.00 0.04 -4.76 3.32 3.41 -1.26 -1.95 113.62 116.43 2cxt n SER 185 Ca -0.17 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.05 2cxt n SER 185 Cb 0.52 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.48 2cxt n SER 185 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2cxt s ASN 186 N -4.80 5.84 0.36 4.04 3.84 -1.26 -4.62 114.94 118.34 2cxt s ASN 186 Ca 0.00 2.67 0.13 0.00 0.21 0.00 0.00 52.86 55.88 2cxt s ASN 186 Cb 0.00 -2.63 0.68 0.00 -0.55 0.00 0.00 41.25 38.75 2cxt s ASN 186 CO 0.00 -1.17 1.79 -0.29 -2.79 0.00 0.00 177.10 174.64 2cxt h ILE 187 N 1.97 1.24 -1.27 -5.21 6.09 -1.99 -3.44 117.51 114.90 2cxt h ILE 187 Ca -0.50 -1.42 -0.81 0.00 -1.37 0.00 0.00 64.86 60.75 2cxt h ILE 187 Cb 1.27 1.78 0.01 0.00 0.47 0.00 0.00 36.82 40.35 2cxt h ILE 187 CO 0.60 0.40 0.80 -0.67 -3.07 0.00 0.00 178.15 176.21 2cxt n ASP 188 N -3.97 1.81 0.31 2.19 4.64 -1.26 -4.75 116.55 115.51 2cxt n ASP 188 Ca -0.02 1.13 0.17 0.00 -1.38 0.00 0.00 54.79 54.70 2cxt n ASP 188 Cb 0.45 -1.01 0.99 0.00 -1.04 0.00 0.00 41.12 40.51 2cxt n ASP 188 CO 0.00 0.00 0.00 1.23 -0.82 0.00 0.00 177.20 177.61 2cxt h GLY 189 N 6.13 0.00 -0.26 0.27 0.00 -2.02 -1.20 103.07 105.98 2cxt h GLY 189 Ca -0.45 0.00 0.23 0.00 0.00 0.00 0.00 47.33 47.11 2cxt h GLY 189 CO 0.97 0.00 0.37 -0.84 0.00 0.00 0.00 176.54 177.04 2cxt h THR 190 N 0.00 0.44 0.47 4.70 2.02 -1.95 -0.88 112.91 117.71 2cxt h THR 190 Ca -0.00 -0.12 -0.02 0.00 0.77 0.00 0.00 66.41 67.03 2cxt h THR 190 Cb 0.01 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.47 2cxt h THR 190 CO 0.00 0.06 -0.23 -0.74 0.37 0.00 0.00 175.52 174.99 2cxt h HIS 191 N 0.36 -0.59 -0.33 3.16 2.76 -1.52 -1.12 115.15 117.87 2cxt h HIS 191 Ca 0.57 -0.01 -0.14 0.00 -2.20 0.00 0.00 60.37 58.58 2cxt h HIS 191 Cb 1.10 0.20 -0.01 0.00 1.55 0.00 0.00 27.41 30.25 2cxt h HIS 191 CO -0.16 -0.29 -0.36 0.97 -1.30 0.00 0.00 177.93 176.79 2cxt h ILE 192 N -0.81 1.28 -0.22 6.26 2.10 -1.71 -2.74 117.51 121.68 2cxt h ILE 192 Ca -0.07 -1.53 0.00 0.00 1.08 0.00 0.00 64.86 64.35 2cxt h ILE 192 Cb 0.56 1.41 -0.01 0.00 -1.09 0.00 0.00 36.82 37.70 2cxt h ILE 192 CO 0.11 0.50 0.14 0.00 -1.08 0.00 0.00 178.15 177.82 2cxt h ALA 193 N 0.95 0.28 0.00 0.18 0.00 -1.08 0.21 119.26 119.80 2cxt h ALA 193 Ca 0.06 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 2cxt h ALA 193 Cb 0.91 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 2cxt h ALA 193 CO 0.08 -0.24 -0.50 1.57 0.00 0.00 0.00 179.25 180.16 2cxt h LYS 194 N 0.29 0.00 0.01 0.00 2.10 -1.26 -2.27 116.57 115.44 2cxt h LYS 194 Ca 0.08 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.73 2cxt h LYS 194 Cb -0.03 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.30 2cxt h LYS 194 CO -0.02 0.50 -0.00 1.15 -2.00 0.00 0.00 179.45 179.08 2cxt h THR 195 N 0.00 1.33 0.00 0.07 2.02 -1.14 -3.28 112.91 111.90 2cxt h THR 195 Ca -0.01 -1.01 -0.05 0.00 0.77 0.00 0.00 66.41 66.12 2cxt h THR 195 Cb 1.00 2.01 -0.01 0.00 -1.74 0.00 0.00 68.15 69.42 2cxt h THR 195 CO 0.07 0.26 -0.23 -0.07 0.37 0.00 0.00 175.52 175.92 2cxt h LEU 196 N -0.44 0.00 -1.96 2.58 3.38 -0.94 -3.19 115.31 114.73 2cxt h LEU 196 Ca -0.00 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.99 2cxt h LEU 196 Cb 0.44 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2cxt h LEU 196 CO 0.00 0.23 0.09 0.00 0.09 0.00 0.00 178.44 178.85 2cxt h ALA 197 N 1.77 2.05 -0.59 1.53 0.00 -1.47 -2.34 119.26 120.22 2cxt h ALA 197 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2cxt h ALA 197 Cb 0.59 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2cxt h ALA 197 CO 0.03 -0.08 0.00 -1.13 0.00 0.00 0.00 179.25 178.07 2cxt n SER 198 N -4.51 3.59 -4.62 0.00 3.41 -1.21 -4.99 113.62 105.30 2cxt n SER 198 Ca -0.00 -1.99 -0.26 0.00 -0.26 0.00 0.00 58.87 56.35 2cxt n SER 198 Cb 0.17 -0.39 -0.08 0.00 -0.26 0.00 0.00 64.21 63.65 2cxt n SER 198 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2cxt s LEU 199 N -1.03 3.15 -0.16 1.04 1.43 -0.88 -5.12 118.68 117.11 2cxt s LEU 199 Ca 0.40 -0.51 -0.05 0.00 -1.03 0.00 0.00 54.13 52.94 2cxt s LEU 199 Cb 0.21 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.60 2cxt s LEU 199 CO 0.28 0.08 0.02 -0.55 0.23 0.00 0.00 176.35 176.41 2cxt s SER 200 N -2.99 5.31 0.61 2.29 0.15 -1.26 -4.99 113.70 112.82 2cxt s SER 200 Ca 0.27 0.03 0.36 0.00 0.70 0.00 0.00 55.95 57.31 2cxt s SER 200 Cb -0.09 -1.84 2.03 0.00 -1.71 0.00 0.00 66.02 64.41 2cxt s SER 200 CO 0.17 0.21 2.27 -0.65 1.20 0.00 0.00 173.24 176.45 2cxt h PRO 201 N 6.42 0.00 0.00 5.44 0.11 -1.95 -2.49 132.00 139.54 2cxt h PRO 201 Ca -0.37 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.65 2cxt h PRO 201 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2cxt h PRO 201 CO 0.65 0.02 -0.41 0.93 -0.21 0.00 0.00 178.00 178.98 2cxt h GLU 202 N 0.00 0.00 0.00 1.05 5.08 -1.97 -3.34 114.58 115.40 2cxt h GLU 202 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2cxt h GLU 202 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 2cxt h GLU 202 CO 0.00 0.41 -0.10 0.25 -1.00 0.00 0.00 179.01 178.58 2cxt n THR 203 N -3.87 0.92 -4.48 1.13 -2.24 -0.97 -4.28 114.28 100.49 2cxt n THR 203 Ca -0.01 -1.04 -0.34 0.00 -2.27 0.00 0.00 64.05 60.38 2cxt n THR 203 Cb 0.47 0.34 -0.12 0.00 -2.10 0.00 0.00 70.33 68.92 2cxt n THR 203 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2cxt s SER 204 N -1.44 4.78 -0.13 3.42 0.01 -1.02 -0.82 113.70 118.49 2cxt s SER 204 Ca 0.11 -0.07 0.02 0.00 1.31 0.00 0.00 55.95 57.31 2cxt s SER 204 Cb 0.09 -1.57 -0.00 0.00 0.21 0.00 0.00 66.02 64.75 2cxt s SER 204 CO 0.01 0.25 -0.19 -0.22 0.41 0.00 0.00 173.24 173.49 2cxt s LEU 205 N -0.12 2.31 -0.15 2.44 0.20 0.15 -4.80 118.68 118.71 2cxt s LEU 205 Ca 0.02 -0.50 -0.12 0.00 0.69 0.00 0.00 54.13 54.22 2cxt s LEU 205 Cb -0.13 -1.49 -0.05 0.00 -0.43 0.00 0.00 46.19 44.09 2cxt s LEU 205 CO 0.03 0.13 0.24 -0.36 -0.29 0.00 0.00 176.35 176.10 2cxt s PHE 206 N 0.53 3.49 -0.27 5.38 0.40 0.17 -0.64 117.98 127.04 2cxt s PHE 206 Ca -0.12 0.56 -0.05 0.00 -0.60 0.00 0.00 56.93 56.72 2cxt s PHE 206 Cb -0.17 -2.24 0.01 0.00 0.51 0.00 0.00 43.02 41.13 2cxt s PHE 206 CO 0.04 0.36 0.04 0.42 0.70 0.00 0.00 175.22 176.78 2cxt s ILE 207 N 0.08 3.70 -0.49 0.64 1.01 0.61 -1.10 121.20 125.65 2cxt s ILE 207 Ca 0.15 -0.69 -0.18 0.00 0.00 0.00 0.00 60.65 59.92 2cxt s ILE 207 Cb -0.13 -2.86 0.06 0.00 0.01 0.00 0.00 42.46 39.54 2cxt s ILE 207 CO 0.03 0.16 0.57 -0.63 0.00 0.00 0.00 174.94 175.08 2cxt s ILE 208 N 1.47 4.96 -0.32 2.92 -1.09 0.02 0.01 121.20 129.18 2cxt s ILE 208 Ca 0.03 -0.61 -0.09 0.00 -2.23 0.00 0.00 60.65 57.74 2cxt s ILE 208 Cb -0.17 -4.25 0.00 0.00 -1.58 0.00 0.00 42.46 36.47 2cxt s ILE 208 CO 0.00 -0.74 0.15 0.00 -1.23 0.00 0.00 174.94 173.12 2cxt s ALA 209 N 2.39 3.23 -0.30 9.38 0.00 0.60 -0.85 121.76 136.21 2cxt s ALA 209 Ca 0.13 -1.47 -0.10 0.00 0.00 0.00 0.00 51.96 50.52 2cxt s ALA 209 Cb -0.20 -2.37 0.15 0.00 0.00 0.00 0.00 23.12 20.70 2cxt s ALA 209 CO 0.11 -1.00 0.76 0.45 0.00 0.00 0.00 175.76 176.08 2cxt s SER 210 N 1.58 -0.99 0.15 0.00 0.15 -0.45 -4.24 113.70 109.90 2cxt s SER 210 Ca 0.04 1.14 -0.19 0.00 0.70 0.00 0.00 55.95 57.64 2cxt s SER 210 Cb -0.17 2.04 0.03 0.00 -1.71 0.00 0.00 66.02 66.20 2cxt s SER 210 CO 0.05 -0.19 1.68 0.50 1.20 0.00 0.00 173.24 176.49 2cxt h LYS 211 N 7.86 -0.02 0.00 5.44 3.64 -1.95 -2.92 116.57 128.63 2cxt h LYS 211 Ca -0.18 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.09 2cxt h LYS 211 Cb 1.12 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.93 2cxt h LYS 211 CO 0.11 -0.01 -0.83 1.79 -2.27 0.00 0.00 179.45 178.24 2cxt h THR 212 N -0.02 0.61 -2.96 1.00 1.35 -1.96 -2.01 112.91 108.92 2cxt h THR 212 Ca 0.14 -1.97 -0.32 0.00 -0.55 0.00 0.00 66.41 63.71 2cxt h THR 212 Cb 0.23 2.19 -0.04 0.00 -1.73 0.00 0.00 68.15 68.80 2cxt h THR 212 CO -0.31 0.35 -0.39 0.33 -0.25 0.00 0.00 175.52 175.26 2cxt n PHE 213 N -3.06 -1.01 -0.27 4.73 -0.00 -1.10 -4.65 117.46 112.10 2cxt n PHE 213 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.43 2cxt n PHE 213 Cb 0.74 -3.20 0.00 0.00 -0.00 0.00 0.00 39.48 37.02 2cxt n PHE 213 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 2cxt n THR 214 N -3.29 0.00 -1.69 -2.13 -2.24 -1.26 -4.88 114.28 98.79 2cxt n THR 214 Ca -0.18 -0.27 -0.42 0.00 -2.27 0.00 0.00 64.05 60.90 2cxt n THR 214 Cb 0.62 1.27 -0.03 0.00 -2.10 0.00 0.00 70.33 70.08 2cxt n THR 214 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2cxt n THR 215 N -0.23 0.44 -0.15 4.28 -1.04 -1.26 -4.89 114.28 111.43 2cxt n THR 215 Ca 0.00 -0.08 -0.05 0.00 -2.04 0.00 0.00 64.05 61.88 2cxt n THR 215 Cb 0.07 -2.17 0.04 0.00 -1.82 0.00 0.00 70.33 66.45 2cxt n THR 215 CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 2cxt h GLN 216 N 8.93 0.45 -0.29 -2.82 4.15 -1.99 -1.27 115.11 122.27 2cxt h GLN 216 Ca -0.47 -0.03 0.01 0.00 0.77 0.00 0.00 58.65 58.94 2cxt h GLN 216 Cb 1.22 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.79 2cxt h GLN 216 CO 0.95 0.30 0.16 0.93 -1.93 0.00 0.00 178.83 179.24 2cxt h GLU 217 N 0.46 0.33 -0.23 1.69 3.07 -1.93 -0.90 114.58 117.07 2cxt h GLU 217 Ca 0.20 -0.02 -0.07 0.00 -0.50 0.00 0.00 59.36 58.98 2cxt h GLU 217 Cb 0.11 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 27.94 2cxt h GLU 217 CO -0.14 0.22 -0.12 1.15 -1.40 0.00 0.00 179.01 178.72 2cxt h THR 218 N 0.34 1.30 -0.51 1.13 2.02 -1.77 -0.99 112.91 114.43 2cxt h THR 218 Ca 0.12 -1.19 -0.10 0.00 0.77 0.00 0.00 66.41 66.00 2cxt h THR 218 Cb 0.01 1.59 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 2cxt h THR 218 CO -0.06 0.37 -0.08 0.40 0.37 0.00 0.00 175.52 176.52 2cxt h ILE 219 N 0.20 1.27 -0.38 3.11 1.08 -1.19 0.26 117.51 121.85 2cxt h ILE 219 Ca 0.05 -1.21 -0.02 0.00 -0.39 0.00 0.00 64.86 63.29 2cxt h ILE 219 Cb 0.62 1.01 -0.02 0.00 -3.07 0.00 0.00 36.82 35.36 2cxt h ILE 219 CO 0.03 0.42 0.16 0.74 -0.69 0.00 0.00 178.15 178.82 2cxt h THR 220 N 0.82 1.19 -0.87 -0.27 2.02 -1.13 0.38 112.91 115.06 2cxt h THR 220 Ca 0.13 -0.57 -0.01 0.00 0.77 0.00 0.00 66.41 66.74 2cxt h THR 220 Cb 0.63 0.86 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 2cxt h THR 220 CO 0.04 0.21 0.51 0.78 0.37 0.00 0.00 175.52 177.43 2cxt h ASN 221 N 0.47 1.05 -0.64 4.18 2.35 -1.05 -0.93 115.58 121.01 2cxt h ASN 221 Ca 0.13 -0.07 -0.05 0.00 -0.55 0.00 0.00 56.30 55.76 2cxt h ASN 221 Cb 0.18 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.25 2cxt h ASN 221 CO -0.01 0.81 0.20 0.00 -1.65 0.00 0.00 177.43 176.78 2cxt h ALA 222 N 1.28 0.83 -0.17 -0.83 0.00 -0.56 -0.67 119.26 119.14 2cxt h ALA 222 Ca 0.31 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 2cxt h ALA 222 Cb -0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2cxt h ALA 222 CO -0.06 0.50 -0.38 0.93 0.00 0.00 0.00 179.25 180.25 2cxt h GLU 223 N 0.91 0.37 -0.52 0.00 5.08 -0.62 -0.59 114.58 119.22 2cxt h GLU 223 Ca 0.21 -0.17 -0.10 0.00 -1.00 0.00 0.00 59.36 58.29 2cxt h GLU 223 Cb 0.28 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 2cxt h GLU 223 CO -0.01 0.70 -0.08 1.15 -1.00 0.00 0.00 179.01 179.77 2cxt h THR 224 N 0.31 1.27 -0.61 1.13 2.02 -0.89 -1.36 112.91 114.78 2cxt h THR 224 Ca 0.03 -1.22 -0.04 0.00 0.77 0.00 0.00 66.41 65.95 2cxt h THR 224 Cb 0.81 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 2cxt h THR 224 CO 0.06 0.43 0.23 0.00 0.37 0.00 0.00 175.52 176.62 2cxt h ALA 225 N 0.92 0.80 -0.62 6.16 0.00 -0.78 -1.63 119.26 124.11 2cxt h ALA 225 Ca 0.14 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 2cxt h ALA 225 Cb 0.64 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2cxt h ALA 225 CO 0.04 0.43 0.18 -0.22 0.00 0.00 0.00 179.25 179.68 2cxt h LYS 226 N 0.86 0.97 -0.45 0.00 3.64 -0.97 -0.40 116.57 120.22 2cxt h LYS 226 Ca 0.20 -0.22 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 2cxt h LYS 226 Cb 0.22 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 2cxt h LYS 226 CO -0.01 0.87 0.23 1.49 -2.27 0.00 0.00 179.45 179.75 2cxt h GLU 227 N 0.89 0.64 -0.58 1.90 4.81 -1.10 0.27 114.58 121.41 2cxt h GLU 227 Ca 0.20 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 2cxt h GLU 227 Cb 0.31 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 2cxt h GLU 227 CO -0.00 0.53 0.37 2.35 -0.73 0.00 0.00 179.01 181.53 2cxt h TRP 228 N 0.59 0.74 -0.16 0.92 7.01 -1.07 -1.67 115.95 122.30 2cxt h TRP 228 Ca 0.16 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.15 2cxt h TRP 228 Cb 0.09 -0.25 -0.01 0.00 -2.10 0.00 0.00 29.16 26.90 2cxt h TRP 228 CO -0.01 0.48 0.05 0.35 -2.79 0.00 0.00 178.44 176.51 2cxt h PHE 229 N 0.78 0.26 0.00 2.65 3.57 -0.84 -3.11 116.94 120.25 2cxt h PHE 229 Ca 0.21 -0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.65 2cxt h PHE 229 Cb -0.07 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 2cxt h PHE 229 CO -0.03 0.37 -0.17 -0.07 -2.23 0.00 0.00 178.31 176.18 2cxt h LEU 230 N 0.08 0.00 -1.40 0.59 3.38 -0.77 -0.27 115.31 116.93 2cxt h LEU 230 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2cxt