#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aja s PRO 2 N 0.00 4.40 -0.04 -0.78 0.02 -1.26 -5.04 135.00 132.30 1aja s PRO 2 Ca 0.00 2.04 -0.04 0.00 0.02 0.00 0.00 61.00 63.02 1aja s PRO 2 Cb 0.00 -3.05 0.01 0.00 0.02 0.00 0.00 34.50 31.48 1aja s PRO 2 CO 0.00 -0.09 0.11 -1.21 -0.33 0.00 0.00 177.00 175.49 1aja s GLU 3 N -1.76 0.15 -0.13 5.54 0.41 -1.26 -5.14 118.70 116.50 1aja s GLU 3 Ca 0.49 0.13 -0.18 0.00 -0.41 0.00 0.00 54.97 55.00 1aja s GLU 3 Cb -0.36 0.07 -0.04 0.00 -1.78 0.00 0.00 34.13 32.02 1aja s GLU 3 CO 0.47 -0.02 0.47 -1.64 -0.49 0.00 0.00 175.26 174.06 1aja s MET 4 N -0.00 4.32 0.42 1.61 -1.94 -1.26 -4.95 119.30 117.49 1aja s MET 4 Ca -0.01 0.42 -0.22 0.00 -1.71 0.00 0.00 55.69 54.17 1aja s MET 4 Cb -0.01 -3.45 -0.10 0.00 2.01 0.00 0.00 34.83 33.28 1aja s MET 4 CO 0.00 0.12 1.00 -1.25 -0.01 0.00 0.00 175.02 174.89 1aja s PRO 5 N 0.75 4.14 0.26 2.03 0.04 -1.26 -4.99 135.00 135.97 1aja s PRO 5 Ca 0.25 1.33 0.06 0.00 0.04 0.00 0.00 61.00 62.68 1aja s PRO 5 Cb -0.15 -2.34 -0.03 0.00 0.04 0.00 0.00 34.50 32.02 1aja s PRO 5 CO 0.10 -0.13 0.27 0.14 0.04 0.00 0.00 177.00 177.42 1aja s VAL 6 N -1.90 4.58 -0.72 -0.36 -7.23 -1.26 -4.77 120.40 108.74 1aja s VAL 6 Ca 0.61 -1.25 -0.27 0.00 -1.81 0.00 0.00 61.98 59.26 1aja s VAL 6 Cb -0.16 -3.52 0.02 0.00 0.56 0.00 0.00 36.38 33.28 1aja s VAL 6 CO 0.20 -0.31 1.43 -0.76 -0.31 0.00 0.00 175.10 175.35 1aja s LEU 7 N -3.92 3.20 0.28 1.32 1.02 -0.36 -4.86 118.68 115.36 1aja s LEU 7 Ca 0.35 -0.28 0.00 0.00 0.02 0.00 0.00 54.13 54.21 1aja s LEU 7 Cb -0.08 -2.55 0.40 0.00 0.02 0.00 0.00 46.19 43.98 1aja s LEU 7 CO 0.27 -1.97 1.78 -0.33 0.02 0.00 0.00 176.35 176.11 1aja h GLU 8 N 11.25 0.69 -1.40 1.70 4.39 -1.96 -3.43 114.58 125.83 1aja h GLU 8 Ca -0.26 -0.19 0.02 0.00 0.34 0.00 0.00 59.36 59.27 1aja h GLU 8 Cb 1.08 -0.08 -0.23 0.00 -0.10 0.00 0.00 28.75 29.41 1aja h GLU 8 CO 1.27 0.73 -0.32 1.21 -1.16 0.00 0.00 179.01 180.74 1aja s ASN 9 N -6.69 -0.89 -0.37 1.42 3.84 -1.26 -4.99 114.94 106.01 1aja s ASN 9 Ca -0.09 0.78 0.10 0.00 0.21 0.00 0.00 52.86 53.86 1aja s ASN 9 Cb 0.15 1.87 0.45 0.00 -0.55 0.00 0.00 41.25 43.16 1aja s ASN 9 CO 0.80 -0.27 1.09 0.54 -2.79 0.00 0.00 177.10 176.48 1aja n ARG 10 N 5.41 2.84 -2.21 0.43 1.74 -1.26 -4.90 116.66 118.71 1aja n ARG 10 Ca -0.03 -4.08 -0.29 0.00 -0.77 0.00 0.00 57.85 52.68 1aja n ARG 10 Cb 0.51 -1.99 0.02 0.00 -1.02 0.00 0.00 32.46 29.98 1aja n ARG 10 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1aja s ALA 11 N -3.49 3.18 0.11 7.54 0.00 -1.26 -4.72 121.76 123.12 1aja s ALA 11 Ca 0.42 -0.44 -0.34 0.00 0.00 0.00 0.00 51.96 51.61 1aja s ALA 11 Cb 0.41 -2.81 -0.14 0.00 0.00 0.00 0.00 23.12 20.58 1aja s ALA 11 CO -0.08 -0.76 1.63 0.00 0.00 0.00 0.00 175.76 176.55 1aja n ALA 12 N -2.65 1.21 0.76 0.00 0.00 0.66 -4.21 120.51 116.28 1aja n ALA 12 Ca 0.05 0.42 0.13 0.00 0.00 0.00 0.00 53.44 54.03 1aja n ALA 12 Cb 0.56 -2.37 0.50 0.00 0.00 0.00 0.00 19.45 18.14 1aja n ALA 12 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1aja n GLN 13 N 4.03 0.13 0.00 0.00 1.13 0.11 -4.93 117.38 117.85 1aja n GLN 13 Ca 0.18 0.14 0.00 0.00 -1.94 0.00 0.00 57.00 55.38 1aja n GLN 13 Cb 0.29 -1.66 0.00 0.00 0.11 0.00 0.00 30.24 28.98 1aja n GLN 13 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1aja n GLY 14 N 1.22 4.48 3.60 1.08 0.00 0.58 -5.04 105.19 111.11 1aja n GLY 14 Ca 0.06 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 1aja n GLY 14 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1aja s ASP 15 N 1.52 6.60 0.00 1.61 2.15 -1.24 -4.76 116.67 122.55 1aja s ASP 15 Ca 0.00 0.51 0.11 0.00 0.43 0.00 0.00 52.55 53.60 1aja s ASP 15 Cb 0.00 -2.40 0.57 0.00 -0.30 0.00 0.00 42.92 40.79 1aja s ASP 15 CO 0.00 -0.66 1.18 2.30 -0.17 0.00 0.00 175.17 177.82 1aja n ILE 16 N 5.64 0.51 0.75 4.11 -5.35 -1.26 -1.40 119.36 122.35 1aja n ILE 16 Ca 0.03 0.13 0.11 0.00 -0.27 0.00 0.00 62.75 62.74 1aja n ILE 16 Cb 0.48 -0.95 -0.06 0.00 -1.74 0.00 0.00 39.64 37.37 1aja n ILE 16 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1aja n THR 17 N -1.19 0.04 -3.95 7.28 -2.24 -1.26 -4.63 114.28 108.32 1aja n THR 17 Ca 0.06 -0.13 -0.28 0.00 -2.27 0.00 0.00 64.05 61.42 1aja n THR 17 Cb 0.07 0.59 -0.04 0.00 -2.10 0.00 0.00 70.33 68.85 1aja n THR 17 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1aja s ALA 18 N -3.12 3.94 -0.31 6.98 0.00 -0.49 -5.04 121.76 123.71 1aja s ALA 18 Ca 0.05 -0.96 -0.40 0.00 0.00 0.00 0.00 51.96 50.65 1aja s ALA 18 Cb 0.15 -1.76 -0.15 0.00 0.00 0.00 0.00 23.12 21.36 1aja s ALA 18 CO 0.84 0.67 1.84 -0.35 0.00 0.00 0.00 175.76 178.76 1aja n PRO 19 N -0.12 1.05 -0.20 0.00 -0.04 -1.26 -1.31 135.00 133.11 1aja n PRO 19 Ca -0.06 0.37 0.00 0.00 -0.04 0.00 0.00 63.50 63.77 1aja n PRO 19 Cb 0.53 -2.11 0.00 0.00 -0.04 0.00 0.00 33.50 31.88 1aja n PRO 19 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1aja n GLY 20 N 4.76 2.03 0.18 0.55 0.00 -1.26 -4.91 105.19 106.55 1aja n GLY 20 Ca 0.31 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.37 1aja n GLY 20 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1aja h GLY 21 N 0.00 0.00 -1.25 -0.02 0.00 -1.31 -2.74 103.07 97.76 1aja h GLY 21 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1aja h GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 1aja n ALA 22 N -2.36 2.49 -1.77 3.60 0.00 -1.26 -0.31 120.51 120.91 1aja n ALA 22 Ca -0.01 -0.65 -0.41 0.00 0.00 0.00 0.00 53.44 52.38 1aja n ALA 22 Cb 0.49 -1.02 -0.01 0.00 0.00 0.00 0.00 19.45 18.91 1aja n ALA 22 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1aja s ARG 23 N -1.73 4.19 0.00 0.00 0.52 -1.03 -4.60 118.95 116.29 1aja s ARG 23 Ca 0.34 2.35 0.19 0.00 -0.52 0.00 0.00 55.73 58.09 1aja s ARG 23 Cb 0.19 -2.97 -0.20 0.00 0.52 0.00 0.00 34.95 32.49 1aja s ARG 23 CO 0.28 -0.38 0.83 0.54 0.02 0.00 0.00 175.30 176.59 1aja n ARG 24 N 0.54 0.69 -4.49 3.54 1.74 -1.26 0.10 116.66 117.53 1aja n ARG 24 Ca 0.01 -0.06 -0.34 0.00 -0.77 0.00 0.00 57.85 56.69 1aja n ARG 24 Cb 0.41 -1.41 -0.10 0.00 -1.02 0.00 0.00 32.46 30.34 1aja n ARG 24 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1aja s LEU 25 N -2.87 3.36 0.00 0.55 1.43 -1.26 -4.45 118.68 115.44 1aja s LEU 25 Ca 0.08 0.04 0.15 0.00 -1.03 0.00 0.00 54.13 53.36 1aja s LEU 25 Cb 0.15 -1.78 0.39 0.00 0.03 0.00 0.00 46.19 44.98 1aja s LEU 25 CO 0.77 0.36 1.31 0.35 0.23 0.00 0.00 176.35 179.37 1aja n THR 26 N 2.07 0.88 -3.64 5.49 -2.24 -1.26 -5.00 114.28 110.58 1aja n THR 26 Ca -0.18 -0.94 0.00 0.00 -2.27 0.00 0.00 64.05 60.66 1aja n THR 26 Cb 0.53 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 1aja n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1aja n GLY 27 N 0.90 -1.28 3.73 3.38 0.00 -1.26 -5.14 105.19 105.52 1aja n GLY 27 Ca 0.15 -1.07 -0.41 0.00 0.00 0.00 0.00 46.02 44.69 1aja n GLY 27 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1aja s ASP 28 N -4.00 7.26 0.05 1.61 2.15 -1.26 -4.97 116.67 117.52 1aja s ASP 28 Ca 0.00 2.00 0.24 0.00 0.43 0.00 0.00 52.55 55.22 1aja s ASP 28 Cb 0.00 -2.59 0.28 0.00 -0.30 0.00 0.00 42.92 40.31 1aja s ASP 28 CO 0.00 -0.26 1.24 0.00 -0.17 0.00 0.00 175.17 175.98 1aja n GLN 29 N 2.88 0.18 -0.10 4.34 1.13 -1.26 -4.59 117.38 119.96 1aja n GLN 29 Ca 0.04 0.03 -0.11 0.00 -1.94 0.00 0.00 57.00 55.02 1aja n GLN 29 Cb 0.47 -1.59 -0.05 0.00 0.11 0.00 0.00 30.24 29.18 1aja n GLN 29 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1aja h THR 30 N 0.00 0.12 -0.61 5.09 2.02 -1.99 -0.77 112.91 116.77 1aja h THR 30 Ca 0.00 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 1aja h THR 30 Cb 0.65 0.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.15 1aja h THR 30 CO 0.00 0.00 0.26 0.00 0.37 0.00 0.00 175.52 176.15 1aja h ALA 31 N 0.35 1.32 -0.45 6.16 0.00 -2.00 -0.07 119.26 124.57 1aja h ALA 31 Ca 0.12 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 1aja h ALA 31 Cb 0.59 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1aja h ALA 31 CO -0.53 0.52 -0.14 0.00 0.00 0.00 0.00 179.25 179.09 1aja h ALA 32 N 1.42 0.90 -0.48 0.00 0.00 -1.71 -1.66 119.26 117.73 1aja h ALA 32 Ca 0.21 -0.34 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 1aja h ALA 32 Cb 0.14 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1aja h ALA 32 CO -0.02 0.63 -0.12 1.25 0.00 0.00 0.00 179.25 180.99 1aja h LEU 33 N 0.76 0.94 -0.95 0.00 5.85 0.39 -1.50 115.31 120.80 1aja h LEU 33 Ca 0.12 -0.36 -0.10 0.00 0.84 0.00 0.00 57.88 58.37 1aja h LEU 33 Cb 0.66 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 1aja h LEU 33 CO 0.05 1.08 -0.37 0.03 -0.34 0.00 0.00 178.44 178.89 1aja h ARG 34 N 0.79 0.30 0.00 1.25 3.08 -1.03 -0.94 114.38 117.82 1aja h ARG 34 Ca 0.12 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1aja h ARG 34 Cb 0.67 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.72 1aja h ARG 34 CO 0.05 0.63 0.00 -0.25 -1.07 0.00 0.00 179.97 179.33 1aja n ASP 35 N -4.05 0.00 -0.90 7.04 8.00 -0.63 -1.92 116.55 124.08 1aja n ASP 35 Ca -0.01 0.33 0.11 0.00 0.71 0.00 0.00 54.79 55.93 1aja n ASP 35 Cb 0.46 -0.42 0.27 0.00 -0.02 0.00 0.00 41.12 41.41 1aja n ASP 35 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1aja n SER 36 N -1.42 2.71 -4.47 -2.24 7.64 -0.36 -4.47 113.62 111.01 1aja n SER 36 Ca 0.05 -1.88 -0.37 0.00 1.01 0.00 0.00 58.87 57.68 1aja n SER 36 Cb 0.17 -0.17 -0.12 0.00 -1.01 0.00 0.00 64.21 63.08 1aja n SER 36 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1aja s LEU 37 N -1.58 3.65 -0.19 -3.43 1.43 -0.81 -4.81 118.68 112.94 1aja s LEU 37 Ca 0.35 -0.21 -0.08 0.00 -1.03 0.00 0.00 54.13 53.17 1aja s LEU 37 Cb 0.20 -1.97 0.08 0.00 0.03 0.00 0.00 46.19 44.53 1aja s LEU 37 CO 0.30 -0.06 0.42 -0.55 0.23 0.00 0.00 176.35 176.68 1aja s SER 38 N 1.65 -0.33 0.00 2.29 0.15 -1.26 -5.02 113.70 111.17 1aja s SER 38 Ca 0.06 0.95 0.26 0.00 0.70 0.00 0.00 55.95 57.93 1aja s SER 38 Cb -0.16 1.14 0.71 0.00 -1.71 0.00 0.00 66.02 66.00 1aja s SER 38 CO 0.06 -0.22 1.55 -0.90 1.20 0.00 0.00 173.24 174.92 1aja n ASP 39 N 5.00 1.82 -4.46 5.45 5.68 -1.26 -0.98 116.55 127.80 1aja n ASP 39 Ca -0.14 -1.52 -0.34 0.00 -0.50 0.00 0.00 54.79 52.30 1aja n ASP 39 Cb 0.51 0.06 0.11 0.00 -1.14 0.00 0.00 41.12 40.67 1aja n ASP 39 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 1aja n LYS 40 N 0.30 -0.11 -2.08 0.11 2.85 -1.26 -4.77 118.16 113.20 1aja n LYS 40 Ca 0.16 0.02 -0.36 0.00 -1.05 0.00 0.00 58.31 57.07 1aja n LYS 40 Cb 0.42 -1.91 0.02 0.00 -0.65 0.00 0.00 35.03 32.91 1aja n LYS 40 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 177.40 175.21 1aja s PRO 41 N -3.48 3.23 -0.19 -1.58 0.02 -1.26 -4.45 135.00 127.28 1aja s PRO 41 Ca 0.61 1.83 -0.11 0.00 0.02 0.00 0.00 61.00 63.35 1aja s PRO 41 Cb -0.25 -2.09 -0.05 0.00 0.02 0.00 0.00 34.50 32.13 1aja s PRO 41 CO 0.63 -1.00 0.17 0.00 -0.33 0.00 0.00 177.00 176.48 1aja s ALA 42 N -1.57 3.66 0.10 -1.55 0.00 -0.13 -4.93 121.76 117.35 1aja s ALA 42 Ca 0.73 -0.64 -0.05 0.00 0.00 0.00 0.00 51.96 51.99 1aja s ALA 42 Cb -0.30 -2.24 -0.18 0.00 0.00 0.00 0.00 23.12 20.40 1aja s ALA 42 CO 0.34 0.12 1.23 -0.22 0.00 0.00 0.00 175.76 177.22 1aja h LYS 43 N 6.73 0.38 -4.69 0.00 3.64 -1.07 -3.36 116.57 118.20 1aja h LYS 43 Ca -0.41 -0.49 -0.24 0.00 -1.27 0.00 0.00 60.65 58.25 1aja h LYS 43 Cb 1.15 0.16 -0.15 0.00 -0.41 0.00 0.00 32.23 32.99 1aja h LYS 43 CO 0.75 1.17 -0.69 -0.80 -2.27 0.00 0.00 179.45 177.61 1aja s ASN 44 N -7.14 1.16 -0.01 4.20 0.01 -1.04 -3.31 114.94 108.81 1aja s ASN 44 Ca -0.05 -1.03 0.00 0.00 -0.71 0.00 0.00 52.86 51.06 1aja s ASN 44 Cb 0.08 0.10 0.01 0.00 0.41 0.00 0.00 41.25 41.84 1aja s ASN 44 CO 0.88 -0.48 0.00 -0.63 -1.51 0.00 0.00 177.10 175.36 1aja s ILE 45 N -3.62 0.04 -0.12 0.60 1.01 -0.92 -1.74 121.20 116.44 1aja s ILE 45 Ca 0.14 0.03 -0.00 0.00 0.00 0.00 0.00 60.65 60.82 1aja s ILE 45 Cb 0.05 -0.07 0.02 0.00 0.01 0.00 0.00 42.46 42.47 1aja s ILE 45 CO -0.03 0.04 -0.10 -0.63 0.00 0.00 0.00 174.94 174.22 1aja s ILE 46 N 0.30 1.22 -0.19 2.92 1.01 0.50 -2.17 121.20 124.79 1aja s ILE 46 Ca -0.03 -0.41 -0.03 0.00 0.00 0.00 0.00 60.65 60.18 1aja s ILE 46 Cb -0.04 -1.19 -0.01 0.00 0.01 0.00 0.00 42.46 41.22 1aja s ILE 46 CO -0.01 0.40 -0.06 -0.22 0.00 0.00 0.00 174.94 175.05 1aja s LEU 47 N 1.59 2.89 -0.11 2.97 2.96 -0.14 -1.41 118.68 127.44 1aja s LEU 47 Ca 0.04 -0.34 0.02 0.00 -0.22 0.00 0.00 54.13 53.63 1aja s LEU 47 Cb -0.13 -1.71 -0.00 0.00 0.50 0.00 0.00 46.19 44.84 1aja s LEU 47 CO -0.09 0.05 -0.20 -0.76 -1.32 0.00 0.00 176.35 174.03 1aja s LEU 48 N 1.07 2.32 -0.15 -0.68 2.01 -0.57 -0.17 118.68 122.52 1aja s LEU 48 Ca 0.01 -0.48 0.01 0.00 0.01 0.00 0.00 54.13 53.68 1aja s LEU 48 Cb -0.15 -1.49 -0.00 0.00 0.01 0.00 0.00 46.19 44.57 1aja s LEU 48 CO -0.01 0.16 -0.17 -0.63 1.01 0.00 0.00 176.35 176.71 1aja s ILE 49 N 0.38 2.56 -0.33 -0.59 -1.09 0.11 -1.62 121.20 120.61 1aja s ILE 49 Ca -0.15 -0.81 -0.17 0.00 -2.23 0.00 0.00 60.65 57.28 1aja s ILE 49 Cb -0.17 -2.06 -0.01 0.00 -1.58 0.00 0.00 42.46 38.63 1aja s ILE 49 CO 0.07 0.52 0.47 -0.83 -1.23 0.00 0.00 174.94 173.94 1aja s GLY 50 N 0.73 1.84 -0.65 6.18 0.00 0.48 -1.30 107.32 114.62 1aja s GLY 50 Ca -0.07 -0.99 -0.26 0.00 0.00 0.00 0.00 44.72 43.40 1aja s GLY 50 CO 0.01 1.18 2.42 1.34 0.00 0.00 0.00 173.10 178.05 1aja n ASP 51 N 5.60 1.97 0.00 1.64 2.03 -0.71 -2.22 116.55 124.87 1aja n ASP 51 Ca -0.06 -0.96 0.00 0.00 0.52 0.00 0.00 54.79 54.29 1aja n ASP 51 Cb 0.49 -1.59 0.00 0.00 -0.72 0.00 0.00 41.12 39.30 1aja n ASP 51 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1aja n GLY 52 N 6.38 0.67 3.50 0.27 0.00 -1.23 -4.97 105.19 109.81 1aja n GLY 52 Ca 0.43 -0.26 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 1aja n GLY 52 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1aja s MET 53 N -0.71 4.04 0.11 1.61 1.75 -0.94 -2.51 119.30 122.64 1aja s MET 53 Ca 0.00 -2.37 -0.01 0.00 -1.25 0.00 0.00 55.69 52.06 1aja s MET 53 Cb 0.00 -5.21 0.02 0.00 2.84 0.00 0.00 34.83 32.48 1aja s MET 53 CO 0.00 -1.93 0.15 0.41 -0.65 0.00 0.00 175.02 173.00 1aja n GLY 54 N 4.57 -0.38 0.33 2.11 0.00 -1.26 -4.40 105.19 106.16 1aja n GLY 54 Ca 0.40 -1.79 0.07 0.00 0.00 0.00 0.00 46.02 44.69 1aja n GLY 54 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1aja h ASP 55 N -0.16 0.45 -0.57 1.61 3.32 -1.92 -1.66 116.42 117.48 1aja h ASP 55 Ca -0.05 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.95 1aja h ASP 55 Cb 0.15 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 1aja h ASP 55 CO 0.04 0.31 0.18 -1.28 -1.72 0.00 0.00 179.24 176.76 1aja h SER 56 N 0.52 0.84 -0.04 6.45 0.87 -1.94 -2.00 113.55 118.25 1aja h SER 56 Ca 0.20 -0.21 -0.16 0.00 -1.23 0.00 0.00 61.79 60.39 1aja h SER 56 Cb 0.15 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 1aja h SER 56 CO -0.05 0.83 -0.54 -0.33 -0.53 0.00 0.00 