#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dpt n LEU 3 N 0.00 -0.85 -3.61 6.15 0.00 -1.26 -5.00 117.00 112.43 2dpt n LEU 3 Ca 0.00 1.93 -0.12 0.00 0.00 0.00 0.00 56.01 57.82 2dpt n LEU 3 Cb 0.00 -4.58 -0.07 0.00 0.00 0.00 0.00 43.42 38.77 2dpt n LEU 3 CO 0.00 -3.09 0.60 0.54 0.00 0.00 0.00 177.39 175.44 2dpt s VAL 4 N -3.12 0.00 -0.15 1.96 0.11 -1.21 -5.03 120.40 112.95 2dpt s VAL 4 Ca 0.00 0.00 -0.19 0.00 -2.93 0.00 0.00 61.98 58.86 2dpt s VAL 4 Cb 0.00 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.81 2dpt s VAL 4 CO 0.00 0.00 0.52 -1.58 -3.33 0.00 0.00 175.10 170.71 2dpt s GLN 5 N -0.12 4.28 0.48 1.54 2.00 -1.26 -1.71 119.66 124.87 2dpt s GLN 5 Ca -0.01 0.47 -0.13 0.00 -2.00 0.00 0.00 55.36 53.69 2dpt s GLN 5 Cb -0.04 -3.49 -0.07 0.00 0.80 0.00 0.00 33.01 30.21 2dpt s GLN 5 CO -0.01 0.01 0.90 -0.51 -0.50 0.00 0.00 175.29 175.18 2dpt s LEU 6 N 1.10 3.68 0.14 3.68 1.43 -0.59 -4.96 118.68 123.16 2dpt s LEU 6 Ca 0.26 1.36 0.08 0.00 -1.03 0.00 0.00 54.13 54.80 2dpt s LEU 6 Cb -0.15 -4.29 -0.04 0.00 0.03 0.00 0.00 46.19 41.74 2dpt s LEU 6 CO 0.10 -0.53 -0.10 -0.55 0.23 0.00 0.00 176.35 175.50 2dpt s SER 7 N -3.23 4.32 0.59 2.29 0.15 -1.26 -3.76 113.70 112.80 2dpt s SER 7 Ca 0.55 -0.48 0.37 0.00 0.70 0.00 0.00 55.95 57.08 2dpt s SER 7 Cb -0.10 -0.77 1.70 0.00 -1.71 0.00 0.00 66.02 65.14 2dpt s SER 7 CO 0.34 0.14 2.11 -0.09 1.20 0.00 0.00 173.24 176.93 2dpt h ARG 8 N 3.25 0.00 0.00 5.44 2.43 -1.98 -3.25 114.38 120.28 2dpt h ARG 8 Ca -0.48 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 2dpt h ARG 8 Cb 1.19 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 2dpt h ARG 8 CO 0.53 0.01 0.00 1.58 -1.51 0.00 0.00 179.97 180.58 2dpt n HIS 9 N -3.12 0.00 -2.01 2.20 -0.00 -1.26 -4.89 115.22 106.14 2dpt n HIS 9 Ca -0.01 0.00 -0.29 0.00 0.46 0.00 0.00 57.72 57.89 2dpt n HIS 9 Cb 0.23 -0.45 0.14 0.00 -0.12 0.00 0.00 29.99 29.80 2dpt n HIS 9 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2dpt s SER 10 N -2.19 3.77 0.00 0.26 0.15 -1.23 -5.00 113.70 109.46 2dpt s SER 10 Ca 0.00 0.37 0.00 0.00 0.70 0.00 0.00 55.95 57.02 2dpt s SER 10 Cb 0.00 -0.62 0.00 0.00 -1.71 0.00 0.00 66.02 63.69 2dpt s SER 10 CO 0.00 -2.32 0.57 -0.38 1.20 0.00 0.00 173.24 172.32 2dpt n ILE 11 N -3.48 0.33 -2.62 6.45 -0.00 -1.26 -4.68 119.36 114.10 2dpt n ILE 11 Ca 0.13 -0.43 -0.34 0.00 -0.00 0.00 0.00 62.75 62.10 2dpt n ILE 11 Cb 0.60 1.02 -0.05 0.00 -0.00 0.00 0.00 39.64 41.21 2dpt n ILE 11 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2dpt s ALA 12 N -0.33 2.93 0.21 -1.39 0.00 -1.26 -4.87 121.76 117.05 2dpt s ALA 12 Ca 0.00 0.55 0.11 0.00 0.00 0.00 0.00 51.96 52.62 2dpt s ALA 12 Cb 0.00 -3.22 -0.05 0.00 0.00 0.00 0.00 23.12 19.85 2dpt s ALA 12 CO 0.00 -0.18 -0.22 -0.06 0.00 0.00 0.00 175.76 175.30 2dpt s PHE 13 N -2.02 2.20 0.43 0.00 0.40 -1.26 -4.92 117.98 112.82 2dpt s PHE 13 Ca 0.65 -0.38 -0.21 0.00 -0.60 0.00 0.00 56.93 56.40 2dpt s PHE 13 Cb -0.14 -1.06 -0.11 0.00 0.51 