h LEU 230 Cb 0.24 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 2cxt h LEU 230 CO -0.00 0.17 0.39 -0.33 0.09 0.00 0.00 178.44 178.76 2cxt h GLU 231 N 0.00 0.79 0.10 1.13 5.08 -1.23 0.16 114.58 120.60 2cxt h GLU 231 Ca -0.00 -0.05 -0.30 0.00 -1.00 0.00 0.00 59.36 58.01 2cxt h GLU 231 Cb 0.52 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2cxt h GLU 231 CO 0.02 0.53 -1.60 0.00 -1.00 0.00 0.00 179.01 176.96 2cxt h ALA 232 N 1.62 0.29 0.08 3.43 0.00 -1.41 -3.40 119.26 119.86 2cxt h ALA 232 Ca 0.22 -1.23 -0.25 0.00 0.00 0.00 0.00 54.91 53.65 2cxt h ALA 232 Cb -0.08 0.62 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2cxt h ALA 232 CO -0.05 0.98 -1.14 0.00 0.00 0.00 0.00 179.25 179.05 2cxt h ALA 233 N -0.10 0.20 -3.27 0.00 0.00 -1.05 -3.47 119.26 111.56 2cxt h ALA 233 Ca -0.36 -0.89 -0.26 0.00 0.00 0.00 0.00 54.91 53.40 2cxt h ALA 233 Cb 1.77 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.47 2cxt h ALA 233 CO 0.01 1.08 -0.31 1.63 0.00 0.00 0.00 179.25 181.67 2cxt n LYS 234 N -3.46 -2.00 -3.39 0.00 5.02 0.55 -4.91 118.16 109.97 2cxt n LYS 234 Ca -0.05 0.65 -0.13 0.00 -2.02 0.00 0.00 58.31 56.75 2cxt n LYS 234 Cb 0.99 -5.17 -0.09 0.00 -0.02 0.00 0.00 35.03 30.74 2cxt n LYS 234 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2cxt s ASP 235 N -2.04 0.93 0.58 4.39 2.15 -1.26 -5.03 116.67 116.38 2cxt s ASP 235 Ca 0.00 -0.24 0.27 0.00 0.43 0.00 0.00 52.55 53.01 2cxt s ASP 235 Cb 0.00 0.78 1.64 0.00 -0.30 0.00 0.00 42.92 45.04 2cxt s ASP 235 CO 0.00 -0.34 2.15 -0.65 -0.17 0.00 0.00 175.17 176.16 2cxt h PRO 236 N 8.23 0.00 0.00 4.34 0.11 -1.96 -1.29 132.00 141.43 2cxt h PRO 236 Ca -0.16 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.95 2cxt h PRO 236 Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 2cxt h PRO 236 CO 0.29 0.00 -0.04 0.66 -0.21 0.00 0.00 178.00 178.70 2cxt h SER 237 N 0.00 0.00 1.23 -2.05 4.64 -1.99 -3.01 113.55 112.37 2cxt h SER 237 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2cxt h SER 237 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2cxt h SER 237 CO -0.00 0.04 0.00 0.00 -0.87 0.00 0.00 176.83 176.00 2cxt h ALA 238 N 1.96 1.00 -0.70 5.18 0.00 -1.63 -3.21 119.26 121.86 2cxt h ALA 238 Ca -0.00 0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.02 2cxt h ALA 238 Cb 0.62 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 2cxt h ALA 238 CO 0.00 0.00 0.46 0.28 0.00 0.00 0.00 179.25 180.00 2cxt h VAL 239 N 0.00 0.89 0.00 0.00 2.07 -1.67 -1.52 116.25 116.02 2cxt h VAL 239 Ca 0.00 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.34 2cxt h VAL 239 Cb 0.62 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2cxt h VAL 239 CO 0.00 0.09 0.00 0.00 0.02 0.00 0.00 177.57 177.68 2cxt h ALA 240 N 1.65 1.00 -0.00 1.67 0.00 -1.79 -0.63 119.26 121.16 2cxt h ALA 240 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2cxt h ALA 240 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2cxt h ALA 240 CO -0.11 0.00 -0.55 1.63 0.00 0.00 0.00 179.25 180.22 2cxt n LYS 241 N -3.06 0.10 0.00 0.00 5.02 -0.57 -4.47 118.16 115.17 2cxt n LYS 241 Ca -0.02 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 2cxt n LYS 241 Cb 0.11 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.63 2cxt n LYS 241 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2cxt n HIS 242 N -1.40 0.00 -4.02 2.13 8.25 -0.53 -4.78 115.22 114.88 2cxt n HIS 242 Ca 0.06 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.28 2cxt n HIS 242 Cb 0.34 0.00 -0.17 0.00 1.12 0.00 0.00 29.99 31.28 2cxt n HIS 242 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2cxt s PHE 243 N -0.29 1.11 0.29 4.41 0.08 -0.36 0.42 117.98 123.64 2cxt s PHE 243 Ca 0.00 -0.45 0.09 0.00 0.12 0.00 0.00 56.93 56.69 2cxt s PHE 243 Cb 0.00 -0.98 -0.06 0.00 -0.57 0.00 0.00 43.02 41.42 2cxt s PHE 243 CO 0.00 -0.36 -0.11 0.14 -0.10 0.00 0.00 175.22 174.78 2cxt s VAL 244 N 1.47 2.06 0.00 -0.44 -7.23 -0.26 -4.75 120.40 111.25 2cxt s VAL 244 Ca -0.01 -2.23 0.05 0.00 -1.81 0.00 0.00 61.98 57.98 2cxt s VAL 244 Cb -0.13 -2.44 -0.01 0.00 0.56 0.00 0.00 36.38 34.35 2cxt s VAL 244 CO -0.04 -0.32 -0.16 0.00 -0.31 0.00 0.00 175.10 174.27 2cxt s ALA 245 N -2.75 1.32 -0.23 1.32 0.00 -0.33 -0.80 121.76 120.29 2cxt s ALA 245 Ca 0.30 -0.73 0.02 0.00 0.00 0.00 0.00 51.96 51.55 2cxt s ALA 245 Cb 0.01 -0.31 0.05 0.00 0.00 0.00 0.00 23.12 22.87 2cxt s ALA 245 CO 0.14 0.31 -0.14 -0.51 0.00 0.00 0.00 175.76 175.56 2cxt s LEU 246 N -0.57 3.02 0.23 0.00 1.43 -0.03 -0.71 118.68 122.05 2cxt s LEU 246 Ca 0.05 -1.14 -0.23 0.00 -1.03 0.00 0.00 54.13 51.78 2cxt s LEU 246 Cb -0.07 -1.53 0.04 0.00 0.03 0.00 0.00 46.19 44.66 2cxt s LEU 246 CO -0.00 -0.13 0.79 -0.55 0.23 0.00 0.00 176.35 176.69 2cxt s SER 247 N 1.17 -0.26 -0.01 2.29 0.15 -1.07 -1.33 113.70 114.64 2cxt s SER 247 Ca -0.04 -0.49 0.20 0.00 0.70 0.00 0.00 55.95 56.31 2cxt s SER 247 Cb -0.18 0.64 -0.24 0.00 -1.71 0.00 0.00 66.02 64.54 2cxt s SER 247 CO -0.08 -1.17 0.77 0.35 1.20 0.00 0.00 173.24 174.32 2cxt n THR 248 N -0.45 0.00 -3.38 6.45 -2.24 -0.76 -1.82 114.28 112.08 2cxt n THR 248 Ca -0.06 -0.11 -0.45 0.00 -2.27 0.00 0.00 64.05 61.17 2cxt n THR 248 Cb 0.60 0.82 -0.02 0.00 -2.10 0.00 0.00 70.33 69.63 2cxt n THR 248 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2cxt s ASN 249 N -3.16 6.94 0.22 3.42 3.84 -1.24 -4.91 114.94 120.05 2cxt s ASN 249 Ca 0.05 -3.29 -0.08 0.00 0.21 0.00 0.00 52.86 49.75 2cxt s ASN 249 Cb 0.15 -2.17 0.30 0.00 -0.55 0.00 0.00 41.25 38.98 2cxt s ASN 249 CO 0.83 -0.37 1.76 0.74 -2.79 0.00 0.00 177.10 177.27 2cxt h THR 250 N 4.12 0.82 -0.35 -5.21 2.02 -1.96 -1.92 112.91 110.44 2cxt h THR 250 Ca 0.15 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 2cxt h THR 250 Cb 0.93 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.58 2cxt h THR 250 CO 0.90 0.09 0.16 0.00 0.37 0.00 0.00 175.52 177.05 2cxt h ALA 251 N 1.42 0.45 -0.00 6.16 0.00 -1.99 -1.53 119.26 123.76 2cxt h ALA 251 Ca 0.32 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 2cxt h ALA 251 Cb 0.36 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2cxt h ALA 251 CO -0.28 0.02 -0.59 0.87 0.00 0.00 0.00 179.25 179.27 2cxt h LYS 252 N 0.43 0.01 -0.48 0.00 1.79 -1.88 -0.58 116.57 115.86 2cxt h LYS 252 Ca 0.12 -0.01 -0.05 0.00 -2.18 0.00 0.00 60.65 58.53 2cxt h LYS 252 Cb 0.13 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.76 2cxt h LYS 252 CO -0.01 0.60 0.11 0.28 -1.08 0.00 0.00 179.45 179.34 2cxt h VAL 253 N 0.01 1.24 -0.46 0.50 2.07 -1.17 -1.81 116.25 116.62 2cxt h VAL 253 Ca -0.01 -0.85 -0.04 0.00 0.82 0.00 0.00 66.70 66.62 2cxt h VAL 253 Cb 1.04 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 2cxt h VAL 253 CO 0.08 0.31 0.14 0.50 0.02 0.00 0.00 177.57 178.61 2cxt h LYS 254 N 0.66 0.72 -0.60 1.57 3.64 -1.04 -2.77 116.57 118.75 2cxt h LYS 254 Ca 0.15 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2cxt h LYS 254 Cb 0.34 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 2cxt h LYS 254 CO 0.00 0.70 0.39 1.49 -2.27 0.00 0.00 179.45 179.76 2cxt h GLU 255 N 0.61 0.80 0.00 1.90 4.81 -0.98 -1.49 114.58 120.23 2cxt h GLU 255 Ca 0.15 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.28 2cxt h GLU 255 Cb 0.28 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 2cxt h GLU 255 CO -0.00 0.54 -0.24 0.35 -0.73 0.00 0.00 179.01 178.93 2cxt h PHE 256 N 0.82 0.00 0.00 0.92 3.04 -1.25 -3.47 116.94 117.00 2cxt h PHE 256 Ca 0.22 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.17 2cxt h PHE 256 Cb -0.08 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.43 2cxt h PHE 256 CO 0.00 0.24 0.00 0.41 -2.02 0.00 0.00 178.31 176.94 2cxt n GLY 257 N -0.27 1.82 3.84 2.40 0.00 -0.56 -5.11 105.19 107.32 2cxt n GLY 257 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 2cxt n GLY 257 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cxt s ILE 258 N -2.00 5.29 0.24 -0.61 1.01 -1.05 -4.90 121.20 119.18 2cxt s ILE 258 Ca 0.00 0.50 -0.31 0.00 0.00 0.00 0.00 60.65 60.85 2cxt s ILE 258 Cb 0.00 -3.55 -0.14 0.00 0.01 0.00 0.00 42.46 38.78 2cxt s ILE 258 CO 0.00 0.57 1.28 -0.67 0.00 0.00 0.00 174.94 176.13 2cxt n ASP 259 N 2.14 2.24 -0.16 3.58 -0.08 -1.26 -4.49 116.55 118.51 2cxt n ASP 259 Ca -0.17 1.16 0.10 0.00 -1.51 0.00 0.00 54.79 54.37 2cxt n ASP 259 Cb 0.53 -1.37 0.41 0.00 2.34 0.00 0.00 41.12 43.04 2cxt n ASP 259 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2cxt h PRO 260 N 3.51 0.59 0.00 -0.67 0.13 -1.97 0.44 132.00 134.04 2cxt h PRO 260 Ca -0.44 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2cxt h PRO 260 Cb 1.30 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2cxt h PRO 260 CO 0.71 0.39 0.00 1.04 -0.23 0.00 0.00 178.00 179.91 2cxt n GLN 261 N -4.49 0.46 -0.74 0.86 3.00 -1.26 -3.22 117.38 112.00 2cxt n GLN 261 Ca 0.11 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.19 2cxt n GLN 261 Cb 0.33 -1.50 0.38 0.00 0.00 0.00 0.00 30.24 29.44 2cxt n GLN 261 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2cxt n ASN 262 N -1.27 5.17 -4.45 1.08 4.13 0.14 -4.92 115.26 115.15 2cxt n ASN 262 Ca 0.15 -2.65 -0.34 0.00 1.68 0.00 0.00 54.58 53.42 2cxt n ASN 262 Cb 0.23 -0.63 -0.13 0.00 -1.54 0.00 0.00 39.78 37.72 2cxt n ASN 262 CO 0.00 0.00 0.00 -0.32 0.28 0.00 0.00 177.26 177.22 2cxt s MET 263 N -2.23 3.59 -0.32 3.52 1.75 -1.20 -1.18 119.30 123.23 2cxt s MET 263 Ca 0.53 -0.55 -0.07 0.00 -1.25 0.00 0.00 55.69 54.35 2cxt s MET 263 Cb 0.37 -2.95 0.03 0.00 2.84 0.00 0.00 34.83 35.11 2cxt s MET 263 CO 0.21 0.11 0.09 -0.06 -0.65 0.00 0.00 175.02 174.72 2cxt s PHE 264 N 0.71 3.20 0.21 4.11 0.40 0.12 -4.99 117.98 121.74 2cxt s PHE 264 Ca -0.02 -1.22 -0.17 0.00 -0.60 0.00 0.00 56.93 54.93 2cxt s PHE 264 Cb -0.14 -2.26 -0.08 0.00 0.51 0.00 0.00 43.02 41.04 2cxt s PHE 264 CO 0.02 -0.66 0.66 -1.21 0.70 0.00 0.00 175.22 174.73 2cxt s GLU 265 N 1.45 4.10 0.04 0.44 2.02 -1.26 -2.59 118.70 122.89 2cxt s GLU 265 Ca 0.00 0.68 0.01 0.00 0.02 0.00 0.00 54.97 55.68 2cxt s GLU 265 Cb -0.18 -2.82 -0.00 0.00 0.10 0.00 0.00 34.13 31.23 2cxt s GLU 265 CO 0.02 0.38 0.02 1.97 0.02 0.00 0.00 175.26 177.68 2cxt n PHE 266 N 0.54 -0.02 -4.35 1.61 1.16 -0.75 -4.54 117.46 111.10 2cxt n PHE 266 Ca -0.02 -0.26 -0.18 0.00 -1.87 0.00 0.00 57.45 55.12 2cxt n PHE 266 Cb 0.52 0.01 -0.10 0.00 -1.61 0.00 0.00 39.48 38.29 2cxt n PHE 266 CO 0.00 0.00 0.00 -1.58 -1.87 0.00 0.00 176.76 173.31 2cxt s TRP 267 N -1.83 1.67 0.44 2.97 0.51 -1.26 -4.27 118.94 117.18 2cxt s TRP 267 Ca 0.03 -0.72 0.34 0.00 -2.12 0.00 0.00 56.10 53.63 2cxt s TRP 267 Cb 0.00 -0.89 1.75 0.00 -0.81 0.00 0.00 33.47 33.52 2cxt s TRP 267 CO 0.02 0.20 2.16 0.38 -0.51 0.00 0.00 176.95 179.20 2cxt h ASP 268 N 2.50 0.00 -0.05 2.95 3.04 -1.97 -1.60 116.42 121.29 2cxt h ASP 268 Ca -0.38 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.41 2cxt h ASP 268 Cb 1.22 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.51 2cxt h ASP 268 CO 0.64 0.05 0.00 -2.67 -2.04 0.00 0.00 179.24 175.23 2cxt n TRP 269 N -3.40 0.06 -3.37 4.15 4.27 -1.26 -4.49 117.44 113.40 2cxt n TRP 269 Ca -0.02 -0.03 -0.44 0.00 -3.89 0.00 0.00 57.50 53.12 2cxt n TRP 269 Cb 0.19 0.00 -0.08 0.00 -1.36 0.00 0.00 31.31 30.06 2cxt n TRP 269 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 2cxt s VAL 270 N -1.94 5.21 0.43 -1.67 1.01 -0.60 -1.28 120.40 121.56 2cxt s VAL 270 Ca 0.26 -1.00 -0.25 0.00 0.00 0.00 0.00 61.98 60.99 2cxt s VAL 270 Cb 0.13 -4.13 -0.08 0.00 0.00 0.00 0.00 36.38 32.29 2cxt s VAL 270 CO 0.20 -0.59 1.24 -0.83 0.00 0.00 0.00 175.10 175.13 2cxt s GLY 271 N 2.57 2.88 0.21 4.51 0.00 -1.26 -4.88 107.32 111.34 2cxt s GLY 271 Ca 0.05 1.11 -0.10 0.00 0.00 0.00 0.00 44.72 45.77 2cxt s GLY 271 CO 0.07 1.64 1.71 -1.33 0.00 0.00 0.00 173.10 175.19 2cxt h GLY 272 N 2.44 0.74 0.56 0.20 0.00 -1.95 0.93 103.07 106.00 2cxt h GLY 272 Ca -0.49 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 46.80 2cxt h GLY 272 CO 0.62 -0.10 0.00 -0.96 0.00 0.00 0.00 176.54 176.10 2cxt n ARG 273 N -5.12 0.85 -0.80 4.80 1.85 -1.26 -2.40 116.66 114.58 2cxt n ARG 273 Ca 0.08 0.00 0.05 0.00 -1.00 0.00 0.00 57.85 56.99 2cxt n ARG 273 Cb 0.30 -1.28 0.13 0.00 -1.05 0.00 0.00 32.46 30.57 2cxt n ARG 273 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 2cxt n TYR 274 N -0.78 0.00 0.80 2.89 4.02 0.27 -4.75 117.16 119.61 2cxt n TYR 274 Ca 0.11 -1.05 0.08 0.00 -0.01 0.00 0.00 57.90 57.04 2cxt n TYR 274 Cb 0.05 -0.20 -0.06 0.00 -0.02 0.00 0.00 39.34 39.12 2cxt n TYR 274 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2cxt n SER 275 N -0.61 1.17 0.32 7.72 3.41 -0.90 -4.48 113.62 120.24 2cxt n SER 275 Ca 0.14 -1.08 0.21 0.00 -0.26 0.00 0.00 58.87 57.87 2cxt n SER 275 Cb 0.82 0.79 1.10 0.00 -0.26 0.00 0.00 64.21 66.67 2cxt n SER 275 CO 0.00 0.00 0.00 0.17 -0.16 0.00 0.00 175.04 175.05 2cxt h LEU 276 N 0.77 0.00 -0.12 1.04 8.10 -1.84 -0.95 115.31 122.30 2cxt h LEU 276 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.99 2cxt h LEU 276 Cb 0.48 