176.83 176.21 1aja h GLU 57 N 0.81 0.62 -0.03 2.24 3.07 -1.62 -0.17 114.58 119.50 1aja h GLU 57 Ca 0.18 -0.39 -0.00 0.00 -0.50 0.00 0.00 59.36 58.66 1aja h GLU 57 Cb 0.29 0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 28.24 1aja h GLU 57 CO -0.01 1.00 0.02 0.82 -1.40 0.00 0.00 179.01 179.44 1aja h ILE 58 N 0.48 1.09 -0.38 3.13 2.04 -1.31 -2.12 117.51 120.44 1aja h ILE 58 Ca 0.01 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1aja h ILE 58 Cb 1.09 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 38.36 1aja h ILE 58 CO 0.11 0.07 0.24 0.74 0.00 0.00 0.00 178.15 179.30 1aja h THR 59 N -0.05 1.11 -0.69 -0.27 2.02 -0.90 -0.88 112.91 113.25 1aja h THR 59 Ca 0.01 -0.24 -0.00 0.00 0.77 0.00 0.00 66.41 66.94 1aja h THR 59 Cb 0.10 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 1aja h THR 59 CO -0.00 0.11 0.41 0.00 0.37 0.00 0.00 175.52 176.41 1aja h ALA 60 N 1.11 1.42 0.06 6.16 0.00 -1.02 -0.74 119.26 126.26 1aja h ALA 60 Ca 0.14 -0.08 -0.24 0.00 0.00 0.00 0.00 54.91 54.72 1aja h ALA 60 Cb -0.02 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 1aja h ALA 60 CO -0.03 0.50 -1.08 0.00 0.00 0.00 0.00 179.25 178.64 1aja h ALA 61 N 1.50 0.27 -0.14 0.00 0.00 -1.06 -2.57 119.26 117.26 1aja h ALA 61 Ca 0.25 -0.82 -0.02 0.00 0.00 0.00 0.00 54.91 54.31 1aja h ALA 61 Cb -0.03 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1aja h ALA 61 CO -0.05 0.97 -0.01 -0.09 0.00 0.00 0.00 179.25 180.08 1aja h ARG 62 N 0.10 0.25 -0.12 0.00 2.43 -0.78 -0.53 114.38 115.71 1aja h ARG 62 Ca -0.09 -0.08 0.04 0.00 -0.81 0.00 0.00 59.98 59.04 1aja h ARG 62 Cb 1.78 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 31.26 1aja h ARG 62 CO 0.17 0.49 -0.13 -0.91 -1.51 0.00 0.00 179.97 178.08 1aja h ASN 63 N -0.03 -0.41 0.65 -3.80 2.35 -1.19 0.55 115.58 113.71 1aja h ASN 63 Ca 0.04 0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1aja h ASN 63 Cb 0.38 0.20 0.01 0.00 0.05 0.00 0.00 38.32 38.96 1aja h ASN 63 CO 0.01 -0.17 -0.31 0.22 -1.65 0.00 0.00 177.43 175.52 1aja h TYR 64 N -0.16 -0.81 0.00 1.19 5.03 -1.44 -1.44 116.97 119.35 1aja h TYR 64 Ca 0.09 -0.02 -0.13 0.00 2.58 0.00 0.00 58.73 61.25 1aja h TYR 64 Cb 0.29 0.27 -0.02 0.00 1.55 0.00 0.00 36.73 38.82 1aja h TYR 64 CO -0.25 -0.47 -0.91 0.00 -1.32 0.00 0.00 178.16 175.21 1aja h ALA 65 N -0.70 0.65 0.00 1.82 0.00 -0.97 -0.22 119.26 119.85 1aja h ALA 65 Ca -0.09 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.22 1aja h ALA 65 Cb 0.70 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1aja h ALA 65 CO 0.15 0.73 -0.86 0.39 0.00 0.00 0.00 179.25 179.65 1aja n GLU 66 N -3.06 1.15 0.00 0.00 -0.58 0.17 -4.82 120.64 113.49 1aja n GLU 66 Ca -0.03 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.71 1aja n GLU 66 Cb 0.77 -0.93 0.00 0.00 -0.57 0.00 0.00 31.44 30.71 1aja n GLU 66 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1aja n GLY 67 N 2.22 -0.39 0.37 0.62 0.00 0.37 -3.68 105.19 104.70 1aja n GLY 67 Ca -0.00 -1.58 0.13 0.00 0.00 0.00 0.00 46.02 44.57 1aja n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aja h ALA 68 N 0.00 1.86 -0.26 4.61 0.00 -1.78 0.12 119.26 123.80 1aja h ALA 68 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1aja h ALA 68 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1aja h ALA 68 CO 0.00 -0.12 0.00 0.41 0.00 0.00 0.00 179.25 179.54 1aja n GLY 69 N -1.43 0.65 2.91 0.00 0.00 -1.26 -4.92 105.19 101.15 1aja n GLY 69 Ca 0.18 -0.47 -0.23 0.00 0.00 0.00 0.00 46.02 45.50 1aja n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aja n GLY 70 N 1.19 -1.93 3.18 -0.02 0.00 0.43 -0.24 105.19 107.79 1aja n GLY 70 Ca 0.16 -1.61 -0.10 0.00 0.00 0.00 0.00 46.02 44.46 1aja n GLY 70 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1aja s PHE 71 N -2.99 -0.63 -0.20 1.61 5.36 -1.26 -4.66 117.98 115.21 1aja s PHE 71 Ca 0.58 1.28 -0.29 0.00 -0.96 0.00 0.00 56.93 57.54 1aja s PHE 71 Cb -0.03 0.19 -0.01 0.00 -0.34 0.00 0.00 43.02 42.83 1aja s PHE 71 CO 0.42 -0.40 1.22 -0.06 -1.46 0.00 0.00 175.22 174.93 1aja s PHE 72 N 2.24 2.94 0.09 10.12 0.08 -1.26 -4.93 117.98 127.26 1aja s PHE 72 Ca -0.03 1.09 0.33 0.00 0.12 0.00 0.00 56.93 58.45 1aja s PHE 72 Cb -0.11 -3.51 1.46 0.00 -0.57 0.00 0.00 43.02 40.29 1aja s PHE 72 CO -0.11 -1.43 1.99 0.87 -0.10 0.00 0.00 175.22 176.44 1aja h LYS 73 N 8.17 0.00 0.00 0.44 6.56 -1.96 -0.89 116.57 128.90 1aja h LYS 73 Ca -0.25 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.34 1aja h LYS 73 Cb 1.09 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.75 1aja h LYS 73 CO 0.98 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 178.78 1aja n GLY 74 N -0.16 -0.31 0.28 3.86 0.00 -1.26 -4.47 105.19 103.13 1aja n GLY 74 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.09 1aja n GLY 74 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1aja h ILE 75 N 0.00 0.54 -0.02 -0.61 2.04 -1.81 -1.57 117.51 116.09 1aja h ILE 75 Ca 0.00 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.75 1aja h ILE 75 Cb 0.00 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.27 1aja h ILE 75 CO 0.00 0.06 -0.02 0.47 0.00 0.00 0.00 178.15 178.66 1aja n ASP 76 N -5.11 1.57 -0.02 1.72 8.00 -0.34 -4.07 116.55 118.30 1aja n ASP 76 Ca 0.15 -1.49 0.13 0.00 0.71 0.00 0.00 54.79 54.29 1aja n ASP 76 Cb 0.47 0.01 0.42 0.00 -0.02 0.00 0.00 41.12 42.01 1aja n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1aja n ALA 77 N 0.19 3.01 -2.56 2.24 0.00 -0.59 -4.83 120.51 117.97 1aja n ALA 77 Ca 0.18 -0.25 -0.43 0.00 0.00 0.00 0.00 53.44 52.94 1aja n ALA 77 Cb 0.37 -1.27 -0.02 0.00 0.00 0.00 0.00 19.45 18.53 1aja n ALA 77 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1aja s LEU 78 N -2.93 4.23 0.40 0.00 1.02 -1.25 -1.23 118.68 118.91 1aja s LEU 78 Ca 0.14 1.64 0.25 0.00 0.02 0.00 0.00 54.13 56.19 1aja s LEU 78 Cb 0.18 -3.55 0.64 0.00 0.02 0.00 0.00 46.19 43.48 1aja s LEU 78 CO 0.61 -0.57 1.71 1.55 0.02 0.00 0.00 176.35 179.67 1aja h PRO 79 N 7.43 0.00 -5.00 1.29 0.13 -1.86 -3.43 132.00 130.56 1aja h PRO 79 Ca -0.30 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.17 1aja h PRO 79 Cb 1.13 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 31.97 1aja h PRO 79 CO 0.90 0.00 -0.75 -0.51 -0.23 0.00 0.00 178.00 177.41 1aja s LEU 80 N -5.73 2.79 0.09 1.56 2.01 -1.09 -5.01 118.68 113.31 1aja s LEU 80 Ca 0.07 -0.49 0.07 0.00 0.01 0.00 0.00 54.13 53.79 1aja s LEU 80 Cb 0.07 -1.68 -0.03 0.00 0.01 0.00 0.00 46.19 44.56 1aja s LEU 80 CO 0.62 -0.03 -0.19 0.42 1.01 0.00 0.00 176.35 178.18 1aja s THR 81 N 1.43 1.52 0.00 5.49 -4.23 -1.26 -0.46 115.64 118.12 1aja s THR 81 Ca 0.05 -1.47 0.00 0.00 -1.18 0.00 0.00 61.69 59.09 1aja s THR 81 Cb -0.14 -1.40 0.00 0.00 1.34 0.00 0.00 72.50 72.30 1aja s THR 81 CO -0.05 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.52 1aja n GLY 82 N 1.14 2.69 3.09 3.99 0.00 -0.19 -4.08 105.19 111.83 1aja n GLY 82 Ca -0.20 -1.15 -0.26 0.00 0.00 0.00 0.00 46.02 44.41 1aja n GLY 82 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1aja s GLN 83 N -1.55 1.86 0.08 1.61 1.11 -0.23 -1.66 119.66 120.88 1aja s GLN 83 Ca 0.00 -0.54 0.08 0.00 0.01 0.00 0.00 55.36 54.91 1aja s GLN 83 Cb 0.00 -1.55 -0.03 0.00 -1.01 0.00 0.00 33.01 30.42 1aja s GLN 83 CO 0.00 0.13 -0.21 1.52 0.01 0.00 0.00 175.29 176.74 1aja s TYR 84 N 0.37 1.86 0.37 0.91 1.13 -0.48 -2.04 117.35 119.46 1aja s TYR 84 Ca -0.11 -0.40 -0.09 0.00 -1.41 0.00 0.00 57.07 55.07 1aja s TYR 84 Cb -0.14 -1.05 -0.06 0.00 -1.10 0.00 0.00 41.96 39.60 1aja s TYR 84 CO 0.04 0.17 0.70 0.95 -2.51 0.00 0.00 175.55 174.90 1aja s THR 85 N -1.00 4.86 -0.30 -3.49 -4.23 -0.51 -2.73 115.64 108.24 1aja s THR 85 Ca 0.08 0.45 0.18 0.00 -1.18 0.00 0.00 61.69 61.22 1aja s THR 85 Cb -0.10 -3.73 0.46 0.00 1.34 0.00 0.00 72.50 70.48 1aja s THR 85 CO 0.03 -0.46 1.29 0.00 -0.54 0.00 0.00 174.62 174.94 1aja n HIS 86 N -1.18 -0.22 -2.34 3.99 1.44 -1.26 -0.02 115.22 115.64 1aja n HIS 86 Ca 0.01 -2.00 -0.35 0.00 -2.01 0.00 0.00 57.72 53.37 1aja n HIS 86 Cb 0.54 0.55 -0.01 0.00 0.12 0.00 0.00 29.99 31.19 1aja n HIS 86 CO 0.00 0.00 0.00 1.52 -2.81 0.00 0.00 176.34 175.05 1aja s TYR 87 N -2.05 2.81 0.11 -1.40 1.13 -1.26 -4.41 117.35 112.27 1aja s TYR 87 Ca 0.20 1.55 0.00 0.00 -1.41 0.00 0.00 57.07 57.41 1aja s TYR 87 Cb 0.38 -3.25 0.02 0.00 -1.10 0.00 0.00 41.96 38.01 1aja s TYR 87 CO -0.07 -1.35 0.14 0.00 -2.51 0.00 0.00 175.55 171.76 1aja n ALA 88 N -1.01 0.06 -2.49 9.51 0.00 -0.73 -4.89 120.51 120.95 1aja n ALA 88 Ca 0.10 -0.30 -0.19 0.00 0.00 0.00 0.00 53.44 53.06 1aja n ALA 88 Cb 0.51 0.05 -0.11 0.00 0.00 0.00 0.00 19.45 19.90 1aja n ALA 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1aja s LEU 89 N 0.00 2.40 -0.05 0.00 1.43 0.50 -0.74 118.68 122.23 1aja s LEU 89 Ca 0.10 -0.81 -0.29 0.00 -1.03 0.00 0.00 54.13 52.09 1aja s LEU 89 Cb -0.01 -0.59 -0.02 0.00 0.03 0.00 0.00 46.19 45.60 1aja s LEU 89 CO 0.06 -0.13 0.96 0.21 0.23 0.00 0.00 176.35 177.69 1aja s ASN 90 N -2.46 7.28 0.21 2.29 3.84 0.14 -3.83 114.94 122.41 1aja s ASN 90 Ca 0.10 1.56 -0.09 0.00 0.21 0.00 0.00 52.86 54.63 1aja s ASN 90 Cb -0.05 -2.55 0.15 0.00 -0.55 0.00 0.00 41.25 38.26 1aja s ASN 90 CO 0.03 -0.31 1.82 0.50 -2.79 0.00 0.00 177.10 176.35 1aja h LYS 91 N 6.91 1.09 0.07 0.43 3.64 -1.93 0.24 116.57 127.02 1aja h LYS 91 Ca -0.37 -0.14 -0.00 0.00 -1.27 0.00 0.00 60.65 58.86 1aja h LYS 91 Cb 1.19 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.80 1aja h LYS 91 CO 0.79 0.82 -0.03 0.87 -2.27 0.00 0.00 179.45 179.62 1aja h LYS 92 N 1.08 -0.09 0.00 1.90 1.79 -1.92 -3.36 116.57 115.97 1aja h LYS 92 Ca 0.27 0.01 -0.09 0.00 -2.18 0.00 0.00 60.65 58.65 1aja h LYS 92 Cb 0.06 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 30.71 1aja h LYS 92 CO -0.04 0.36 -1.53 0.25 -1.08 0.00 0.00 179.45 177.40 1aja n THR 93 N -4.91 0.74 -1.02 -0.16 -2.24 -1.22 -4.97 114.28 100.50 1aja n THR 93 Ca -0.08 -0.62 -0.01 0.00 -2.27 0.00 0.00 64.05 61.07 1aja n THR 93 Cb 0.25 -0.40 -0.00 0.00 -2.10 0.00 0.00 70.33 68.07 1aja n THR 93 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1aja n GLY 94 N 1.33 0.48 3.89 3.38 0.00 0.85 -4.99 105.19 110.14 1aja n GLY 94 Ca -0.08 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 1aja n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aja s LYS 95 N -0.93 3.69 0.45 1.61 1.02 -1.25 -4.67 119.74 119.65 1aja s LYS 95 Ca 0.00 0.11 -0.25 0.00 0.02 0.00 0.00 55.97 55.85 1aja s LYS 95 Cb 0.00 -2.65 -0.09 0.00 -0.52 0.00 0.00 37.83 34.57 1aja s LYS 95 CO 0.00 0.26 1.31 -2.30 -0.92 0.00 0.00 175.35 173.70 1aja n PRO 96 N -0.60 1.94 -3.97 -1.68 -0.02 -1.26 0.27 135.00 129.68 1aja n PRO 96 Ca -0.01 0.69 -0.34 0.00 -2.02 0.00 0.00 63.50 61.83 1aja n PRO 96 Cb 0.53 -2.45 -0.14 0.00 -0.02 0.00 0.00 33.50 31.42 1aja n PRO 96 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1aja s ASP 97 N -0.58 4.72 0.66 2.55 -1.08 0.09 -4.60 116.67 118.42 1aja s ASP 97 Ca 0.63 -1.37 0.43 0.00 -0.52 0.00 0.00 52.55 51.72 1aja s ASP 97 Cb -0.48 -1.65 2.36 0.00 -1.46 0.00 0.00 42.92 41.69 1aja s ASP 97 CO 0.57 -0.24 2.35 1.88 0.52 0.00 0.00 175.17 180.24 1aja h TYR 98 N 7.90 0.00 -3.51 -5.34 0.05 -1.94 -1.95 116.97 112.17 1aja h TYR 98 Ca -0.20 0.00 -0.64 0.00 0.05 0.00 0.00 58.73 57.95 1aja h TYR 98 Cb 1.05 0.00 -0.40 0.00 1.01 0.00 0.00 36.73 38.39 1aja h TYR 98 CO 0.62 0.00 -0.73 0.08 -1.05 0.00 0.00 178.16 177.08 1aja s VAL 99 N -4.19 1.85 0.75 -2.88 1.01 -1.26 -4.45 120.40 111.22 1aja s VAL 99 Ca -0.05 -2.08 -0.11 0.00 0.00 0.00 0.00 61.98 59.74 1aja s VAL 99 Cb 0.13 -2.37 0.04 0.00 0.00 0.00 0.00 36.38 34.18 1aja s VAL 99 CO 0.42 -0.63 1.09 0.28 0.00 0.00 0.00 175.10 176.25 1aja s THR 100 N 1.09 3.42 0.45 3.92 -1.32 -1.26 -4.82 115.64 117.13 1aja s THR 100 Ca 0.11 0.49 0.06 0.00 -1.21 0.00 0.00 61.69 61.14 1aja s THR 100 Cb -0.19 -3.01 0.06 0.00 -1.51 0.00 0.00 72.50 67.85 1aja s THR 100 CO -0.13 -0.58 0.50 -0.90 -2.21 0.00 0.00 174.62 171.30 1aja n ASP 101 N -3.32 2.01 -0.08 8.08 5.75 -1.26 -4.89 116.55 122.84 1aja n ASP 101 Ca 0.09 -2.36 -0.12 0.00 -0.01 0.00 0.00 54.79 52.39 1aja n ASP 101 Cb 0.53 -0.20 -0.05 0.00 -1.03 0.00 0.00 41.12 40.37 1aja n ASP 101 CO 0.00 0.00 0.00 -1.28 -0.11 0.00 0.00 177.20 175.81 1aja h SER 102 N 0.28 0.45 -0.25 -1.12 0.87 -1.99 -2.78 113.55 109.01 1aja h SER 102 Ca -0.25 -0.37 0.05 0.00 -1.23 0.00 0.00 61.79 60.00 1aja h SER 102 Cb 1.01 -0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 62.79 1aja h SER 102 CO 0.37 0.71 -0.10 0.00 -0.53 0.00 0.00 176.83 177.28 1aja h ALA 103 N 0.75 0.11 -0.17 6.23 0.00 -1.86 0.13 119.26 124.44 1aja h ALA 103 Ca 0.06 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 1aja h ALA 103 Cb 0.52 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1aja h ALA 103 CO 0.02 -0.51 -0.36 0.00 0.00 0.00 0.00 179.25 178.41 1aja h ALA 104 N 1.16 1.08 -0.04 0.00 0.00 -1.62 0.31 119.26 120.14 1aja h ALA 104 Ca 0.13 -0.39 -0.18 0.00 0.00 0.00 0.00 54.91 54.47 1aja h ALA 104 Cb 0.25 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1aja h ALA 104 CO -0.29 0.58 -0.76 0.66 0.00 0.00 0.00 179.25 179.45 1aja h SER 105 N 0.31 0.34 -0.23 0.00 4.64 -1.17 -2.23 113.55 115.21 1aja h SER 105 Ca 0.03 -0.24 -0.17 0.00 -0.47 0.00 0.00 61.79 60.95 1aja h SER 105 Cb 0.77 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.76 1aja h SER 105 CO 0.06 0.98 -0.47 0.00 -0.87 0.00 0.00 176.83 176.52 1aja h ALA 106 N 1.01 0.60 -0.78 5.18 0.00 -0.20 -2.75 119.26 122.32 1aja h ALA 106 Ca -0.03 -0.48 -0.03 0.00 0.00 0.00 0.00 54.91 54.36 1aja h ALA 106 Cb 1.33 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 1aja h ALA 106 CO 0.12 0.68 0.37 1.15 0.00 0.00 0.00 179.25 181.57 1aja h THR 107 N 0.64 1.25 -0.51 0.00 2.02 -0.90 -2.69 112.91 112.72 1aja h THR 107 Ca 0.03 -0.71 -0.01 0.00 0.77 0.00 0.00 66.41 66.50 1aja h THR 107 Cb 1.05 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 1aja h THR 107 CO 0.10 0.30 0.29 0.00 0.37 0.00 0.00 175.52 176.59 1aja h ALA 108 N 1.19 0.65 0.00 6.16 0.00 -1.11 0.17 119.26 126.33 1aja h ALA 108 Ca 0.27 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1aja h ALA 108 Cb 0.13 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1aja h ALA 108 CO -0.03 0.15 -0.25 0.11 0.00 0.00 0.00 179.25 179.23 1aja h TRP 109 N 0.68 0.00 0.00 0.00 0.09 -1.47 -0.13 115.95 115.12 1aja h TRP 109 Ca 0.18 0.00 -0.17 0.00 0.09 0.00 0.00 58.89 58.99 1aja h TRP 109 Cb 0.02 0.00 -0.03 0.00 0.08 0.00 0.00 29.16 29.23 1aja h TRP 109 CO -0.02 0.00 -1.68 -1.13 0.09 0.00 0.00 178.44 175.70 1aja n SER 110 N -2.50 0.55 -0.03 0.11 3.41 -1.02 -3.61 113.62 110.53 1aja n SER 110 Ca 0.04 0.24 -0.02 0.00 -0.26 0.00 0.00 58.87 58.87 1aja n SER 110 Cb 0.47 0.65 -0.05 0.00 -0.26 0.00 0.00 64.21 65.02 1aja n SER 110 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1aja