0.00 0.00 43.02 42.22 2dpt s PHE 13 CO 0.18 0.52 0.96 -1.25 0.70 0.00 0.00 175.22 176.33 2dpt s PRO 14 N -2.90 4.19 0.06 0.24 0.04 -1.26 -4.96 135.00 130.41 2dpt s PRO 14 Ca 0.22 1.14 -0.34 0.00 0.04 0.00 0.00 61.00 62.06 2dpt s PRO 14 Cb -0.07 -2.17 -0.14 0.00 0.04 0.00 0.00 34.50 32.16 2dpt s PRO 14 CO 0.10 -0.06 1.65 0.45 0.04 0.00 0.00 177.00 179.18 2dpt n SER 15 N -0.67 3.05 -0.35 6.66 2.88 -1.26 -4.85 113.62 119.09 2dpt n SER 15 Ca 0.07 1.05 0.23 0.00 -1.33 0.00 0.00 58.87 58.90 2dpt n SER 15 Cb 0.54 -1.38 0.48 0.00 -0.75 0.00 0.00 64.21 63.10 2dpt n SER 15 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2dpt h PRO 16 N 6.85 0.38 0.00 -1.46 0.11 -1.93 -1.53 132.00 134.42 2dpt h PRO 16 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2dpt h PRO 16 Cb 1.27 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2dpt h PRO 16 CO 0.90 0.25 0.08 1.49 -0.21 0.00 0.00 178.00 180.52 2dpt h GLU 17 N 0.40 0.00 -0.06 1.05 4.57 -1.93 -0.30 114.58 118.31 2dpt h GLU 17 Ca 0.68 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.86 2dpt h GLU 17 Cb 1.60 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.19 2dpt h GLU 17 CO -0.45 0.00 0.00 0.41 -1.18 0.00 0.00 179.01 177.79 2dpt n GLY 18 N -1.17 -0.11 3.55 1.92 0.00 -0.58 -4.94 105.19 103.87 2dpt n GLY 18 Ca -0.02 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 2dpt n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dpt n ALA 19 N -0.00 -1.92 -1.63 4.61 0.00 -0.13 -4.78 120.51 116.67 2dpt n ALA 19 Ca 0.18 -0.82 -0.30 0.00 0.00 0.00 0.00 53.44 52.51 2dpt n ALA 19 Cb 0.30 -2.04 0.07 0.00 0.00 0.00 0.00 19.45 17.77 2dpt n ALA 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2dpt s LEU 20 N -5.85 2.78 -0.12 0.00 1.43 -0.30 -4.90 118.68 111.72 2dpt s LEU 20 Ca 0.66 1.34 -0.07 0.00 -1.03 0.00 0.00 54.13 55.03 2dpt s LEU 20 Cb -0.23 -4.05 -0.26 0.00 0.03 0.00 0.00 46.19 41.68 2dpt s LEU 20 CO 0.62 -1.72 0.36 0.54 0.23 0.00 0.00 176.35 176.38 2dpt n ARG 21 N -3.27 0.76 -3.48 1.70 5.12 -1.26 -2.24 116.66 113.99 2dpt n ARG 21 Ca 0.07 0.26 -0.13 0.00 -1.93 0.00 0.00 57.85 56.13 2dpt n ARG 21 Cb 0.56 -1.71 -0.11 0.00 -1.16 0.00 0.00 32.46 30.04 2dpt n ARG 21 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 2dpt s GLU 22 N -2.56 0.26 0.04 5.56 2.56 -1.26 -2.36 118.70 120.95 2dpt s GLU 22 Ca -0.23 0.52 -0.33 0.00 0.00 0.00 0.00 54.97 54.93 2dpt s GLU 22 Cb 0.07 -0.55 -0.12 0.00 2.00 0.00 0.00 34.13 35.53 2dpt s GLU 22 CO 0.77 -0.54 1.79 -0.35 -0.56 0.00 0.00 175.26 176.36 2dpt n PRO 23 N 5.35 2.36 -1.64 4.30 -0.04 -1.26 -5.08 135.00 138.99 2dpt n PRO 23 Ca -0.05 0.86 -0.46 0.00 -0.04 0.00 0.00 63.50 63.81 2dpt n PRO 23 Cb 0.50 -2.70 -0.04 0.00 -0.04 0.00 0.00 33.50 31.21 2dpt n PRO 23 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2dpt n ASN 24 N 5.56 3.46 0.00 3.54 2.85 -0.99 -2.33 115.26 127.34 2dpt n ASN 24 Ca 0.20 0.77 0.00 0.00 -0.11 0.00 0.00 54.58 55.44 2dpt n ASN 24 Cb 0.32 -1.43 0.00 0.00 1.24 0.00 