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.70 2cxt h LEU 276 CO 0.00 0.01 0.00 0.79 -4.11 0.00 0.00 178.44 175.13 2cxt n TRP 277 N -3.22 0.66 -1.98 0.17 7.02 -1.26 -2.73 117.44 116.10 2cxt n TRP 277 Ca -0.03 0.21 0.00 0.00 -1.02 0.00 0.00 57.50 56.66 2cxt n TRP 277 Cb 0.11 -0.84 0.00 0.00 -2.42 0.00 0.00 31.31 28.16 2cxt n TRP 277 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 2cxt n SER 278 N -2.05 0.00 -0.39 -0.99 3.41 -0.36 -4.75 113.62 108.49 2cxt n SER 278 Ca 0.05 -0.20 0.36 0.00 -0.26 0.00 0.00 58.87 58.82 2cxt n SER 278 Cb 0.36 0.00 0.71 0.00 -0.26 0.00 0.00 64.21 65.02 2cxt n SER 278 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cxt h ALA 279 N -0.84 3.03 -0.28 7.33 0.00 -1.81 -0.27 119.26 126.41 2cxt h ALA 279 Ca 0.00 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.98 2cxt h ALA 279 Cb 0.00 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2cxt h ALA 279 CO 0.00 -1.44 0.28 0.82 0.00 0.00 0.00 179.25 178.91 2cxt h ILE 280 N 0.08 0.51 -0.02 0.00 1.08 -1.85 -0.41 117.51 116.90 2cxt h ILE 280 Ca 0.65 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 65.12 2cxt h ILE 280 Cb 2.37 0.78 0.00 0.00 -3.07 0.00 0.00 36.82 36.90 2cxt h ILE 280 CO -0.10 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 177.97 2cxt n GLY 281 N -1.47 -0.91 0.27 5.37 0.00 -0.11 -4.31 105.19 104.03 2cxt n GLY 281 Ca 0.04 -0.02 0.02 0.00 0.00 0.00 0.00 46.02 46.06 2cxt n GLY 281 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2cxt h LEU 282 N 0.11 0.45 -1.70 0.99 5.85 -1.25 -0.18 115.31 119.59 2cxt h LEU 282 Ca 0.00 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 2cxt h LEU 282 Cb 0.03 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2cxt h LEU 282 CO 0.00 0.25 -0.02 0.77 -0.34 0.00 0.00 178.44 179.10 2cxt h SER 283 N 0.59 0.14 0.15 1.25 4.64 -1.85 0.72 113.55 119.20 2cxt h SER 283 Ca 0.36 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.66 2cxt h SER 283 Cb 0.40 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2cxt h SER 283 CO -0.28 0.19 -0.07 0.40 -0.87 0.00 0.00 176.83 176.20 2cxt h ILE 284 N 0.16 0.96 -0.69 0.95 2.04 -1.37 -2.12 117.51 117.45 2cxt h ILE 284 Ca 0.04 -0.50 -0.02 0.00 1.00 0.00 0.00 64.86 65.38 2cxt h ILE 284 Cb 0.15 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 2cxt h ILE 284 CO 0.00 0.12 0.33 0.00 0.00 0.00 0.00 178.15 178.60 2cxt h ALA 285 N 0.36 1.29 -0.70 1.87 0.00 -0.72 -0.40 119.26 120.97 2cxt h ALA 285 Ca -0.02 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 2cxt h ALA 285 Cb 0.35 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2cxt h ALA 285 CO 0.03 0.55 0.28 -0.07 0.00 0.00 0.00 179.25 180.04 2cxt h LEU 286 N 0.97 0.97 -0.01 0.00 3.38 -0.87 0.16 115.31 119.90 2cxt h LEU 286 Ca 0.24 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 2cxt h LEU 286 Cb 0.10 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2cxt h LEU 286 CO -0.03 0.88 -0.21 -0.74 0.09 0.00 0.00 178.44 178.42 2cxt h HIS 287 N 1.00 0.22 -0.02 1.13 2.76 -0.65 -3.36 115.15 116.23 2cxt h HIS 287 Ca 0.23 -0.12 0.00 0.00 -2.20 0.00 0.00 60.37 58.29 2cxt h HIS 287 Cb 0.21 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.15 2cxt h HIS 287 CO 0.02 0.90 -0.31 1.33 -1.30 0.00 0.00 177.93 178.57 2cxt n VAL 288 N -4.54 0.00 0.00 5.26 0.24 -0.23 -4.14 118.33 114.92 2cxt n VAL 288 Ca -0.10 -0.35 0.00 0.00 -2.04 0.00 0.00 64.34 61.86 2cxt n VAL 288 Cb 0.48 1.26 0.00 0.00 -1.47 0.00 0.00 33.84 34.11 2cxt n VAL 288 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2cxt n GLY 289 N 1.22 0.45 0.30 7.63 0.00 0.55 -4.40 105.19 110.95 2cxt n GLY 289 Ca 0.08 -1.58 -0.01 0.00 0.00 0.00 0.00 46.02 44.52 2cxt n GLY 289 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2cxt h PHE 290 N 0.00 0.73 -0.34 1.61 3.57 -1.91 -2.26 116.94 118.34 2cxt h PHE 290 Ca 0.00 -0.04 0.06 0.00 3.53 0.00 0.00 57.97 61.51 2cxt h PHE 290 Cb 0.00 -0.22 -0.05 0.00 2.79 0.00 0.00 35.95 38.47 2cxt h PHE 290 CO 0.00 0.59 0.03 -0.44 -2.23 0.00 0.00 178.31 176.26 2cxt h ASP 291 N 0.71 -0.07 -0.21 0.41 3.32 -1.92 0.35 116.42 119.02 2cxt h ASP 291 Ca 0.17 0.07 -0.08 0.00 0.02 0.00 0.00 57.03 57.20 2cxt h ASP 291 Cb 0.19 0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 2cxt h ASP 291 CO -0.01 0.00 -0.13 0.45 -1.72 0.00 0.00 179.24 177.83 2cxt h HIS 292 N 0.14 0.66 -0.70 4.55 3.86 -1.70 -1.91 115.15 120.04 2cxt h HIS 292 Ca 0.16 -0.11 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 2cxt h HIS 292 Cb 0.21 -0.17 -0.03 0.00 1.06 0.00 0.00 27.41 28.47 2cxt h HIS 292 CO -0.21 0.71 0.36 0.35 0.86 0.00 0.00 177.93 179.99 2cxt h PHE 293 N 0.55 0.99 -0.49 2.45 3.57 -0.81 -1.10 116.94 122.10 2cxt h PHE 293 Ca 0.10 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.53 2cxt h PHE 293 Cb 0.55 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 2cxt h PHE 293 CO 0.02 0.72 0.19 0.93 -2.23 0.00 0.00 178.31 177.95 2cxt h GLU 294 N 0.97 0.71 -0.51 1.11 5.08 -0.53 -1.26 114.58 120.14 2cxt h GLU 294 Ca 0.24 -0.10 -0.08 0.00 -1.00 0.00 0.00 59.36 58.42 2cxt h GLU 294 Cb 0.09 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 2cxt h GLU 294 CO -0.03 0.59 -0.01 1.96 -1.00 0.00 0.00 179.01 180.51 2cxt h GLN 295 N 0.70 0.91 -0.21 2.33 4.20 -0.93 0.77 115.11 122.89 2cxt h GLN 295 Ca 0.17 -0.29 0.03 0.00 0.06 0.00 0.00 58.65 58.61 2cxt h GLN 295 Cb 0.15 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 2cxt h GLN 295 CO -0.02 0.94 0.03 1.25 -0.67 0.00 0.00 178.83 180.36 2cxt h LEU 296 N 0.78 -0.02 -0.87 1.46 5.85 -0.74 -0.82 115.31 120.95 2cxt h LEU 296 Ca 0.14 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.92 2cxt h LEU 296 Cb 0.53 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.57 2cxt h LEU 296 CO 0.03 0.02 0.57 -0.07 -0.34 0.00 0.00 178.44 178.65 2cxt h LEU 297 N 0.10 0.97 -0.98 2.25 3.38 -1.09 -2.63 115.31 117.32 2cxt h LEU 297 Ca 0.09 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 2cxt h LEU 297 Cb 0.10 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2cxt h LEU 297 CO -0.14 0.69 0.10 0.28 0.09 0.00 0.00 178.44 179.47 2cxt h SER 298 N 1.15 0.80 -0.36 -0.43 0.02 -0.30 -0.41 113.55 114.01 2cxt h SER 298 Ca 0.33 -0.16 -0.04 0.00 -0.84 0.00 0.00 61.79 61.08 2cxt h SER 298 Cb -0.09 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.23 2cxt h SER 298 CO -0.08 0.80 0.07 1.23 -1.14 0.00 0.00 176.83 177.71 2cxt h GLY 299 N 0.98 0.64 0.85 -3.77 0.00 -1.01 -0.30 103.07 100.46 2cxt h GLY 299 Ca 0.17 -0.42 0.03 0.00 0.00 0.00 0.00 47.33 47.12 2cxt h GLY 299 CO 0.00 0.39 0.46 0.00 0.00 0.00 0.00 176.54 177.39 2cxt h ALA 300 N 0.92 0.97 -0.72 3.60 0.00 -1.16 -2.10 119.26 120.77 2cxt h ALA 300 Ca 0.11 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2cxt h ALA 300 Cb 0.34 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2cxt h ALA 300 CO 0.00 0.23 0.42 1.25 0.00 0.00 0.00 179.25 181.16 2cxt h HIS 301 N 0.89 0.96 -0.43 0.00 6.17 -0.80 0.84 115.15 122.77 2cxt h HIS 301 Ca 0.30 -0.01 0.05 0.00 0.71 0.00 0.00 60.37 61.42 2cxt h HIS 301 Cb 0.04 -0.31 -0.04 0.00 2.52 0.00 0.00 27.41 29.62 2cxt h HIS 301 CO -0.04 0.66 0.18 2.35 0.71 0.00 0.00 177.93 181.79 2cxt h TRP 302 N 0.98 0.32 -0.16 5.26 7.01 -0.65 -1.18 115.95 127.53 2cxt h TRP 302 Ca 0.26 0.02 -0.12 0.00 2.11 0.00 0.00 58.89 61.16 2cxt h TRP 302 Cb -0.01 -0.08 -0.01 0.00 -2.10 0.00 0.00 29.16 26.96 2cxt h TRP 302 CO -0.01 0.14 -0.40 1.98 -2.79 0.00 0.00 178.44 177.36 2cxt h MET 303 N 0.36 0.37 -0.61 2.65 4.05 -0.84 -0.77 114.93 120.13 2cxt h MET 303 Ca 0.20 -0.18 0.01 0.00 -0.28 0.00 0.00 59.70 59.45 2cxt h MET 303 Cb 0.16 -0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 30.92 2cxt h MET 303 CO -0.18 0.71 0.40 -0.44 0.23 0.00 0.00 176.91 177.63 2cxt h ASP 304 N 0.31 0.67 -0.23 1.39 3.32 -0.40 0.30 116.42 121.77 2cxt h ASP 304 Ca 0.03 -0.01 -0.14 0.00 0.02 0.00 0.00 57.03 56.93 2cxt h ASP 304 Cb 0.84 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.22 2cxt h ASP 304 CO 0.07 0.48 -0.35 1.56 -1.72 0.00 0.00 179.24 179.28 2cxt h GLN 305 N 0.80 0.75 -0.34 3.56 1.08 -0.91 -0.09 115.11 119.96 2cxt h GLN 305 Ca 0.23 -0.36 0.01 0.00 -1.45 0.00 0.00 58.65 57.08 2cxt h GLN 305 Cb -0.05 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.36 2cxt h GLN 305 CO -0.07 0.98 0.21 1.25 -0.95 0.00 0.00 178.83 180.26 2cxt h HIS 306 N 0.63 0.40 -0.77 2.96 2.76 -0.84 -0.99 115.15 119.30 2cxt h HIS 306 Ca 0.06 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.24 2cxt h HIS 306 Cb 0.88 -0.13 -0.04 0.00 1.55 0.00 0.00 27.41 29.67 2cxt h HIS 306 CO 0.05 0.25 0.46 0.35 -1.30 0.00 0.00 177.93 177.73 2cxt h PHE 307 N 0.44 1.03 -0.27 5.26 3.57 -0.71 -2.39 116.94 123.86 2cxt h PHE 307 Ca 0.13 -0.01 -0.19 0.00 3.53 0.00 0.00 57.97 61.44 2cxt h PHE 307 Cb -0.03 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 38.38 2cxt h PHE 307 CO -0.06 0.69 -0.56 1.25 -2.23 0.00 0.00 178.31 177.41 2cxt h LEU 308 N 1.06 0.95 0.00 0.59 5.85 -0.77 -3.36 115.31 119.63 2cxt h LEU 308 Ca 0.28 -0.55 0.00 0.00 0.84 0.00 0.00 57.88 58.45 2cxt h LEU 308 Cb -0.02 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.73 2cxt h LEU 308 CO -0.05 1.32 -1.59 0.29 -0.34 0.00 0.00 178.44 178.07 2cxt n LYS 309 N -4.03 0.45 -3.19 1.25 5.02 -0.40 -4.96 118.16 112.30 2cxt n LYS 309 Ca -0.05 -0.11 -0.39 0.00 -2.02 0.00 0.00 58.31 55.74 2cxt n LYS 309 Cb 0.63 -1.54 -0.05 0.00 -0.02 0.00 0.00 35.03 34.05 2cxt n LYS 309 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2cxt s THR 310 N -3.34 5.06 0.36 -0.18 2.01 -0.90 -5.03 115.64 113.62 2cxt s THR 310 Ca -0.02 1.20 -0.26 0.00 0.31 0.00 0.00 61.69 62.92 2cxt s THR 310 Cb 0.14 -3.92 -0.12 0.00 0.01 0.00 0.00 72.50 68.61 2cxt s THR 310 CO 0.88 0.33 1.11 -2.65 -0.69 0.00 0.00 174.62 173.59 2cxt n PRO 311 N 3.44 1.61 -0.25 4.92 -0.02 -1.26 -4.72 135.00 138.73 2cxt n PRO 311 Ca -0.05 0.57 0.11 0.00 -2.02 0.00 0.00 63.50 62.11 2cxt n PRO 311 Cb 0.51 -2.09 0.38 0.00 -0.02 0.00 0.00 33.50 32.28 2cxt n PRO 311 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2cxt h LEU 312 N 1.98 0.64 -0.96 2.45 3.38 -1.95 -1.99 115.31 118.86 2cxt h LEU 312 Ca -0.44 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.56 2cxt h LEU 312 Cb 1.32 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2cxt h LEU 312 CO 0.60 0.34 0.00 -1.84 0.09 0.00 0.00 178.44 177.63 2cxt n GLU 313 N -4.54 0.18 -0.72 1.13 0.00 -1.26 -2.13 120.64 113.30 2cxt n GLU 313 Ca 0.16 0.50 0.05 0.00 0.00 0.00 0.00 57.16 57.86 2cxt n GLU 313 Cb 0.43 -1.90 0.08 0.00 0.00 0.00 0.00 31.44 30.04 2cxt n GLU 313 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.13 177.49 2cxt n LYS 314 N -2.25 0.61 -3.34 3.44 2.85 -0.77 -5.02 118.16 113.69 2cxt n LYS 314 Ca 0.01 -2.12 -0.43 0.00 -1.05 0.00 0.00 58.31 54.72 2cxt n LYS 314 Cb 0.16 -0.81 -0.09 0.00 -0.65 0.00 0.00 35.03 33.64 2cxt n LYS 314 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 2cxt s ASN 315 N -2.17 6.19 0.11 -5.58 3.84 -0.91 -4.90 114.94 111.52 2cxt s ASN 315 Ca 0.25 -0.62 -0.32 0.00 0.21 0.00 0.00 52.86 52.37 2cxt s ASN 315 Cb 0.25 -2.22 -0.11 0.00 -0.55 0.00 0.00 41.25 38.62 2cxt s ASN 315 CO -0.06 -0.54 1.57 0.00 -2.79 0.00 0.00 177.10 175.28 2cxt h ALA 316 N 8.69 -0.83 -0.37 1.71 0.00 -1.91 -0.21 119.26 126.33 2cxt h ALA 316 Ca -0.27 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2cxt h ALA 316 Cb 1.12 0.82 -0.02 0.00 0.00 0.00 0.00 17.79 19.71 2cxt h ALA 316 CO 0.78 -1.04 0.19 -1.00 0.00 0.00 0.00 179.25 178.18 2cxt h PRO 317 N -0.66 0.50 -0.32 0.00 0.13 -1.94 -1.36 132.00 128.35 2cxt h PRO 317 Ca 0.02 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 65.06 2cxt h PRO 317 Cb 0.71 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 31.72 2cxt h PRO 317 CO -0.31 0.38 0.00 0.28 -0.23 0.00 0.00 178.00 178.13 2cxt h VAL 318 N 0.51 1.26 -0.56 1.56 2.07 -1.70 -1.12 116.25 118.26 2cxt h VAL 318 Ca 0.13 -0.94 -0.05 0.00 0.82 0.00 0.00 66.70 66.66 2cxt h VAL 318 Cb 0.03 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 2cxt h VAL 318 CO -0.02 0.31 0.14 -0.07 0.02 0.00 0.00 177.57 177.95 2cxt h LEU 319 N 0.36 0.85 -0.82 2.57 3.38 -0.61 0.03 115.31 121.07 2cxt h LEU 319 Ca 0.09 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2cxt h LEU 319 Cb 0.44 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 2cxt h LEU 319 CO 0.02 0.86 0.44 -0.07 0.09 0.00 0.00 178.44 179.78 2cxt h LEU 320 N 0.80 1.04 -0.60 1.67 3.38 -1.22 -1.10 115.31 119.27 2cxt h LEU 320 Ca 0.18 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2cxt h LEU 320 Cb 0.33 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2cxt h LEU 320 CO 0.00 0.84 0.30 0.00 0.09 0.00 0.00 178.44 179.68 2cxt h ALA 321 N 1.24 0.78 -0.48 1.53 0.00 -0.78 -2.14 119.26 119.39 2cxt h ALA 321 Ca 0.29 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.94 2cxt h ALA 321 Cb 0.04 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2cxt h ALA 321 CO -0.04 0.32 -0.23 -0.07 0.00 0.00 0.00 179.25 179.23 2cxt h LEU 322 N 0.82 