n THR 111 N -2.74 0.37 -0.76 6.66 -1.04 0.02 0.70 114.28 117.49 1aja n THR 111 Ca -0.13 -0.24 0.00 0.00 -2.04 0.00 0.00 64.05 61.64 1aja n THR 111 Cb 0.84 -0.70 0.00 0.00 -1.82 0.00 0.00 70.33 68.65 1aja n THR 111 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1aja n GLY 112 N 2.57 0.80 3.43 3.41 0.00 -0.06 -4.92 105.19 110.42 1aja n GLY 112 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 1aja n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aja s VAL 113 N -3.07 2.67 0.83 1.61 0.11 -1.26 -4.86 120.40 116.43 1aja s VAL 113 Ca 0.00 -1.19 -0.11 0.00 -2.93 0.00 0.00 61.98 57.74 1aja s VAL 113 Cb 0.00 -2.10 0.09 0.00 -1.53 0.00 0.00 36.38 32.84 1aja s VAL 113 CO 0.00 0.37 1.09 -0.54 -3.33 0.00 0.00 175.10 172.69 1aja s LYS 114 N -1.33 1.84 0.09 1.54 -0.14 -1.26 -3.75 119.74 116.72 1aja s LYS 114 Ca 0.14 0.75 -0.03 0.00 -1.36 0.00 0.00 55.97 55.47 1aja s LYS 114 Cb -0.10 -1.88 0.01 0.00 -1.68 0.00 0.00 37.83 34.17 1aja s LYS 114 CO 0.04 -1.82 0.17 -2.37 -0.76 0.00 0.00 175.35 170.61 1aja n THR 115 N -3.58 0.00 -2.86 2.17 5.66 -1.26 -4.47 114.28 109.93 1aja n THR 115 Ca 0.07 -0.31 -0.23 0.00 -3.05 0.00 0.00 64.05 60.54 1aja n THR 115 Cb 0.56 0.25 0.02 0.00 -1.55 0.00 0.00 70.33 69.61 1aja n THR 115 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1aja s TYR 116 N -6.38 3.12 -0.05 1.09 1.13 -1.25 -0.37 117.35 114.63 1aja s TYR 116 Ca 0.05 0.17 -0.30 0.00 -1.41 0.00 0.00 57.07 55.59 1aja s TYR 116 Cb -0.01 -2.46 -0.03 0.00 -1.10 0.00 0.00 41.96 38.37 1aja s TYR 116 CO 0.04 -0.52 1.10 -0.80 -2.51 0.00 0.00 175.55 172.85 1aja s ASN 117 N -4.28 7.17 0.00 -0.18 0.01 -1.26 -2.36 114.94 114.04 1aja s ASN 117 Ca 0.51 1.71 0.00 0.00 -0.71 0.00 0.00 52.86 54.37 1aja s ASN 117 Cb -0.10 -2.56 0.00 0.00 0.41 0.00 0.00 41.25 39.00 1aja s ASN 117 CO 0.38 -0.48 0.00 0.61 -1.51 0.00 0.00 177.10 176.11 1aja n GLY 118 N 3.18 1.89 3.76 0.66 0.00 -1.26 -4.97 105.19 108.44 1aja n GLY 118 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 1aja n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aja s ALA 119 N -2.27 3.36 -0.17 4.61 0.00 -0.99 0.40 121.76 126.71 1aja s ALA 119 Ca 0.00 0.55 0.01 0.00 0.00 0.00 0.00 51.96 52.52 1aja s ALA 119 Cb 0.00 -3.15 0.03 0.00 0.00 0.00 0.00 23.12 20.00 1aja s ALA 119 CO 0.00 0.22 -0.13 -0.51 0.00 0.00 0.00 175.76 175.34 1aja s LEU 120 N -1.13 1.93 -1.91 0.00 1.43 -0.71 -3.61 118.68 114.67 1aja s LEU 120 Ca 0.40 -0.64 0.00 0.00 -1.03 0.00 0.00 54.13 52.85 1aja s LEU 120 Cb -0.25 -1.21 0.00 0.00 0.03 0.00 0.00 46.19 44.76 1aja s LEU 120 CO 0.31 -0.09 0.00 0.61 0.23 0.00 0.00 176.35 177.41 1aja n GLY 121 N 4.73 1.54 3.18 -3.19 0.00 -1.26 -0.46 105.19 109.73 1aja n GLY 121 Ca -0.16 -0.13 -0.18 0.00 0.00 0.00 0.00 46.02 45.55 1aja n GLY 121 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1aja s VAL 122 N -2.71 1.12 0.00 1.61 -7.23 -1.26 -2.54 120.40 109.39 1aja s VAL 122 Ca 0.00 -1.42 0.00 0.00 -1.81 0.00 0.00 61.98 58.75 1aja s VAL 122 Cb 0.00 -1.19 0.00 0.00 0.56 0.00 0.00 36.38 35.75 1aja s VAL 122 CO 0.00 -0.31 0.00 -0.90 -0.31 0.00 0.00 175.10 173.58 1aja n ASP 123 N 1.04 0.00 0.00 4.85 5.68 -0.63 -4.79 116.55 122.70 1aja n ASP 123 Ca -0.19 -0.41 0.11 0.00 -0.50 0.00 0.00 54.79 53.80 1aja n ASP 123 Cb 0.55 0.00 0.60 0.00 -1.14 0.00 0.00 41.12 41.13 1aja n ASP 123 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 1aja n ILE 124 N -0.58 0.21 -0.87 2.12 -5.35 -1.26 -1.71 119.36 111.92 1aja n ILE 124 Ca 0.00 0.05 0.08 0.00 -0.27 0.00 0.00 62.75 62.61 1aja n ILE 124 Cb 0.00 -0.68 0.32 0.00 -1.74 0.00 0.00 39.64 37.54 1aja n ILE 124 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1aja n HIS 125 N -1.20 1.40 -1.84 4.28 8.25 -1.26 -4.93 115.22 119.92 1aja n HIS 125 Ca 0.13 -0.77 -0.15 0.00 -0.26 0.00 0.00 57.72 56.67 1aja n HIS 125 Cb 0.15 -0.36 -0.04 0.00 1.12 0.00 0.00 29.99 30.85 1aja n HIS 125 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1aja n GLU 126 N 0.15 -1.63 -2.77 -0.41 1.02 -0.69 -4.98 120.64 111.33 1aja n GLU 126 Ca 0.24 0.82 -0.42 0.00 -0.02 0.00 0.00 57.16 57.78 1aja n GLU 126 Cb 0.98 -5.24 -0.03 0.00 -0.02 0.00 0.00 31.44 27.13 1aja n GLU 126 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1aja s LYS 127 N -3.99 4.54 0.46 3.49 2.36 -1.26 -4.71 119.74 120.62 1aja s LYS 127 Ca 0.00 1.33 -0.23 0.00 -2.55 0.00 0.00 55.97 54.51 1aja s LYS 127 Cb 0.00 -3.46 -0.07 0.00 -1.05 0.00 0.00 37.83 33.25 1aja s LYS 127 CO 0.00 -0.03 1.17 -0.51 1.55 0.00 0.00 175.35 177.53 1aja s ASP 128 N 0.97 6.19 -0.01 1.43 1.01 -1.26 -1.60 116.67 123.39 1aja s ASP 128 Ca 0.49 2.32 0.02 0.00 0.71 0.00 0.00 52.55 56.09 1aja s ASP 128 Cb -0.20 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.12 1aja s ASP 128 CO 0.26 -0.91 -0.06 -1.00 0.21 0.00 0.00 175.17 173.68 1aja s HIS 129 N -1.53 0.56 0.30 4.23 3.76 -1.05 -4.93 115.29 116.62 1aja s HIS 129 Ca 0.63 -0.11 -0.29 0.00 -0.15 0.00 0.00 55.06 55.13 1aja s HIS 129 Cb -0.29 -0.39 -0.13 0.00 1.11 0.00 0.00 32.58 32.88 1aja s HIS 129 CO 0.35 -0.04 1.37 -2.30 -0.85 0.00 0.00 174.74 173.28 1aja n PRO 130 N 3.13 2.16 -2.85 8.40 -0.02 -1.26 -4.91 135.00 139.66 1aja n PRO 130 Ca -0.15 0.76 -0.25 0.00 -2.02 0.00 0.00 63.50 61.84 1aja n PRO 130 Cb 0.57 -2.40 0.01 0.00 -0.02 0.00 0.00 33.50 31.66 1aja n PRO 130 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1aja s THR 131 N -0.58 4.27 0.59 3.45 -4.23 -1.26 -4.44 115.64 113.44 1aja s THR 131 Ca 0.61 -0.25 0.29 0.00 -1.18 0.00 0.00 61.69 61.17 1aja s THR 131 Cb -0.59 -3.61 0.36 0.00 1.34 0.00 0.00 72.50 70.00 1aja s THR 131 CO 0.56 -0.50 2.19 -0.29 -0.54 0.00 0.00 174.62 176.04 1aja h ILE 132 N 0.29 0.49 0.08 2.99 6.09 -0.05 -1.33 117.51 126.07 1aja h ILE 132 Ca -0.47 0.00 -0.28 0.00 -1.37 0.00 0.00 64.86 62.74 1aja h ILE 132 Cb 1.24 0.93 0.02 0.00 0.47 0.00 0.00 36.82 39.48 1aja h ILE 132 CO 0.59 0.00 -1.16 0.25 -3.07 0.00 0.00 178.15 174.77 1aja h LEU 133 N 0.00 0.80 -0.61 2.19 6.46 -1.84 -1.81 115.31 120.50 1aja h LEU 133 Ca 0.03 -0.71 -0.05 0.00 -0.12 0.00 0.00 57.88 57.04 1aja h LEU 133 Cb 0.21 -0.25 -0.03 0.00 -0.73 0.00 0.00 40.66 39.86 1aja h LEU 133 CO -0.00 1.52 0.18 -0.33 -0.62 0.00 0.00 178.44 179.18 1aja h GLU 134 N 0.28 0.96 -0.01 1.25 5.08 -1.49 -0.91 114.58 119.73 1aja h GLU 134 Ca -0.16 -0.21 -0.12 0.00 -1.00 0.00 0.00 59.36 57.88 1aja h GLU 134 Cb 1.82 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.92 1aja h GLU 134 CO 0.22 0.86 -0.54 0.52 -1.00 0.00 0.00 179.01 179.06 1aja h MET 135 N 0.88 0.02 -0.16 2.33 2.86 -1.38 0.14 114.93 119.62 1aja h MET 135 Ca 0.20 -0.01 -0.17 0.00 -2.06 0.00 0.00 59.70 57.65 1aja h MET 135 Cb 0.31 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.98 1aja h MET 135 CO -0.00 0.56 -0.57 0.00 1.06 0.00 0.00 176.91 177.95 1aja h ALA 136 N 1.44 0.28 -0.45 6.32 0.00 -0.86 -2.16 119.26 123.83 1aja h ALA 136 Ca -0.00 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1aja h ALA 136 Cb 0.96 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1aja h ALA 136 CO 0.07 0.51 0.29 -0.22 0.00 0.00 0.00 179.25 179.90 1aja h LYS 137 N 0.34 0.60 -0.16 0.00 3.64 -1.06 0.14 116.57 120.07 1aja h LYS 137 Ca -0.03 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1aja h LYS 137 Cb 1.20 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.88 1aja h LYS 137 CO 0.12 0.41 0.10 0.00 -2.27 0.00 0.00 179.45 177.80 1aja h ALA 138 N 1.16 1.87 -0.16 5.00 0.00 -0.66 -0.83 119.26 125.64 1aja h ALA 138 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1aja h ALA 138 Cb -0.06 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1aja h ALA 138 CO -0.03 0.12 0.00 0.00 0.00 0.00 0.00 179.25 179.33 1aja n ALA 139 N -2.51 2.52 -0.37 0.00 0.00 -0.82 -4.91 120.51 114.41 1aja n ALA 139 Ca -0.01 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.01 1aja n ALA 139 Cb 0.09 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1aja n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aja n GLY 140 N 1.00 0.75 3.87 0.00 0.00 -0.32 -5.06 105.19 105.43 1aja n GLY 140 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 1aja n GLY 140 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aja s LEU 141 N 0.00 3.76 0.36 0.99 1.02 -0.01 -4.80 118.68 119.99 1aja s LEU 141 Ca 0.00 1.22 -0.25 0.00 0.02 0.00 0.00 54.13 55.13 1aja s LEU 141 Cb 0.00 -4.12 -0.10 0.00 0.02 0.00 0.00 46.19 41.99 1aja s LEU 141 CO 0.00 -0.46 0.96 0.00 0.02 0.00 0.00 176.35 176.87 1aja s ALA 142 N -2.46 3.15 0.05 4.21 0.00 -0.35 -4.14 121.76 122.22 1aja s ALA 142 Ca 0.53 0.53 0.02 0.00 0.00 0.00 0.00 51.96 53.04 1aja s ALA 142 Cb -0.10 -3.19 -0.03 0.00 0.00 0.00 0.00 23.12 19.80 1aja s ALA 142 CO 0.33 0.10 -0.08 0.95 0.00 0.00 0.00 175.76 177.06 1aja s THR 143 N -1.75 0.58 0.04 0.00 -4.23 -1.26 -0.96 115.64 108.07 1aja s THR 143 Ca 0.54 -1.18 -0.04 0.00 -1.18 0.00 0.00 61.69 59.83 1aja s THR 143 Cb -0.17 -0.74 -0.02 0.00 1.34 0.00 0.00 72.50 72.92 1aja s THR 143 CO 0.22 -0.42 0.07 -0.83 -0.54 0.00 0.00 174.62 173.11 1aja s GLY 144 N -1.74 0.22 -0.22 3.99 0.00 0.27 -2.04 107.32 107.81 1aja s GLY 144 Ca -0.07 -0.65 -0.03 0.00 0.00 0.00 0.00 44.72 43.96 1aja s GLY 144 CO -0.00 -0.78 0.23 0.21 0.00 0.00 0.00 173.10 172.77 1aja s ASN 145 N -2.19 1.44 -0.01 1.64 2.47 0.34 -2.74 114.94 115.89 1aja s ASN 145 Ca -0.04 -0.31 0.06 0.00 0.42 0.00 0.00 52.86 52.99 1aja s ASN 145 Cb -0.01 0.40 -0.02 0.00 -1.45 0.00 0.00 41.25 40.18 1aja s ASN 145 CO -0.05 -0.34 -0.19 -0.69 -3.72 0.00 0.00 177.10 172.11 1aja s VAL 146 N 2.33 1.53 0.13 -5.21 1.01 -0.82 -1.35 120.40 118.03 1aja s VAL 146 Ca 0.08 -0.83 -0.16 0.00 0.00 0.00 0.00 61.98 61.06 1aja s VAL 146 Cb -0.16 -1.27 0.03 0.00 0.00 0.00 0.00 36.38 34.98 1aja s VAL 146 CO -0.16 0.43 0.40 -0.55 0.00 0.00 0.00 175.10 175.22 1aja s SER 147 N -0.47 -0.21 0.00 3.32 0.15 -0.22 -0.50 113.70 115.76 1aja s SER 147 Ca 0.07 -0.36 0.20 0.00 0.70 0.00 0.00 55.95 56.56 1aja s SER 147 Cb -0.07 0.48 -0.04 0.00 -1.71 0.00 0.00 66.02 64.67 1aja s SER 147 CO -0.01 -0.87 0.95 0.35 1.20 0.00 0.00 173.24 174.86 1aja n THR 148 N -0.23 0.00 -2.89 6.45 -2.24 -1.06 -3.88 114.28 110.43 1aja n THR 148 Ca -0.15 -0.25 -0.12 0.00 -2.27 0.00 0.00 64.05 61.26 1aja n THR 148 Cb 0.64 1.19 0.05 0.00 -2.10 0.00 0.00 70.33 70.10 1aja n THR 148 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1aja n ALA 149 N -0.31 0.59 -1.77 6.98 0.00 -1.15 -1.01 120.51 123.85 1aja n ALA 149 Ca 0.07 -1.24 -0.41 0.00 0.00 0.00 0.00 53.44 51.87 1aja n ALA 149 Cb 0.39 0.31 -0.00 0.00 0.00 0.00 0.00 19.45 20.15 1aja n ALA 149 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1aja n GLU 150 N -1.84 2.65 0.27 0.00 1.02 -1.26 -0.96 120.64 120.52 1aja n GLU 150 Ca 0.10 0.93 0.15 0.00 -0.02 0.00 0.00 57.16 58.32 1aja n GLU 150 Cb 0.36 -2.65 0.72 0.00 -0.02 0.00 0.00 31.44 29.85 1aja n GLU 150 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1aja h LEU 151 N 3.01 0.00 -0.75 -4.62 4.07 -1.25 -0.06 115.31 115.71 1aja h LEU 151 Ca -0.50 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.46 1aja h LEU 151 Cb 1.24 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.98 1aja h LEU 151 CO 0.65 0.08 0.00 0.00 -1.08 0.00 0.00 178.44 178.08 1aja n GLN 152 N -3.28 1.47 -2.24 1.13 3.00 -1.26 -3.39 117.38 112.81 1aja n GLN 152 Ca -0.01 -0.69 -0.32 0.00 -0.01 0.00 0.00 57.00 55.97 1aja n GLN 152 Cb 0.28 -1.17 -0.02 0.00 0.00 0.00 0.00 30.24 29.33 1aja n GLN 152 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1aja s GLY 153 N -0.96 2.01 0.29 1.08 0.00 -0.04 -4.78 107.32 104.92 1aja s GLY 153 Ca 0.13 0.18 0.01 0.00 0.00 0.00 0.00 44.72 45.03 1aja s GLY 153 CO 0.08 0.46 1.60 0.00 0.00 0.00 0.00 173.10 175.24 1aja h ALA 154 N 0.61 1.14 -0.02 3.20 0.00 -1.90 -1.05 119.26 121.24 1aja h ALA 154 Ca -0.46 0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1aja h ALA 154 Cb 1.19 0.50 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1aja h ALA 154 CO 0.61 -0.53 -0.20 1.15 0.00 0.00 0.00 179.25 180.28 1aja h THR 155 N 0.07 1.50 -0.42 0.00 2.02 -1.92 -1.75 112.91 112.40 1aja h THR 155 Ca 0.56 -1.76 -0.08 0.00 0.77 0.00 0.00 66.41 65.90 1aja h THR 155 Cb 1.14 2.57 -0.01 0.00 -1.74 0.00 0.00 68.15 70.10 1aja h THR 155 CO -0.82 0.48 -0.04 1.55 0.37 0.00 0.00 175.52 177.07 1aja h PRO 156 N -0.44 0.77 -0.78 6.66 0.13 -1.80 -3.33 132.00 133.21 1aja h PRO 156 Ca -0.02 -0.26 -0.01 0.00 -0.87 0.00 0.00 66.00 64.84 1aja h PRO 156 Cb 0.89 -0.06 -0.04 0.00 0.13 0.00 0.00 31.00 31.93 1aja h PRO 156 CO 0.04 0.86 0.45 0.00 -0.23 0.00 0.00 178.00 179.12 1aja h ALA 157 N 0.88 1.32 -0.04 -0.56 0.00 -1.19 -2.33 119.26 117.34 1aja h ALA 157 Ca 0.11 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1aja h ALA 157 Cb 0.54 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1aja h ALA 157 CO 0.03 0.57 0.26 0.00 0.00 0.00 0.00 179.25 180.11 1aja h ALA 158 N 1.41 1.34 0.00 0.00 0.00 -1.42 0.38 119.26 120.97 1aja h ALA 158 Ca 0.28 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 1aja h ALA 158 Cb -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1aja h ALA 158 CO -0.05 -0.28 -0.15 -0.07 0.00 0.00 0.00 179.25 178.70 1aja h LEU 159 N 0.00 0.00 -0.64 0.00 3.38 -1.60 -3.40 115.31 113.06 1aja h LEU 159 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1aja h LEU 159 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1aja h LEU 159 CO -0.00 0.15 0.00 1.33 0.09 0.00 0.00 178.44 180.01 1aja n VAL 160 N -3.15 0.08 -4.07 1.22 0.24 -0.07 -4.50 118.33 108.08 1aja n VAL 160 Ca 0.03 -0.17 -0.11 0.00 -2.04 0.00 0.00 64.34 62.05 1aja n VAL 160 Cb 0.57 1.48 -0.11 0.00 -1.47 0.00 0.00 33.84 34.31 1aja n VAL 160 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1aja s ALA 161 N -0.08 0.56 -0.24 2.33 0.00 -0.12 -3.96 121.76 120.26 1aja s ALA 161 Ca 0.00 -0.94 -0.03 0.00 0.00 0.00 0.00 51.96 50.99 1aja s ALA 161 Cb 0.00 0.13 0.08 0.00 0.00 0.00 0.00 23.12 23.33 1aja s ALA 161 CO 0.00 -0.16 0.08 -1.01 0.00 0.00 0.00 175.76 174.67 1aja s HIS 162 N -2.34 0.85 0.09 0.00 3.76 -1.26 -4.08 115.29 112.31 1aja s HIS 162 Ca -0.03 -0.94 -0.04 0.00 -0.15 0.00 0.00 55.06 53.89 1aja s HIS 162 Cb -0.03 -1.08 -0.03 0.00 1.11 0.00 0.00 32.58 32.55 1aja s HIS 162 CO -0.03 -0.70 0.09 0.14 -0.85 0.00 0.00 174.74 173.39 1aja s VAL 163 N 1.91 0.16 -0.76 -0.90 -7.23 0.39 -4.97 120.40 108.99 1aja s VAL 163 Ca 0.04 -1.61 0.25 0.00 -1.81 0.00 0.00 61.98 58.85 1aja s VAL 163 Cb -0.17 -1.62 0.09 0.00 0.56 0.00 0.00 36.38 35.25 1aja s VAL 163 CO -0.18 -0.71 1.46 0.35 -0.31 0.00 0.00 175.10 175.71 1aja n THR 164 N -0.02 0.28 -3.81 5.32 -2.24 -1.26 -1.74 114.28 110.81 1aja n THR 164 Ca -0.12 -0.19 -0.14 0.00 -2.27 0.00 0.00 64.05 61.33 1aja n THR 164 Cb 0.62 -0.15 -0.15 0.00 -2.10 0.00 0.00 70.33 68.55 1aja n THR 164 