0.00 39.78 39.91 2dpt n ASN 24 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2dpt n GLY 25 N 4.89 2.75 3.55 8.20 0.00 -0.95 -4.43 105.19 119.20 2dpt n GLY 25 Ca 0.25 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.77 2dpt n GLY 25 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2dpt n LEU 26 N 0.00 2.62 -0.04 0.99 0.00 -0.98 -1.25 117.00 118.34 2dpt n LEU 26 Ca 0.00 0.58 -0.07 0.00 0.00 0.00 0.00 56.01 56.53 2dpt n LEU 26 Cb 0.00 -1.31 -0.04 0.00 0.00 0.00 0.00 43.42 42.07 2dpt n LEU 26 CO 0.00 -0.53 -0.78 -0.11 0.00 0.00 0.00 177.39 175.97 2dpt n LEU 27 N 8.89 2.34 -3.67 -1.96 7.94 -0.25 -1.15 117.00 129.15 2dpt n LEU 27 Ca 0.34 -0.00 -0.09 0.00 -1.11 0.00 0.00 56.01 55.15 2dpt n LEU 27 Cb 0.26 -0.28 -0.02 0.00 0.53 0.00 0.00 43.42 43.92 2dpt n LEU 27 CO 0.75 0.51 0.47 0.00 -1.11 0.00 0.00 177.39 178.00 2dpt s ALA 28 N -2.16 -1.42 0.14 1.96 0.00 -1.15 -3.29 121.76 115.84 2dpt s ALA 28 Ca -0.11 0.08 0.02 0.00 0.00 0.00 0.00 51.96 51.95 2dpt s ALA 28 Cb 0.03 0.84 -0.04 0.00 0.00 0.00 0.00 23.12 23.95 2dpt s ALA 28 CO 0.18 -0.92 -0.04 -0.48 0.00 0.00 0.00 175.76 174.50 2dpt s LEU 29 N -2.84 2.34 0.00 0.00 2.34 -0.69 0.66 118.68 120.49 2dpt s LEU 29 Ca 0.07 -1.08 0.00 0.00 0.06 0.00 0.00 54.13 53.18 2dpt s LEU 29 Cb -0.04 -0.10 0.00 0.00 -0.56 0.00 0.00 46.19 45.49 2dpt s LEU 29 CO -0.02 -0.49 0.00 0.61 -1.06 0.00 0.00 176.35 175.39 2dpt n GLY 30 N -0.15 -1.72 6.02 -3.48 0.00 0.33 -1.54 105.19 104.66 2dpt n GLY 30 Ca -0.09 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.23 2dpt n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dpt n GLY 31 N 0.00 0.31 0.70 -0.02 0.00 -1.25 -4.67 105.19 100.26 2dpt n GLY 31 Ca 0.00 -1.07 -0.03 0.00 0.00 0.00 0.00 46.02 44.93 2dpt n GLY 31 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dpt n ASP 32 N 3.03 -0.30 -0.88 1.61 5.75 -1.26 -4.91 116.55 119.58 2dpt n ASP 32 Ca 0.00 -1.38 0.00 0.00 -0.01 0.00 0.00 54.79 53.40 2dpt n ASP 32 Cb 0.00 0.56 0.18 0.00 -1.03 0.00 0.00 41.12 40.83 2dpt n ASP 32 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2dpt n LEU 33 N 0.00 3.22 -4.77 -2.12 4.77 -1.26 -4.81 117.00 112.03 2dpt n LEU 33 Ca -0.00 -4.02 -0.37 0.00 -0.03 0.00 0.00 56.01 51.59 2dpt n LEU 33 Cb 0.12 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.69 2dpt n LEU 33 CO 0.06 1.49 0.86 -0.94 -1.33 0.00 0.00 177.39 177.53 2dpt s SER 34 N -3.20 5.92 0.28 -1.43 1.04 -1.26 -4.74 113.70 110.32 2dpt s SER 34 Ca 0.41 2.40 -0.03 0.00 0.48 0.00 0.00 55.95 59.21 2dpt s SER 34 Cb 0.38 -2.61 0.58 0.00 0.10 0.00 0.00 66.02 64.47 2dpt s SER 34 CO -0.05 -1.10 1.59 -0.65 0.98 0.00 0.00 173.24 174.01 2dpt h PRO 35 N 1.84 0.03 0.13 4.02 0.11 -1.97 0.26 132.00 136.42 2dpt h PRO 35 Ca -0.50 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 2dpt h PRO 35 Cb 1.26 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 2dpt h PRO 35 CO 0.59 0.02 -0.10 0.00 -0.21 0.00 0.00 178.00 178.30 2dpt h ALA 36 N 1.90 -0.22 -0.34 -0.75 