1.03 -0.99 0.00 3.38 -0.62 -0.60 115.31 118.34 2cxt h LEU 322 Ca 0.21 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.78 2cxt h LEU 322 Cb 0.09 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.51 2cxt h LEU 322 CO -0.03 1.20 0.63 -0.07 0.09 0.00 0.00 178.44 180.26 2cxt h LEU 323 N 0.86 1.15 -0.27 1.67 3.38 -1.16 -0.97 115.31 119.97 2cxt h LEU 323 Ca 0.11 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 2cxt h LEU 323 Cb 0.81 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 2cxt h LEU 323 CO 0.07 0.85 0.17 1.23 0.09 0.00 0.00 178.44 180.85 2cxt h GLY 324 N 1.34 0.39 0.54 0.83 0.00 -0.82 -1.75 103.07 103.60 2cxt h GLY 324 Ca 0.36 -0.16 0.07 0.00 0.00 0.00 0.00 47.33 47.60 2cxt h GLY 324 CO -0.07 0.15 0.25 -2.22 0.00 0.00 0.00 176.54 174.66 2cxt h ILE 325 N 0.35 0.86 -0.38 2.60 1.08 -0.76 0.92 117.51 122.17 2cxt h ILE 325 Ca 0.10 -0.16 0.05 0.00 -0.39 0.00 0.00 64.86 64.46 2cxt h ILE 325 Cb -0.00 0.34 -0.05 0.00 -3.07 0.00 0.00 36.82 34.05 2cxt h ILE 325 CO -0.02 0.09 0.11 -0.25 -0.69 0.00 0.00 178.15 177.38 2cxt h TRP 326 N 0.47 0.18 -0.03 1.37 -0.00 -0.82 0.18 115.95 117.31 2cxt h TRP 326 Ca 0.28 0.02 -0.19 0.00 -0.00 0.00 0.00 58.89 59.00 2cxt h TRP 326 Cb 0.27 -0.03 -0.01 0.00 -0.00 0.00 0.00 29.16 29.40 2cxt h TRP 326 CO -0.13 0.06 -0.81 1.88 -0.00 0.00 0.00 178.44 179.43 2cxt h TYR 327 N 0.25 0.44 0.02 2.65 0.05 -0.87 -2.33 116.97 117.18 2cxt h TYR 327 Ca 0.18 -0.22 -0.00 0.00 0.05 0.00 0.00 58.73 58.74 2cxt h TYR 327 Cb 0.19 -0.06 0.00 0.00 1.01 0.00 0.00 36.73 37.87 2cxt h TYR 327 CO -0.17 0.99 -0.01 0.82 -1.05 0.00 0.00 178.16 178.74 2cxt h ILE 328 N 0.19 1.38 0.00 -2.88 2.04 -0.53 -0.23 117.51 117.49 2cxt h ILE 328 Ca -0.04 -1.87 0.00 0.00 1.00 0.00 0.00 64.86 63.95 2cxt h ILE 328 Cb 1.40 2.54 0.00 0.00 -0.74 0.00 0.00 36.82 40.02 2cxt h ILE 328 CO 0.13 0.44 -1.04 0.59 0.00 0.00 0.00 178.15 178.28 2cxt n ASN 329 N -4.70 0.62 -0.07 1.72 5.03 0.62 -2.59 115.26 115.88 2cxt n ASN 329 Ca -0.08 -0.26 -0.14 0.00 0.87 0.00 0.00 54.58 54.97 2cxt n ASN 329 Cb 0.36 0.82 -0.06 0.00 -1.02 0.00 0.00 39.78 39.89 2cxt n ASN 329 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2cxt h TYR 331 N -0.37 0.00 -0.21 0.00 -1.99 -1.40 -3.49 116.97 109.51 2cxt h TYR 331 Ca -0.35 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.33 2cxt h TYR 331 Cb 1.37 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 40.09 2cxt h TYR 331 CO -0.03 0.05 -0.05 0.41 -0.00 0.00 0.00 178.16 178.55 2cxt n GLY 332 N 1.17 0.41 3.68 3.88 0.00 -0.49 -4.98 105.19 108.85 2cxt n GLY 332 Ca 0.01 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.71 2cxt n GLY 332 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cxt h GLU 334 N 8.11 0.00 -5.79 0.00 5.08 -1.89 -3.40 114.58 116.70 2cxt h GLU 334 Ca -0.34 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.46 2cxt h GLU 334 Cb 1.15 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.27 2cxt h GLU 334 CO 0.92 0.66 -0.69 0.95 -1.00 0.00 0.00 179.01 179.85 2cxt s THR 335 N -3.21 2.02 -0.04 1.13 -4.23 -1.26 -0.83 115.64 109.22 2cxt s THR 335 Ca 0.01 -2.20 -0.02 0.00 -1.18 0.00 0.00 61.69 58.30 2cxt s THR 335 Cb 0.11 -2.49 0.03 0.00 1.34 0.00 0.00 72.50 71.49 2cxt s THR 335 CO 0.76 -0.29 0.05 -2.28 -0.54 0.00 0.00 174.62 172.32 2cxt s HIS 336 N -2.77 0.12 -0.14 3.99 2.46 0.16 -4.22 115.29 114.90 2cxt s HIS 336 Ca 0.30 0.21 -0.12 0.00 0.47 0.00 0.00 55.06 55.92 2cxt s HIS 336 Cb 0.02 -0.49 -0.05 0.00 -0.13 0.00 0.00 32.58 31.93 2cxt s HIS 336 CO 0.14 -0.20 0.24 0.00 -2.47 0.00 0.00 174.74 172.46 2cxt s ALA 337 N 2.06 3.69 -0.24 1.58 0.00 -0.55 -2.14 121.76 126.16 2cxt s ALA 337 Ca 0.04 -0.51 -0.05 0.00 0.00 0.00 0.00 51.96 51.44 2cxt s ALA 337 Cb -0.12 -2.25 -0.01 0.00 0.00 0.00 0.00 23.12 20.74 2cxt s ALA 337 CO -0.03 0.28 -0.00 -0.51 0.00 0.00 0.00 175.76 175.50 2cxt s LEU 338 N -0.12 3.19 -0.59 0.00 1.43 0.01 -0.68 118.68 121.92 2cxt s LEU 338 Ca 0.16 -0.45 0.04 0.00 -1.03 0.00 0.00 54.13 52.85 2cxt s LEU 338 Cb -0.13 -1.79 0.17 0.00 0.03 0.00 0.00 46.19 44.46 2cxt s LEU 338 CO 0.04 -0.06 0.43 -0.76 0.23 0.00 0.00 176.35 176.23 2cxt s LEU 339 N 1.50 3.59 -0.01 1.79 1.43 0.52 -3.92 118.68 123.58 2cxt s LEU 339 Ca 0.05 -3.53 -0.30 0.00 -1.03 0.00 0.00 54.13 49.32 2cxt s LEU 339 Cb -0.15 -1.21 -0.04 0.00 0.03 0.00 0.00 46.19 44.82 2cxt s LEU 339 CO -0.01 -0.12 1.08 -2.16 0.23 0.00 0.00 176.35 175.36 2cxt s PRO 340 N -0.86 4.48 -1.29 1.29 0.04 -1.26 -2.26 135.00 135.13 2cxt s PRO 340 Ca 0.27 1.55 -0.08 0.00 0.04 0.00 0.00 61.00 62.78 2cxt s PRO 340 Cb -0.03 -3.45 0.15 0.00 0.04 0.00 0.00 34.50 31.21 2cxt s PRO 340 CO -0.17 -0.20 2.01 0.66 0.04 0.00 0.00 177.00 179.34 2cxt n TYR 341 N 4.25 2.82 -3.28 0.56 4.02 0.19 -1.35 117.16 124.37 2cxt n TYR 341 Ca 0.08 -2.79 0.03 0.00 -0.01 0.00 0.00 57.90 55.21 2cxt n TYR 341 Cb 0.49 -1.91 -0.03 0.00 -0.02 0.00 0.00 39.34 37.87 2cxt n TYR 341 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2cxt s ASP 342 N 0.70 -0.77 0.33 7.72 2.15 -1.25 -4.66 116.67 120.89 2cxt s ASP 342 Ca 0.43 0.70 0.02 0.00 0.43 0.00 0.00 52.55 54.14 2cxt s ASP 342 Cb 0.12 1.73 0.56 0.00 -0.30 0.00 0.00 42.92 45.04 2cxt s ASP 342 CO -0.02 -0.15 1.91 -0.61 -0.17 0.00 0.00 175.17 176.14 2cxt h GLN 343 N 7.83 0.72 0.00 4.34 5.75 -1.86 -1.82 115.11 130.07 2cxt h GLN 343 Ca -0.17 -0.11 -0.01 0.00 -0.15 0.00 0.00 58.65 58.22 2cxt h GLN 343 Cb 1.14 -0.13 -0.00 0.00 1.07 0.00 0.00 27.48 29.57 2cxt h GLN 343 CO 0.06 0.60 -0.03 1.88 -2.65 0.00 0.00 178.83 178.70 2cxt h TYR 344 N 0.71 0.00 -0.35 3.99 0.99 -1.91 -2.12 116.97 118.27 2cxt h TYR 344 Ca 0.17 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.85 2cxt h TYR 344 Cb 0.16 0.00 -0.03 0.00 1.00 0.00 0.00 36.73 37.86 2cxt h TYR 344 CO 0.01 0.03 0.07 -1.33 -0.00 0.00 0.00 178.16 176.93 2cxt n MET 345 N -4.01 2.84 0.20 4.88 2.81 -0.68 -2.61 117.12 120.55 2cxt n MET 345 Ca -0.03 -1.68 0.14 0.00 -1.81 0.00 0.00 57.70 54.32 2cxt n MET 345 Cb 0.11 -1.86 0.69 0.00 -0.71 0.00 0.00 33.22 31.45 2cxt n MET 345 CO 0.00 0.00 0.00 1.12 1.51 0.00 0.00 175.97 178.60 2cxt h HIS 346 N 1.85 0.00 -0.49 2.03 2.07 -1.46 -1.42 115.15 117.72 2cxt h HIS 346 Ca 0.06 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.58 2cxt h HIS 346 Cb 1.43 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.41 2cxt h HIS 346 CO 0.64 0.00 0.00 0.54 -3.07 0.00 0.00 177.93 176.04 2cxt n ARG 347 N -2.49 2.79 -0.07 5.12 5.12 -1.26 -4.63 116.66 121.25 2cxt n ARG 347 Ca -0.01 -2.28 -0.11 0.00 -1.93 0.00 0.00 57.85 53.52 2cxt n ARG 347 Cb 0.12 -1.39 -0.05 0.00 -1.16 0.00 0.00 32.46 29.98 2cxt n ARG 347 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 2cxt h PHE 348 N 2.93 0.40 -0.65 -1.55 3.57 -1.60 -1.98 116.94 118.05 2cxt h PHE 348 Ca 0.00 -0.07 -0.04 0.00 3.53 0.00 0.00 57.97 61.39 2cxt h PHE 348 Cb 0.83 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.44 2cxt h PHE 348 CO 0.33 0.55 0.24 0.00 -2.23 0.00 0.00 178.31 177.19 2cxt h ALA 349 N 0.80 0.84 -0.64 2.41 0.00 -1.82 -2.27 119.26 118.58 2cxt h ALA 349 Ca 0.06 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 2cxt h ALA 349 Cb 0.38 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2cxt h ALA 349 CO 0.01 0.48 0.32 0.00 0.00 0.00 0.00 179.25 180.05 2cxt h ALA 350 N 1.10 1.35 -0.07 0.00 0.00 -1.84 -0.31 119.26 119.49 2cxt h ALA 350 Ca 0.21 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2cxt h ALA 350 Cb 0.24 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2cxt h ALA 350 CO -0.01 0.51 0.04 -0.92 0.00 0.00 0.00 179.25 178.87 2cxt h TYR 351 N 0.90 0.11 0.00 0.00 3.20 -1.03 -2.92 116.97 117.22 2cxt h TYR 351 Ca 0.22 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.09 2cxt h TYR 351 Cb 0.08 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.32 2cxt h TYR 351 CO 0.01 0.19 0.00 1.19 -1.64 0.00 0.00 178.16 177.91 2cxt n PHE 352 N -4.97 0.21 -0.09 -3.82 3.01 -0.88 -1.75 117.46 109.16 2cxt n PHE 352 Ca -0.06 0.07 -0.07 0.00 1.01 0.00 0.00 57.45 58.40 2cxt n PHE 352 Cb 0.09 -0.61 0.01 0.00 -0.01 0.00 0.00 39.48 38.96 2cxt n PHE 352 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 2cxt h GLN 353 N 0.00 0.21 0.07 -1.08 4.20 -0.86 0.20 115.11 117.85 2cxt h GLN 353 Ca 0.00 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 2cxt h GLN 353 Cb 0.47 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.20 2cxt h GLN 353 CO 0.00 0.14 -0.03 0.37 -0.67 0.00 0.00 178.83 178.63 2cxt h GLN 354 N 0.21 -0.09 -0.87 1.46 4.15 -1.46 -0.73 115.11 117.78 2cxt h GLN 354 Ca 0.15 0.01 0.13 0.00 0.77 0.00 0.00 58.65 59.70 2cxt h GLN 354 Cb 0.14 0.02 -0.09 0.00 0.21 0.00 0.00 27.48 27.77 2cxt h GLN 354 CO -0.18 0.40 0.48 0.78 -1.93 0.00 0.00 178.83 178.38 2cxt h GLY 355 N -0.64 1.40 0.00 2.39 0.00 -1.28 -1.11 103.07 103.84 2cxt h GLY 355 Ca -0.01 -0.30 -0.07 0.00 0.00 0.00 0.00 47.33 46.95 2cxt h GLY 355 CO 0.02 0.04 -0.60 -1.80 0.00 0.00 0.00 176.54 174.20 2cxt h ASP 356 N 0.74 0.00 0.06 0.19 1.82 -0.71 -3.32 116.42 115.19 2cxt h ASP 356 Ca 0.45 -0.27 -0.18 0.00 -0.39 0.00 0.00 57.03 56.63 2cxt h ASP 356 Cb 0.54 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.55 2cxt h ASP 356 CO -0.31 0.97 -0.67 0.24 -1.61 0.00 0.00 179.24 177.86 2cxt h MET 357 N -1.00 0.57 0.00 0.28 0.00 -1.09 0.92 114.93 114.62 2cxt h MET 357 Ca -0.11 -0.42 -0.12 0.00 0.00 0.00 0.00 59.70 59.05 2cxt h MET 357 Cb 0.73 0.07 -0.02 0.00 0.00 0.00 0.00 31.60 32.38 2cxt h MET 357 CO -0.07 1.04 -0.56 1.49 0.00 0.00 0.00 176.91 178.82 2cxt h GLU 358 N 0.41 0.00 0.22 1.72 4.81 -1.27 -0.76 114.58 119.70 2cxt h GLU 358 Ca -0.02 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 2cxt h GLU 358 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 2cxt h GLU 358 CO 0.13 0.56 -0.11 0.77 -0.73 0.00 0.00 179.01 179.63 2cxt h SER 359 N 0.00 -0.25 -0.34 1.04 0.02 -1.54 -3.40 113.55 109.08 2cxt h SER 359 Ca -0.01 -0.26 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 2cxt h SER 359 Cb 1.08 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.68 2cxt h SER 359 CO 0.07 0.26 0.00 0.59 -1.14 0.00 0.00 176.83 176.61 2cxt n ASN 360 N -4.98 2.91 -3.97 3.07 3.02 0.29 -4.17 115.26 111.42 2cxt n ASN 360 Ca -0.08 -1.94 -0.42 0.00 -0.03 0.00 0.00 54.58 52.11 2cxt n ASN 360 Cb 0.25 -0.23 0.00 0.00 -0.61 0.00 0.00 39.78 39.20 2cxt n ASN 360 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cxt n GLY 361 N 0.64 4.07 3.14 7.41 0.00 -0.29 -1.00 105.19 119.16 2cxt n GLY 361 Ca 0.12 -1.70 -0.11 0.00 0.00 0.00 0.00 46.02 44.33 2cxt n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cxt s LYS 362 N 2.71 0.76 0.00 1.61 -0.14 -1.26 -4.96 119.74 118.46 2cxt s LYS 362 Ca 0.47 -1.19 0.00 0.00 -1.36 0.00 0.00 55.97 53.88 2cxt s LYS 362 Cb 0.10 -0.23 0.00 0.00 -1.68 0.00 0.00 37.83 36.02 2cxt s LYS 362 CO -0.03 0.00 0.13 2.48 -0.76 0.00 0.00 175.35 177.17 2cxt n TYR 363 N 0.33 0.00 -4.80 3.18 0.18 -1.26 -4.70 117.16 110.08 2cxt n TYR 363 Ca -0.15 -0.01 -0.33 0.00 1.88 0.00 0.00 57.90 59.30 2cxt n TYR 363 Cb 0.59 -0.00 -0.15 0.00 -0.38 0.00 0.00 39.34 39.40 2cxt n TYR 363 CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 2cxt s ILE 364 N -0.01 2.92 0.72 -3.48 -1.09 -1.26 -1.07 121.20 117.92 2cxt s ILE 364 Ca 0.00 -0.71 -0.05 0.00 -2.23 0.00 0.00 60.65 57.66 2cxt s ILE 364 Cb 0.00 -2.22 0.09 0.00 -1.58 0.00 0.00 42.46 38.75 2cxt s ILE 364 CO 0.00 0.53 1.01 0.42 -1.23 0.00 0.00 174.94 175.67 2cxt s THR 365 N 0.39 2.27 0.46 2.92 -4.23 0.01 -4.47 115.64 112.99 2cxt s THR 365 Ca -0.11 -0.38 0.19 0.00 -1.18 0.00 0.00 61.69 60.21 2cxt s THR 365 Cb -0.16 -2.89 0.37 0.00 1.34 0.00 0.00 72.50 71.16 2cxt s THR 365 CO 0.06 0.00 1.94 0.50 -0.54 0.00 0.00 174.62 176.58 2cxt h LYS 366 N -0.61 0.26 0.00 3.99 3.64 -1.31 0.63 116.57 123.17 2cxt h LYS 366 Ca -0.42 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 2cxt h LYS 366 Cb 1.29 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 2cxt h LYS 366 CO 0.51 0.17 0.00 -1.13 -2.27 0.00 0.00 179.45 176.73 2cxt n SER 367 N -4.44 0.00 0.00 4.20 3.41 -1.26 -4.89 113.62 110.64 2cxt n SER 367 Ca 0.13 0.40 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 2cxt n SER 367 Cb 0.57 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 2cxt n SER 367 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cxt n GLY 368 N 1.38 1.00 3.77 5.00 0.00 0.21 -5.05 105.19 111.50 2cxt n GLY 368 Ca 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 2cxt n GLY 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cxt s ALA 369 N -2.49 3.10 0.38 4.61 0.00 -1.26 -4.69 121.76 121.41 2cxt s ALA 369 Ca 0.00 0.89 -0.26 0.00 0.00 0.00 0.00 51.96 52.58 2cxt s ALA 369 Cb 0.00 -3.35 -0.09 0.00 0.00 0.00 0.00 23.12 19.68 2cxt s ALA 369 CO 0.00 -0.46 1.23 0.50 0.00 0.00 0.00 175.76 177.03 2cxt s ARG 370 N -2.41 4.12 0.47 0.00 3.52 -1.26 -0.81 118.95 122.59 2cxt s ARG 370 Ca 0.58 2.00 -0.23 0.00 -0.13 0.00 0.00 55.73 57.95 2cxt s ARG 370 Cb -0.28 -2.81 -0.07 0.00 -1.56 0.00 0.00 34.95 30.23 