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1aja s SER 165 N -3.90 0.02 0.57 3.42 0.15 -1.25 -4.16 113.70 108.55 1aja s SER 165 Ca 0.09 0.05 0.27 0.00 0.70 0.00 0.00 55.95 57.05 1aja s SER 165 Cb 0.15 -0.02 1.61 0.00 -1.71 0.00 0.00 66.02 66.05 1aja s SER 165 CO 0.68 -0.08 2.12 0.08 1.20 0.00 0.00 173.24 177.24 1aja h ARG 166 N 6.78 0.00 0.00 5.44 0.11 -0.36 -2.28 114.38 124.07 1aja h ARG 166 Ca -0.36 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.72 1aja h ARG 166 Cb 1.16 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.24 1aja h ARG 166 CO 0.49 0.00 0.00 1.63 0.10 0.00 0.00 179.97 182.19 1aja n LYS 167 N -3.96 0.21 -2.13 0.08 5.02 -1.26 -4.35 118.16 111.76 1aja n LYS 167 Ca 0.01 0.14 -0.42 0.00 -2.02 0.00 0.00 58.31 56.02 1aja n LYS 167 Cb 0.29 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 1aja n LYS 167 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1aja h TYR 169 N 5.95 0.25 -4.05 0.00 -1.99 -1.88 -0.67 116.97 114.58 1aja h TYR 169 Ca 0.46 -0.08 -0.27 0.00 2.00 0.00 0.00 58.73 60.84 1aja h TYR 169 Cb 0.65 -0.05 -0.07 0.00 2.00 0.00 0.00 36.73 39.26 1aja h TYR 169 CO 1.33 0.68 -0.15 0.20 -0.00 0.00 0.00 178.16 180.22 1aja s GLY 170 N -3.40 1.46 0.14 3.88 0.00 -1.26 -1.64 107.32 106.51 1aja s GLY 170 Ca -0.15 -1.49 -0.27 0.00 0.00 0.00 0.00 44.72 42.81 1aja s GLY 170 CO 0.72 -0.96 1.46 -2.55 0.00 0.00 0.00 173.10 171.78 1aja h PRO 171 N 2.08 -0.01 -0.91 2.90 0.11 -1.93 -0.87 132.00 133.37 1aja h PRO 171 Ca -0.28 0.00 0.15 0.00 0.11 0.00 0.00 66.00 65.98 1aja h PRO 171 Cb 1.24 0.00 -0.16 0.00 0.11 0.00 0.00 31.00 32.20 1aja h PRO 171 CO 0.39 -0.00 -0.32 0.43 -0.21 0.00 0.00 178.00 178.29 1aja n SER 172 N -4.93 -0.51 0.09 -2.05 7.64 -1.26 -0.96 113.62 111.65 1aja n SER 172 Ca 0.02 1.59 -0.14 0.00 1.01 0.00 0.00 58.87 61.34 1aja n SER 172 Cb 0.22 -0.40 -0.14 0.00 -1.01 0.00 0.00 64.21 62.89 1aja n SER 172 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1aja h ALA 173 N 1.44 0.16 -0.22 -0.43 0.00 -1.63 -3.22 119.26 115.36 1aja h ALA 173 Ca 0.36 -0.90 -0.08 0.00 0.00 0.00 0.00 54.91 54.29 1aja h ALA 173 Cb 0.58 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1aja h ALA 173 CO -0.92 1.04 -0.16 1.15 0.00 0.00 0.00 179.25 180.36 1aja h THR 174 N 0.06 1.32 -0.70 0.00 2.02 -0.25 -0.19 112.91 115.16 1aja h THR 174 Ca -0.11 -1.28 0.14 0.00 0.77 0.00 0.00 66.41 65.93 1aja h THR 174 Cb 1.93 1.68 -0.10 0.00 -1.74 0.00 0.00 68.15 69.92 1aja h THR 174 CO 0.19 0.39 0.19 0.28 0.37 0.00 0.00 175.52 176.94 1aja h SER 175 N 0.18 0.07 0.77 4.18 0.02 -1.13 0.24 113.55 117.89 1aja h SER 175 Ca 0.04 0.13 -0.25 0.00 -0.84 0.00 0.00 61.79 60.87 1aja h SER 175 Cb 0.68 0.16 -0.04 0.00 0.14 0.00 0.00 62.40 63.35 1aja h SER 175 CO 0.04 0.01 -1.32 -0.08 -1.14 0.00 0.00 176.83 174.34 1aja h GLU 176 N 0.31 0.01 0.00 3.45 4.81 -1.54 -3.34 114.58 118.28 1aja h GLU 176 Ca 0.39 -0.02 -0.20 0.00 -0.13 0.00 0.00 59.36 59.40 1aja h GLU 176 Cb 0.63 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.97 1aja h GLU 176 CO -0.46 0.79 -1.74 1.63 -0.73 0.00 0.00 179.01 178.50 1aja n LYS 177 N -3.23 2.22 -3.08 1.92 5.02 -0.09 -4.70 118.16 116.22 1aja n LYS 177 Ca -0.08 -0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 55.96 1aja n LYS 177 Cb 0.99 -1.28 -0.05 0.00 -0.02 0.00 0.00 35.03 34.68 1aja n LYS 177 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1aja h PRO 179 N 3.22 0.00 0.00 0.00 0.13 -1.63 0.15 132.00 133.88 1aja h PRO 179 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1aja h PRO 179 Cb 0.65 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.78 1aja h PRO 179 CO 0.73 0.16 0.00 0.41 -0.23 0.00 0.00 178.00 179.07 1aja n GLY 180 N -0.52 -1.09 0.19 1.56 0.00 -1.26 -2.14 105.19 101.93 1aja n GLY 180 Ca -0.01 -0.08 0.04 0.00 0.00 0.00 0.00 46.02 45.96 1aja n GLY 180 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1aja n ASN 181 N -1.42 1.13 -4.74 1.61 4.13 0.46 -4.28 115.26 112.16 1aja n ASN 181 Ca 0.06 -1.06 -0.42 0.00 1.68 0.00 0.00 54.58 54.84 1aja n ASN 181 Cb 0.20 0.38 -0.02 0.00 -1.54 0.00 0.00 39.78 38.80 1aja n ASN 181 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1aja s ALA 182 N -1.02 3.73 0.21 5.41 0.00 -0.76 -0.21 121.76 129.11 1aja s ALA 182 Ca 0.06 1.42 -0.09 0.00 0.00 0.00 0.00 51.96 53.35 1aja s ALA 182 Cb 0.06 -3.61 0.15 0.00 0.00 0.00 0.00 23.12 19.72 1aja s ALA 182 CO 0.16 -0.82 1.82 1.25 0.00 0.00 0.00 175.76 178.17 1aja h LEU 183 N 5.72 0.97 -1.12 0.00 5.85 -1.89 -1.15 115.31 123.69 1aja h LEU 183 Ca -0.45 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.16 1aja h LEU 183 Cb 1.21 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.99 1aja h LEU 183 CO 0.84 0.80 0.00 -1.84 -0.34 0.00 0.00 178.44 177.90 1aja n GLU 184 N -4.42 0.61 -0.21 1.25 0.00 -1.26 -2.13 120.64 114.48 1aja n GLU 184 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.23 1aja n GLU 184 Cb 0.11 -1.29 0.01 0.00 0.00 0.00 0.00 31.44 30.26 1aja n GLU 184 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1aja n LYS 185 N 0.25 0.18 -0.84 3.44 4.01 -0.52 -4.99 118.16 119.69 1aja n LYS 185 Ca 0.00 -0.83 0.00 0.00 -0.51 0.00 0.00 58.31 56.97 1aja n LYS 185 Cb 0.17 -0.56 0.00 0.00 -0.51 0.00 0.00 35.03 34.13 1aja n LYS 185 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1aja n GLY 186 N -0.08 0.85 3.94 0.72 0.00 -0.91 -4.91 105.19 104.81 1aja n GLY 186 Ca 0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1aja n GLY 186 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1aja s GLY 187 N -1.88 1.73 0.24 -0.02 0.00 -0.69 -5.00 107.32 101.71 1aja s GLY 187 Ca 0.00 -1.17 0.25 0.00 0.00 0.00 0.00 44.72 43.80 1aja s GLY 187 CO 0.00 -0.57 1.75 0.28 0.00 0.00 0.00 173.10 174.55 1aja n LYS 188 N -3.29 0.23 0.00 2.90 5.02 -1.21 -4.15 118.16 117.66 1aja n LYS 188 Ca 0.12 0.33 0.00 0.00 -2.02 0.00 0.00 58.31 56.74 1aja n LYS 188 Cb 0.60 -1.84 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 1aja n LYS 188 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1aja n GLY 189 N 0.62 -0.89 3.68 0.72 0.00 0.70 -4.52 105.19 105.50 1aja n GLY 189 Ca 0.04 -2.26 -0.30 0.00 0.00 0.00 0.00 46.02 43.51 1aja n GLY 189 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1aja s SER 190 N -0.27 1.87 0.17 1.61 1.04 -1.26 -4.71 113.70 112.15 1aja s SER 190 Ca 0.00 0.73 -0.14 0.00 0.48 0.00 0.00 55.95 57.01 1aja s SER 190 Cb 0.00 -1.07 0.06 0.00 0.10 0.00 0.00 66.02 65.11 1aja s SER 190 CO 0.00 -3.54 1.82 0.40 0.98 0.00 0.00 173.24 172.89 1aja h ILE 191 N -2.18 1.15 -0.52 -1.02 2.04 -1.10 -0.72 117.51 115.15 1aja h ILE 191 Ca -0.48 -0.30 -0.06 0.00 1.00 0.00 0.00 64.86 65.02 1aja h ILE 191 Cb 1.30 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1aja h ILE 191 CO 0.43 0.14 0.07 0.74 0.00 0.00 0.00 178.15 179.53 1aja h THR 192 N 0.69 1.24 -0.25 -0.27 2.02 -1.55 -0.09 112.91 114.69 1aja h THR 192 Ca 0.19 -0.92 -0.10 0.00 0.77 0.00 0.00 66.41 66.35 1aja h THR 192 Cb -0.04 0.76 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 1aja h THR 192 CO -0.04 0.33 -0.23 -0.33 0.37 0.00 0.00 175.52 175.62 1aja h GLU 193 N 0.79 0.60 0.00 6.66 5.08 -1.69 -1.49 114.58 124.53 1aja h GLU 193 Ca 0.16 -0.31 -0.08 0.00 -1.00 0.00 0.00 59.36 58.13 1aja h GLU 193 Cb 0.38 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 1aja h GLU 193 CO 0.01 0.90 -0.38 1.96 -1.00 0.00 0.00 179.01 180.50 1aja h GLN 194 N 0.32 0.00 -0.25 2.33 4.20 -0.88 -0.97 115.11 119.86 1aja h GLN 194 Ca 0.04 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 1aja h GLN 194 Cb 0.78 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.55 1aja h GLN 194 CO 0.06 0.38 0.11 1.25 -0.67 0.00 0.00 178.83 179.96 1aja h LEU 195 N 0.00 0.33 -1.01 1.46 6.46 -0.79 0.21 115.31 121.96 1aja h LEU 195 Ca -0.00 -0.15 -0.02 0.00 -0.12 0.00 0.00 57.88 57.58 1aja h LEU 195 Cb 0.69 -0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 40.50 1aja h LEU 195 CO 0.05 0.39 0.38 -0.07 -0.62 0.00 0.00 178.44 178.56 1aja h LEU 196 N 0.25 0.97 -0.68 2.25 4.07 -0.74 -2.21 115.31 119.23 1aja h LEU 196 Ca 0.08 -0.10 -0.14 0.00 0.08 0.00 0.00 57.88 57.80 1aja h LEU 196 Cb 0.15 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 41.63 1aja h LEU 196 CO -0.01 0.81 -0.58 0.78 -1.08 0.00 0.00 178.44 178.37 1aja h ASN 197 N 1.07 0.29 0.56 -0.43 2.35 -0.83 -3.27 115.58 115.33 1aja h ASN 197 Ca 0.26 -0.16 -0.04 0.00 -0.55 0.00 0.00 56.30 55.81 1aja h ASN 197 Cb 0.09 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 1aja h ASN 197 CO -0.04 0.81 -0.18 0.00 -1.65 0.00 0.00 177.43 176.37 1aja h ALA 198 N 1.20 1.19 -6.66 -0.83 0.00 0.05 -3.47 119.26 110.73 1aja h ALA 198 Ca -0.00 -0.16 -0.52 0.00 0.00 0.00 0.00 54.91 54.23 1aja h ALA 198 Cb 1.07 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.85 1aja h ALA 198 CO 0.09 0.23 -0.97 -2.13 0.00 0.00 0.00 179.25 176.46 1aja n ARG 199 N -3.58 -0.75 -2.27 0.00 0.63 -1.16 -4.95 116.66 104.57 1aja n ARG 199 Ca -0.01 0.34 -0.36 0.00 -0.92 0.00 0.00 57.85 56.89 1aja n ARG 199 Cb 0.32 -3.03 -0.01 0.00 0.45 0.00 0.00 32.46 30.19 1aja n ARG 199 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1aja s ALA 200 N -3.40 2.88 0.38 5.13 0.00 -1.26 -4.94 121.76 120.55 1aja s ALA 200 Ca 0.40 0.88 0.06 0.00 0.00 0.00 0.00 51.96 53.30 1aja s ALA 200 Cb -0.19 -3.37 0.75 0.00 0.00 0.00 0.00 23.12 20.31 1aja s ALA 200 CO 0.92 -0.67 1.96 -0.44 0.00 0.00 0.00 175.76 177.53 1aja h ASP 201 N 1.76 0.43 -3.35 0.00 3.32 -1.72 -3.42 116.42 113.45 1aja h ASP 201 Ca -0.50 -0.05 -0.39 0.00 0.02 0.00 0.00 57.03 56.12 1aja h ASP 201 Cb 1.25 -0.11 -0.37 0.00 0.22 0.00 0.00 39.33 40.32 1aja h ASP 201 CO 0.59 0.43 -0.75 -0.69 -1.72 0.00 0.00 179.24 177.10 1aja s VAL 202 N -5.15 0.16 -0.09 -1.35 1.01 -1.14 -1.26 120.40 112.58 1aja s VAL 202 Ca -0.07 0.21 -0.01 0.00 0.00 0.00 0.00 61.98 62.10 1aja s VAL 202 Cb 0.16 -0.33 0.03 0.00 0.00 0.00 0.00 36.38 36.24 1aja s VAL 202 CO 0.74 0.20 -0.04 -0.89 0.00 0.00 0.00 175.10 175.11 1aja s THR 203 N 1.73 0.74 -0.03 3.92 2.01 -0.12 -0.51 115.64 123.38 1aja s THR 203 Ca 0.00 -0.11 0.00 0.00 0.31 0.00 0.00 61.69 61.90 1aja s THR 203 Cb -0.13 -0.81 0.03 0.00 0.01 0.00 0.00 72.50 71.60 1aja s THR 203 CO -0.03 0.32 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.44 1aja s LEU 204 N 1.77 1.18 0.00 4.42 1.43 -0.46 -0.10 118.68 126.92 1aja s LEU 204 Ca 0.04 -0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.09 1aja s LEU 204 Cb -0.13 -0.28 0.00 0.00 0.03 0.00 0.00 46.19 45.81 1aja s LEU 204 CO -0.06 -0.09 0.00 0.61 0.23 0.00 0.00 176.35 177.03 1aja n GLY 205 N 4.16 -0.97 0.00 -3.19 0.00 -0.36 -1.06 105.19 103.77 1aja n GLY 205 Ca -0.25 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 44.91 1aja n GLY 205 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aja n GLY 206 N 0.00 2.38 0.07 -0.02 0.00 -0.13 -1.47 105.19 106.02 1aja n GLY 206 Ca 0.00 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.92 1aja n GLY 206 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aja n GLY 207 N 5.00 0.98 0.36 -0.02 0.00 -0.01 -0.76 105.19 110.74 1aja n GLY 207 Ca 0.00 -0.01 0.17 0.00 0.00 0.00 0.00 46.02 46.17 1aja n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aja h ALA 208 N 0.00 1.69 -0.73 4.61 0.00 -0.91 -3.12 119.26 120.80 1aja h ALA 208 Ca 0.00 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.95 1aja h ALA 208 Cb 0.00 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1aja h ALA 208 CO 0.00 -0.50 0.44 -0.22 0.00 0.00 0.00 179.25 178.97 1aja h LYS 209 N 0.00 0.81 0.00 0.00 3.64 -1.54 -1.97 116.57 117.51 1aja h LYS 209 Ca 0.08 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.32 1aja h LYS 209 Cb 0.91 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 1aja h LYS 209 CO -0.00 0.53 -0.45 1.15 -2.27 0.00 0.00 179.45 178.41 1aja h THR 210 N 0.83 1.17 0.00 1.00 2.02 -1.81 -2.33 112.91 113.79 1aja h THR 210 Ca 0.31 -1.63 0.00 0.00 0.77 0.00 0.00 66.41 65.86 1aja h THR 210 Cb 0.11 1.92 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 1aja h THR 210 CO -0.15 0.44 0.00 0.49 0.37 0.00 0.00 175.52 176.67 1aja n PHE 211 N -3.78 0.00 1.52 3.16 3.01 -0.74 -0.81 117.46 119.82 1aja n PHE 211 Ca -0.01 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.59 1aja n PHE 211 Cb 0.51 -0.39 0.65 0.00 -0.01 0.00 0.00 39.48 40.24 1aja n PHE 211 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1aja n ALA 212 N -1.39 2.72 -2.01 4.37 0.00 -0.88 -1.04 120.51 122.28 1aja n ALA 212 Ca 0.01 -0.29 -0.31 0.00 0.00 0.00 0.00 53.44 52.85 1aja n ALA 212 Cb 0.02 -1.33 -0.03 0.00 0.00 0.00 0.00 19.45 18.10 1aja n ALA 212 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1aja s GLU 213 N -2.31 3.86 -0.09 0.00 2.02 0.01 -4.80 118.70 117.38 1aja s GLU 213 Ca 0.34 0.71 -0.04 0.00 0.02 0.00 0.00 54.97 56.00 1aja s GLU 213 Cb 0.21 -2.26 -0.04 0.00 0.10 0.00 0.00 34.13 32.14 1aja s GLU 213 CO 0.43 -0.16 0.06 0.95 0.02 0.00 0.00 175.26 176.57 1aja s THR 214 N -2.50 4.81 0.50 3.63 -4.23 -1.26 -0.79 115.64 115.80 1aja s THR 214 Ca 0.55 -0.08 -0.21 0.00 -1.18 0.00 0.00 61.69 60.77 1aja s THR 214 Cb -0.10 -3.07 -0.07 0.00 1.34 0.00 0.00 72.50 70.61 1aja s THR 214 CO 0.31 0.59 1.13 0.00 -0.54 0.00 0.00 174.62 176.12 1aja s ALA 215 N -0.96 2.82 -0.57 3.99 0.00 -0.93 -4.81 121.76 121.30 1aja s ALA 215 Ca 0.15 0.85 0.24 0.00 0.00 0.00 0.00 51.96 53.19 1aja s ALA 215 Cb -0.12 -3.36 0.27 0.00 0.00 0.00 0.00 23.12 19.91 1aja s ALA 215 CO 0.04 -0.68 1.26 1.79 0.00 0.00 0.00 175.76 178.17 1aja h THR 216 N 1.51 0.00 -2.81 0.00 1.35 -1.93 -1.79 112.91 109.25 1aja h THR 216 Ca -0.50 -0.57 -0.04 0.00 -0.55 0.00 0.00 66.41 64.75 1aja h THR 216 Cb 1.25 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 68.79 1aja h THR 216 CO 0.58 0.00 0.17 0.00 -0.25 0.00 0.00 175.52 176.03 1aja n ALA 217 N -1.88 -1.21 0.00 6.62 0.00 -1.26 -4.80 120.51 117.97 1aja n ALA 217 Ca 0.03 -0.96 0.00 0.00 0.00 0.00 0.00 53.44 52.50 1aja n ALA 217 Cb 0.46 0.77 0.00 0.00 0.00 0.00 0.00 19.45 20.67 1aja n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aja n GLY 218 N -0.40 -2.22 0.28 0.00 0.00 -1.26 -3.63 105.19 97.96 1aja n GLY 218 Ca -0.06 -1.51 0.14 0.00 0.00 0.00 0.00 46.02 44.60 1aja n GLY 218 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1aja h GLU 219 N 0.00 0.00 -0.21 1.61 4.81 -2.01 -2.83 114.58 115.95 1aja h GLU 219 Ca 0.00 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 1aja h GLU 219 Cb 0.00 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 1aja h GLU 219 CO 0.00 0.09 -0.07 0.91 -0.73 0.00 0.00 179.01 179.21 1aja n TRP 220 N -3.56 0.70 -1.64 0.92 8.01 -1.26 -5.03 117.44 115.58 1aja n TRP 220 Ca -0.02 -1.19 -0.47 0.00 -1.31 0.00 0.00 57.50 54.52 1aja n TRP 220 Cb 0.21 -0.33 -0.04 0.00 -2.01 0.00 0.00 31.31 29.15 1aja n TRP 220 