0.00 -1.98 0.11 119.26 117.98 2dpt h ALA 36 Ca 0.51 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.30 2dpt h ALA 36 Cb 0.95 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2dpt h ALA 36 CO -0.87 -0.63 -0.10 -0.09 0.00 0.00 0.00 179.25 177.55 2dpt h ARG 37 N -0.24 0.66 0.18 0.00 2.43 -1.51 -0.59 114.38 115.31 2dpt h ARG 37 Ca -0.00 -0.26 -0.00 0.00 -0.81 0.00 0.00 59.98 58.90 2dpt h ARG 37 Cb 0.21 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 2dpt h ARG 37 CO -0.01 0.84 -0.12 -0.07 -1.51 0.00 0.00 179.97 179.10 2dpt h LEU 38 N 0.44 -0.31 -0.94 3.80 3.38 -0.93 0.96 115.31 121.71 2dpt h LEU 38 Ca 0.08 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.14 2dpt h LEU 38 Cb 0.61 0.10 -0.07 0.00 0.09 0.00 0.00 40.66 41.39 2dpt h LEU 38 CO 0.04 -0.19 0.60 0.25 0.09 0.00 0.00 178.44 179.22 2dpt h LEU 39 N -0.30 0.96 -0.69 1.67 5.85 -0.76 -0.84 115.31 121.20 2dpt h LEU 39 Ca -0.01 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 2dpt h LEU 39 Cb 0.26 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 2dpt h LEU 39 CO 0.00 0.61 0.38 -0.03 -0.34 0.00 0.00 178.44 179.06 2dpt h MET 40 N 1.09 0.96 -0.23 1.25 4.05 -0.45 -1.91 114.93 119.68 2dpt h MET 40 Ca 0.41 -0.11 -0.00 0.00 -0.28 0.00 0.00 59.70 59.72 2dpt h MET 40 Cb 0.17 -0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 30.77 2dpt h MET 40 CO -0.17 0.72 0.14 0.00 0.23 0.00 0.00 176.91 177.82 2dpt h ALA 41 N 1.19 0.30 -0.66 0.39 0.00 0.53 -1.92 119.26 119.09 2dpt h ALA 41 Ca 0.24 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2dpt h ALA 41 Cb 0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2dpt h ALA 41 CO -0.04 -0.19 0.32 1.88 0.00 0.00 0.00 179.25 181.22 2dpt h TYR 42 N 0.28 0.93 -0.68 0.00 0.05 -1.14 0.14 116.97 116.55 2dpt h TYR 42 Ca 0.08 -0.03 0.07 0.00 0.05 0.00 0.00 58.73 58.89 2dpt h TYR 42 Cb 0.04 -0.29 -0.06 0.00 1.01 0.00 0.00 36.73 37.43 2dpt h TYR 42 CO -0.04 0.68 0.37 1.96 -1.05 0.00 0.00 178.16 180.07 2dpt h GLN 43 N 0.93 0.65 -0.11 4.88 4.20 -0.92 -1.73 115.11 123.01 2dpt h GLN 43 Ca 0.23 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.90 2dpt h GLN 43 Cb 0.10 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.73 2dpt h GLN 43 CO -0.03 0.43 0.00 0.54 -0.67 0.00 0.00 178.83 179.10 2dpt n ARG 44 N -4.80 1.40 -2.14 1.46 3.00 -0.74 -4.87 116.66 109.97 2dpt n ARG 44 Ca 0.09 -0.61 -0.06 0.00 -0.01 0.00 0.00 57.85 57.25 2dpt n ARG 44 Cb 0.19 -1.30 -0.00 0.00 0.00 0.00 0.00 32.46 31.35 2dpt n ARG 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2dpt n GLY 45 N 0.93 0.12 3.37 -0.13 0.00 -0.61 -4.81 105.19 104.06 2dpt n GLY 45 Ca 0.13 -0.61 -0.27 0.00 0.00 0.00 0.00 46.02 45.26 2dpt n GLY 45 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dpt s ILE 46 N -2.34 2.13 0.01 -0.61 1.01 0.41 -4.65 121.20 117.15 2dpt s ILE 46 Ca 0.00 -1.74 -0.03 0.00 0.00 0.00 0.00 60.65 58.88 2dpt s ILE 46 Cb -0.00 -1.90 -0.01 0.00 0.01 0.00 0.00 42.46 40.55 2dpt s ILE 46 CO 0.01 