2cxt s ARG 370 CO 0.35 -0.31 1.24 0.14 -0.81 0.00 0.00 175.30 175.91 2cxt s VAL 371 N -1.30 2.74 -0.30 7.11 -7.23 -0.23 -4.58 120.40 116.61 2cxt s VAL 371 Ca 0.55 0.57 0.08 0.00 -1.81 0.00 0.00 61.98 61.37 2cxt s VAL 371 Cb -0.35 -3.30 0.46 0.00 0.56 0.00 0.00 36.38 33.75 2cxt s VAL 371 CO 0.45 0.01 1.32 -0.90 -0.31 0.00 0.00 175.10 175.67 2cxt n ASP 372 N -0.52 3.66 -3.93 4.85 5.75 -1.26 -5.01 116.55 120.09 2cxt n ASP 372 Ca 0.07 -3.81 -0.09 0.00 -0.01 0.00 0.00 54.79 50.95 2cxt n ASP 372 Cb 0.46 -0.51 -0.05 0.00 -1.03 0.00 0.00 41.12 39.99 2cxt n ASP 372 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 2cxt s HIS 373 N -3.44 0.25 0.51 2.11 -3.43 -1.26 -5.04 115.29 105.00 2cxt s HIS 373 Ca 0.47 -0.61 -0.20 0.00 -0.80 0.00 0.00 55.06 53.92 2cxt s HIS 373 Cb 0.41 0.20 -0.07 0.00 -1.43 0.00 0.00 32.58 31.68 2cxt s HIS 373 CO -0.01 -0.93 1.06 -0.65 -2.00 0.00 0.00 174.74 172.21 2cxt s GLN 374 N -3.98 3.63 0.00 -0.38 -1.52 -1.26 -5.07 119.66 111.09 2cxt s GLN 374 Ca 0.18 1.40 0.00 0.00 -1.95 0.00 0.00 55.36 55.00 2cxt s GLN 374 Cb -0.00 -2.07 0.00 0.00 -0.22 0.00 0.00 33.01 30.72 2cxt s GLN 374 CO 0.05 -0.58 0.00 0.25 -0.25 0.00 0.00 175.29 174.76 2cxt n THR 375 N -1.17 0.00 -1.64 -0.19 -2.24 -1.26 -4.90 114.28 102.88 2cxt n THR 375 Ca 0.10 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.45 2cxt n THR 375 Cb 0.52 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.75 2cxt n THR 375 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cxt n GLY 376 N 5.00 0.11 3.92 3.38 0.00 -0.17 -5.00 105.19 112.43 2cxt n GLY 376 Ca 0.00 0.26 -0.27 0.00 0.00 0.00 0.00 46.02 46.01 2cxt n GLY 376 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cxt s PRO 377 N -1.85 2.28 -0.17 1.61 0.04 -1.26 -4.80 135.00 130.85 2cxt s PRO 377 Ca 0.59 -0.06 -0.26 0.00 0.04 0.00 0.00 61.00 61.31 2cxt s PRO 377 Cb -0.60 -2.11 -0.01 0.00 0.04 0.00 0.00 34.50 31.82 2cxt s PRO 377 CO 0.60 -1.26 0.89 0.42 0.04 0.00 0.00 177.00 177.68 2cxt s ILE 378 N -3.32 4.84 -0.14 0.56 1.01 -0.01 -4.68 121.20 119.46 2cxt s ILE 378 Ca 0.60 1.74 -0.09 0.00 0.00 0.00 0.00 60.65 62.90 2cxt s ILE 378 Cb -0.11 -4.19 -0.04 0.00 0.01 0.00 0.00 42.46 38.13 2cxt s ILE 378 CO 0.47 -0.01 0.17 -0.69 0.00 0.00 0.00 174.94 174.88 2cxt s VAL 379 N 2.28 5.42 0.27 2.92 1.01 -1.26 -0.66 120.40 130.38 2cxt s VAL 379 Ca 0.40 0.29 -0.18 0.00 0.00 0.00 0.00 61.98 62.49 2cxt s VAL 379 Cb -0.17 -3.47 0.01 0.00 0.00 0.00 0.00 36.38 32.76 2cxt s VAL 379 CO 0.12 0.54 0.64 -1.66 0.00 0.00 0.00 175.10 174.74 2cxt s TRP 380 N -0.48 -0.01 0.00 5.22 1.48 -0.91 -4.80 118.94 119.44 2cxt s TRP 380 Ca 0.14 -0.41 0.00 0.00 -1.06 0.00 0.00 56.10 54.76 2cxt s TRP 380 Cb -0.12 0.53 0.00 0.00 -1.16 0.00 0.00 33.47 32.72 2cxt s TRP 380 CO 0.03 -1.15 0.00 0.41 -4.06 0.00 0.00 176.95 172.18 2cxt n GLY 381 N -0.43 3.20 3.17 3.67 0.00 -1.26 -0.81 105.19 112.73 2cxt n GLY 381 Ca -0.03 -1.14 -0.12 0.00 0.00 0.00 0.00 46.02 44.72 2cxt n GLY 381 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cxt s GLU 382 N -2.21 0.84 0.44 1.61 0.41 -1.25 -4.86 118.70 113.67 2cxt s GLU 382 Ca 0.00 -1.27 -0.25 0.00 -0.41 0.00 0.00 54.97 53.04 2cxt s GLU 382 Cb 0.00 -0.32 -0.08 0.00 -1.78 0.00 0.00 34.13 31.94 2cxt s GLU 382 CO 0.00 0.02 1.39 -2.14 -0.49 0.00 0.00 175.26 174.04 2cxt s PRO 383 N -3.43 3.74 0.41 0.39 0.02 -1.26 -4.38 135.00 130.48 2cxt s PRO 383 Ca 0.09 2.34 -0.23 0.00 0.02 0.00 0.00 61.00 63.22 2cxt s PRO 383 Cb 0.02 -2.66 -0.10 0.00 0.02 0.00 0.00 34.50 31.78 2cxt s PRO 383 CO -0.03 -0.74 0.99 0.20 -0.33 0.00 0.00 177.00 177.09 2cxt s GLY 384 N -0.59 2.59 0.00 0.52 0.00 -0.46 -2.20 107.32 107.18 2cxt s GLY 384 Ca 0.60 0.55 0.28 0.00 0.00 0.00 0.00 44.72 46.15 2cxt s GLY 384 CO 0.54 0.91 1.73 -1.30 0.00 0.00 0.00 173.10 174.97 2cxt n THR 385 N -0.30 0.00 -0.26 0.90 -2.24 -1.26 -3.77 114.28 107.35 2cxt n THR 385 Ca 0.06 -0.25 0.04 0.00 -2.27 0.00 0.00 64.05 61.64 2cxt n THR 385 Cb 0.52 0.51 0.18 0.00 -2.10 0.00 0.00 70.33 69.43 2cxt n THR 385 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 2cxt h ASN 386 N 2.31 0.37 -0.49 3.42 4.21 -1.81 -0.12 115.58 123.48 2cxt h ASN 386 Ca 0.00 0.09 0.11 0.00 1.21 0.00 0.00 56.30 57.71 2cxt h ASN 386 Cb 0.51 0.04 -0.02 0.00 -1.12 0.00 0.00 38.32 37.73 2cxt h ASN 386 CO 0.00 0.17 0.34 1.23 -1.29 0.00 0.00 177.43 177.88 2cxt h GLY 387 N 0.51 0.23 1.86 2.83 0.00 -1.73 -0.72 103.07 106.05 2cxt h GLY 387 Ca 0.40 -0.06 0.02 0.00 0.00 0.00 0.00 47.33 47.69 2cxt h GLY 387 CO -0.36 0.04 0.05 1.46 0.00 0.00 0.00 176.54 177.73 2cxt h GLN 388 N 0.16 0.00 -0.62 4.80 4.20 -1.32 -1.21 115.11 121.12 2cxt h GLN 388 Ca 0.23 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.94 2cxt h GLN 388 Cb 0.70 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.48 2cxt h GLN 388 CO -0.03 0.00 0.00 0.72 -0.67 0.00 0.00 178.83 178.85 2cxt n HIS 389 N -4.34 1.22 0.05 2.96 8.25 -0.29 -4.36 115.22 118.72 2cxt n HIS 389 Ca -0.01 -0.59 0.00 0.00 -0.26 0.00 0.00 57.72 56.86 2cxt n HIS 389 Cb 0.16 -0.16 0.00 0.00 1.12 0.00 0.00 29.99 31.10 2cxt n HIS 389 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2cxt n ALA 390 N 1.11 3.00 -0.23 -1.41 0.00 -0.55 -5.00 120.51 117.43 2cxt n ALA 390 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 2cxt n ALA 390 Cb 0.78 0.15 0.00 0.00 0.00 0.00 0.00 19.45 20.37 2cxt n ALA 390 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 2cxt n PHE 391 N -3.22 0.00 0.30 0.00 1.16 -0.64 -4.72 117.46 110.34 2cxt n PHE 391 Ca 0.00 0.00 0.18 0.00 -1.87 0.00 0.00 57.45 55.76 2cxt n PHE 391 Cb 0.00 0.00 0.93 0.00 -1.61 0.00 0.00 39.48 38.80 2cxt n PHE 391 CO 0.00 0.00 0.00 1.88 -1.87 0.00 0.00 176.76 176.77 2cxt h TYR 392 N 0.00 0.00 -0.74 2.97 -1.99 -1.68 -1.03 116.97 114.49 2cxt h TYR 392 Ca 0.00 0.00 0.15 0.00 2.00 0.00 0.00 58.73 60.88 2cxt h TYR 392 Cb 0.12 0.00 -0.10 0.00 2.00 0.00 0.00 36.73 38.74 2cxt h TYR 392 CO 0.00 0.03 0.23 0.37 -0.00 0.00 0.00 178.16 178.79 2cxt h GLN 393 N 0.00 0.33 -0.18 4.88 5.75 -1.84 0.80 115.11 124.84 2cxt h GLN 393 Ca -0.00 -0.02 -0.19 0.00 -0.15 0.00 0.00 58.65 58.29 2cxt h GLN 393 Cb 0.22 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 28.70 2cxt h GLN 393 CO 0.00 0.22 -0.65 1.25 -2.65 0.00 0.00 178.83 177.01 2cxt h LEU 394 N 0.34 0.77 -0.82 -2.39 6.46 -1.55 0.53 115.31 118.65 2cxt h LEU 394 Ca 0.42 -0.45 -0.05 0.00 -0.12 0.00 0.00 57.88 57.67 2cxt h LEU 394 Cb 0.68 -0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 40.35 2cxt h LEU 394 CO -0.46 1.22 0.29 0.40 -0.62 0.00 0.00 178.44 179.26 2cxt h ILE 395 N 0.49 1.26 0.11 4.05 2.04 -1.21 0.94 117.51 125.19 2cxt h ILE 395 Ca -0.01 -0.84 -0.30 0.00 1.00 0.00 0.00 64.86 64.71 2cxt h ILE 395 Cb 1.24 0.36 0.03 0.00 -0.74 0.00 0.00 36.82 37.70 2cxt h ILE 395 CO 0.13 0.34 -1.23 0.45 0.00 0.00 0.00 178.15 177.83 2cxt h HIS 396 N 1.13 0.99 0.00 1.37 3.86 -0.76 -3.41 115.15 118.32 2cxt h HIS 396 Ca 0.25 -0.62 0.00 0.00 -1.16 0.00 0.00 60.37 58.85 2cxt h HIS 396 Cb 0.24 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.63 2cxt h HIS 396 CO 0.02 1.46 -0.11 1.04 0.86 0.00 0.00 177.93 181.20 2cxt n GLN 397 N -3.78 0.94 -0.12 2.45 6.02 0.17 -4.61 117.38 118.44 2cxt n GLN 397 Ca -0.13 -1.15 0.00 0.00 -0.01 0.00 0.00 57.00 55.71 2cxt n GLN 397 Cb 0.98 -0.76 0.00 0.00 1.02 0.00 0.00 30.24 31.48 2cxt n GLN 397 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2cxt n GLY 398 N -0.32 0.07 0.49 1.08 0.00 0.32 -4.94 105.19 101.89 2cxt n GLY 398 Ca 0.02 -1.79 0.06 0.00 0.00 0.00 0.00 46.02 44.31 2cxt n GLY 398 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cxt n THR 399 N -0.59 1.57 -4.68 2.61 -2.24 -1.26 -5.00 114.28 104.68 2cxt n THR 399 Ca 0.00 -1.52 -0.33 0.00 -2.27 0.00 0.00 64.05 59.93 2cxt n THR 399 Cb 0.00 0.12 -0.12 0.00 -2.10 0.00 0.00 70.33 68.24 2cxt n THR 399 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2cxt s LYS 400 N -1.93 2.60 -0.18 -0.78 3.01 -1.26 -5.10 119.74 116.11 2cxt s LYS 400 Ca 0.26 -0.65 -0.20 0.00 -1.01 0.00 0.00 55.97 54.38 2cxt s LYS 400 Cb 0.20 -2.49 -0.03 0.00 -1.01 0.00 0.00 37.83 34.50 2cxt s LYS 400 CO 0.08 0.64 0.59 1.41 0.51 0.00 0.00 175.35 178.57 2cxt s MET 401 N -0.92 4.24 -0.33 1.68 -2.45 -1.26 -4.95 119.30 115.32 2cxt s MET 401 Ca 0.13 0.56 -0.01 0.00 -1.25 0.00 0.00 55.69 55.13 2cxt s MET 401 Cb -0.11 -3.54 0.11 0.00 1.25 0.00 0.00 34.83 32.54 2cxt s MET 401 CO 0.02 -0.13 0.13 0.42 1.05 0.00 0.00 175.02 176.51 2cxt s ILE 402 N 1.56 0.73 0.23 10.11 1.01 -1.26 -4.69 121.20 128.89 2cxt s ILE 402 Ca 0.28 -1.46 -0.32 0.00 0.00 0.00 0.00 60.65 59.15 2cxt s ILE 402 Cb -0.16 -1.55 -0.12 0.00 0.01 0.00 0.00 42.46 40.64 2cxt s ILE 402 CO 0.11 -0.74 1.61 -2.65 0.00 0.00 0.00 174.94 173.27 2cxt n PRO 403 N 4.69 2.53 -4.78 2.79 -0.02 -1.26 -4.82 135.00 134.13 2cxt n PRO 403 Ca -0.00 0.91 -0.26 0.00 -2.02 0.00 0.00 63.50 62.13 2cxt n PRO 403 Cb 0.41 -2.69 -0.16 0.00 -0.02 0.00 0.00 33.50 31.04 2cxt n PRO 403 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2cxt s ASP 405 N 0.13 5.75 -0.21 0.00 1.01 0.15 -0.96 116.67 122.54 2cxt s ASP 405 Ca -0.05 -0.23 -0.13 0.00 0.71 0.00 0.00 52.55 52.85 2cxt s ASP 405 Cb -0.12 -2.06 -0.04 0.00 1.01 0.00 0.00 42.92 41.71 2cxt s ASP 405 CO 0.02 -0.11 0.28 -0.36 0.21 0.00 0.00 175.17 175.22 2cxt s PHE 406 N 1.70 3.37 0.01 4.23 0.40 0.11 -0.35 117.98 127.44 2cxt s PHE 406 Ca 0.06 0.46 0.07 0.00 -0.60 0.00 0.00 56.93 56.91 2cxt s PHE 406 Cb -0.16 -2.39 -0.02 0.00 0.51 0.00 0.00 43.02 40.96 2cxt s PHE 406 CO 0.08 0.07 -0.20 -0.51 0.70 0.00 0.00 175.22 175.36 2cxt s LEU 407 N 1.05 2.10 -0.22 -0.37 1.02 -0.96 0.18 118.68 121.47 2cxt s LEU 407 Ca 0.14 -0.43 -0.26 0.00 0.02 0.00 0.00 54.13 53.59 2cxt s LEU 407 Cb -0.14 -0.98 0.07 0.00 0.02 0.00 0.00 46.19 45.16 2cxt s LEU 407 CO 0.06 0.20 0.73 -0.51 0.02 0.00 0.00 176.35 176.84 2cxt s ILE 408 N -0.63 0.00 0.19 -0.59 2.07 -0.70 0.54 121.20 122.08 2cxt s ILE 408 Ca 0.07 0.00 -0.27 0.00 -1.41 0.00 0.00 60.65 59.04 2cxt s ILE 408 Cb -0.08 -1.00 -0.08 0.00 0.13 0.00 0.00 42.46 41.43 2cxt s ILE 408 CO 0.00 0.00 0.85 -2.16 -1.91 0.00 0.00 174.94 171.72 2cxt s PRO 409 N 0.04 4.69 0.14 3.50 0.04 -1.26 -2.01 135.00 140.15 2cxt s PRO 409 Ca -0.02 1.30 -0.13 0.00 0.04 0.00 0.00 61.00 62.18 2cxt s PRO 409 Cb -0.04 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 31.23 2cxt s PRO 409 CO 0.03 0.53 1.60 0.28 0.04 0.00 0.00 177.00 179.47 2cxt h VAL 410 N 3.31 1.26 -3.32 -0.36 2.07 -0.21 -3.42 116.25 115.57 2cxt h VAL 410 Ca -0.46 -1.00 -0.61 0.00 0.82 0.00 0.00 66.70 65.45 2cxt h VAL 410 Cb 1.20 1.01 -0.14 0.00 -1.52 0.00 0.00 31.29 31.85 2cxt h VAL 410 CO 0.67 0.35 -0.52 -1.10 0.02 0.00 0.00 177.57 176.99 2cxt s GLN 411 N -5.07 4.10 0.33 1.57 -0.21 0.18 -5.02 119.66 115.54 2cxt s GLN 411 Ca -0.13 -0.27 -0.11 0.00 0.02 0.00 0.00 55.36 54.87 2cxt s GLN 411 Cb 0.11 -3.36 -0.07 0.00 1.00 0.00 0.00 33.01 30.68 2cxt s GLN 411 CO 0.80 0.26 0.69 -0.08 -2.12 0.00 0.00 175.29 174.85 2cxt s THR 412 N 0.46 4.80 -0.27 -0.19 -1.32 -1.26 -4.46 115.64 113.40 2cxt s THR 412 Ca 0.06 0.64 0.28 0.00 -1.21 0.00 0.00 61.69 61.46 2cxt s THR 412 Cb -0.12 -3.67 0.33 0.00 -1.51 0.00 0.00 72.50 67.54 2cxt s THR 412 CO -0.00 -0.30 1.81 1.56 -2.21 0.00 0.00 174.62 175.47 2cxt h GLN 413 N 1.87 0.00 -2.45 7.08 1.08 -1.98 -3.38 115.11 117.32 2cxt h GLN 413 Ca -0.47 0.00 -0.59 0.00 -1.45 0.00 0.00 58.65 56.13 2cxt h GLN 413 Cb 1.18 0.00 -0.39 0.00 -0.05 0.00 0.00 27.48 28.22 2cxt h GLN 413 CO 0.66 0.00 -0.87 0.72 -0.95 0.00 0.00 178.83 178.38 2cxt n HIS 414 N -2.78 0.56 -1.01 2.96 8.25 -1.26 -5.01 115.22 116.92 2cxt n HIS 414 Ca 0.02 -3.66 -0.22 0.00 -0.26 0.00 0.00 57.72 53.60 2cxt n HIS 414 Cb 0.36 -0.13 -0.09 0.00 1.12 0.00 0.00 29.99 31.25 2cxt n HIS 414 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2cxt n PRO 415 N 2.20 2.51 -1.64 -0.41 -0.04 -1.26 -4.91 135.00 131.45 2cxt n PRO 415 Ca 0.26 -1.44 -0.34 0.00 -0.04 0.00 0.00 63.50 61.94 2cxt n PRO 415 Cb 0.45 -2.32 0.07 0.00 -0.04 0.00 0.00 33.50 31.66 2cxt n PRO 415 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2cxt s ILE 416 N 1.88 2.57 -1.39 0.52 -4.36 -1.26 -3.13 121.20 116.03 2cxt s ILE 416 Ca 0.60 0.29 -0.02 0.00 -0.26 0.00 0.00 60.65 61.27 2cxt s ILE 416 Cb 0.22 -2.90 0.01 0.00 1.25 0.00 0.00 42.46 41.04 2cxt s ILE 416 CO -0.03 -0.13 0.56 0.54 0.24 0.00 0.00 174.94 176.12 2cxt n ARG 417 N -2.38 -3.98 -2.44 0.37 1.74 -1.26 -1.49 116.66 107.22 2cxt n ARG 417 Ca 0.13 0.49 -0.16 0.00 -0.77 0.00 0.00 57.85 57.54 2cxt n ARG 417 Cb 0.50 -4.84 -0.01 0.00 -1.02 0.00 0.00 32.46 27.10 2cxt n ARG 417 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2cxt n LYS 418 N -4.37 -2.05 -0.53 5.56 5.02 -1.24 -1.93 118.16 118.62 2cxt n LYS 418 Ca -0.27 0.77 0.00 0.00 -2.02 0.00 0.00 58.31 56.79 2cxt n LYS 418 Cb 0.67 -5.40 0.00 0.00 -0.02 0.00 0.00 35.03 30.28 2cxt n LYS 418 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2cxt n GLY 419 N -0.90 0.73 0.09 0.72 0.00 -0.55 -4.99 105.19 