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.69 177.62 1aja n GLN 221 N -0.96 1.74 0.00 -0.99 7.27 -1.07 -1.52 117.38 121.85 1aja n GLN 221 Ca 0.24 0.62 0.00 0.00 0.07 0.00 0.00 57.00 57.93 1aja n GLN 221 Cb 0.87 -2.26 0.00 0.00 2.41 0.00 0.00 30.24 31.26 1aja n GLN 221 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1aja n GLY 222 N 2.40 3.06 3.88 1.69 0.00 -0.67 -4.92 105.19 110.62 1aja n GLY 222 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1aja n GLY 222 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aja s LYS 223 N -0.18 3.71 0.62 1.61 -0.14 -0.57 -4.84 119.74 119.95 1aja s LYS 223 Ca 0.00 0.54 -0.10 0.00 -1.36 0.00 0.00 55.97 55.06 1aja s LYS 223 Cb 0.00 -2.28 -0.02 0.00 -1.68 0.00 0.00 37.83 33.86 1aja s LYS 223 CO 0.00 -0.24 1.00 0.95 -0.76 0.00 0.00 175.35 176.30 1aja s THR 224 N -2.69 4.20 0.36 2.17 -4.23 -1.26 -2.18 115.64 112.01 1aja s THR 224 Ca 0.52 0.53 0.32 0.00 -1.18 0.00 0.00 61.69 61.89 1aja s THR 224 Cb -0.10 -3.68 0.35 0.00 1.34 0.00 0.00 72.50 70.40 1aja s THR 224 CO 0.40 -0.84 2.09 -0.07 -0.54 0.00 0.00 174.62 175.66 1aja h LEU 225 N -0.33 0.00 -0.13 4.79 3.38 -0.72 0.81 115.31 123.11 1aja h LEU 225 Ca -0.45 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.46 1aja h LEU 225 Cb 1.22 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.97 1aja h LEU 225 CO 0.62 0.07 -0.17 -0.09 0.09 0.00 0.00 178.44 178.97 1aja h ARG 226 N 0.00 0.34 -0.61 1.13 2.43 -1.37 -1.29 114.38 115.01 1aja h ARG 226 Ca -0.00 -0.19 -0.04 0.00 -0.81 0.00 0.00 59.98 58.93 1aja h ARG 226 Cb 0.35 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.88 1aja h ARG 226 CO 0.01 0.76 0.21 0.93 -1.51 0.00 0.00 179.97 180.37 1aja h GLU 227 N -0.06 0.92 0.51 0.20 5.08 -1.38 -2.30 114.58 117.55 1aja h GLU 227 Ca 0.02 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.19 1aja h GLU 227 Cb 0.72 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 1aja h GLU 227 CO 0.04 0.78 -0.30 0.37 -1.00 0.00 0.00 179.01 178.90 1aja h GLN 228 N 0.89 -0.73 -0.98 2.33 4.15 -0.91 -0.09 115.11 119.78 1aja h GLN 228 Ca 0.20 0.05 0.14 0.00 0.77 0.00 0.00 58.65 59.81 1aja h GLN 228 Cb 0.23 0.17 -0.08 0.00 0.21 0.00 0.00 27.48 28.00 1aja h GLN 228 CO -0.01 -0.49 0.62 0.00 -1.93 0.00 0.00 178.83 177.02 1aja h ALA 229 N -0.31 1.62 0.21 3.38 0.00 -0.89 0.26 119.26 123.54 1aja h ALA 229 Ca -0.06 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1aja h ALA 229 Cb 0.62 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1aja h ALA 229 CO 0.07 0.11 -0.10 0.93 0.00 0.00 0.00 179.25 180.26 1aja h GLU 230 N 0.89 -0.27 -0.61 0.00 5.08 -1.28 -0.95 114.58 117.44 1aja h GLU 230 Ca 0.50 0.02 0.15 0.00 -1.00 0.00 0.00 59.36 59.02 1aja h GLU 230 Cb 0.61 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.89 1aja h GLU 230 CO -0.27 0.01 0.42 0.00 -1.00 0.00 0.00 179.01 178.18 1aja h ALA 231 N 0.16 2.33 -0.30 3.43 0.00 -0.01 -0.83 119.26 124.03 1aja h ALA 231 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1aja h ALA 231 Cb 0.41 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1aja h ALA 231 CO 0.05 -0.50 0.00 0.54 0.00 0.00 0.00 179.25 179.34 1aja n ARG 232 N -4.42 2.03 -0.51 0.00 1.74 0.83 -4.89 116.66 111.44 1aja n ARG 232 Ca 0.11 -1.23 0.00 0.00 -0.77 0.00 0.00 57.85 55.96 1aja n ARG 232 Cb 0.56 -1.43 0.00 0.00 -1.02 0.00 0.00 32.46 30.57 1aja n ARG 232 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1aja n GLY 233 N 0.79 0.71 3.77 -0.13 0.00 -0.32 -5.00 105.19 105.02 1aja n GLY 233 Ca 0.11 -0.35 -0.40 0.00 0.00 0.00 0.00 46.02 45.38 1aja n GLY 233 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1aja s TYR 234 N -2.00 3.87 -0.30 1.61 1.51 -0.40 -3.75 117.35 117.90 1aja s TYR 234 Ca 0.00 1.60 -0.21 0.00 -1.01 0.00 0.00 57.07 57.46 1aja s TYR 234 Cb 0.00 -2.78 -0.01 0.00 -0.11 0.00 0.00 41.96 39.06 1aja s TYR 234 CO 0.00 0.46 0.65 1.14 -1.11 0.00 0.00 175.55 176.69 1aja s GLN 235 N -0.89 3.92 -0.22 -0.62 -2.07 0.50 -4.54 119.66 115.75 1aja s GLN 235 Ca 0.36 0.35 -0.09 0.00 -1.82 0.00 0.00 55.36 54.17 1aja s GLN 235 Cb -0.23 -3.72 -0.04 0.00 -1.09 0.00 0.00 33.01 27.93 1aja s GLN 235 CO 0.26 -0.57 0.11 -0.51 -1.32 0.00 0.00 175.29 173.25 1aja s LEU 236 N 2.64 3.92 0.03 2.60 1.02 -1.26 -0.73 118.68 126.90 1aja s LEU 236 Ca 0.26 0.07 0.09 0.00 0.02 0.00 0.00 54.13 54.56 1aja s LEU 236 Cb -0.15 -2.03 -0.03 0.00 0.02 0.00 0.00 46.19 44.01 1aja s LEU 236 CO 0.12 0.10 -0.25 0.68 0.02 0.00 0.00 176.35 177.01 1aja s VAL 237 N 0.82 2.05 -0.04 -1.59 -7.23 -0.71 -5.00 120.40 108.70 1aja s VAL 237 Ca 0.06 -1.28 0.06 0.00 -1.81 0.00 0.00 61.98 59.01 1aja s VAL 237 Cb -0.13 -1.74 0.10 0.00 0.56 0.00 0.00 36.38 35.17 1aja s VAL 237 CO 0.02 0.40 0.97 -1.54 -0.31 0.00 0.00 175.10 174.64 1aja n SER 238 N 1.97 1.19 -3.66 4.85 3.41 -1.26 -1.79 113.62 118.33 1aja n SER 238 Ca -0.17 -2.20 -0.07 0.00 -0.26 0.00 0.00 58.87 56.17 1aja n SER 238 Cb 0.52 -0.21 -0.01 0.00 -0.26 0.00 0.00 64.21 64.25 1aja n SER 238 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1aja s ASP 239 N -1.47 -0.20 0.40 4.04 1.47 -1.26 -4.53 116.67 115.11 1aja s ASP 239 Ca 0.11 -0.72 0.09 0.00 1.18 0.00 0.00 52.55 53.21 1aja s ASP 239 Cb 0.10 0.75 0.82 0.00 -0.34 0.00 0.00 42.92 44.25 1aja s ASP 239 CO 0.01 -1.41 1.95 0.00 0.68 0.00 0.00 175.17 176.39 1aja h ALA 240 N 2.00 1.56 0.27 2.11 0.00 -1.10 -2.49 119.26 121.60 1aja h ALA 240 Ca -0.22 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 1aja h ALA 240 Cb 1.25 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1aja h ALA 240 CO 0.27 0.32 -0.13 0.00 0.00 0.00 0.00 179.25 179.71 1aja h ALA 241 N 1.68 -0.36 -0.46 0.00 0.00 -1.90 -1.42 119.26 116.80 1aja h ALA 241 Ca 0.06 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1aja h ALA 241 Cb 0.29 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1aja h ALA 241 CO 0.01 -0.56 0.03 0.66 0.00 0.00 0.00 179.25 179.40 1aja h SER 242 N -0.64 0.70 -0.38 0.00 4.64 -1.97 -2.20 113.55 113.70 1aja h SER 242 Ca -0.04 -0.15 0.01 0.00 -0.47 0.00 0.00 61.79 61.14 1aja h SER 242 Cb 0.46 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.34 1aja h SER 242 CO 0.06 0.75 0.24 0.25 -0.87 0.00 0.00 176.83 177.26 1aja h LEU 243 N 0.70 0.39 -0.54 5.97 5.85 -1.30 -2.10 115.31 124.28 1aja h LEU 243 Ca 0.14 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1aja h LEU 243 Cb 0.39 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.33 1aja h LEU 243 CO 0.01 0.28 0.00 0.59 -0.34 0.00 0.00 178.44 178.99 1aja n ASN 244 N -4.85 0.67 0.18 1.25 4.13 -0.55 -2.23 115.26 113.86 1aja n ASN 244 Ca 0.00 0.64 0.03 0.00 1.68 0.00 0.00 54.58 56.94 1aja n ASN 244 Cb 0.04 -0.79 0.34 0.00 -1.54 0.00 0.00 39.78 37.84 1aja n ASN 244 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 1aja h SER 245 N 0.00 0.00 -2.46 6.41 0.02 -0.87 -3.46 113.55 113.19 1aja h SER 245 Ca 0.00 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.40 1aja h SER 245 Cb 0.43 0.00 0.05 0.00 0.14 0.00 0.00 62.40 63.02 1aja h SER 245 CO 0.00 0.41 1.00 0.52 -1.14 0.00 0.00 176.83 177.61 1aja n VAL 246 N -3.87 0.16 -0.02 2.27 0.31 -0.95 -4.90 118.33 111.34 1aja n VAL 246 Ca -0.01 -0.03 -0.17 0.00 -0.01 0.00 0.00 64.34 64.11 1aja n VAL 246 Cb 0.46 -1.92 -0.14 0.00 -0.91 0.00 0.00 33.84 31.34 1aja n VAL 246 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1aja n THR 247 N 4.16 1.70 -3.56 2.52 -1.04 -1.26 -5.01 114.28 111.78 1aja n THR 247 Ca 0.17 -0.69 -0.11 0.00 -2.04 0.00 0.00 64.05 61.38 1aja n THR 247 Cb 0.34 -1.48 -0.04 0.00 -1.82 0.00 0.00 70.33 67.33 1aja n THR 247 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1aja s GLU 248 N -2.56 1.13 -0.06 -2.82 0.41 -1.26 -4.92 118.70 108.61 1aja s GLU 248 Ca -0.19 -0.61 -0.04 0.00 -0.41 0.00 0.00 54.97 53.72 1aja s GLU 248 Cb 0.07 0.51 0.03 0.00 -1.78 0.00 0.00 34.13 32.96 1aja s GLU 248 CO 0.77 -0.46 0.15 0.00 -0.49 0.00 0.00 175.26 175.23 1aja s ALA 249 N -3.73 -0.32 0.00 5.21 0.00 -1.26 -4.91 121.76 116.75 1aja s ALA 249 Ca 0.02 0.58 0.00 0.00 0.00 0.00 0.00 51.96 52.56 1aja s ALA 249 Cb 0.01 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.76 1aja s ALA 249 CO -0.12 -0.12 0.00 0.27 0.00 0.00 0.00 175.76 175.79 1aja n ASN 250 N 3.68 0.00 0.22 0.00 0.23 -0.24 -4.86 115.26 114.30 1aja n ASN 250 Ca -0.20 -0.78 0.10 0.00 -0.53 0.00 0.00 54.58 53.16 1aja n ASN 250 Cb 0.55 0.00 0.44 0.00 -2.08 0.00 0.00 39.78 38.69 1aja n ASN 250 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 1aja h GLN 251 N 0.00 0.00 0.22 -3.83 1.08 -1.92 -1.54 115.11 109.11 1aja h GLN 251 Ca 0.00 0.00 -0.35 0.00 -1.45 0.00 0.00 58.65 56.85 1aja h GLN 251 Cb 0.00 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 27.45 1aja h GLN 251 CO 0.00 0.23 -1.63 1.96 -0.95 0.00 0.00 178.83 178.44 1aja h GLN 252 N 0.00 0.46 -3.14 1.46 4.20 -1.96 -3.39 115.11 112.73 1aja h GLN 252 Ca -0.00 -0.79 -0.63 0.00 0.06 0.00 0.00 58.65 57.29 1aja h GLN 252 Cb 0.78 0.29 -0.42 0.00 0.30 0.00 0.00 27.48 28.43 1aja h GLN 252 CO 0.03 1.38 -0.56 0.15 -0.67 0.00 0.00 178.83 179.16 1aja s LYS 253 N -2.59 2.42 0.16 1.46 1.02 -1.17 -4.84 119.74 116.21 1aja s LYS 253 Ca -0.13 -3.23 -0.20 0.00 0.02 0.00 0.00 55.97 52.43 1aja s LYS 253 Cb 0.05 -3.43 -0.08 0.00 -0.52 0.00 0.00 37.83 33.85 1aja s LYS 253 CO 0.89 -1.26 0.66 -1.25 -0.92 0.00 0.00 175.35 173.48 1aja s PRO 254 N -1.27 4.26 -0.09 -1.68 0.04 -0.59 -1.08 135.00 134.59 1aja s PRO 254 Ca 0.24 0.83 -0.16 0.00 0.04 0.00 0.00 61.00 61.95 1aja s PRO 254 Cb -0.08 -3.07 -0.05 0.00 0.04 0.00 0.00 34.50 31.35 1aja s PRO 254 CO -0.14 0.51 0.41 -1.17 0.04 0.00 0.00 177.00 176.65 1aja s LEU 255 N -1.56 4.34 -0.16 -3.56 2.96 -0.39 -0.37 118.68 119.93 1aja s LEU 255 Ca 0.37 0.79 -0.02 0.00 -0.22 0.00 0.00 54.13 55.05 1aja s LEU 255 Cb -0.18 -2.58 0.05 0.00 0.50 0.00 0.00 46.19 43.98 1aja s LEU 255 CO 0.21 0.14 -0.00 -0.22 -1.32 0.00 0.00 176.35 175.16 1aja s LEU 256 N 0.01 1.26 -0.21 -0.68 2.96 0.09 -0.94 118.68 121.17 1aja s LEU 256 Ca 0.23 -0.65 -0.03 0.00 -0.22 0.00 0.00 54.13 53.46 1aja s LEU 256 Cb -0.15 -0.69 -0.01 0.00 0.50 0.00 0.00 46.19 45.85 1aja s LEU 256 CO 0.10 -0.25 -0.06 -0.83 -1.32 0.00 0.00 176.35 173.99 1aja s GLY 257 N 1.79 1.59 -0.39 7.98 0.00 0.86 -1.73 107.32 117.42 1aja s GLY 257 Ca 0.00 -1.13 0.04 0.00 0.00 0.00 0.00 44.72 43.63 1aja s GLY 257 CO -0.07 0.35 0.11 1.08 0.00 0.00 0.00 173.10 174.57 1aja s LEU 258 N 1.33 4.66 0.00 0.66 1.43 -0.74 -1.23 118.68 124.79 1aja s LEU 258 Ca 0.04 -2.39 0.24 0.00 -1.03 0.00 0.00 54.13 50.99 1aja s LEU 258 Cb -0.14 -1.64 0.38 0.00 0.03 0.00 0.00 46.19 44.81 1aja s LEU 258 CO -0.03 -0.34 1.32 0.49 0.23 0.00 0.00 176.35 178.02 1aja n PHE 259 N 3.95 0.00 -3.63 0.29 3.72 -0.54 -4.45 117.46 116.79 1aja n PHE 259 Ca 0.04 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.30 1aja n PHE 259 Cb 0.39 -0.14 -0.06 0.00 -0.94 0.00 0.00 39.48 38.73 1aja n PHE 259 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1aja s ALA 260 N -2.81 -1.18 0.11 4.37 0.00 -1.26 -4.92 121.76 116.07 1aja s ALA 260 Ca 0.15 0.55 -0.15 0.00 0.00 0.00 0.00 51.96 52.50 1aja s ALA 260 Cb 0.18 0.26 -0.05 0.00 0.00 0.00 0.00 23.12 23.51 1aja s ALA 260 CO 0.67 -0.43 1.51 -0.44 0.00 0.00 0.00 175.76 177.07 1aja h ASP 261 N 3.07 0.68 0.00 0.00 5.19 -1.92 -1.07 116.42 122.37 1aja h ASP 261 Ca -0.30 -0.37 0.00 0.00 -0.62 0.00 0.00 57.03 55.74 1aja h ASP 261 Cb 1.19 -0.19 0.00 0.00 0.18 0.00 0.00 39.33 40.52 1aja h ASP 261 CO 0.42 0.89 0.00 0.61 -3.12 0.00 0.00 179.24 178.04 1aja n GLY 262 N -0.17 1.77 3.81 2.75 0.00 -1.26 -1.62 105.19 110.48 1aja n GLY 262 Ca -0.02 -0.34 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 1aja n GLY 262 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1aja s ASN 263 N 0.02 5.79 0.70 1.61 0.01 -1.26 -0.83 114.94 120.98 1aja s ASN 263 Ca 0.00 1.78 -0.13 0.00 -0.71 0.00 0.00 52.86 53.80 1aja s ASN 263 Cb 0.00 -2.53 0.02 0.00 0.41 0.00 0.00 41.25 39.15 1aja s ASN 263 CO 0.00 -1.16 1.10 -0.04 -1.51 0.00 0.00 177.10 175.48 1aja s MET 264 N -4.18 2.65 0.36 -0.60 -1.94 -0.18 -4.86 119.30 110.55 1aja s MET 264 Ca 0.63 1.27 -0.27 0.00 -1.71 0.00 0.00 55.69 55.61 1aja s MET 264 Cb -0.15 -1.94 -0.09 0.00 2.01 0.00 0.00 34.83 34.66 1aja s MET 264 CO 0.39 -1.35 1.18 -1.25 -0.01 0.00 0.00 175.02 173.98 1aja s PRO 265 N -4.45 4.26 0.39 2.03 0.04 -1.26 -4.87 135.00 131.14 1aja s PRO 265 Ca 0.64 1.91 -0.26 0.00 0.04 0.00 0.00 61.00 63.33 1aja s PRO 265 Cb -0.19 -2.88 -0.09 0.00 0.04 0.00 0.00 34.50 31.39 1aja s PRO 265 CO 0.47 -0.16 1.23 0.08 0.04 0.00 0.00 177.00 178.66 1aja s VAL 266 N -1.30 2.91 0.13 -0.36 1.01 -1.26 -4.86 120.40 116.66 1aja s VAL 266 Ca 0.52 0.81 -0.16 0.00 0.00 0.00 0.00 61.98 63.15 1aja s VAL 266 Cb -0.33 -3.47 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 1aja s VAL 266 CO 0.42 0.11 1.66 -0.09 0.00 0.00 0.00 175.10 177.20 1aja h ARG 267 N 2.81 0.60 -5.85 2.72 2.43 -1.89 -3.42 114.38 111.78 1aja h ARG 267 Ca -0.49 -0.12 -0.55 0.00 -0.81 0.00 0.00 59.98 58.01 1aja h ARG 267 Cb 1.24 -0.09 -0.26 0.00 -0.42 0.00 0.00 29.97 30.44 1aja h ARG 267 CO 0.63 0.60 -0.83 -1.58 -1.51 0.00 0.00 179.97 177.28 1aja s TRP 268 N -5.44 1.65 0.03 2.20 0.51 -1.26 -0.75 118.94 115.88 1aja s TRP 268 Ca -0.13 -0.36 0.01 0.00 -2.12 0.00 0.00 56.10 53.50 1aja s TRP 268 Cb 0.10 -0.99 -0.04 0.00 -0.81 0.00 0.00 33.47 31.73 1aja s TRP 268 CO 0.76 0.06 0.09 -0.51 -0.51 0.00 0.00 176.95 176.84 1aja s LEU 269 N -1.04 3.91 0.01 2.99 1.02 0.63 -3.95 118.68 122.24 1aja s LEU 269 Ca 0.06 0.10 -0.29 0.00 0.02 0.00 0.00 54.13 54.02 1aja s LEU 269 Cb -0.08 -2.42 0.10 0.00 0.02 0.00 0.00 46.19 43.81 1aja s LEU 269 CO 0.01 0.22 1.06 -0.83 0.02 0.00 0.00 176.35 176.83 1aja s GLY 270 N -2.06 -0.35 0.90 -3.19 0.00 -1.26 -2.14 107.32 99.23 1aja s GLY 270 Ca 0.26 0.78 -0.12 0.00 0.00 0.00 0.00 44.72 45.64 1aja s GLY 270 CO 0.18 0.22 1.12 -4.14 0.00 0.00 0.00 173.10 170.48 1aja s PRO 271 N -2.89 1.20 0.33 2.90 0.02 -1.26 -4.91 135.00 130.39 1aja s PRO 271 Ca 0.10 0.45 -0.18 0.00 0.02 0.00 0.00 61.00 61.39 1aja s PRO 271 Cb 0.00 -1.83 -0.09 0.00 0.02 0.00 0.00 34.50 32.59 1aja s PRO 271 CO -0.04 -2.19 0.80 0.15 -0.33 0.00 0.00 177.00 175.40 1aja s LYS 272 N -5.16 4.14 0.79 5.54 1.02 -1.26 -4.35 119.74 120.46 1aja s LYS 272 Ca 0.63 0.86 -0.11 0.00 0.02 0.00 0.00 55.97 57.37 1aja s LYS 272 Cb -0.16 -2.46 0.07 0.00 -0.52 0.00 0.00 37.83 34.76 1aja s LYS 272 CO 0.55 0.15 1.11 0.00 -0.92 0.00 0.00 175.35 176.24 1aja s ALA 273 N -1.94 2.11 0.05 5.17 0.00 0.92 -4.98 121.76 123.09 1aja s ALA 273 Ca 0.54 0.40 -0.07 0.00 0.00 0.00 0.00 51.96 52.83 1aja s ALA 273 Cb -0.11 -3.33 -0.01 0.00 0.00 0.00 0.00 23.12 19.67 1aja s ALA 273 CO 0.17 -1.92 0.14 0.99 0.00 0.00 0.00 175.76 175.15 1aja s THR 274 N -2.73 0.13 -0.07 0.00 2.01 -0.12 -4.72 115.64 110.14 1aja