0.02 0.04 0.72 0.00 0.00 0.00 174.94 175.73 2dpt s PHE 47 N -1.18 0.17 0.21 3.97 -0.12 -0.02 -3.14 117.98 117.87 2dpt s PHE 47 Ca 0.13 -0.37 -0.15 0.00 -0.05 0.00 0.00 56.93 56.49 2dpt s PHE 47 Cb -0.10 -0.13 -0.08 0.00 -0.63 0.00 0.00 43.02 42.09 2dpt s PHE 47 CO 0.06 -0.23 0.63 -1.25 -0.05 0.00 0.00 175.22 174.38 2dpt s PRO 48 N -1.45 4.03 -0.29 1.99 0.04 -1.26 0.39 135.00 138.45 2dpt s PRO 48 Ca -0.15 0.59 -0.14 0.00 0.04 0.00 0.00 61.00 61.33 2dpt s PRO 48 Cb -0.09 -2.78 0.14 0.00 0.04 0.00 0.00 34.50 31.81 2dpt s PRO 48 CO 0.00 0.37 0.86 -0.46 0.04 0.00 0.00 177.00 177.82 2dpt s TRP 49 N -1.63 -0.85 -0.18 0.56 -0.00 0.05 -4.93 118.94 111.97 2dpt s TRP 49 Ca 0.44 1.57 -0.30 0.00 -0.00 0.00 0.00 56.10 57.81 2dpt s TRP 49 Cb -0.14 0.51 0.14 0.00 -0.00 0.00 0.00 33.47 33.97 2dpt s TRP 49 CO 0.20 -0.42 1.04 -0.59 -0.00 0.00 0.00 176.95 177.18 2dpt s PHE 50 N 2.04 -0.33 0.58 5.86 -0.12 -1.26 -4.18 117.98 120.57 2dpt s PHE 50 Ca -0.07 0.56 -0.14 0.00 -0.05 0.00 0.00 56.93 57.24 2dpt s PHE 50 Cb -0.06 0.46 -0.05 0.00 -0.63 0.00 0.00 43.02 42.73 2dpt s PHE 50 CO -0.17 -0.30 1.01 -1.54 -0.05 0.00 0.00 175.22 174.17 2dpt s SER 51 N -1.10 6.34 0.23 1.98 1.04 -1.26 -4.69 113.70 116.25 2dpt s SER 51 Ca -0.00 1.51 -0.31 0.00 0.48 0.00 0.00 55.95 57.62 2dpt s SER 51 Cb -0.01 -2.49 -0.13 0.00 0.10 0.00 0.00 66.02 63.49 2dpt s SER 51 CO 0.00 -0.79 1.46 -2.65 0.98 0.00 0.00 173.24 172.25 2dpt n PRO 52 N -2.24 2.14 0.00 4.02 -0.02 -1.26 -1.78 135.00 135.85 2dpt n PRO 52 Ca 0.06 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 2dpt n PRO 52 Cb 0.54 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2dpt n PRO 52 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dpt n GLY 53 N 2.36 1.62 3.93 -1.23 0.00 -1.26 -5.05 105.19 105.56 2dpt n GLY 53 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 2dpt n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dpt s ASP 54 N -1.90 6.35 0.69 1.61 1.01 -0.73 -5.08 116.67 118.62 2dpt s ASP 54 Ca 0.00 0.44 -0.11 0.00 0.71 0.00 0.00 52.55 53.59 2dpt s ASP 54 Cb 0.00 -2.02 0.01 0.00 1.01 0.00 0.00 42.92 41.91 2dpt s ASP 54 CO 0.00 -0.17 1.06 -2.16 0.21 0.00 0.00 175.17 174.11 2dpt s PRO 55 N -3.84 2.95 0.21 8.23 0.04 -1.26 -4.90 135.00 136.42 2dpt s PRO 55 Ca 0.39 0.95 -0.32 0.00 0.04 0.00 0.00 61.00 62.07 2dpt s PRO 55 Cb -0.10 -1.99 -0.14 0.00 0.04 0.00 0.00 34.50 32.31 2dpt s PRO 55 CO 0.32 -1.09 1.46 -0.89 0.04 0.00 0.00 177.00 176.84 2dpt n ILE 56 N -3.12 0.59 -5.18 0.56 5.41 -1.26 -4.78 119.36 111.57 2dpt n ILE 56 Ca 0.07 -0.15 -0.32 0.00 1.00 0.00 0.00 62.75 63.36 2dpt n ILE 56 Cb 0.54 -1.46 -0.16 0.00 -0.71 0.00 0.00 39.64 37.85 2dpt n ILE 56 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2dpt s LEU 57 N 0.39 2.23 -0.07 1.39 1.43 -1.26 -0.52 118.68 122.28 2dpt s LEU 57 Ca 0.72 -0.43 0.03 0.00 -1.03 0.00 0.00 54.13 53.43 2dpt s LEU 57 Cb -0.67 -1.41 -0.02 0.00 0.03 0.00 0.00 46.19 44.11 2dpt s LEU 57 CO 0.46 0.29 -0.14 0.26 