100.29 2cxt n GLY 419 Ca -0.19 -0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.66 2cxt n GLY 419 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2cxt h LEU 420 N 0.00 0.14 -0.68 0.99 5.85 -1.31 -1.04 115.31 119.25 2cxt h LEU 420 Ca 0.00 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.73 2cxt h LEU 420 Cb 0.00 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 2cxt h LEU 420 CO 0.00 0.10 0.45 0.45 -0.34 0.00 0.00 178.44 179.10 2cxt h HIS 421 N 0.18 0.86 -0.12 1.25 3.86 -1.85 -2.17 115.15 117.17 2cxt h HIS 421 Ca 0.06 0.02 -0.14 0.00 -1.16 0.00 0.00 60.37 59.15 2cxt h HIS 421 Cb -0.00 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.17 2cxt h HIS 421 CO -0.08 0.55 -0.54 1.25 0.86 0.00 0.00 177.93 179.97 2cxt h HIS 422 N 0.93 0.42 -0.37 2.45 -0.00 -1.82 -0.17 115.15 116.58 2cxt h HIS 422 Ca 0.25 -0.15 0.05 0.00 -0.00 0.00 0.00 60.37 60.52 2cxt h HIS 422 Cb -0.10 -0.08 -0.04 0.00 -0.00 0.00 0.00 27.41 27.18 2cxt h HIS 422 CO -0.02 0.80 0.12 -0.22 -0.00 0.00 0.00 177.93 178.60 2cxt h LYS 423 N 0.26 0.25 -0.44 5.26 3.64 -1.00 0.89 116.57 125.44 2cxt h LYS 423 Ca 0.00 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.31 2cxt h LYS 423 Cb 1.03 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.78 2cxt h LYS 423 CO 0.09 0.17 0.05 0.82 -2.27 0.00 0.00 179.45 178.30 2cxt h ILE 424 N 0.26 1.25 -0.21 2.00 2.04 -1.03 -0.81 117.51 121.01 2cxt h ILE 424 Ca 0.17 -0.94 0.03 0.00 1.00 0.00 0.00 64.86 65.11 2cxt h ILE 424 Cb 0.16 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 2cxt h ILE 424 CO -0.19 0.33 0.04 0.25 0.00 0.00 0.00 178.15 178.58 2cxt h LEU 425 N 0.59 0.02 -0.62 1.44 5.85 -0.70 -1.39 115.31 120.50 2cxt h LEU 425 Ca 0.13 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.88 2cxt h LEU 425 Cb 0.42 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 2cxt h LEU 425 CO 0.01 0.04 0.38 -0.07 -0.34 0.00 0.00 178.44 178.47 2cxt h LEU 426 N 0.13 0.74 -0.84 2.25 3.38 -0.70 -1.24 115.31 119.03 2cxt h LEU 426 Ca 0.10 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2cxt h LEU 426 Cb 0.09 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 2cxt h LEU 426 CO -0.12 0.57 0.50 0.00 0.09 0.00 0.00 178.44 179.48 2cxt h ALA 427 N 1.20 1.07 -0.55 1.53 0.00 -0.85 -1.04 119.26 120.62 2cxt h ALA 427 Ca 0.22 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 2cxt h ALA 427 Cb -0.04 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 2cxt h ALA 427 CO -0.04 0.54 0.08 -0.91 0.00 0.00 0.00 179.25 178.92 2cxt h ASN 428 N 1.16 0.88 -0.38 0.00 2.35 -1.02 -0.48 115.58 118.09 2cxt h ASN 428 Ca 0.30 -0.26 0.04 0.00 -0.55 0.00 0.00 56.30 55.83 2cxt h ASN 428 Cb -0.03 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.06 2cxt h ASN 428 CO -0.06 0.92 0.15 0.15 -1.65 0.00 0.00 177.43 176.95 2cxt h PHE 429 N 0.81 0.28 -0.25 1.19 3.57 -0.73 -0.73 116.94 121.08 2cxt h PHE 429 Ca 0.17 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.58 2cxt h PHE 429 Cb 0.42 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.09 2cxt h PHE 429 CO 0.03 0.12 -0.24 -0.07 -2.23 0.00 0.00 178.31 175.92 2cxt h LEU 430 N 0.32 0.64 -0.93 0.59 3.38 -1.13 -3.27 115.31 114.91 2cxt h LEU 430 Ca 0.17 -0.47 -0.09 0.00 0.09 0.00 0.00 57.88 57.58 2cxt h LEU 430 Cb 0.13 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2cxt h LEU 430 CO -0.16 0.98 -0.14 0.00 0.09 0.00 0.00 178.44 179.21 2cxt h ALA 431 N 0.68 1.10 -0.27 1.53 0.00 -0.84 -2.38 119.26 119.08 2cxt h ALA 431 Ca 0.04 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 2cxt h ALA 431 Cb 0.80 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2cxt h ALA 431 CO 0.06 0.56 0.02 1.96 0.00 0.00 0.00 179.25 181.85 2cxt h GLN 432 N 0.56 0.47 -0.23 0.00 1.08 -1.19 0.17 115.11 115.98 2cxt h GLN 432 Ca 0.10 -0.14 -0.13 0.00 -1.45 0.00 0.00 58.65 57.02 2cxt h GLN 432 Cb 0.57 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.95 2cxt h GLN 432 CO 0.04 0.61 -0.42 1.79 -0.95 0.00 0.00 178.83 179.90 2cxt h THR 433 N 0.26 1.30 -0.47 -0.54 1.35 -1.61 -0.39 112.91 112.81 2cxt h THR 433 Ca 0.08 -1.59 0.02 0.00 -0.55 0.00 0.00 66.41 64.37 2cxt h THR 433 Cb 0.39 1.58 -0.03 0.00 -1.73 0.00 0.00 68.15 68.36 2cxt h THR 433 CO 0.01 0.50 0.28 -0.08 -0.25 0.00 0.00 175.52 175.98 2cxt h GLU 434 N 0.44 0.54 -0.54 4.72 4.81 -1.29 -1.67 114.58 121.59 2cxt h GLU 434 Ca 0.04 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 2cxt h GLU 434 Cb 0.91 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.15 2cxt h GLU 434 CO 0.08 0.36 0.14 0.00 -0.73 0.00 0.00 179.01 178.86 2cxt h ALA 435 N 1.21 0.71 -0.68 2.92 0.00 -0.33 -0.24 119.26 122.84 2cxt h ALA 435 Ca 0.19 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2cxt h ALA 435 Cb 0.02 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2cxt h ALA 435 CO -0.09 0.40 0.34 -0.07 0.00 0.00 0.00 179.25 179.84 2cxt h LEU 436 N 0.76 0.86 0.08 0.00 3.38 -0.93 -0.02 115.31 119.42 2cxt h LEU 436 Ca 0.17 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2cxt h LEU 436 Cb 0.33 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2cxt h LEU 436 CO 0.00 0.71 -0.04 -0.03 0.09 0.00 0.00 178.44 179.18 2cxt h MET 437 N 0.96 -0.10 0.06 1.13 4.05 -1.06 -0.35 114.93 119.62 2cxt h MET 437 Ca 0.24 0.01 -0.25 0.00 -0.28 0.00 0.00 59.70 59.42 2cxt h MET 437 Cb 0.07 0.02 0.02 0.00 -0.80 0.00 0.00 31.60 30.91 2cxt h MET 437 CO -0.03 0.44 -1.00 0.87 0.23 0.00 0.00 176.91 177.41 2cxt h LYS 438 N -0.76 0.57 0.00 0.39 1.57 -0.95 -0.69 116.57 116.71 2cxt h LYS 438 Ca -0.01 -0.70 0.00 0.00 -1.87 0.00 0.00 60.65 58.07 2cxt h LYS 438 Cb 0.59 0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.12 2cxt h LYS 438 CO 0.02 1.29 0.00 0.41 -0.57 0.00 0.00 179.45 180.60 2cxt n GLY 439 N 1.25 0.32 2.89 3.86 0.00 -0.03 -4.63 105.19 108.85 2cxt n GLY 439 Ca -0.12 -0.95 -0.15 0.00 0.00 0.00 0.00 46.02 44.80 2cxt n GLY 439 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2cxt s LYS 440 N 0.00 0.07 0.55 1.61 2.20 -0.14 -4.90 119.74 119.12 2cxt s LYS 440 Ca 0.00 0.55 -0.16 0.00 -0.36 0.00 0.00 55.97 56.00 2cxt s LYS 440 Cb 0.00 -0.21 -0.06 0.00 -1.51 0.00 0.00 37.83 36.05 2cxt s LYS 440 CO 0.00 -0.27 1.01 -0.51 -0.36 0.00 0.00 175.35 175.22 2cxt s LEU 441 N 2.02 3.55 0.30 5.43 1.43 -1.26 -1.89 118.68 128.26 2cxt s LEU 441 Ca -0.00 1.63 0.05 0.00 -1.03 0.00 0.00 54.13 54.78 2cxt s LEU 441 Cb -0.12 -4.51 0.73 0.00 0.03 0.00 0.00 46.19 42.32 2cxt s LEU 441 CO -0.06 -0.79 1.77 -0.65 0.23 0.00 0.00 176.35 176.85 2cxt h PRO 442 N 0.67 0.69 -0.13 1.29 0.11 -1.95 -1.02 132.00 131.65 2cxt h PRO 442 Ca -0.47 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 2cxt h PRO 442 Cb 1.20 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 2cxt h PRO 442 CO 0.60 0.46 -0.12 1.05 -0.21 0.00 0.00 178.00 179.78 2cxt h GLU 443 N 0.71 0.21 -0.01 1.05 9.09 -1.99 0.14 114.58 123.78 2cxt h GLU 443 Ca 0.57 -0.04 -0.09 0.00 0.05 0.00 0.00 59.36 59.85 2cxt h GLU 443 Cb 0.91 -0.03 0.01 0.00 -1.65 0.00 0.00 28.75 27.99 2cxt h GLU 443 CO -0.40 0.34 -0.33 0.93 0.05 0.00 0.00 179.01 179.60 2cxt h GLU 444 N 0.20 0.24 -0.52 1.06 5.08 -1.61 -3.15 114.58 115.88 2cxt h GLU 444 Ca 0.04 -0.25 -0.07 0.00 -1.00 0.00 0.00 59.36 58.08 2cxt h GLU 444 Cb 0.35 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 2cxt h GLU 444 CO 0.02 0.96 0.04 0.00 -1.00 0.00 0.00 179.01 179.03 2cxt h ALA 445 N 0.28 1.09 -0.56 3.43 0.00 -1.06 -2.91 119.26 119.53 2cxt h ALA 445 Ca -0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 2cxt h ALA 445 Cb 1.07 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 2cxt h ALA 445 CO 0.07 0.58 0.31 -0.09 0.00 0.00 0.00 179.25 180.12 2cxt h ARG 446 N 0.80 0.78 -0.51 0.00 2.43 -0.80 -1.31 114.38 115.77 2cxt h ARG 446 Ca 0.16 -0.09 -0.07 0.00 -0.81 0.00 0.00 59.98 59.17 2cxt h ARG 446 Cb 0.42 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 2cxt h ARG 446 CO 0.01 0.60 0.03 0.87 -1.51 0.00 0.00 179.97 179.98 2cxt h LYS 447 N 0.75 0.83 -0.52 0.20 1.57 -1.49 -0.35 116.57 117.56 2cxt h LYS 447 Ca 0.20 -0.21 -0.05 0.00 -1.87 0.00 0.00 60.65 58.72 2cxt h LYS 447 Cb 0.05 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 2cxt h LYS 447 CO -0.03 0.81 0.14 0.93 -0.57 0.00 0.00 179.45 180.73 2cxt h GLU 448 N 0.78 0.83 -0.63 3.15 5.08 -1.27 -0.53 114.58 121.98 2cxt h GLU 448 Ca 0.16 -0.19 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 2cxt h GLU 448 Cb 0.42 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.53 2cxt h GLU 448 CO 0.01 0.78 0.23 -0.07 -1.00 0.00 0.00 179.01 178.96 2cxt h LEU 449 N 0.73 0.89 -0.34 1.33 -0.00 -0.93 -1.85 115.31 115.15 2cxt h LEU 449 Ca 0.17 -0.19 -0.00 0.00 -0.00 0.00 0.00 57.88 57.86 2cxt h LEU 449 Cb 0.31 -0.23 -0.02 0.00 -0.00 0.00 0.00 40.66 40.72 2cxt h LEU 449 CO -0.00 0.84 0.21 1.56 -0.00 0.00 0.00 178.44 181.05 2cxt h GLN 450 N 0.90 0.46 0.00 1.13 1.08 -0.84 -2.59 115.11 115.25 2cxt h GLN 450 Ca 0.21 -0.04 -0.04 0.00 -1.45 0.00 0.00 58.65 57.32 2cxt h GLN 450 Cb 0.24 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 2cxt h GLN 450 CO -0.01 0.34 -0.21 0.00 -0.95 0.00 0.00 178.83 178.00 2cxt h ALA 451 N 1.09 1.26 0.00 3.87 0.00 -0.98 -2.50 119.26 121.99 2cxt h ALA 451 Ca 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2cxt h ALA 451 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2cxt h ALA 451 CO -0.02 0.26 0.00 0.00 0.00 0.00 0.00 179.25 179.49 2cxt n ALA 452 N -2.32 2.62 -1.45 0.00 0.00 -0.71 -4.89 120.51 113.76 2cxt n ALA 452 Ca -0.01 -0.17 -0.04 0.00 0.00 0.00 0.00 53.44 53.21 2cxt n ALA 452 Cb 0.32 -1.44 -0.01 0.00 0.00 0.00 0.00 19.45 18.32 2cxt n ALA 452 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cxt n GLY 453 N 0.87 0.53 3.75 0.00 0.00 -0.94 -5.01 105.19 104.38 2cxt n GLY 453 Ca 0.21 -0.82 -0.41 0.00 0.00 0.00 0.00 46.02 45.00 2cxt n GLY 453 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cxt s LYS 454 N -2.99 4.50 0.73 1.61 -0.14 -1.08 -5.02 119.74 117.36 2cxt s LYS 454 Ca 0.00 1.92 -0.14 0.00 -1.36 0.00 0.00 55.97 56.39 2cxt s LYS 454 Cb 0.00 -3.19 0.04 0.00 -1.68 0.00 0.00 37.83 33.00 2cxt s LYS 454 CO 0.00 -0.03 1.16 -1.54 -0.76 0.00 0.00 175.35 174.18 2cxt s SER 455 N -0.24 4.38 0.32 2.83 1.04 -1.26 -4.70 113.70 116.07 2cxt s SER 455 Ca 0.50 2.17 0.07 0.00 0.48 0.00 0.00 55.95 59.17 2cxt s SER 455 Cb -0.34 -2.57 0.75 0.00 0.10 0.00 0.00 66.02 63.97 2cxt s SER 455 CO 0.41 -2.13 1.82 -0.65 0.98 0.00 0.00 173.24 173.67 2cxt h PRO 456 N -0.44 0.74 -0.14 4.02 0.11 -1.98 0.28 132.00 134.58 2cxt h PRO 456 Ca -0.46 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 2cxt h PRO 456 Cb 1.27 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 2cxt h PRO 456 CO 0.50 0.49 0.01 1.49 -0.21 0.00 0.00 178.00 180.28 2cxt h GLU 457 N 0.76 0.24 -0.62 1.05 4.81 -2.00 -2.15 114.58 116.67 2cxt h GLU 457 Ca 0.52 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 59.59 2cxt h GLU 457 Cb 0.79 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.13 2cxt h GLU 457 CO -0.29 0.46 0.06 -0.44 -0.73 0.00 0.00 179.01 178.07 2cxt h ASP 458 N -0.01 1.03 -0.20 1.04 3.32 -1.71 -2.43 116.42 117.47 2cxt h ASP 458 Ca 0.04 -0.28 0.01 0.00 0.02 0.00 0.00 57.03 56.82 2cxt h ASP 458 Cb 0.34 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 2cxt h ASP 458 CO 0.01 1.05 0.10 0.25 -1.72 0.00 0.00 179.24 178.93 2cxt h LEU 459 N 0.97 0.15 -0.71 1.55 6.46 -0.50 -0.99 115.31 122.24 2cxt h LEU 459 Ca 0.18 0.01 0.04 0.00 -0.12 0.00 0.00 57.88 57.99 2cxt h LEU 459 Cb 0.49 -0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 40.35 2cxt h LEU 459 CO 0.02 0.12 0.43 -0.08 -0.62 0.00 0.00 178.44 178.31 2cxt h GLU 460 N 0.22 0.81 -0.32 1.25 4.81 -1.22 -0.74 114.58 119.38 2cxt h GLU 460 Ca 0.08 -0.05 -0.15 0.00 -0.13 0.00 0.00 59.36 59.12 2cxt h GLU 460 Cb 0.02 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.21 2cxt h GLU 460 CO -0.06 0.53 -0.37 0.87 -0.73 0.00 0.00 179.01 179.26 2cxt h LYS 461 N 0.83 0.82 0.00 1.92 1.57 -1.22 -3.28 116.57 117.21 2cxt h LYS 461 Ca 0.30 -0.45 -0.18 0.00 -1.87 0.00 0.00 60.65 58.45 2cxt h LYS 461 Cb 0.08 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 2cxt h LYS 461 CO -0.13 1.08 -0.85 -0.07 -0.57 0.00 0.00 179.45 178.91 2cxt h LEU 462 N 0.59 0.00 -0.33 2.94 4.07 -0.98 -3.40 115.31 118.20 2cxt h LEU 462 Ca 0.05 0.00 0.06 0.00 0.08 0.00 0.00 57.88 58.06 2cxt h LEU 462 Cb 0.96 0.00 -0.08 0.00 1.08 0.00 0.00 40.66 42.61 2cxt h LEU 462 CO 0.09 0.85 -0.45 0.25 -1.08 0.00 0.00 178.44 178.10 2cxt h LEU 463 N 0.00 -1.47 -2.21 1.67 5.85 -1.19 -1.19 115.31 116.77 2cxt h LEU 463 Ca -0.01 0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.92 2cxt h LEU 463 Cb 1.59 0.62 -0.00 0.00 0.37 0.00 0.00 40.66 43.24 2cxt h LEU 463 CO 0.11 -0.39 -0.01 1.55 -0.34 0.00 0.00 178.44 179.36 2cxt h PRO 464 N -0.39 0.00 0.00 5.25 0.13 -1.80 -0.53 132.00 134.66 2cxt h PRO 464 Ca 0.11 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.21 2cxt h PRO 464 Cb 0.60 