s THR 274 Ca 0.64 -1.09 -0.30 0.00 0.31 0.00 0.00 61.69 61.25 1aja s THR 274 Cb -0.19 -1.05 -0.04 0.00 0.01 0.00 0.00 72.50 71.23 1aja s THR 274 CO 0.54 -0.60 1.50 -0.47 -0.69 0.00 0.00 174.62 174.90 1aja s TYR 275 N -2.97 2.39 -1.61 4.92 5.04 -1.25 -0.53 117.35 123.34 1aja s TYR 275 Ca -0.02 0.54 0.00 0.00 -2.44 0.00 0.00 57.07 55.15 1aja s TYR 275 Cb 0.01 -3.76 0.00 0.00 0.35 0.00 0.00 41.96 38.56 1aja s TYR 275 CO -0.06 -3.00 0.00 0.72 -1.34 0.00 0.00 175.55 171.87 1aja n HIS 276 N 6.61 -0.78 0.23 4.97 8.25 -1.26 -4.91 115.22 128.34 1aja n HIS 276 Ca 0.15 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.69 1aja n HIS 276 Cb 0.43 -3.56 0.57 0.00 1.12 0.00 0.00 29.99 28.55 1aja n HIS 276 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1aja h GLY 277 N 0.00 0.00 2.00 -1.41 0.00 -1.28 0.20 103.07 102.58 1aja h GLY 277 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1aja h GLY 277 CO 0.52 0.00 0.00 1.16 0.00 0.00 0.00 176.54 178.22 1aja n ASN 278 N -4.09 0.41 -0.04 0.19 6.94 -1.26 -1.89 115.26 115.53 1aja n ASN 278 Ca -0.02 0.55 -0.05 0.00 -0.02 0.00 0.00 54.58 55.04 1aja n ASN 278 Cb 0.25 -0.66 -0.05 0.00 -2.36 0.00 0.00 39.78 36.96 1aja n ASN 278 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 1aja n ILE 279 N -1.90 0.52 0.90 1.53 -5.35 -0.61 -4.67 119.36 109.78 1aja n ILE 279 Ca 0.06 -0.27 0.13 0.00 -0.27 0.00 0.00 62.75 62.39 1aja n ILE 279 Cb 0.35 -0.82 0.44 0.00 -1.74 0.00 0.00 39.64 37.87 1aja n ILE 279 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1aja n ASP 280 N -2.47 0.33 -4.09 7.28 8.00 0.61 -4.89 116.55 121.32 1aja n ASP 280 Ca -0.14 0.26 -0.13 0.00 0.71 0.00 0.00 54.79 55.49 1aja n ASP 280 Cb 0.72 -0.26 -0.11 0.00 -0.02 0.00 0.00 41.12 41.44 1aja n ASP 280 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1aja s LYS 281 N -3.03 0.62 1.03 -1.24 3.01 -0.79 -5.00 119.74 114.33 1aja s LYS 281 Ca 0.12 -0.88 -0.12 0.00 -1.01 0.00 0.00 55.97 54.08 1aja s LYS 281 Cb 0.17 -0.34 0.21 0.00 -1.01 0.00 0.00 37.83 36.86 1aja s LYS 281 CO 0.61 0.05 1.08 -1.25 0.51 0.00 0.00 175.35 176.35 1aja s PRO 282 N -2.00 0.15 0.55 -1.68 0.04 -1.26 -4.67 135.00 126.13 1aja s PRO 282 Ca -0.05 1.08 -0.19 0.00 0.04 0.00 0.00 61.00 61.88 1aja s PRO 282 Cb -0.07 -1.66 -0.06 0.00 0.04 0.00 0.00 34.50 32.75 1aja s PRO 282 CO -0.00 -3.08 1.10 0.00 0.04 0.00 0.00 177.00 175.06 1aja s ALA 283 N -2.61 2.72 -0.02 8.56 0.00 -1.26 -4.66 121.76 124.49 1aja s ALA 283 Ca 0.67 0.69 -0.01 0.00 0.00 0.00 0.00 51.96 53.31 1aja s ALA 283 Cb -0.23 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 1aja s ALA 283 CO 0.61 -0.72 0.09 0.08 0.00 0.00 0.00 175.76 175.82 1aja s VAL 284 N -1.96 4.83 -0.13 0.00 1.01 0.36 -4.83 120.40 119.69 1aja s VAL 284 Ca 0.70 -0.32 0.01 0.00 0.00 0.00 0.00 61.98 62.37 1aja s VAL 284 Cb -0.21 -3.19 -0.01 0.00 0.00 0.00 0.00 36.38 32.97 1aja s VAL 284 CO 0.28 0.39 -0.16 -0.89 0.00 0.00 0.00 175.10 174.72 1aja s THR 285 N -1.17 2.80 0.27 3.92 2.01 -1.26 -1.31 115.64 120.89 1aja s THR 285 Ca 0.22 -0.75 -0.29 0.00 0.31 0.00 0.00 61.69 61.18 1aja s THR 285 Cb -0.12 -2.16 -0.09 0.00 0.01 0.00 0.00 72.50 70.14 1aja s THR 285 CO 0.13 0.53 1.17 0.00 -0.69 0.00 0.00 174.62 175.76 1aja s THR 287 N -0.89 2.06 0.09 0.00 -1.32 -0.91 -4.94 115.64 109.72 1aja s THR 287 Ca 0.47 -1.27 -0.26 0.00 -1.21 0.00 0.00 61.69 59.43 1aja s THR 287 Cb -0.34 -1.74 -0.14 0.00 -1.51 0.00 0.00 72.50 68.77 1aja s THR 287 CO 0.43 0.43 0.60 -2.65 -2.21 0.00 0.00 174.62 171.21 1aja n PRO 288 N 2.03 0.00 -2.65 7.08 -0.02 -1.26 -0.27 135.00 139.91 1aja n PRO 288 Ca -0.17 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 60.89 1aja n PRO 288 Cb 0.52 -0.96 -0.02 0.00 -0.02 0.00 0.00 33.50 33.02 1aja n PRO 288 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1aja s ASN 289 N -0.43 7.10 0.44 2.55 3.84 0.07 -4.56 114.94 123.95 1aja s ASN 289 Ca 0.60 1.41 0.22 0.00 0.21 0.00 0.00 52.86 55.30 1aja s ASN 289 Cb -0.85 -2.54 1.20 0.00 -0.55 0.00 0.00 41.25 38.51 1aja s ASN 289 CO 0.44 -0.66 1.83 -0.65 -2.79 0.00 0.00 177.10 175.28 1aja h PRO 290 N 7.46 0.29 -0.01 0.43 0.11 -1.91 -2.12 132.00 136.25 1aja h PRO 290 Ca -0.20 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1aja h PRO 290 Cb 1.07 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1aja h PRO 290 CO 0.97 0.19 -0.12 1.04 -0.21 0.00 0.00 178.00 179.87 1aja n GLN 291 N -4.47 1.14 -0.25 1.05 6.02 -1.26 -4.12 117.38 115.49 1aja n GLN 291 Ca 0.21 -0.60 0.12 0.00 -0.01 0.00 0.00 57.00 56.73 1aja n GLN 291 Cb 0.85 -1.49 0.39 0.00 1.02 0.00 0.00 30.24 31.01 1aja n GLN 291 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.06 176.12 1aja h ARG 292 N 1.47 0.64 -0.48 -1.09 0.11 -1.62 -3.47 114.38 109.93 1aja h ARG 292 Ca 0.00 -0.04 0.05 0.00 0.10 0.00 0.00 59.98 60.09 1aja h ARG 292 Cb 0.45 -0.14 -0.03 0.00 1.11 0.00 0.00 29.97 31.36 1aja h ARG 292 CO 0.00 0.42 -0.17 0.09 0.10 0.00 0.00 179.97 180.41 1aja n ASN 293 N -4.54 -1.09 -0.03 0.08 3.02 -1.26 -4.25 115.26 107.18 1aja n ASN 293 Ca 0.17 0.19 -0.03 0.00 -0.03 0.00 0.00 54.58 54.88 1aja n ASN 293 Cb 0.47 -0.68 -0.14 0.00 -0.61 0.00 0.00 39.78 38.82 1aja n ASN 293 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1aja n ASP 294 N -2.39 0.38 0.05 6.41 -0.08 -1.26 -4.06 116.55 115.60 1aja n ASP 294 Ca -0.01 0.17 0.00 0.00 -1.51 0.00 0.00 54.79 53.44 1aja n ASP 294 Cb 0.09 0.77 -0.06 0.00 2.34 0.00 0.00 41.12 44.26 1aja n ASP 294 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 1aja h SER 295 N 0.00 0.00 -3.57 1.67 4.64 -1.97 -3.45 113.55 110.86 1aja h SER 295 Ca -0.31 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.38 1aja h SER 295 Cb 1.81 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.76 1aja h SER 295 CO 0.04 0.57 0.06 -0.69 -0.87 0.00 0.00 176.83 175.94 1aja s VAL 296 N -2.93 4.96 0.12 0.95 1.01 -1.26 -0.49 120.40 122.77 1aja s VAL 296 Ca -0.01 0.63 -0.31 0.00 0.00 0.00 0.00 61.98 62.28 1aja s VAL 296 Cb 0.08 -3.99 -0.09 0.00 0.00 0.00 0.00 36.38 32.39 1aja s VAL 296 CO 0.80 -0.18 1.48 -2.16 0.00 0.00 0.00 175.10 175.03 1aja s PRO 297 N 2.53 4.27 0.83 2.72 0.04 -1.26 -4.78 135.00 139.35 1aja s PRO 297 Ca 0.22 2.19 -0.11 0.00 0.04 0.00 0.00 61.00 63.34 1aja s PRO 297 Cb -0.15 -3.27 0.09 0.00 0.04 0.00 0.00 34.50 31.21 1aja s PRO 297 CO 0.13 -0.53 1.09 0.95 0.04 0.00 0.00 177.00 178.68 1aja s THR 298 N 1.33 2.94 0.39 1.26 -4.23 -1.26 -4.79 115.64 111.28 1aja s THR 298 Ca 0.67 0.30 0.06 0.00 -1.18 0.00 0.00 61.69 61.55 1aja s THR 298 Cb -0.39 -2.95 0.24 0.00 1.34 0.00 0.00 72.50 70.74 1aja s THR 298 CO 0.30 -0.40 2.01 0.25 -0.54 0.00 0.00 174.62 176.25 1aja h LEU 299 N -1.25 0.49 -0.75 4.79 5.85 -1.94 -0.86 115.31 121.64 1aja h LEU 299 Ca -0.48 -0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.15 1aja h LEU 299 Cb 1.27 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 1aja h LEU 299 CO 0.57 0.41 -0.30 0.00 -0.34 0.00 0.00 178.44 178.78 1aja h ALA 300 N 1.68 0.93 0.16 1.25 0.00 -1.88 -1.72 119.26 119.67 1aja h ALA 300 Ca 0.15 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1aja h ALA 300 Cb 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1aja h ALA 300 CO -0.02 0.38 -0.08 1.96 0.00 0.00 0.00 179.25 181.49 1aja h GLN 301 N 0.00 -0.20 -0.57 0.00 4.20 -1.69 -1.15 115.11 115.70 1aja h GLN 301 Ca -0.00 0.01 0.10 0.00 0.06 0.00 0.00 58.65 58.82 1aja h GLN 301 Cb 0.94 0.05 -0.08 0.00 0.30 0.00 0.00 27.48 28.69 1aja h GLN 301 CO 0.04 0.23 0.14 0.52 -0.67 0.00 0.00 178.83 179.09 1aja h MET 302 N -0.77 0.28 -0.82 1.46 2.86 -1.20 0.68 114.93 117.43 1aja h MET 302 Ca -0.02 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.64 1aja h MET 302 Cb 0.52 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 32.07 1aja h MET 302 CO 0.04 0.19 0.54 1.15 1.06 0.00 0.00 176.91 179.88 1aja h THR 303 N 0.29 1.12 -0.17 2.22 2.02 -1.31 -0.68 112.91 116.40 1aja h THR 303 Ca 0.29 -0.34 -0.20 0.00 0.77 0.00 0.00 66.41 66.93 1aja h THR 303 Cb 0.41 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.85 1aja h THR 303 CO -0.36 0.18 -0.69 -0.78 0.37 0.00 0.00 175.52 174.25 1aja h ASP 304 N 1.00 0.82 -0.16 4.18 3.58 0.06 -2.04 116.42 123.86 1aja h ASP 304 Ca 0.33 -0.50 -0.08 0.00 0.42 0.00 0.00 57.03 57.20 1aja h ASP 304 Cb 0.06 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 40.87 1aja h ASP 304 CO -0.10 1.28 -0.19 0.50 -2.88 0.00 0.00 179.24 177.85 1aja h LYS 305 N 0.50 0.42 -0.45 0.28 1.63 -0.57 -2.46 116.57 115.92 1aja h LYS 305 Ca -0.03 -0.23 0.08 0.00 -0.85 0.00 0.00 60.65 59.62 1aja h LYS 305 Cb 1.30 0.01 -0.07 0.00 -0.60 0.00 0.00 32.23 32.87 1aja h LYS 305 CO 0.14 0.81 0.01 0.00 -3.45 0.00 0.00 179.45 176.96 1aja h ALA 306 N 0.61 0.43 -0.50 5.00 0.00 -1.13 -1.48 119.26 122.18 1aja h ALA 306 Ca 0.02 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1aja h ALA 306 Cb 0.75 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1aja h ALA 306 CO 0.05 -0.38 0.16 0.82 0.00 0.00 0.00 179.25 179.89 1aja h ILE 307 N 0.13 1.20 0.48 0.00 2.04 -1.30 -0.38 117.51 119.68 1aja h ILE 307 Ca 0.22 -0.69 -0.02 0.00 1.00 0.00 0.00 64.86 65.37 1aja h ILE 307 Cb 0.32 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1aja h ILE 307 CO -0.36 0.26 -0.23 -0.08 0.00 0.00 0.00 178.15 177.74 1aja h GLU 308 N 0.73 -0.62 -0.75 2.37 4.81 -0.82 -1.49 114.58 118.81 1aja h GLU 308 Ca 0.17 0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.40 1aja h GLU 308 Cb 0.22 0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 1aja h GLU 308 CO -0.01 -0.35 0.30 -0.07 -0.73 0.00 0.00 179.01 178.14 1aja h LEU 309 N -0.77 1.02 -0.64 1.64 3.38 -1.12 -2.95 115.31 115.87 1aja h LEU 309 Ca -0.07 -0.15 -0.11 0.00 0.09 0.00 0.00 57.88 57.64 1aja h LEU 309 Cb 0.55 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1aja h LEU 309 CO 0.11 0.91 -0.54 -0.07 0.09 0.00 0.00 178.44 178.94 1aja h LEU 310 N 1.09 0.00 0.00 1.67 4.07 -1.00 -3.20 115.31 117.94 1aja h LEU 310 Ca 0.25 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.21 1aja h LEU 310 Cb 0.21 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.95 1aja h LEU 310 CO -0.02 0.54 0.00 -1.54 -1.08 0.00 0.00 178.44 176.34 1aja n SER 311 N -3.54 0.00 0.29 -0.43 3.41 -0.57 -2.46 113.62 110.31 1aja n SER 311 Ca -0.00 -0.29 0.17 0.00 -0.26 0.00 0.00 58.87 58.48 1aja n SER 311 Cb 0.62 -0.23 0.82 0.00 -0.26 0.00 0.00 64.21 65.16 1aja n SER 311 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1aja h LYS 312 N 0.00 0.00 -6.51 4.33 1.79 -1.62 -3.42 116.57 111.14 1aja h LYS 312 Ca 0.00 0.00 -0.57 0.00 -2.18 0.00 0.00 60.65 57.90 1aja h LYS 312 Cb 0.21 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 30.81 1aja h LYS 312 CO 0.00 0.05 1.02 1.21 -1.08 0.00 0.00 179.45 180.65 1aja s ASN 313 N -5.73 6.47 0.46 0.86 3.84 -1.03 -4.89 114.94 114.91 1aja s ASN 313 Ca -0.02 0.87 0.28 0.00 0.21 0.00 0.00 52.86 54.20 1aja s ASN 313 Cb 0.11 -2.54 1.34 0.00 -0.55 0.00 0.00 41.25 39.61 1aja s ASN 313 CO 0.53 -1.32 1.74 -0.33 -2.79 0.00 0.00 177.10 174.93 1aja h GLU 314 N 10.11 0.19 0.00 0.43 5.08 -1.90 -2.07 114.58 126.42 1aja h GLU 314 Ca -0.26 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1aja h GLU 314 Cb 1.10 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.30 1aja h GLU 314 CO 1.08 0.12 -0.38 1.63 -1.00 0.00 0.00 179.01 180.46 1aja n LYS 315 N -4.48 0.21 0.00 2.33 4.76 -1.26 -5.07 118.16 114.66 1aja n LYS 315 Ca 0.29 0.10 0.00 0.00 -2.87 0.00 0.00 58.31 55.83 1aja n LYS 315 Cb 1.17 -1.67 0.00 0.00 -1.84 0.00 0.00 35.03 32.69 1aja n LYS 315 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1aja n GLY 316 N 1.37 0.99 3.35 0.72 0.00 -0.78 -4.90 105.19 105.95 1aja n GLY 316 Ca 0.05 -2.29 -0.10 0.00 0.00 0.00 0.00 46.02 43.68 1aja n GLY 316 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1aja s PHE 317 N -1.11 -0.03 -0.05 1.61 -0.12 -1.21 -1.22 117.98 115.86 1aja s PHE 317 Ca 0.00 -0.32 0.04 0.00 -0.05 0.00 0.00 56.93 56.60 1aja s PHE 317 Cb 0.00 0.19 -0.00 0.00 -0.63 0.00 0.00 43.02 42.58 1aja s PHE 317 CO 0.00 -0.73 -0.18 0.12 -0.05 0.00 0.00 175.22 174.38 1aja s PHE 318 N -3.86 1.80 -0.05 3.49 5.36 -0.14 -2.16 117.98 122.42 1aja s PHE 318 Ca 0.07 -0.55 -0.02 0.00 -0.96 0.00 0.00 56.93 55.48 1aja s PHE 318 Cb 0.02 -1.21 0.04 0.00 -0.34 0.00 0.00 43.02 41.52 1aja s PHE 318 CO -0.08 -0.20 0.10 -1.17 -1.46 0.00 0.00 175.22 172.41 1aja s LEU 319 N 0.10 0.59 -0.08 6.12 2.96 -0.92 -0.56 118.68 126.89 1aja s LEU 319 Ca -0.06 0.18 0.01 0.00 -0.22 0.00 0.00 54.13 54.04 1aja s LEU 319 Cb -0.12 0.12 -0.03 0.00 0.50 0.00 0.00 46.19 46.66 1aja s LEU 319 CO 0.03 -0.18 -0.07 -1.58 -1.32 0.00 0.00 176.35 173.23 1aja s GLN 320 N 1.51 2.83 -0.06 1.98 0.74 -1.11 -0.96 119.66 124.59 1aja s GLN 320 Ca -0.05 -0.55 0.02 0.00 0.05 0.00 0.00 55.36 54.83 1aja s GLN 320 Cb -0.12 -2.61 0.01 0.00 1.10 0.00 0.00 33.01 31.39 1aja s GLN 320 CO -0.04 0.62 -0.11 0.08 -0.55 0.00 0.00 175.29 175.28 1aja s VAL 321 N -0.69 1.07 -0.16 1.34 1.01 0.76 -1.93 120.40 121.80 1aja s VAL 321 Ca 0.10 -0.44 -0.01 0.00 0.00 0.00 0.00 61.98 61.64 1aja s VAL 321 Cb -0.11 -0.98 -0.00 0.00 0.00 0.00 0.00 36.38 35.28 1aja s VAL 321 CO 0.02 0.34 -0.13 -0.70 0.00 0.00 0.00 175.10 174.62 1aja s GLU 322 N 0.69 3.27 -0.44 2.72 2.12 0.34 -0.72 118.70 126.68 1aja s GLU 322 Ca -0.14 -0.72 -0.17 0.00 0.36 0.00 0.00 54.97 54.30 1aja s GLU 322 Cb -0.16 -2.69 0.03 0.00 0.26 0.00 0.00 34.13 31.58 1aja s GLU 322 CO 0.03 0.01 0.45 0.20 -0.54 0.00 0.00 175.26 175.41 1aja s GLY 323 N 0.87 1.90 -0.14 -1.50 0.00 -0.42 -2.55 107.32 105.48 1aja s GLY 323 Ca -0.04 -1.65 -0.25 0.00 0.00 0.00 0.00 44.72 42.79 1aja s GLY 323 CO -0.00 1.19 0.62 0.00 0.00 0.00 0.00 173.10 174.90 1aja s ALA 324 N 2.12 -1.56 0.00 3.20 0.00 -1.26 -1.74 121.76 122.52 1aja s ALA 324 Ca 0.11 1.45 0.00 0.00 0.00 0.00 0.00 51.96 53.52 1aja s ALA 324 Cb -0.19 -0.52 0.00 0.00 0.00 0.00 0.00 23.12 22.41 1aja s ALA 324 CO 0.12 -0.32 0.21 0.43 0.00 0.00 0.00 175.76 176.20 1aja n SER 325 N 1.88 -0.13 0.00 0.00 7.64 -1.26 -2.92 113.62 118.82 1aja n SER 325 Ca -0.17 -0.42 0.00 0.00 1.01 0.00 0.00 58.87 59.30 1aja n SER 325 Cb 0.56 0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.80 1aja n SER 325 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1aja n ALA 332 N 0.00 0.00 -3.67 -0.43 0.00 -1.26 -4.76 120.51 110.39 1aja n ALA 332 Ca -0.04 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.20 1aja n ALA 332 Cb 0.25 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.67 1aja n ALA 332 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aja n ALA 333 N -0.14 -1.69 -3.89 0.00 0.00 -1.26 -4.81 120.51 108.72 1aja n ALA 333 Ca 0.00 -0.27 -0.30 0.00 0.00 0.00 0.00 53.44 52.86 1aja n ALA 333 Cb 0.00 -0.82 -0.15 0.00 0.00 0.00 0.00 19.45 18.48 1aja n ALA 333 