0.23 0.00 0.00 176.35 177.44 2dpt s TRP 58 N -0.41 2.72 0.13 0.29 0.52 0.21 -0.77 118.94 121.63 2dpt s TRP 58 Ca 0.04 -0.28 0.04 0.00 0.02 0.00 0.00 56.10 55.93 2dpt s TRP 58 Cb -0.12 -1.67 -0.04 0.00 -1.15 0.00 0.00 33.47 30.49 2dpt s TRP 58 CO 0.01 0.09 -0.11 -1.58 0.02 0.00 0.00 176.95 175.39 2dpt s TRP 59 N -0.49 1.24 -0.51 -1.98 0.52 0.16 -1.09 118.94 116.80 2dpt s TRP 59 Ca 0.06 -0.72 0.07 0.00 0.02 0.00 0.00 56.10 55.53 2dpt s TRP 59 Cb -0.12 -0.64 0.21 0.00 -1.15 0.00 0.00 33.47 31.77 2dpt s TRP 59 CO 0.02 0.07 0.79 0.45 0.02 0.00 0.00 176.95 178.30 2dpt n SER 60 N 0.03 -3.19 -4.70 2.95 2.88 -0.38 -0.84 113.62 110.38 2dpt n SER 60 Ca -0.12 -3.07 -0.31 0.00 -1.33 0.00 0.00 58.87 54.04 2dpt n SER 60 Cb 0.60 1.75 0.15 0.00 -0.75 0.00 0.00 64.21 65.95 2dpt n SER 60 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2dpt s PRO 61 N 0.78 1.32 -0.12 -1.46 0.04 -1.26 -4.38 135.00 129.92 2dpt s PRO 61 Ca 0.31 1.38 -0.04 0.00 0.04 0.00 0.00 61.00 62.69 2dpt s PRO 61 Cb 0.09 -1.77 0.05 0.00 0.04 0.00 0.00 34.50 32.91 2dpt s PRO 61 CO -0.13 -2.37 0.13 0.34 0.04 0.00 0.00 177.00 175.01 2dpt s ASP 62 N -2.92 1.34 1.05 6.66 -1.08 -1.26 -4.19 116.67 116.28 2dpt s ASP 62 Ca 0.65 -0.05 -0.04 0.00 -0.52 0.00 0.00 52.55 52.59 2dpt s ASP 62 Cb -0.21 0.07 0.05 0.00 -1.46 0.00 0.00 42.92 41.38 2dpt s ASP 62 CO 0.58 -0.29 0.17 -0.81 0.52 0.00 0.00 175.17 175.34 2dpt n PRO 63 N 5.31 -1.66 -4.74 4.34 -0.04 -1.26 -4.93 135.00 132.01 2dpt n PRO 63 Ca -0.05 -0.27 -0.25 0.00 -0.04 0.00 0.00 63.50 62.89 2dpt n PRO 63 Cb 0.50 -0.28 -0.15 0.00 -0.04 0.00 0.00 33.50 33.53 2dpt n PRO 63 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2dpt s ARG 64 N -3.39 1.38 0.23 0.54 6.06 0.43 -4.77 118.95 119.43 2dpt s ARG 64 Ca 0.11 -0.74 -0.30 0.00 -2.50 0.00 0.00 55.73 52.30 2dpt s ARG 64 Cb -0.01 -1.38 -0.09 0.00 0.06 0.00 0.00 34.95 33.52 2dpt s ARG 64 CO 0.09 0.37 0.95 0.00 -2.50 0.00 0.00 175.30 174.21 2dpt s ALA 65 N -0.58 3.34 0.07 6.12 0.00 0.26 -1.66 121.76 129.30 2dpt s ALA 65 Ca 0.06 0.63 -0.14 0.00 0.00 0.00 0.00 51.96 52.52 2dpt s ALA 65 Cb -0.08 -3.22 0.02 0.00 0.00 0.00 0.00 23.12 19.85 2dpt s ALA 65 CO 0.00 0.18 0.31 0.08 0.00 0.00 0.00 175.76 176.34 2dpt s VAL 66 N -1.11 0.09 -0.08 0.00 1.01 0.12 -1.35 120.40 119.07 2dpt s VAL 66 Ca 0.41 -0.72 -0.02 0.00 0.00 0.00 0.00 61.98 61.66 2dpt s VAL 66 Cb -0.26 -1.04 0.03 0.00 0.00 0.00 0.00 36.38 35.11 2dpt s VAL 66 CO 0.32 -0.40 0.04 -0.22 0.00 0.00 0.00 175.10 174.85 2dpt s LEU 67 N -2.32 0.43 -0.26 3.92 2.96 0.23 -0.02 118.68 123.62 2dpt s LEU 67 Ca -0.02 -0.14 -0.29 0.00 -0.22 0.00 0.00 54.13 53.46 2dpt s LEU 67 Cb 0.01 -0.31 0.01 0.00 0.50 0.00 0.00 46.19 46.40 2dpt s LEU 67 CO -0.06 -0.24 1.05 0.26 -1.32 0.00 0.00 176.35 176.04 2dpt s TRP 68 N 2.06 3.28 0.32 5.38 0.52 -1.26 -1.93 118.94 127.31 2dpt s TRP 68 Ca 0.04 1.38 0.09 0.00 0.02 0.00 0.00 56.10 57.64 2dpt s TRP 68 Cb -0.13 -3.40 0.96 0.00 -1.15 0.00 0.00 33.47 29.75 2dpt s TRP 68 