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.73 2cxt h PRO 464 CO -0.53 0.01 -0.14 0.45 -0.23 0.00 0.00 178.00 177.56 2cxt h HIS 465 N 0.00 0.00 -0.01 1.56 3.86 -1.48 -3.10 115.15 115.99 2cxt h HIS 465 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2cxt h HIS 465 Cb 0.01 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.48 2cxt h HIS 465 CO 0.00 0.14 -0.56 1.63 0.86 0.00 0.00 177.93 180.00 2cxt n LYS 466 N -3.39 0.74 -3.03 2.45 4.76 -0.22 -4.92 118.16 114.55 2cxt n LYS 466 Ca -0.01 -0.57 -0.39 0.00 -2.87 0.00 0.00 58.31 54.47 2cxt n LYS 466 Cb 0.33 -1.49 -0.06 0.00 -1.84 0.00 0.00 35.03 31.97 2cxt n LYS 466 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2cxt s VAL 467 N -2.65 4.49 -0.20 -0.18 1.01 -1.14 -4.88 120.40 116.85 2cxt s VAL 467 Ca 0.16 1.61 -0.02 0.00 0.00 0.00 0.00 61.98 63.73 2cxt s VAL 467 Cb 0.18 -4.09 -0.00 0.00 0.00 0.00 0.00 36.38 32.46 2cxt s VAL 467 CO 0.64 0.51 -0.09 -0.36 0.00 0.00 0.00 175.10 175.80 2cxt s PHE 468 N -0.98 2.90 0.25 5.22 0.08 -0.79 -4.93 117.98 119.74 2cxt s PHE 468 Ca 0.35 -1.02 0.19 0.00 0.12 0.00 0.00 56.93 56.56 2cxt s PHE 468 Cb -0.22 -2.03 0.80 0.00 -0.57 0.00 0.00 43.02 41.00 2cxt s PHE 468 CO 0.24 -0.54 1.80 0.93 -0.10 0.00 0.00 175.22 177.55 2cxt h GLU 469 N 7.86 0.00 0.00 0.44 5.08 -1.82 -0.35 114.58 125.78 2cxt h GLU 469 Ca -0.40 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 2cxt h GLU 469 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2cxt h GLU 469 CO 0.60 0.34 0.00 0.41 -1.00 0.00 0.00 179.01 179.37 2cxt n GLY 470 N -0.05 0.81 2.41 -3.84 0.00 -1.26 -4.70 105.19 98.57 2cxt n GLY 470 Ca -0.01 -0.68 -0.20 0.00 0.00 0.00 0.00 46.02 45.13 2cxt n GLY 470 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2cxt n ASN 471 N -2.31 -5.56 -4.52 1.61 5.15 -0.26 -4.91 115.26 104.45 2cxt n ASN 471 Ca 0.00 0.08 -0.40 0.00 -0.60 0.00 0.00 54.58 53.67 2cxt n ASN 471 Cb 0.00 -4.63 -0.11 0.00 -0.53 0.00 0.00 39.78 34.51 2cxt n ASN 471 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2cxt s ARG 472 N -4.72 3.55 0.37 1.20 0.52 -0.18 -4.91 118.95 114.79 2cxt s ARG 472 Ca 0.00 -0.60 -0.23 0.00 -0.52 0.00 0.00 55.73 54.38 2cxt s ARG 472 Cb 0.00 -3.73 -0.10 0.00 0.52 0.00 0.00 34.95 31.64 2cxt s ARG 472 CO 0.00 -0.39 0.94 -1.25 0.02 0.00 0.00 175.30 174.62 2cxt s PRO 473 N 1.71 4.40 0.06 3.54 0.04 -1.26 -3.72 135.00 139.75 2cxt s PRO 473 Ca 0.06 1.20 -0.04 0.00 0.04 0.00 0.00 61.00 62.26 2cxt s PRO 473 Cb -0.17 -2.50 -0.02 0.00 0.04 0.00 0.00 34.50 31.85 2cxt s PRO 473 CO 0.10 0.13 0.05 0.95 0.04 0.00 0.00 177.00 178.27 2cxt s THR 474 N -1.89 0.18 -0.03 1.26 -4.23 -0.72 -3.67 115.64 106.53 2cxt s THR 474 Ca 0.56 -1.46 -0.01 0.00 -1.18 0.00 0.00 61.69 59.60 2cxt s THR 474 Cb -0.14 -1.28 -0.04 0.00 1.34 0.00 0.00 72.50 72.38 2cxt s THR 474 CO 0.18 -0.80 0.03 0.20 -0.54 0.00 0.00 174.62 173.69 2cxt s ASN 475 N -2.67 5.40 -0.20 3.99 0.02 -0.14 -4.05 114.94 117.30 2cxt s ASN 475 Ca 0.03 0.11 -0.01 0.00 -1.02 0.00 0.00 52.86 51.97 2cxt s ASN 475 Cb 0.04 -1.51 0.01 0.00 0.02 0.00 0.00 41.25 39.82 2cxt s ASN 475 CO -0.09 0.31 -0.14 -0.44 0.02 0.00 0.00 177.10 176.77 2cxt s SER 476 N -1.38 3.58 -0.30 -1.22 0.01 -0.43 -0.71 113.70 113.26 2cxt s SER 476 Ca 0.18 -0.57 -0.02 0.00 1.31 0.00 0.00 55.95 56.85 2cxt s SER 476 Cb -0.12 -1.58 0.05 0.00 0.21 0.00 0.00 66.02 64.58 2cxt s SER 476 CO 0.09 -0.01 -0.00 -0.63 0.41 0.00 0.00 173.24 173.09 2cxt s ILE 477 N 1.36 3.02 -0.05 1.44 1.01 0.13 -0.57 121.20 127.52 2cxt s ILE 477 Ca 0.05 -1.32 0.06 0.00 0.00 0.00 0.00 60.65 59.44 2cxt s ILE 477 Cb -0.14 -2.71 -0.01 0.00 0.01 0.00 0.00 42.46 39.61 2cxt s ILE 477 CO -0.09 -0.07 -0.24 -0.69 0.00 0.00 0.00 174.94 173.84 2cxt s VAL 478 N 1.27 1.98 0.04 2.92 1.01 -0.34 -1.72 120.40 125.56 2cxt s VAL 478 Ca -0.04 -1.03 -0.00 0.00 0.00 0.00 0.00 61.98 60.90 2cxt s VAL 478 Cb -0.19 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 2cxt s VAL 478 CO -0.01 0.55 -0.04 0.72 0.00 0.00 0.00 175.10 176.32 2cxt s PHE 479 N -0.20 0.43 0.16 5.22 -0.12 -0.85 0.48 117.98 123.10 2cxt s PHE 479 Ca -0.02 -0.76 -0.16 0.00 -0.05 0.00 0.00 56.93 55.94 2cxt s PHE 479 Cb -0.13 -0.30 0.09 0.00 -0.63 0.00 0.00 43.02 42.04 2cxt s PHE 479 CO 0.03 -0.25 1.72 1.15 -0.05 0.00 0.00 175.22 177.82 2cxt h THR 480 N 3.95 0.79 -1.83 -4.49 2.02 -1.68 0.30 112.91 111.98 2cxt h THR 480 Ca -0.33 -0.06 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 2cxt h THR 480 Cb 1.18 0.60 -0.21 0.00 -1.74 0.00 0.00 68.15 67.98 2cxt h THR 480 CO 0.52 0.03 0.31 -0.75 0.37 0.00 0.00 175.52 176.00 2cxt s LYS 481 N -6.17 0.84 -1.26 6.66 2.20 -1.26 -0.64 119.74 120.10 2cxt s LYS 481 Ca -0.13 0.36 -0.16 0.00 -0.36 0.00 0.00 55.97 55.68 2cxt s LYS 481 Cb 0.13 0.40 0.12 0.00 -1.51 0.00 0.00 37.83 36.97 2cxt s LYS 481 CO 0.71 -0.23 1.62 -0.11 -0.36 0.00 0.00 175.35 176.98 2cxt n LEU 482 N 1.22 5.20 -4.96 5.43 7.94 -1.26 -4.72 117.00 125.85 2cxt n LEU 482 Ca -0.15 -4.20 -0.23 0.00 -1.11 0.00 0.00 56.01 50.32 2cxt n LEU 482 Cb 0.57 -1.68 0.03 0.00 0.53 0.00 0.00 43.42 42.87 2cxt n LEU 482 CO 0.17 0.49 0.37 0.42 -1.11 0.00 0.00 177.39 177.73 2cxt s THR 483 N 2.83 3.26 0.20 1.96 -4.23 -1.26 -4.89 115.64 113.50 2cxt s THR 483 Ca 0.48 -0.49 -0.14 0.00 -1.18 0.00 0.00 61.69 60.36 2cxt s THR 483 Cb 0.01 -3.24 0.17 0.00 1.34 0.00 0.00 72.50 70.78 2cxt s THR 483 CO 0.04 -0.18 1.66 -0.65 -0.54 0.00 0.00 174.62 174.95 2cxt h PRO 484 N 0.12 0.06 0.13 3.99 0.11 -1.92 0.01 132.00 134.49 2cxt h PRO 484 Ca -0.44 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.67 2cxt h PRO 484 Cb 1.28 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 2cxt h PRO 484 CO 0.56 0.04 -0.16 0.35 -0.21 0.00 0.00 178.00 178.57 2cxt h PHE 485 N 0.06 -0.42 -0.68 0.65 3.57 -1.86 -1.42 116.94 116.84 2cxt h PHE 485 Ca 0.27 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.73 2cxt h PHE 485 Cb 0.42 0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.30 2cxt h PHE 485 CO -0.39 -0.25 0.24 0.82 -2.23 0.00 0.00 178.31 176.51 2cxt h ILE 486 N -0.34 1.25 -0.74 1.41 1.08 -1.77 -1.54 117.51 116.86 2cxt h ILE 486 Ca 0.01 -0.81 0.04 0.00 -0.39 0.00 0.00 64.86 63.71 2cxt h ILE 486 Cb 0.34 0.51 -0.05 0.00 -3.07 0.00 0.00 36.82 34.54 2cxt h ILE 486 CO -0.07 0.32 0.46 0.25 -0.69 0.00 0.00 178.15 178.42 2cxt h LEU 487 N 0.97 0.74 -0.55 1.44 5.85 -0.89 -0.71 115.31 122.16 2cxt h LEU 487 Ca 0.22 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.97 2cxt h LEU 487 Cb 0.25 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 2cxt h LEU 487 CO -0.01 0.50 0.35 1.23 -0.34 0.00 0.00 178.44 180.16 2cxt h GLY 488 N 0.88 0.78 1.00 3.75 0.00 -0.68 -0.93 103.07 107.86 2cxt h GLY 488 Ca 0.31 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 2cxt h GLY 488 CO -0.13 0.24 0.37 0.00 0.00 0.00 0.00 176.54 177.02 2cxt h ALA 489 N 1.23 0.81 -0.46 3.60 0.00 -0.81 -1.87 119.26 121.77 2cxt h ALA 489 Ca 0.21 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 2cxt h ALA 489 Cb -0.02 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2cxt h ALA 489 CO -0.08 0.31 0.09 -0.07 0.00 0.00 0.00 179.25 179.50 2cxt h LEU 490 N 0.87 0.71 -0.14 0.00 3.38 -0.66 -0.61 115.31 118.85 2cxt h LEU 490 Ca 0.23 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2cxt h LEU 490 Cb 0.00 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2cxt h LEU 490 CO -0.04 0.78 0.07 0.40 0.09 0.00 0.00 178.44 179.74 2cxt h ILE 491 N 0.62 1.12 -0.95 1.22 2.04 -1.12 -2.75 117.51 117.68 2cxt h ILE 491 Ca 0.14 -0.34 0.06 0.00 1.00 0.00 0.00 64.86 65.72 2cxt h ILE 491 Cb 0.36 1.08 -0.06 0.00 -0.74 0.00 0.00 36.82 37.46 2cxt h ILE 491 CO 0.01 0.11 0.62 0.00 0.00 0.00 0.00 178.15 178.88 2cxt h ALA 492 N 0.94 1.44 -0.44 1.87 0.00 -1.23 -0.90 119.26 120.95 2cxt h ALA 492 Ca 0.05 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.97 2cxt h ALA 492 Cb 0.11 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 2cxt h ALA 492 CO -0.01 0.43 0.21 1.98 0.00 0.00 0.00 179.25 181.86 2cxt h MET 493 N 1.13 0.41 -0.21 0.00 1.85 -0.91 -0.96 114.93 116.24 2cxt h MET 493 Ca 0.40 -0.02 -0.16 0.00 -0.61 0.00 0.00 59.70 59.31 2cxt h MET 493 Cb 0.13 -0.09 -0.01 0.00 0.43 0.00 0.00 31.60 32.07 2cxt h MET 493 CO -0.15 0.27 -0.51 1.88 -0.40 0.00 0.00 176.91 178.00 2cxt h TYR 494 N 0.42 0.72 -0.59 1.39 -1.99 -1.15 -1.31 116.97 114.45 2cxt h TYR 494 Ca 0.19 -0.24 0.10 0.00 2.00 0.00 0.00 58.73 60.78 2cxt h TYR 494 Cb 0.12 -0.14 -0.08 0.00 2.00 0.00 0.00 36.73 38.62 2cxt h TYR 494 CO -0.11 0.97 0.16 0.93 -0.00 0.00 0.00 178.16 180.12 2cxt h GLU 495 N 0.46 0.30 -0.01 4.88 5.08 -0.74 -1.01 114.58 123.54 2cxt h GLU 495 Ca 0.02 -0.02 -0.17 0.00 -1.00 0.00 0.00 59.36 58.19 2cxt h GLU 495 Cb 1.05 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 2cxt h GLU 495 CO 0.10 0.20 -0.77 0.45 -1.00 0.00 0.00 179.01 177.98 2cxt h HIS 496 N 0.31 0.11 -0.42 4.33 3.86 -0.99 -1.86 115.15 120.48 2cxt h HIS 496 Ca 0.31 -0.06 0.07 0.00 -1.16 0.00 0.00 60.37 59.53 2cxt h HIS 496 Cb 0.43 -0.01 -0.06 0.00 1.06 0.00 0.00 27.41 28.82 2cxt h HIS 496 CO -0.22 0.82 0.06 -0.22 0.86 0.00 0.00 177.93 179.23 2cxt h LYS 497 N 0.05 0.18 -0.73 2.45 3.64 -0.82 -0.43 116.57 120.91 2cxt h LYS 497 Ca -0.02 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.30 2cxt h LYS 497 Cb 1.36 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 33.11 2cxt h LYS 497 CO 0.11 0.12 0.24 0.82 -2.27 0.00 0.00 179.45 178.47 2cxt h ILE 498 N 0.18 1.26 -0.07 2.00 2.04 -0.94 -1.72 117.51 120.26 2cxt h ILE 498 Ca 0.21 -0.88 -0.00 0.00 1.00 0.00 0.00 64.86 65.19 2cxt h ILE 498 Cb 0.27 0.45 -0.00 0.00 -0.74 0.00 0.00 36.82 36.80 2cxt h ILE 498 CO -0.29 0.35 0.04 0.15 0.00 0.00 0.00 178.15 178.39 2cxt h PHE 499 N 1.07 0.09 -0.58 1.37 3.57 -1.02 -1.66 116.94 119.79 2cxt h PHE 499 Ca 0.24 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.74 2cxt h PHE 499 Cb 0.29 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.97 2cxt h PHE 499 CO 0.02 0.10 0.35 0.28 -2.23 0.00 0.00 178.31 176.84 2cxt h VAL 500 N 0.05 1.17 -0.71 1.41 2.07 -0.82 -1.76 116.25 117.66 2cxt h VAL 500 Ca 0.02 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 2cxt h VAL 500 Cb 0.04 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 30.14 2cxt h VAL 500 CO -0.00 0.17 0.36 1.56 0.02 0.00 0.00 177.57 179.68 2cxt h GLN 501 N 0.78 1.01 -0.52 1.57 4.20 -1.18 -1.97 115.11 119.00 2cxt h GLN 501 Ca 0.21 -0.14 0.03 0.00 0.06 0.00 0.00 58.65 58.81 2cxt h GLN 501 Cb -0.03 -0.19 -0.04 0.00 0.30 0.00 0.00 27.48 27.52 2cxt h GLN 501 CO -0.04 0.78 0.30 0.78 -0.67 0.00 0.00 178.83 179.97 2cxt h GLY 502 N 0.99 0.73 1.00 3.46 0.00 -0.96 -1.22 103.07 107.06 2cxt h GLY 502 Ca 0.25 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.36 2cxt h GLY 502 CO -0.04 0.17 0.33 -2.22 0.00 0.00 0.00 176.54 174.78 2cxt h ILE 503 N 0.58 1.15 -0.38 2.60 1.08 -1.11 -1.30 117.51 120.14 2cxt h ILE 503 Ca 0.21 -0.30 -0.06 0.00 -0.39 0.00 0.00 64.86 64.32 2cxt h ILE 503 Cb 0.06 0.41 -0.02 0.00 -3.07 0.00 0.00 36.82 34.21 2cxt h ILE 503 CO -0.11 0.15 -0.01 0.24 -0.69 0.00 0.00 178.15 177.72 2cxt h MET 504 N 0.70 0.60 0.00 2.37 2.86 -0.97 -1.72 114.93 118.78 2cxt h MET 504 Ca 0.19 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 2cxt h MET 504 Cb -0.05 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.53 2cxt h MET 504 CO -0.04 0.63 0.00 0.91 1.06 0.00 0.00 176.91 179.47 2cxt n TRP 505 N -4.25 0.24 -1.98 -0.22 8.01 -0.50 -4.48 117.44 114.26 2cxt n TRP 505 Ca 0.02 0.07 -0.12 0.00 -1.31 0.00 0.00 57.50 56.15 2cxt n TRP 505 Cb 0.27 -0.61 -0.02 0.00 -2.01 0.00 0.00 31.31 28.93 2cxt n TRP 505 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 2cxt n ASP 506 N -1.69 -4.09 -4.94 -0.99 2.03 -0.56 -4.73 116.55 101.58 2cxt n ASP 506 Ca 0.06 0.08 -0.19 0.00 0.52 0.00 0.00 54.79 55.26 2cxt n ASP 506 Cb 0.35 -3.12 -0.01 0.00 -0.72 0.00 0.00 41.12 37.63 2cxt n ASP 506 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2cxt s ILE 507 N -2.57 2.72 -0.44 5.18 -4.36 -0.77 -0.84 121.20 120.11 2cxt s ILE 507 Ca 0.00 -1.20 -0.17 0.00 -0.26 0.00 0.00 60.65 59.02 2cxt s ILE 507 Cb 0.00 -2.91 0.03 0.00 1.25 0.00 0.00 42.46 40.83 2cxt s ILE 507 CO 0.00 0.00 0.46 0.21 0.24 0.00 0.00 174.94 175.85 2cxt s ASN 508 N -4.26 6.19 0.00 4.36 3.84 -1.26 -4.52 114.94 119.30 2cxt s ASN 508 Ca 0.51 -0.79 0.20 0.00 0.21 0.00 0.00 52.86 52.99 2cxt s ASN 508 Cb -0.06 -2.23 1.04 0.00 -0.55 0.00 0.00 41.25 39.45 2cxt s ASN 508 CO 0.30 -0.64 1.63 -1.20 -2.79 0.00 0.00 177.10 174.41 2cxt n SER 509 N 5.64 0.00 0.00 -4.21 7.64 -1.26 -3.98 113.62 117.46 2cxt n SER 509 Ca -0.08 -0.08 0.00 0.00 1.01 0.00 0.00 58.87 59.73 2cxt n SER 509 Cb 0.47 -0.25 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 2cxt n SER 509 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2cxt n PHE 510 N -1.25 0.00 -3.55 1.43 3.01 -1.26 -4.36 117.46 111.48 2cxt n PHE 510 Ca 0.10 0.00 -0.22 0.00 1.01 0.00 0.00 57.45 58.34 2cxt n PHE 510 Cb 0.15 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 