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1aja s ASN 334 N -3.93 4.38 0.34 0.00 3.84 -1.26 -0.06 114.94 118.25 1aja s ASN 334 Ca 0.11 -2.15 0.08 0.00 0.21 0.00 0.00 52.86 51.11 1aja s ASN 334 Cb -0.06 -1.34 0.79 0.00 -0.55 0.00 0.00 41.25 40.08 1aja s ASN 334 CO 0.54 -0.36 1.85 -0.65 -2.79 0.00 0.00 177.10 175.69 1aja h PRO 335 N 7.53 0.71 -0.18 0.43 0.11 -1.91 -2.29 132.00 136.40 1aja h PRO 335 Ca -0.07 -0.04 -0.18 0.00 0.11 0.00 0.00 66.00 65.82 1aja h PRO 335 Cb 0.99 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.94 1aja h PRO 335 CO 0.52 0.47 -0.60 0.00 -0.21 0.00 0.00 178.00 178.18 1aja h GLY 337 N 0.99 0.71 0.71 0.00 0.00 -1.58 -0.91 103.07 102.99 1aja h GLY 337 Ca -0.00 -0.48 0.03 0.00 0.00 0.00 0.00 47.33 46.87 1aja h GLY 337 CO 0.12 0.44 -0.04 -1.61 0.00 0.00 0.00 176.54 175.45 1aja h GLN 338 N 0.50 -0.01 -0.17 4.80 4.15 -1.32 -1.14 115.11 121.91 1aja h GLN 338 Ca 0.12 0.00 -0.18 0.00 0.77 0.00 0.00 58.65 59.36 1aja h GLN 338 Cb 0.38 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.07 1aja h GLN 338 CO 0.01 -0.01 -0.62 0.82 -1.93 0.00 0.00 178.83 177.10 1aja h ILE 339 N -0.01 1.32 -0.87 2.39 2.04 -1.08 -3.06 117.51 118.23 1aja h ILE 339 Ca 0.07 -1.88 0.11 0.00 1.00 0.00 0.00 64.86 64.16 1aja h ILE 339 Cb 0.12 1.85 -0.08 0.00 -0.74 0.00 0.00 36.82 37.96 1aja h ILE 339 CO -0.15 0.59 0.50 1.23 0.00 0.00 0.00 178.15 180.32 1aja h GLY 340 N 0.98 1.38 1.88 5.37 0.00 -0.71 -1.40 103.07 110.57 1aja h GLY 340 Ca -0.01 -0.32 -0.12 0.00 0.00 0.00 0.00 47.33 46.88 1aja h GLY 340 CO 0.12 0.09 -0.51 0.83 0.00 0.00 0.00 176.54 177.08 1aja h GLU 341 N 0.79 0.13 -0.34 4.80 4.39 -1.13 -0.64 114.58 122.59 1aja h GLU 341 Ca 0.43 -0.08 -0.12 0.00 0.34 0.00 0.00 59.36 59.94 1aja h GLU 341 Cb 0.46 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 1aja h GLU 341 CO -0.28 0.61 -0.28 1.15 -1.16 0.00 0.00 179.01 179.06 1aja h THR 342 N 0.11 1.28 -0.39 1.13 2.02 -1.21 -1.13 112.91 114.71 1aja h THR 342 Ca 0.00 -1.39 -0.05 0.00 0.77 0.00 0.00 66.41 65.74 1aja h THR 342 Cb 0.93 1.32 -0.02 0.00 -1.74 0.00 0.00 68.15 68.64 1aja h THR 342 CO 0.07 0.46 0.05 0.58 0.37 0.00 0.00 175.52 177.05 1aja h VAL 343 N 0.60 1.25 -0.12 3.16 2.07 -1.14 -0.33 116.25 121.73 1aja h VAL 343 Ca 0.08 -0.89 0.04 0.00 0.82 0.00 0.00 66.70 66.74 1aja h VAL 343 Cb 0.78 1.07 -0.07 0.00 -1.52 0.00 0.00 31.29 31.55 1aja h VAL 343 CO 0.06 0.30 -0.42 0.44 0.02 0.00 0.00 177.57 177.98 1aja h ASP 344 N 0.50 -1.31 -0.75 0.57 3.32 -0.90 -2.00 116.42 115.85 1aja h ASP 344 Ca 0.12 0.17 -0.00 0.00 0.02 0.00 0.00 57.03 57.34 1aja h ASP 344 Cb 0.39 0.53 -0.04 0.00 0.22 0.00 0.00 39.33 40.44 1aja h ASP 344 CO 0.01 -0.43 0.45 0.25 -1.72 0.00 0.00 179.24 177.80 1aja h LEU 345 N -0.50 0.90 -1.22 1.55 5.85 -1.03 -1.85 115.31 119.01 1aja h LEU 345 Ca 0.07 -0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.79 1aja h LEU 345 Cb 0.63 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 1aja h LEU 345 CO -0.39 0.70 0.55 -0.78 -0.34 0.00 0.00 178.44 178.18 1aja h ASP 346 N 1.02 0.83 -0.58 1.25 3.58 -0.68 0.14 116.42 121.99 1aja h ASP 346 Ca 0.27 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.72 1aja h ASP 346 Cb -0.04 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 40.81 1aja h ASP 346 CO -0.05 0.55 0.34 -0.33 -2.88 0.00 0.00 179.24 176.86 1aja h GLU 347 N 0.95 0.79 -0.50 0.28 5.08 -0.61 -1.96 114.58 118.60 1aja h GLU 347 Ca 0.35 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 1aja h GLU 347 Cb 0.18 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1aja h GLU 347 CO -0.12 0.58 0.31 0.00 -1.00 0.00 0.00 179.01 178.78 1aja h ALA 348 N 1.16 0.64 -0.33 3.43 0.00 -0.69 -2.41 119.26 121.07 1aja h ALA 348 Ca 0.21 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1aja h ALA 348 Cb 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1aja h ALA 348 CO -0.04 0.11 0.14 0.28 0.00 0.00 0.00 179.25 179.75 1aja h VAL 349 N 0.68 1.12 -0.41 0.00 2.07 -0.57 -1.97 116.25 117.17 1aja h VAL 349 Ca 0.18 -0.37 -0.12 0.00 0.82 0.00 0.00 66.70 67.21 1aja h VAL 349 Cb -0.03 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1aja h VAL 349 CO -0.04 0.15 -0.23 1.56 0.02 0.00 0.00 177.57 179.03 1aja h GLN 350 N 0.46 0.88 0.47 1.57 4.20 -0.89 -0.18 115.11 121.63 1aja h GLN 350 Ca 0.12 -0.40 -0.02 0.00 0.06 0.00 0.00 58.65 58.41 1aja h GLN 350 Cb 0.08 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.84 1aja h GLN 350 CO -0.01 1.05 -0.26 0.00 -0.67 0.00 0.00 178.83 178.93 1aja h ARG 351 N 0.70 -0.67 -0.66 1.46 2.47 -1.21 0.22 114.38 116.69 1aja h ARG 351 Ca 0.09 0.05 0.08 0.00 -1.26 0.00 0.00 59.98 58.94 1aja h ARG 351 Cb 0.80 0.15 -0.07 0.00 -1.65 0.00 0.00 29.97 29.20 1aja h ARG 351 CO 0.07 -0.44 0.32 0.00 0.56 0.00 0.00 179.97 180.48 1aja h ALA 352 N -0.19 0.89 -0.17 0.04 0.00 -1.26 -1.37 119.26 117.20 1aja h ALA 352 Ca -0.06 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1aja h ALA 352 Cb 0.55 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1aja h ALA 352 CO 0.08 -0.06 -0.29 1.25 0.00 0.00 0.00 179.25 180.23 1aja h LEU 353 N 0.57 0.32 -0.44 0.00 5.85 -0.82 -0.59 115.31 120.20 1aja h LEU 353 Ca 0.32 -0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.88 1aja h LEU 353 Cb 0.31 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 1aja h LEU 353 CO -0.25 0.61 0.06 -0.33 -0.34 0.00 0.00 178.44 178.19 1aja h GLU 354 N 0.29 0.74 0.24 1.25 4.39 0.53 -1.66 114.58 120.35 1aja h GLU 354 Ca 0.04 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.54 1aja h GLU 354 Cb 0.65 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.20 1aja h GLU 354 CO 0.05 0.77 -0.24 0.35 -1.16 0.00 0.00 179.01 178.78 1aja h PHE 355 N 0.59 -0.63 -0.84 4.33 3.57 -1.15 -1.94 116.94 120.87 1aja h PHE 355 Ca 0.13 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.60 1aja h PHE 355 Cb 0.39 0.25 -0.04 0.00 2.79 0.00 0.00 35.95 39.34 1aja h PHE 355 CO 0.03 -0.35 0.38 0.00 -2.23 0.00 0.00 178.31 176.14 1aja h ALA 356 N 0.16 1.08 -0.14 2.41 0.00 -1.00 0.63 119.26 122.41 1aja h ALA 356 Ca -0.00 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 1aja h ALA 356 Cb 0.47 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1aja h ALA 356 CO -0.05 0.67 -0.26 -0.22 0.00 0.00 0.00 179.25 179.38 1aja h LYS 357 N 1.20 0.25 0.10 0.00 3.64 -1.26 -0.74 116.57 119.76 1aja h LYS 357 Ca 0.29 -0.08 -0.16 0.00 -1.27 0.00 0.00 60.65 59.42 1aja h LYS 357 Cb 0.15 -0.02 0.02 0.00 -0.41 0.00 0.00 32.23 31.97 1aja h LYS 357 CO -0.03 0.50 -0.69 -0.22 -2.27 0.00 0.00 179.45 176.73 1aja h LYS 358 N 0.22 0.29 -0.33 1.90 3.64 -0.53 -3.37 116.57 118.39 1aja h LYS 358 Ca 0.03 -0.45 -0.09 0.00 -1.27 0.00 0.00 60.65 58.88 1aja h LYS 358 Cb 0.59 0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 1aja h LYS 358 CO 0.04 1.19 -0.14 1.49 -2.27 0.00 0.00 179.45 179.75 1aja h GLU 359 N -0.38 0.68 0.00 1.90 4.22 -0.83 -3.48 114.58 116.70 1aja h GLU 359 Ca -0.11 -0.29 0.00 0.00 0.08 0.00 0.00 59.36 59.03 1aja h GLU 359 Cb 1.51 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.74 1aja h GLU 359 CO 0.13 0.88 0.00 0.41 -2.18 0.00 0.00 179.01 178.25 1aja n GLY 360 N -0.07 1.25 1.46 1.92 0.00 -0.29 -4.85 105.19 104.61 1aja n GLY 360 Ca -0.03 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.03 1aja n GLY 360 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1aja n ASN 361 N 0.00 1.20 -4.47 1.61 3.02 -1.26 -4.84 115.26 110.53 1aja n ASN 361 Ca 0.00 -2.32 -0.33 0.00 -0.03 0.00 0.00 54.58 51.90 1aja n ASN 361 Cb 0.00 -0.35 -0.13 0.00 -0.61 0.00 0.00 39.78 38.69 1aja n ASN 361 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1aja s THR 362 N -0.83 3.02 -0.19 3.41 2.01 -1.26 -0.49 115.64 121.31 1aja s THR 362 Ca 0.34 -0.74 -0.07 0.00 0.31 0.00 0.00 61.69 61.54 1aja s THR 362 Cb 0.38 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 70.68 1aja s THR 362 CO -0.14 0.59 0.04 -0.22 -0.69 0.00 0.00 174.62 174.20 1aja s LEU 363 N -0.69 3.62 -0.11 4.42 2.96 -0.71 -4.21 118.68 123.96 1aja s LEU 363 Ca 0.11 -0.02 0.03 0.00 -0.22 0.00 0.00 54.13 54.02 1aja s LEU 363 Cb -0.11 -1.92 -0.00 0.00 0.50 0.00 0.00 46.19 44.66 1aja s LEU 363 CO 0.01 0.13 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.25 1aja s VAL 364 N 0.63 2.19 -0.03 1.68 1.01 0.23 -0.37 120.40 125.74 1aja s VAL 364 Ca 0.02 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 61.07 1aja s VAL 364 Cb -0.13 -1.85 -0.01 0.00 0.00 0.00 0.00 36.38 34.39 1aja s VAL 364 CO 0.02 0.55 -0.16 -0.63 0.00 0.00 0.00 175.10 174.88 1aja s ILE 365 N 0.40 1.31 -0.07 2.22 1.01 -0.50 -0.67 121.20 124.90 1aja s ILE 365 Ca -0.17 -0.67 0.02 0.00 0.00 0.00 0.00 60.65 59.83 1aja s ILE 365 Cb -0.17 -1.12 0.02 0.00 0.01 0.00 0.00 42.46 41.19 1aja s ILE 365 CO 0.07 0.38 -0.11 -0.69 0.00 0.00 0.00 174.94 174.59 1aja s VAL 366 N -0.06 1.10 0.00 2.92 1.01 -0.48 -1.51 120.40 123.38 1aja s VAL 366 Ca -0.01 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.54 1aja s VAL 366 Cb -0.10 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.25 1aja s VAL 366 CO 0.01 0.35 0.00 1.07 0.00 0.00 0.00 175.10 176.54 1aja n THR 367 N 4.05 0.00 -4.27 3.92 5.66 -0.64 -2.33 114.28 120.66 1aja n THR 367 Ca -0.21 0.00 -0.16 0.00 -3.05 0.00 0.00 64.05 60.63 1aja n THR 367 Cb 0.51 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.19 1aja n THR 367 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1aja s ALA 368 N -1.06 1.61 0.02 1.79 0.00 -1.26 -0.39 121.76 122.48 1aja s ALA 368 Ca 0.00 -1.51 -0.24 0.00 0.00 0.00 0.00 51.96 50.21 1aja s ALA 368 Cb 0.00 -0.01 -0.17 0.00 0.00 0.00 0.00 23.12 22.94 1aja s ALA 368 CO 0.00 -0.02 1.44 0.38 0.00 0.00 0.00 175.76 177.56 1aja h ASP 369 N 2.83 0.05 -5.02 0.00 2.03 -1.93 -3.47 116.42 110.91 1aja h ASP 369 Ca -0.37 -0.32 -0.02 0.00 -0.73 0.00 0.00 57.03 55.58 1aja h ASP 369 Cb 1.20 -0.01 -0.12 0.00 -0.83 0.00 0.00 39.33 39.57 1aja h ASP 369 CO 0.61 0.35 0.15 -1.38 -1.03 0.00 0.00 179.24 177.94 1aja s HIS 370 N -4.93 -0.45 0.30 4.15 -3.43 -1.26 -4.88 115.29 104.79 1aja s HIS 370 Ca -0.15 0.20 -0.28 0.00 -0.80 0.00 0.00 55.06 54.04 1aja s HIS 370 Cb 0.04 0.50 -0.09 0.00 -1.43 0.00 0.00 32.58 31.59 1aja s HIS 370 CO 0.68 -0.83 0.99 0.00 -2.00 0.00 0.00 174.74 173.58 1aja s ALA 371 N -3.77 3.27 0.19 -1.38 0.00 -1.26 -3.51 121.76 115.30 1aja s ALA 371 Ca 0.02 0.66 0.02 0.00 0.00 0.00 0.00 51.96 52.66 1aja s ALA 371 Cb -0.01 -3.23 0.03 0.00 0.00 0.00 0.00 23.12 19.91 1aja s ALA 371 CO -0.12 0.05 0.23 0.72 0.00 0.00 0.00 175.76 176.65 1aja n HIS 372 N 0.85 -2.84 -0.20 0.00 8.25 -1.05 -1.45 115.22 118.79 1aja n HIS 372 Ca 0.01 -0.59 0.11 0.00 -0.26 0.00 0.00 57.72 56.99 1aja n HIS 372 Cb 0.48 -0.16 0.28 0.00 1.12 0.00 0.00 29.99 31.71 1aja n HIS 372 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1aja n ALA 373 N -2.83 2.36 -1.85 -1.41 0.00 -1.23 -4.42 120.51 111.13 1aja n ALA 373 Ca -0.04 -1.21 -0.40 0.00 0.00 0.00 0.00 53.44 51.79 1aja n ALA 373 Cb 0.17 -0.85 -0.05 0.00 0.00 0.00 0.00 19.45 18.73 1aja n ALA 373 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1aja s SER 374 N -1.10 7.34 0.01 0.00 1.04 -1.26 -4.77 113.70 114.96 1aja s SER 374 Ca 0.43 2.15 0.08 0.00 0.48 0.00 0.00 55.95 59.09 1aja s SER 374 Cb 0.23 -2.62 -0.02 0.00 0.10 0.00 0.00 66.02 63.71 1aja s SER 374 CO 0.31 -0.11 -0.24 -1.10 0.98 0.00 0.00 173.24 173.08 1aja s GLN 375 N -1.06 1.80 -0.36 4.02 -0.21 -0.39 -4.76 119.66 118.70 1aja s GLN 375 Ca 0.45 -0.93 -0.26 0.00 0.02 0.00 0.00 55.36 54.64 1aja s GLN 375 Cb -0.30 -1.83 0.01 0.00 1.00 0.00 0.00 33.01 31.90 1aja s GLN 375 CO 0.37 0.49 0.94 0.42 -2.12 0.00 0.00 175.29 175.40 1aja s ILE 376 N -0.66 4.58 0.53 1.08 1.01 -1.26 -0.16 121.20 126.31 1aja s ILE 376 Ca 0.10 1.27 0.03 0.00 0.00 0.00 0.00 60.65 62.04 1aja s ILE 376 Cb -0.09 -4.34 0.01 0.00 0.01 0.00 0.00 42.46 38.05 1aja s ILE 376 CO 0.00 -0.52 0.17 0.68 0.00 0.00 0.00 174.94 175.27 1aja s VAL 377 N 3.49 1.33 0.35 2.92 -7.23 -0.66 -4.99 120.40 115.61 1aja s VAL 377 Ca 0.39 -1.79 -0.26 0.00 -1.81 0.00 0.00 61.98 58.51 1aja s VAL 377 Cb -0.12 -2.12 -0.10 0.00 0.56 0.00 0.00 36.38 34.61 1aja s VAL 377 CO 0.18 0.00 1.00 0.00 -0.31 0.00 0.00 175.10 175.97 1aja s ALA 378 N -2.84 3.18 0.47 1.32 0.00 -1.26 -4.02 121.76 118.61 1aja s ALA 378 Ca 0.16 0.62 0.20 0.00 0.00 0.00 0.00 51.96 52.95 1aja s ALA 378 Cb -0.00 -3.23 1.20 0.00 0.00 0.00 0.00 23.12 21.09 1aja s ALA 378 CO 0.10 -0.00 1.94 -1.35 0.00 0.00 0.00 175.76 176.45 1aja h PRO 379 N 2.96 0.23 -0.84 0.00 0.11 -1.93 -0.29 132.00 132.24 1aja h PRO 379 Ca -0.47 -0.01 -0.21 0.00 0.11 0.00 0.00 66.00 65.41 1aja h PRO 379 Cb 1.20 -0.05 -0.13 0.00 0.11 0.00 0.00 31.00 32.13 1aja h PRO 379 CO 0.64 0.16 0.27 -0.40 -0.21 0.00 0.00 178.00 178.46 1aja n ASP 380 N -4.43 4.14 -4.74 -2.05 5.75 -1.26 -4.85 116.55 109.10 1aja n ASP 380 Ca 0.13 -3.01 -0.41 0.00 -0.01 0.00 0.00 54.79 51.50 1aja n ASP 380 Cb 0.59 -0.71 -0.05 0.00 -1.03 0.00 0.00 41.12 39.93 1aja n ASP 380 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1aja s THR 381 N -2.49 3.97 -0.44 2.12 2.01 -0.12 -4.99 115.64 115.69 1aja s THR 381 Ca 0.44 1.78 -0.05 0.00 0.31 0.00 0.00 61.69 64.17 1aja s THR 381 Cb 0.35 -4.14 0.12 0.00 0.01 0.00 0.00 72.50 68.84 1aja s THR 381 CO 0.10 0.35 0.26 -0.54 -0.69 0.00 0.00 174.62 174.10 1aja s LYS 382 N -0.65 2.17 0.23 4.92 1.02 -1.26 -4.91 119.74 121.26 1aja s LYS 382 Ca 0.46 -1.83 0.07 0.00 0.02 0.00 0.00 55.97 54.69 1aja s LYS 382 Cb -0.28 -3.70 -0.04 0.00 -0.52 0.00 0.00 37.83 33.29 1aja s LYS 382 CO 0.34 -1.12 0.11 0.00 -0.92 0.00 0.00 175.35 173.76 1aja s ALA 383 N 1.16 3.42 -2.15 5.17 0.00 -1.26 -5.04 121.76 123.06 1aja s ALA 383 Ca 0.08 -1.44 0.24 0.00 0.00 0.00 0.00 51.96 50.84 1aja s ALA 383 Cb -0.24 -1.13 1.21 0.00 0.00 0.00 0.00 23.12 22.96 1aja s ALA 383 CO -0.03 0.33 1.81 -0.35 0.00 0.00 0.00 175.76 177.52 1aja n PRO 384 N -0.81 1.28 0.00 0.00 -0.04 -1.26 -4.70 135.00 129.47 1aja n PRO 384 Ca -0.08 -0.41 0.00 0.00 -0.04 0.00 0.00 63.50 62.97 1aja n PRO 384 Cb 0.57 -1.40 0.00 0.00 -0.04 0.00 0.00 33.50 32.63 1aja n PRO 384 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1aja n GLY 385 N 0.98 2.32 3.50 0.55 0.00 -1.26 -5.04 105.19 106.25 1aja n GLY 385 Ca 0.18 -1.53 -0.34 0.00 0.00 0.00 0.00 46.02 44.33 1aja n GLY 385 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aja s LEU 386 N 0.00 3.20 0.24 0.99 1.43 -0.88 -3.94 118.68 119.73 1aja s LEU 386 Ca 0.00 -0.13 0.04 0.00 -1.03 0.00 0.00 54.13 53.01 1aja s LEU 386 Cb 0.00 -1.76 -0.05 0.00 0.03 0.00 0.00 46.19 44.41 1aja s LEU 386 CO 0.00 0.19 -0.02 0.42 0.23 0.00 0.00 176.35 177.17 1aja s THR 387 N 0.26 1.18 -0.09 5.49 -4.23 0.31 -0.23 115.64 118.33 1aja s THR 387 Ca -0.04 -2.05 -0.24 0.00 -1.18 0.00 0.00 61.69 58.18 1aja s THR 387 Cb -0.14 -2.37 0.06 