CO -0.05 -0.57 1.61 -1.35 0.02 0.00 0.00 176.95 176.61 2dpt h PRO 69 N 7.65 0.11 0.00 4.98 0.11 -1.94 0.29 132.00 143.20 2dpt h PRO 69 Ca -0.19 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.90 2dpt h PRO 69 Cb 1.06 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 2dpt h PRO 69 CO 1.00 0.08 -0.05 0.93 -0.21 0.00 0.00 178.00 179.74 2dpt h GLU 70 N 0.12 0.00 -0.63 1.05 3.07 -1.93 -3.03 114.58 113.24 2dpt h GLU 70 Ca 0.68 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.54 2dpt h GLU 70 Cb 1.55 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.46 2dpt h GLU 70 CO -0.75 0.05 0.00 0.43 -1.40 0.00 0.00 179.01 177.34 2dpt n SER 71 N -3.15 3.35 -4.67 1.42 7.64 0.10 -4.92 113.62 113.39 2dpt n SER 71 Ca 0.01 -2.34 -0.42 0.00 1.01 0.00 0.00 58.87 57.13 2dpt n SER 71 Cb 0.37 -0.49 -0.03 0.00 -1.01 0.00 0.00 64.21 63.05 2dpt n SER 71 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2dpt s LEU 72 N -1.42 4.36 -0.10 -3.43 2.96 -1.15 -4.59 118.68 115.32 2dpt s LEU 72 Ca 0.33 2.43 -0.25 0.00 -0.22 0.00 0.00 54.13 56.42 2dpt s LEU 72 Cb 0.22 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.34 2dpt s LEU 72 CO 0.15 -0.94 0.79 -2.28 -1.32 0.00 0.00 176.35 172.74 2dpt s HIS 73 N 3.59 3.52 -0.21 5.38 5.65 0.50 -4.99 115.29 128.74 2dpt s HIS 73 Ca 0.77 1.30 0.01 0.00 0.25 0.00 0.00 55.06 57.39 2dpt s HIS 73 Cb -0.38 -2.93 0.05 0.00 -1.18 0.00 0.00 32.58 28.14 2dpt s HIS 73 CO 0.33 -0.06 -0.07 0.42 -0.65 0.00 0.00 174.74 174.71 2dpt s ILE 74 N 1.37 1.48 0.92 0.89 -1.09 -1.26 -4.78 121.20 118.73 2dpt s ILE 74 Ca 0.40 -1.03 -0.11 0.00 -2.23 0.00 0.00 60.65 57.68 2dpt s ILE 74 Cb -0.18 -1.66 0.12 0.00 -1.58 0.00 0.00 42.46 39.16 2dpt s ILE 74 CO 0.17 0.04 1.01 -1.54 -1.23 0.00 0.00 174.94 173.39 2dpt n SER 75 N 4.72 -0.08 0.21 3.58 3.41 -1.26 -4.82 113.62 119.38 2dpt n SER 75 Ca -0.13 0.42 0.08 0.00 -0.26 0.00 0.00 58.87 58.98 2dpt n SER 75 Cb 0.46 -1.43 0.44 0.00 -0.26 0.00 0.00 64.21 63.42 2dpt n SER 75 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 2dpt h ARG 76 N -1.76 0.00 0.00 4.33 0.11 -2.00 -2.39 114.38 112.68 2dpt h ARG 76 Ca -0.43 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 59.62 2dpt h ARG 76 Cb 1.28 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.35 2dpt h ARG 76 CO 0.40 0.29 -0.13 0.66 0.10 0.00 0.00 179.97 181.29 2dpt h SER 77 N 0.00 0.00 0.43 0.08 4.64 -1.99 -2.39 113.55 114.32 2dpt h SER 77 Ca -0.00 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.07 2dpt h SER 77 Cb 0.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 2dpt h SER 77 CO 0.04 0.13 -1.06 -0.03 -0.87 0.00 0.00 176.83 175.04 2dpt h MET 78 N 0.00 0.37 -0.39 4.77 1.85 -1.78 -1.75 114.93 117.99 2dpt h MET 78 Ca -0.00 -0.46 -0.08 0.00 -0.61 0.00 0.00 59.70 58.55 2dpt h MET 78 Cb 1.00 0.15 -0.01 0.00 0.43 0.00 0.00 31.60 33.16 2dpt h MET 78 CO 0.02 1.15 -0.06 0.87 -0.40 0.00 0.00 176.91 178.49 2dpt h LYS 79 N 0.17 0.74 -0.26 0.39 1.57 -1.36 0.23 116.57 118.05 