39.64 2cxt n PHE 510 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 2cxt n ASP 511 N -0.01 2.39 -2.74 4.37 3.85 -1.26 -4.97 116.55 118.18 2cxt n ASP 511 Ca 0.00 -2.64 -0.09 0.00 -0.71 0.00 0.00 54.79 51.35 2cxt n ASP 511 Cb 0.00 -0.17 0.09 0.00 -1.35 0.00 0.00 41.12 39.69 2cxt n ASP 511 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2cxt n GLN 512 N -1.88 1.09 0.26 0.11 0.00 -1.26 -4.77 117.38 110.93 2cxt n GLN 512 Ca 0.05 -1.98 0.18 0.00 0.00 0.00 0.00 57.00 55.25 2cxt n GLN 512 Cb 0.57 -0.71 0.82 0.00 0.00 0.00 0.00 30.24 30.93 2cxt n GLN 512 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.06 175.57 2cxt h TRP 513 N 2.64 0.00 0.00 2.61 4.06 -1.98 -3.12 115.95 120.16 2cxt h TRP 513 Ca -0.16 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.79 2cxt h TRP 513 Cb 1.17 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.33 2cxt h TRP 513 CO 0.27 0.00 0.00 0.41 -3.56 0.00 0.00 178.44 175.56 2cxt n GLY 514 N -0.50 -0.92 0.01 1.49 0.00 -1.26 -2.63 105.19 101.39 2cxt n GLY 514 Ca -0.01 -0.09 0.11 0.00 0.00 0.00 0.00 46.02 46.03 2cxt n GLY 514 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2cxt n VAL 515 N -1.28 0.04 -0.07 1.61 0.24 -1.18 -4.54 118.33 113.15 2cxt n VAL 515 Ca 0.09 -0.06 -0.11 0.00 -2.04 0.00 0.00 64.34 62.22 2cxt n VAL 515 Cb 0.15 0.47 -0.04 0.00 -1.47 0.00 0.00 33.84 32.95 2cxt n VAL 515 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 2cxt h GLU 516 N 0.00 0.37 -0.44 7.34 4.81 -1.74 -3.09 114.58 121.84 2cxt h GLU 516 Ca 0.00 -0.09 0.01 0.00 -0.13 0.00 0.00 59.36 59.15 2cxt h GLU 516 Cb 0.56 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.87 2cxt h GLU 516 CO 0.00 0.50 0.27 1.25 -0.73 0.00 0.00 179.01 180.30 2cxt h LEU 517 N 0.19 0.46 -1.11 1.64 5.85 -1.80 -1.20 115.31 119.33 2cxt h LEU 517 Ca 0.07 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2cxt h LEU 517 Cb 0.30 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 2cxt h LEU 517 CO 0.00 0.33 0.53 1.23 -0.34 0.00 0.00 178.44 180.19 2cxt h GLY 518 N 0.56 1.21 0.97 3.75 0.00 -1.85 -1.61 103.07 106.09 2cxt h GLY 518 Ca 0.17 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 46.95 2cxt h GLY 518 CO -0.06 0.47 0.05 0.50 0.00 0.00 0.00 176.54 177.50 2cxt h LYS 519 N 1.16 0.77 -0.12 4.80 1.57 -1.34 -1.90 116.57 121.50 2cxt h LYS 519 Ca 0.31 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2cxt h LYS 519 Cb -0.08 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 2cxt h LYS 519 CO -0.06 0.80 0.07 1.96 -0.57 0.00 0.00 179.45 181.66 2cxt h GLN 520 N 0.63 0.16 0.00 3.15 4.20 -0.75 -2.41 115.11 120.09 2cxt h GLN 520 Ca 0.14 -0.01 -0.10 0.00 0.06 0.00 0.00 58.65 58.74 2cxt h GLN 520 Cb 0.42 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 2cxt h GLN 520 CO 0.01 0.13 -0.46 -0.07 -0.67 0.00 0.00 178.83 177.78 2cxt h LEU 521 N 0.14 0.00 -0.52 1.46 3.38 -1.27 -2.81 115.31 115.68 2cxt h LEU 521 Ca 0.04 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.88 2cxt h LEU 521 Cb 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2cxt h LEU 521 CO -0.01 0.46 -0.28 0.00 0.09 0.00 0.00 178.44 178.70 2cxt h ALA 522 N 1.54 0.71 -0.64 1.53 0.00 -1.15 -2.32 119.26 118.93 2cxt h ALA 522 Ca -0.00 -0.41 0.01 0.00 0.00 0.00 0.00 54.91 54.51 2cxt h ALA 522 Cb 0.81 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 2cxt h ALA 522 CO 0.06 0.67 0.42 0.87 0.00 0.00 0.00 179.25 181.27 2cxt h LYS 523 N 0.76 0.81 -0.16 0.00 1.79 -1.19 -1.21 116.57 117.38 2cxt h LYS 523 Ca 0.09 -0.05 -0.16 0.00 -2.18 0.00 0.00 60.65 58.35 2cxt h LYS 523 Cb 0.85 -0.18 -0.01 0.00 -1.58 0.00 0.00 32.23 31.31 2cxt h LYS 523 CO 0.07 0.53 -0.56 0.87 -1.08 0.00 0.00 179.45 179.29 2cxt h LYS 524 N 0.83 0.48 0.13 3.15 1.57 -1.32 -3.33 116.57 118.09 2cxt h LYS 524 Ca 0.24 -0.30 -0.29 0.00 -1.87 0.00 0.00 60.65 58.43 2cxt h LYS 524 Cb -0.05 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.30 2cxt h LYS 524 CO -0.06 0.91 -1.33 0.82 -0.57 0.00 0.00 179.45 179.23 2cxt h ILE 525 N 0.37 1.41 -0.40 1.86 2.04 -0.86 -3.39 117.51 118.53 2cxt h ILE 525 Ca 0.00 -2.98 0.07 0.00 1.00 0.00 0.00 64.86 62.95 2cxt h ILE 525 Cb 1.09 2.91 -0.09 0.00 -0.74 0.00 0.00 36.82 39.99 2cxt h ILE 525 CO 0.10 0.87 -0.43 -0.08 0.00 0.00 0.00 178.15 178.61 2cxt h GLU 526 N 0.08 -0.32 0.00 2.37 4.81 -1.35 -0.82 114.58 119.35 2cxt h GLU 526 Ca -0.17 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.08 2cxt h GLU 526 Cb 2.00 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 31.45 2cxt h GLU 526 CO 0.20 -0.21 -0.03 -1.00 -0.73 0.00 0.00 179.01 177.23 2cxt h PRO 527 N -0.33 0.00 0.00 0.92 0.13 -1.77 -2.84 132.00 128.11 2cxt h PRO 527 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2cxt h PRO 527 Cb 0.58 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.71 2cxt h PRO 527 CO -0.57 0.03 0.00 0.93 -0.23 0.00 0.00 178.00 178.16 2cxt h GLU 528 N 0.00 0.00 -0.00 0.86 5.08 -1.34 -3.28 114.58 115.90 2cxt h GLU 528 Ca -0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.18 2cxt h GLU 528 Cb 0.25 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 2cxt h GLU 528 CO 0.00 0.00 -0.82 -0.07 -1.00 0.00 0.00 179.01 177.12 2cxt h LEU 529 N 0.00 0.14 -9.91 1.33 3.38 -1.44 -3.45 115.31 105.35 2cxt h LEU 529 Ca 0.00 -0.11 -0.53 0.00 0.09 0.00 0.00 57.88 57.34 2cxt h LEU 529 Cb 0.71 -0.04 0.08 0.00 0.09 0.00 0.00 40.66 41.50 2cxt h LEU 529 CO 0.00 0.89 0.66 -0.70 0.09 0.00 0.00 178.44 179.39 2cxt s GLU 530 N -3.24 4.19 0.01 1.13 2.12 -1.24 -4.86 118.70 116.81 2cxt s GLU 530 Ca -0.02 2.28 0.00 0.00 0.36 0.00 0.00 54.97 57.59 2cxt s GLU 530 Cb 0.11 -2.96 0.00 0.00 0.26 0.00 0.00 34.13 31.54 2cxt s GLU 530 CO 0.81 -0.35 0.00 0.41 -0.54 0.00 0.00 175.26 175.58 2cxt n GLY 531 N 0.69 -1.76 0.59 -1.50 0.00 -1.26 -4.68 105.19 97.27 2cxt n GLY 531 Ca 0.01 -1.50 0.13 0.00 0.00 0.00 0.00 46.02 44.66 2cxt n GLY 531 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cxt n SER 532 N -2.11 1.95 -4.76 1.61 3.41 -1.26 -4.95 113.62 107.51 2cxt n SER 532 Ca -0.00 -1.56 -0.41 0.00 -0.26 0.00 0.00 58.87 56.65 2cxt n SER 532 Cb 0.01 0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.02 2cxt n SER 532 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2cxt s SER 533 N -2.14 6.95 0.36 4.04 1.04 -1.26 -4.97 113.70 117.70 2cxt s SER 533 Ca 0.30 2.51 -0.28 0.00 0.48 0.00 0.00 55.95 58.97 2cxt s SER 533 Cb 0.20 -2.64 -0.10 0.00 0.10 0.00 0.00 66.02 63.59 2cxt s SER 533 CO 0.38 -0.41 1.32 0.00 0.98 0.00 0.00 173.24 175.51 2cxt s ALA 534 N -0.93 3.43 -0.23 5.32 0.00 -1.26 -5.02 121.76 123.08 2cxt s ALA 534 Ca 0.49 1.27 -0.07 0.00 0.00 0.00 0.00 51.96 53.65 2cxt s ALA 534 Cb -0.37 -3.49 -0.03 0.00 0.00 0.00 0.00 23.12 19.23 2cxt s ALA 534 CO 0.47 -0.72 0.07 0.08 0.00 0.00 0.00 175.76 175.66 2cxt s VAL 535 N -1.18 4.44 0.00 0.00 1.01 -1.26 -4.95 120.40 118.46 2cxt s VAL 535 Ca 0.51 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.36 2cxt s VAL 535 Cb -0.40 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 32.93 2cxt s VAL 535 CO 0.52 0.37 0.72 0.35 0.00 0.00 0.00 175.10 177.06 2cxt n THR 536 N 4.59 0.52 1.30 3.92 -2.24 -1.26 -4.72 114.28 116.38 2cxt n THR 536 Ca -0.16 -0.61 0.14 0.00 -2.27 0.00 0.00 64.05 61.15 2cxt n THR 536 Cb 0.52 0.82 0.70 0.00 -2.10 0.00 0.00 70.33 70.27 2cxt n THR 536 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2cxt n SER 537 N -0.26 0.00 -2.83 3.42 3.41 -1.26 -4.85 113.62 111.26 2cxt n SER 537 Ca 0.00 -0.04 -0.09 0.00 -0.26 0.00 0.00 58.87 58.48 2cxt n SER 537 Cb 0.25 -0.31 -0.01 0.00 -0.26 0.00 0.00 64.21 63.88 2cxt n SER 537 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2cxt n HIS 538 N -1.31 -0.11 -0.69 7.33 8.25 -1.26 -5.11 115.22 122.31 2cxt n HIS 538 Ca 0.13 -0.75 -0.30 0.00 -0.26 0.00 0.00 57.72 56.54 2cxt n HIS 538 Cb 0.24 -0.11 0.18 0.00 1.12 0.00 0.00 29.99 31.42 2cxt n HIS 538 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 2cxt s ASP 539 N -1.89 2.54 0.51 0.41 1.47 -1.26 -4.74 116.67 113.71 2cxt s ASP 539 Ca 0.03 2.03 0.22 0.00 1.18 0.00 0.00 52.55 56.00 2cxt s ASP 539 Cb -0.00 -2.51 1.36 0.00 -0.34 0.00 0.00 42.92 41.43 2cxt s ASP 539 CO 0.02 -3.31 2.09 0.77 0.68 0.00 0.00 175.17 175.42 2cxt h SER 540 N -2.01 0.00 0.38 2.11 4.64 -1.98 -1.34 113.55 115.35 2cxt h SER 540 Ca -0.47 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.83 2cxt h SER 540 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2cxt h SER 540 CO 0.44 0.10 -0.18 -1.28 -0.87 0.00 0.00 176.83 175.04 2cxt h SER 541 N 0.00 -0.43 -0.62 4.97 0.87 -1.98 -0.07 113.55 116.29 2cxt h SER 541 Ca -0.00 -0.14 0.09 0.00 -1.23 0.00 0.00 61.79 60.51 2cxt h SER 541 Cb 0.22 0.11 -0.07 0.00 -0.44 0.00 0.00 62.40 62.22 2cxt h SER 541 CO 0.01 -0.01 0.24 0.74 -0.53 0.00 0.00 176.83 177.28 2cxt h THR 542 N -0.94 0.79 -0.80 2.23 2.02 -1.89 0.62 112.91 114.94 2cxt h THR 542 Ca -0.05 -0.15 -0.01 0.00 0.77 0.00 0.00 66.41 66.97 2cxt h THR 542 Cb 0.54 0.31 -0.04 0.00 -1.74 0.00 0.00 68.15 67.22 2cxt h THR 542 CO 0.08 0.08 0.47 0.78 0.37 0.00 0.00 175.52 177.30 2cxt h ASN 543 N 0.43 0.97 -0.08 4.18 2.35 -1.28 -1.49 115.58 120.66 2cxt h ASN 543 Ca 0.31 -0.08 -0.13 0.00 -0.55 0.00 0.00 56.30 55.85 2cxt h ASN 543 Cb 0.37 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 2cxt h ASN 543 CO -0.30 0.76 -0.38 1.23 -1.65 0.00 0.00 177.43 177.10 2cxt h GLY 544 N 1.10 0.64 1.01 2.83 0.00 -0.11 0.22 103.07 108.76 2cxt h GLY 544 Ca 0.28 -0.63 -0.12 0.00 0.00 0.00 0.00 47.33 46.86 2cxt h GLY 544 CO -0.05 0.57 -0.28 1.41 0.00 0.00 0.00 176.54 178.18 2cxt h LEU 545 N 0.49 0.81 -0.57 3.11 3.38 -0.74 -1.79 115.31 120.01 2cxt h LEU 545 Ca 0.05 -0.46 -0.03 0.00 0.09 0.00 0.00 57.88 57.53 2cxt h LEU 545 Cb 0.88 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 2cxt h LEU 545 CO 0.08 1.10 0.24 0.40 0.09 0.00 0.00 178.44 180.34 2cxt h ILE 546 N 0.54 1.22 -0.64 1.22 2.04 -1.09 -0.94 117.51 119.86 2cxt h ILE 546 Ca 0.06 -0.68 0.05 0.00 1.00 0.00 0.00 64.86 65.29 2cxt h ILE 546 Cb 0.86 0.60 -0.05 0.00 -0.74 0.00 0.00 36.82 37.49 2cxt h ILE 546 CO 0.07 0.27 0.36 -1.28 0.00 0.00 0.00 178.15 177.56 2cxt h SER 547 N 0.79 0.54 -0.52 1.72 0.87 -0.87 -0.56 113.55 115.52 2cxt h SER 547 Ca 0.19 0.03 0.01 0.00 -1.23 0.00 0.00 61.79 60.78 2cxt h SER 547 Cb 0.19 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 62.04 2cxt h SER 547 CO -0.02 0.35 0.34 0.15 -0.53 0.00 0.00 176.83 177.13 2cxt h PHE 548 N 0.67 0.64 -0.36 2.24 3.57 -0.98 -1.17 116.94 121.55 2cxt h PHE 548 Ca 0.28 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.80 2cxt h PHE 548 Cb 0.15 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.65 2cxt h PHE 548 CO -0.08 0.40 0.23 0.82 -2.23 0.00 0.00 178.31 177.45 2cxt h ILE 549 N 0.69 1.07 -0.31 1.41 2.04 -0.54 -0.23 117.51 121.64 2cxt h ILE 549 Ca 0.19 -0.16 -0.10 0.00 1.00 0.00 0.00 64.86 65.79 2cxt h ILE 549 Cb -0.07 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 2cxt h ILE 549 CO -0.04 0.08 -0.22 0.11 0.00 0.00 0.00 178.15 178.08 2cxt h LYS 550 N 0.46 0.59 -0.11 2.37 1.57 -0.91 -2.11 116.57 118.44 2cxt h LYS 550 Ca 0.14 -0.22 -0.19 0.00 -1.87 0.00 0.00 60.65 58.50 2cxt h LYS 550 Cb -0.03 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.24 2cxt h LYS 550 CO -0.05 0.77 -0.73 0.37 -0.57 0.00 0.00 179.45 179.25 2cxt h GLN 551 N 0.53 0.53 0.00 3.15 4.15 -0.95 -3.34 115.11 119.18 2cxt h GLN 551 Ca 0.08 -0.43 0.00 0.00 0.77 0.00 0.00 58.65 59.07 2cxt h GLN 551 Cb 0.67 0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.45 2cxt h GLN 551 CO 0.05 1.05 -0.88 1.04 -1.93 0.00 0.00 178.83 178.16 2cxt n GLN 552 N -3.88 0.32 0.11 1.69 1.13 -0.12 -4.29 117.38 112.35 2cxt n GLN 552 Ca -0.05 0.04 0.12 0.00 -1.94 0.00 0.00 57.00 55.17 2cxt n GLN 552 Cb 0.71 -1.65 0.46 0.00 0.11 0.00 0.00 30.24 29.88 2cxt n GLN 552 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 2cxt n ARG 553 N -2.08 0.20 -0.00 -1.09 1.85 -0.81 -2.73 116.66 112.00 2cxt n ARG 553 Ca 0.02 0.35 0.09 0.00 -1.00 0.00 0.00 57.85 57.32 2cxt n ARG 553 Cb 0.45 -1.83 -0.11 0.00 -1.05 0.00 0.00 32.46 29.92 2cxt n ARG 553 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2cxt n ASP 554 N -2.19 0.91 -4.72 2.89 8.00 -1.26 -4.99 116.55 115.18 2cxt n ASP 554 Ca 0.03 -0.92 -0.42 0.00 0.71 0.00 0.00 54.79 54.19 2cxt n ASP 554 Cb 0.28 1.04 -0.03 0.00 -0.02 0.00 0.00 41.12 42.39 2cxt n ASP 554 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2cxt s THR 555 N -2.88 2.56 -0.39 -3.53 2.01 -1.10 -4.98 115.64 107.32 2cxt s THR 555 Ca 0.07 0.41 -0.16 0.00 0.31 0.00 0.00 61.69 62.31 2cxt s THR 555 Cb 0.15 -3.26 0.01 0.00 0.01 0.00 0.00 72.50 69.40 2cxt s THR 555 CO 0.81 0.04 0.40 -0.54 -0.69 0.00 0.00 174.62 174.64 2cxt s LYS 556 N 0.85 3.29 0.00 4.92 1.02 -1.26 -5.12 119.74 123.44 2cxt s LYS 556 Ca 0.69 -0.62 0.23 0.00 0.02 0.00 0.00 55.97 56.29 2cxt s LYS 556 Cb -0.44 -3.90 0.19 0.00 -0.52 0.00 0.00 37.83 33.15 2cxt s LYS 556 CO 0.34 -0.71 1.24 1.28 -0.92 0.00 0.00 175.35 176.58