0.00 1.34 0.00 0.00 72.50 71.38 1aja s THR 387 CO 0.03 -0.32 0.57 -1.58 -0.54 0.00 0.00 174.62 172.78 1aja s GLN 388 N -3.83 0.86 -0.02 3.99 0.74 -0.87 -0.94 119.66 119.58 1aja s GLN 388 Ca 0.29 0.32 -0.00 0.00 0.05 0.00 0.00 55.36 56.02 1aja s GLN 388 Cb 0.05 0.40 -0.04 0.00 1.10 0.00 0.00 33.01 34.53 1aja s GLN 388 CO 0.09 -0.22 0.03 0.00 -0.55 0.00 0.00 175.29 174.65 1aja s ALA 389 N -0.76 3.40 0.01 1.58 0.00 -1.26 -1.03 121.76 123.70 1aja s ALA 389 Ca -0.08 -0.88 0.04 0.00 0.00 0.00 0.00 51.96 51.03 1aja s ALA 389 Cb -0.02 -1.47 -0.01 0.00 0.00 0.00 0.00 23.12 21.61 1aja s ALA 389 CO 0.06 0.65 -0.12 -0.51 0.00 0.00 0.00 175.76 175.84 1aja s LEU 390 N -1.46 2.09 -0.24 0.00 1.43 0.87 -0.49 118.68 120.88 1aja s LEU 390 Ca 0.19 -0.30 -0.22 0.00 -1.03 0.00 0.00 54.13 52.77 1aja s LEU 390 Cb -0.12 -0.54 -0.01 0.00 0.03 0.00 0.00 46.19 45.55 1aja s LEU 390 CO 0.10 0.08 0.72 0.20 0.23 0.00 0.00 176.35 177.67 1aja s ASN 391 N -0.63 6.71 0.55 2.29 -0.87 -0.43 -0.58 114.94 121.99 1aja s ASN 391 Ca 0.02 0.87 0.05 0.00 -1.57 0.00 0.00 52.86 52.24 1aja s ASN 391 Cb -0.06 -2.38 0.09 0.00 -0.02 0.00 0.00 41.25 38.88 1aja s ASN 391 CO 0.00 -0.42 0.73 0.35 -2.57 0.00 0.00 177.10 175.19 1aja n THR 392 N 5.16 0.00 0.25 1.60 -2.24 -0.36 -4.83 114.28 113.85 1aja n THR 392 Ca 0.02 -1.52 0.18 0.00 -2.27 0.00 0.00 64.05 60.47 1aja n THR 392 Cb 0.48 -0.72 0.89 0.00 -2.10 0.00 0.00 70.33 68.88 1aja n THR 392 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1aja h LYS 393 N 0.00 0.00 -0.00 -0.78 3.64 -1.12 0.22 116.57 118.53 1aja h LYS 393 Ca -0.24 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.14 1aja h LYS 393 Cb 1.04 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 1aja h LYS 393 CO 0.31 0.00 -0.14 -0.25 -2.27 0.00 0.00 179.45 177.11 1aja n ASP 394 N -3.44 0.32 -1.91 4.20 8.00 -1.26 -4.90 116.55 117.56 1aja n ASP 394 Ca 0.00 -0.24 -0.15 0.00 0.71 0.00 0.00 54.79 55.12 1aja n ASP 394 Cb 0.32 -0.14 0.01 0.00 -0.02 0.00 0.00 41.12 41.30 1aja n ASP 394 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1aja n GLY 395 N 1.37 -0.16 3.59 0.44 0.00 0.06 -5.04 105.19 105.46 1aja n GLY 395 Ca 0.11 -0.22 -0.26 0.00 0.00 0.00 0.00 46.02 45.66 1aja n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aja s ALA 396 N -2.86 3.10 -0.12 4.61 0.00 -1.26 -4.91 121.76 120.32 1aja s ALA 396 Ca 0.12 -2.09 -0.09 0.00 0.00 0.00 0.00 51.96 49.91 1aja s ALA 396 Cb -0.05 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 22.89 1aja s ALA 396 CO 0.15 0.03 0.18 0.08 0.00 0.00 0.00 175.76 176.20 1aja s VAL 397 N -2.60 5.43 -0.07 0.00 1.01 -1.26 -1.23 120.40 121.68 1aja s VAL 397 Ca 0.34 0.29 0.04 0.00 0.00 0.00 0.00 61.98 62.66 1aja s VAL 397 Cb 0.03 -3.46 -0.01 0.00 0.00 0.00 0.00 36.38 32.94 1aja s VAL 397 CO 0.18 0.58 -0.21 -0.32 0.00 0.00 0.00 175.10 175.33 1aja s MET 398 N -0.74 2.75 -0.08 2.72 0.00 0.26 -4.91 119.30 119.29 1aja s MET 398 Ca 0.15 -0.83 -0.01 0.00 0.00 0.00 0.00 55.69 55.00 1aja s MET 398 Cb -0.12 -2.30 -0.03 0.00 0.00 0.00 0.00 34.83 32.37 1aja s MET 398 CO 0.04 0.37 -0.02 0.08 0.00 0.00 0.00 175.02 175.50 1aja s VAL 399 N -0.12 4.16 -0.01 10.11 1.01 -1.26 -0.09 120.40 134.20 1aja s VAL 399 Ca -0.04 -0.30 0.08 0.00 0.00 0.00 0.00 61.98 61.72 1aja s VAL 399 Cb -0.14 -2.74 -0.02 0.00 0.00 0.00 0.00 36.38 33.48 1aja s VAL 399 CO 0.04 0.60 -0.25 -0.04 0.00 0.00 0.00 175.10 175.45 1aja s MET 400 N -0.85 2.10 -0.02 2.72 -1.94 -0.19 -1.66 119.30 119.45 1aja s MET 400 Ca 0.13 -0.94 0.07 0.00 -1.71 0.00 0.00 55.69 53.24 1aja s MET 400 Cb -0.11 -2.05 -0.02 0.00 2.01 0.00 0.00 34.83 34.66 1aja s MET 400 CO 0.02 0.56 -0.24 0.45 -0.01 0.00 0.00 175.02 175.80 1aja s SER 401 N -0.69 2.86 0.44 3.03 0.15 0.77 -2.05 113.70 118.21 1aja s SER 401 Ca 0.10 -0.45 0.05 0.00 0.70 0.00 0.00 55.95 56.36 1aja s SER 401 Cb -0.10 -0.40 -0.06 0.00 -1.71 0.00 0.00 66.02 63.75 1aja s SER 401 CO -0.01 0.29 0.02 -0.31 1.20 0.00 0.00 173.24 174.44 1aja s TYR 402 N -0.50 2.35 0.00 3.44 2.02 0.69 -1.26 117.35 124.09 1aja s TYR 402 Ca 0.07 -0.74 0.00 0.00 -0.37 0.00 0.00 57.07 56.03 1aja s TYR 402 Cb -0.10 -1.75 0.00 0.00 -0.40 0.00 0.00 41.96 39.71 1aja s TYR 402 CO -0.00 0.36 0.00 -0.85 -1.57 0.00 0.00 175.55 173.49 1aja n GLU 411 N -1.07 0.00 -4.26 -0.62 -0.00 -1.26 -2.07 120.64 111.35 1aja n GLU 411 Ca -0.08 0.00 -0.27 0.00 -0.00 0.00 0.00 57.16 56.80 1aja n GLU 411 Cb 0.67 0.00 -0.09 0.00 -0.00 0.00 0.00 31.44 32.02 1aja n GLU 411 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.13 176.12 1aja s HIS 412 N -2.36 2.69 0.36 -1.84 0.09 -1.26 -3.50 115.29 109.47 1aja s HIS 412 Ca 0.00 -0.19 0.05 0.00 -0.00 0.00 0.00 55.06 54.92 1aja s HIS 412 Cb 0.00 -1.34 -0.07 0.00 -0.00 0.00 0.00 32.58 31.17 1aja s HIS 412 CO 0.00 0.49 0.04 0.95 -0.00 0.00 0.00 174.74 176.22 1aja s THR 413 N -1.58 1.48 -2.39 1.30 -4.23 -0.53 -4.85 115.64 104.85 1aja s THR 413 Ca 0.24 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.99 1aja s THR 413 Cb -0.09 -2.86 0.48 0.00 1.34 0.00 0.00 72.50 71.36 1aja s THR 413 CO 0.15 0.00 1.44 0.61 -0.54 0.00 0.00 174.62 176.28 1aja n GLY 414 N -0.79 1.90 3.76 3.99 0.00 -1.26 -4.24 105.19 108.55 1aja n GLY 414 Ca -0.03 -0.76 -0.39 0.00 0.00 0.00 0.00 46.02 44.84 1aja n GLY 414 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1aja s SER 415 N -1.39 6.02 0.74 1.61 0.15 -1.26 -4.86 113.70 114.71 1aja s SER 415 Ca 0.41 2.72 -0.14 0.00 0.70 0.00 0.00 55.95 59.64 1aja s SER 415 Cb 0.24 -2.64 0.05 0.00 -1.71 0.00 0.00 66.02 61.95 1aja s SER 415 CO 0.32 -1.05 1.18 0.00 1.20 0.00 0.00 173.24 174.88 1aja s GLN 416 N -2.43 2.13 0.32 5.44 -2.07 -1.26 -4.56 119.66 117.22 1aja s GLN 416 Ca 0.61 1.64 0.02 0.00 -1.82 0.00 0.00 55.36 55.80 1aja s GLN 416 Cb -0.39 -1.85 -0.02 0.00 -1.09 0.00 0.00 33.01 29.66 1aja s GLN 416 CO 0.50 -1.81 0.35 -0.48 -1.32 0.00 0.00 175.29 172.52 1aja s LEU 417 N -5.31 1.33 0.22 2.60 0.05 -1.11 -4.90 118.68 111.56 1aja s LEU 417 Ca 0.71 -1.58 -0.30 0.00 0.05 0.00 0.00 54.13 53.02 1aja s LEU 417 Cb -0.26 0.96 -0.09 0.00 -2.05 0.00 0.00 46.19 44.75 1aja s LEU 417 CO 0.47 -1.14 1.25 -0.60 -0.55 0.00 0.00 176.35 175.78 1aja s ARG 418 N -3.38 4.45 -0.01 1.48 3.52 -1.26 -1.39 118.95 122.35 1aja s ARG 418 Ca 0.36 1.99 0.04 0.00 -0.13 0.00 0.00 55.73 57.99 1aja s ARG 418 Cb 0.02 -3.19 -0.01 0.00 -1.56 0.00 0.00 34.95 30.21 1aja s ARG 418 CO 0.22 -0.13 -0.13 -1.50 -0.81 0.00 0.00 175.30 172.95 1aja s ILE 419 N -0.29 1.05 0.03 4.11 2.07 -0.66 -4.37 121.20 123.15 1aja s ILE 419 Ca 0.53 -0.56 0.00 0.00 -1.41 0.00 0.00 60.65 59.21 1aja s ILE 419 Cb -0.35 -0.89 -0.02 0.00 0.13 0.00 0.00 42.46 41.33 1aja s ILE 419 CO 0.40 0.30 -0.04 0.00 -1.91 0.00 0.00 174.94 173.69 1aja s ALA 420 N -0.23 0.30 0.15 1.50 0.00 -0.99 -1.03 121.76 121.47 1aja s ALA 420 Ca 0.03 -0.74 -0.14 0.00 0.00 0.00 0.00 51.96 51.11 1aja s ALA 420 Cb -0.06 0.15 0.02 0.00 0.00 0.00 0.00 23.12 23.23 1aja s ALA 420 CO -0.00 -0.17 0.38 0.00 0.00 0.00 0.00 175.76 175.97 1aja s ALA 421 N -1.89 -0.66 -0.03 0.00 0.00 0.39 -1.38 121.76 118.18 1aja s ALA 421 Ca -0.10 -0.34 -0.01 0.00 0.00 0.00 0.00 51.96 51.51 1aja s ALA 421 Cb -0.07 0.74 0.03 0.00 0.00 0.00 0.00 23.12 23.83 1aja s ALA 421 CO -0.02 -0.67 0.04 -0.47 0.00 0.00 0.00 175.76 174.64 1aja s TYR 422 N -3.86 0.03 -3.27 0.00 5.04 0.15 -2.66 117.35 112.78 1aja s TYR 422 Ca 0.08 0.19 0.00 0.00 -2.44 0.00 0.00 57.07 54.90 1aja s TYR 422 Cb 0.02 -0.32 0.00 0.00 0.35 0.00 0.00 41.96 42.00 1aja s TYR 422 CO -0.07 -0.13 0.00 0.41 -1.34 0.00 0.00 175.55 174.42 1aja n GLY 423 N 4.61 0.79 3.77 8.97 0.00 -1.26 -0.60 105.19 121.47 1aja n GLY 423 Ca -0.19 -2.06 -0.41 0.00 0.00 0.00 0.00 46.02 43.37 1aja n GLY 423 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1aja s PRO 424 N -1.23 4.19 0.00 1.61 0.02 -1.26 -2.77 135.00 135.56 1aja s PRO 424 Ca 0.00 2.42 0.00 0.00 0.02 0.00 0.00 61.00 63.44 1aja s PRO 424 Cb 0.00 -2.99 0.00 0.00 0.02 0.00 0.00 34.50 31.53 1aja s PRO 424 CO 0.00 -0.41 0.00 0.72 -0.33 0.00 0.00 177.00 176.98 1aja n HIS 425 N 0.56 0.00 0.28 6.54 8.25 -0.16 -4.65 115.22 126.04 1aja n HIS 425 Ca 0.01 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.61 1aja n HIS 425 Cb 0.40 -0.57 0.86 0.00 1.12 0.00 0.00 29.99 31.80 1aja n HIS 425 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1aja h ALA 426 N 0.00 1.64 -0.03 -1.41 0.00 -1.77 -1.91 119.26 115.78 1aja h ALA 426 Ca 0.00 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1aja h ALA 426 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1aja h ALA 426 CO 0.00 -0.03 0.20 0.00 0.00 0.00 0.00 179.25 179.43 1aja h ALA 427 N 1.98 1.29 -0.01 0.00 0.00 -1.88 -2.04 119.26 118.60 1aja h ALA 427 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1aja h ALA 427 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1aja h ALA 427 CO -0.00 -0.22 0.00 0.09 0.00 0.00 0.00 179.25 179.12 1aja n ASN 428 N -3.07 0.13 -0.09 0.00 3.02 -0.72 -2.78 115.26 111.74 1aja n ASN 428 Ca -0.02 -1.42 0.11 0.00 -0.03 0.00 0.00 54.58 53.23 1aja n ASN 428 Cb 0.27 -0.01 0.02 0.00 -0.61 0.00 0.00 39.78 39.45 1aja n ASN 428 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1aja n VAL 429 N -0.72 0.00 -2.51 2.41 0.24 -0.77 -4.96 118.33 112.02 1aja n VAL 429 Ca 0.15 -0.05 -0.37 0.00 -2.04 0.00 0.00 64.34 62.02 1aja n VAL 429 Cb 0.09 0.83 -0.04 0.00 -1.47 0.00 0.00 33.84 33.25 1aja n VAL 429 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1aja s VAL 430 N -2.89 3.63 0.00 3.34 1.01 -1.12 -3.31 120.40 121.07 1aja s VAL 430 Ca 0.11 1.33 0.00 0.00 0.00 0.00 0.00 61.98 63.42 1aja s VAL 430 Cb 0.17 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.82 1aja s VAL 430 CO 0.76 0.09 0.00 0.61 0.00 0.00 0.00 175.10 176.56 1aja n GLY 431 N 0.54 -1.48 3.58 4.51 0.00 -1.26 -4.75 105.19 106.32 1aja n GLY 431 Ca 0.04 -1.54 -0.40 0.00 0.00 0.00 0.00 46.02 44.12 1aja n GLY 431 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1aja s LEU 432 N 0.00 4.21 0.00 0.99 2.96 -1.26 -1.07 118.68 124.51 1aja s LEU 432 Ca 0.00 0.03 0.00 0.00 -0.22 0.00 0.00 54.13 53.95 1aja s LEU 432 Cb 0.00 -2.37 -0.00 0.00 0.50 0.00 0.00 46.19 44.32 1aja s LEU 432 CO 0.00 -0.25 0.00 0.35 -1.32 0.00 0.00 176.35 175.14 1aja n THR 433 N 5.18 0.00 -4.39 3.68 -2.24 -0.87 -5.00 114.28 110.64 1aja n THR 433 Ca -0.09 -0.05 -0.22 0.00 -2.27 0.00 0.00 64.05 61.42 1aja n THR 433 Cb 0.50 0.02 -0.11 0.00 -2.10 0.00 0.00 70.33 68.64 1aja n THR 433 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1aja s ASP 434 N -1.06 3.01 0.37 3.42 2.15 -1.26 -1.42 116.67 121.89 1aja s ASP 434 Ca 0.00 -0.95 0.12 0.00 0.43 0.00 0.00 52.55 52.15 1aja s ASP 434 Cb 0.00 -0.21 0.91 0.00 -0.30 0.00 0.00 42.92 43.32 1aja s ASP 434 CO 0.00 -0.03 1.86 -0.61 -0.17 0.00 0.00 175.17 176.22 1aja h GLN 435 N 2.80 0.58 0.00 4.34 4.15 -0.78 -0.54 115.11 125.66 1aja h GLN 435 Ca -0.41 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 58.97 1aja h GLN 435 Cb 1.22 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.79 1aja h GLN 435 CO 0.56 0.38 0.00 1.79 -1.93 0.00 0.00 178.83 179.63 1aja h THR 436 N 0.59 0.00 0.00 2.39 1.35 -1.85 -1.68 112.91 113.72 1aja h THR 436 Ca 0.46 -0.66 -0.04 0.00 -0.55 0.00 0.00 66.41 65.62 1aja h THR 436 Cb 0.88 1.64 -0.01 0.00 -1.73 0.00 0.00 68.15 68.94 1aja h THR 436 CO -0.21 0.00 -0.20 0.44 -0.25 0.00 0.00 175.52 175.30 1aja h ASP 437 N 0.00 0.00 -1.00 5.36 3.32 -1.41 -2.55 116.42 120.14 1aja h ASP 437 Ca 0.00 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.07 1aja h ASP 437 Cb 0.68 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.18 1aja h ASP 437 CO 0.00 0.20 0.66 0.25 -1.72 0.00 0.00 179.24 178.63 1aja h LEU 438 N 0.00 1.13 -0.11 1.55 5.85 -1.35 0.56 115.31 122.94 1aja h LEU 438 Ca -0.00 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.72 1aja h LEU 438 Cb 0.37 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 1aja h LEU 438 CO 0.03 0.81 -0.08 0.15 -0.34 0.00 0.00 178.44 179.01 1aja h PHE 439 N 1.33 -0.20 -0.21 1.25 3.57 -1.51 -0.50 116.94 120.67 1aja h PHE 439 Ca 0.37 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.81 1aja h PHE 439 Cb -0.13 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 1aja h PHE 439 CO -0.00 -0.13 -0.19 1.88 -2.23 0.00 0.00 178.31 177.64 1aja h TYR 440 N -0.09 0.40 -0.50 0.41 0.05 -1.35 0.25 116.97 116.13 1aja h TYR 440 Ca 0.07 -0.07 -0.11 0.00 0.05 0.00 0.00 58.73 58.67 1aja h TYR 440 Cb 0.19 -0.11 -0.02 0.00 1.01 0.00 0.00 36.73 37.81 1aja h TYR 440 CO -0.20 0.55 -0.12 1.15 -1.05 0.00 0.00 178.16 178.49 1aja h THR 441 N 0.34 1.27 0.06 -2.88 2.02 -0.48 -1.31 112.91 111.93 1aja h THR 441 Ca 0.06 -1.25 -0.00 0.00 0.77 0.00 0.00 66.41 65.99 1aja h THR 441 Cb 0.54 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.94 1aja h THR 441 CO 0.04 0.44 -0.03 0.24 0.37 0.00 0.00 175.52 176.57 1aja h MET 442 N 0.84 -0.08 -0.68 6.66 2.86 -0.50 -1.16 114.93 122.87 1aja h MET 442 Ca 0.13 0.01 0.07 0.00 -2.06 0.00 0.00 59.70 57.85 1aja h MET 442 Cb 0.66 0.02 -0.10 0.00 0.06 0.00 0.00 31.60 32.24 1aja h MET 442 CO 0.05 0.26 -0.55 0.87 1.06 0.00 0.00 176.91 178.59 1aja h LYS 443 N -0.43 -0.18 -0.28 1.72 1.79 -0.95 -1.49 116.57 116.75 1aja h LYS 443 Ca -0.01 0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 1aja h LYS 443 Cb 0.38 0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 31.05 1aja h LYS 443 CO 0.01 -0.12 -0.01 0.00 -1.08 0.00 0.00 179.45 178.26 1aja h ALA 444 N 0.18 1.47 -0.09 3.86 0.00 -1.17 0.12 119.26 123.63 1aja h ALA 444 Ca 0.11 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1aja h ALA 444 Cb 0.48 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1aja h ALA 444 CO -0.74 0.38 -0.02 0.00 0.00 0.00 0.00 179.25 178.87 1aja h ALA 445 N 1.59 0.13 0.00 0.00 0.00 -0.63 -2.85 119.26 117.49 1aja h ALA 445 Ca 0.09 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1aja h ALA 445 Cb 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1aja h ALA 445 CO 0.01 -0.15 0.00 -0.11 0.00 0.00 0.00 179.25 179.00 1aja n LEU 446 N -4.79 0.00 -0.18 0.00 7.94 -0.61 -0.95 117.00 118.40 1aja n LEU 446 Ca -0.06 0.11 -0.02 0.00 -1.11 0.00 0.00 56.01 54.93 1aja n LEU 446 Cb 0.23 -0.11 -0.01 0.00 0.53 0.00 0.00 43.42 44.06 1aja n LEU 446 CO 0.35 -0.01 -0.02 0.61 -1.11 0.00 0.00 177.39 177.21 1aja n GLY 447 N 0.95 0.41 3.75 -3.96 0.00 -0.09 -4.95 105.19 101.30 1aja n GLY 447 Ca 0.19 -0.08 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1aja n GLY 447 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aja s LEU 448 N -0.54 3.78 0.00 0.99 1.02 -0.50 -4.98 118.68 118.45 1aja s LEU 448 Ca 0.00 2.69 0.00 0.00 0.02 0.00 0.00 54.13 56.84 1aja s LEU 448 Cb 0.00 -4.37 0.00 0.00 0.02 0.00 0.00 46.19 41.84 1aja s LEU 448 CO 0.00 -1.65 0.00 0.29 0.02 0.00 0.00 176.35 175.01