2dpt h LYS 79 Ca -0.10 -0.27 0.02 0.00 -1.87 0.00 0.00 60.65 58.44 2dpt h LYS 79 Cb 1.72 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.96 2dpt h LYS 79 CO 0.18 0.86 0.10 0.00 -0.57 0.00 0.00 179.45 180.02 2dpt h ARG 80 N 0.55 0.23 -0.01 3.15 3.08 -1.44 0.15 114.38 120.10 2dpt h ARG 80 Ca 0.10 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.16 2dpt h ARG 80 Cb 0.57 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 2dpt h ARG 80 CO 0.03 0.15 -0.09 0.35 -1.07 0.00 0.00 179.97 179.34 2dpt h PHE 81 N 0.23 -0.22 -0.75 3.04 3.57 -0.98 -2.96 116.94 118.87 2dpt h PHE 81 Ca 0.11 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.59 2dpt h PHE 81 Cb 0.06 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.87 2dpt h PHE 81 CO -0.12 -0.14 0.35 1.25 -2.23 0.00 0.00 178.31 177.43 2dpt h HIS 82 N -0.15 1.07 -0.75 0.41 2.76 -0.15 -0.15 115.15 118.20 2dpt h HIS 82 Ca 0.04 -0.05 0.16 0.00 -2.20 0.00 0.00 60.37 58.31 2dpt h HIS 82 Cb 0.20 -0.33 -0.05 0.00 1.55 0.00 0.00 27.41 28.77 2dpt h HIS 82 CO -0.16 0.78 0.50 -0.22 -1.30 0.00 0.00 177.93 177.54 2dpt h LYS 83 N 1.07 0.35 -0.68 5.26 3.64 -0.81 0.40 116.57 125.80 2dpt h LYS 83 Ca 0.26 -0.02 -0.49 0.00 -1.27 0.00 0.00 60.65 59.13 2dpt h LYS 83 Cb 0.12 -0.08 -0.41 0.00 -0.41 0.00 0.00 32.23 31.45 2dpt h LYS 83 CO -0.03 0.23 -0.84 0.54 -2.27 0.00 0.00 179.45 177.08 2dpt n ARG 84 N -4.46 3.29 -1.69 1.90 1.74 -0.87 -5.02 116.66 111.55 2dpt n ARG 84 Ca 0.14 -4.04 -0.42 0.00 -0.77 0.00 0.00 57.85 52.76 2dpt n ARG 84 Cb 0.56 -2.16 -0.00 0.00 -1.02 0.00 0.00 32.46 29.84 2dpt n ARG 84 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2dpt n SER 85 N -0.71 2.53 -1.45 0.55 2.88 0.13 -4.92 113.62 112.63 2dpt n SER 85 Ca 0.38 1.18 0.10 0.00 -1.33 0.00 0.00 58.87 59.20 2dpt n SER 85 Cb 0.94 -1.47 0.33 0.00 -0.75 0.00 0.00 64.21 63.27 2dpt n SER 85 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2dpt n PRO 86 N 0.45 3.48 -4.41 -1.46 -0.04 -1.26 -3.79 135.00 127.98 2dpt n PRO 86 Ca 0.06 -2.80 -0.26 0.00 -0.04 0.00 0.00 63.50 60.46 2dpt n PRO 86 Cb 0.37 -1.80 -0.11 0.00 -0.04 0.00 0.00 33.50 31.92 2dpt n PRO 86 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2dpt s TYR 87 N -1.70 2.36 -0.14 0.54 4.12 -1.26 -4.38 117.35 116.88 2dpt s TYR 87 Ca 0.48 -0.33 0.01 0.00 0.02 0.00 0.00 57.07 57.26 2dpt s TYR 87 Cb 0.30 -1.15 0.00 0.00 -1.52 0.00 0.00 41.96 39.60 2dpt s TYR 87 CO 0.25 0.53 -0.19 0.50 0.02 0.00 0.00 175.55 176.66 2dpt s ARG 88 N -2.81 3.13 -0.15 -0.62 3.52 0.10 -3.07 118.95 119.04 2dpt s ARG 88 Ca 0.23 -0.80 -0.04 0.00 -0.13 0.00 0.00 55.73 54.99 2dpt s ARG 88 Cb -0.08 -2.52 -0.03 0.00 -1.56 0.00 0.00 34.95 30.77 2dpt s ARG 88 CO 0.11 0.03 -0.03 0.08 -0.81 0.00 0.00 175.30 174.69 2dpt s VAL 89 N 0.75 3.98 0.24 7.11 1.01 -0.21 0.13 120.40 133.40 2dpt s VAL 89 Ca -0.08 -0.33 0.05 0.00 0.00 0.00 0.00 61.98 61.62 2dpt s VAL 89 Cb -0.16 -2.74 -0.05 0.00 0.00 0.00 0.00 36.38 33.43 2dpt s VAL 89 CO 0.00 0.50 -0.03 0.42 0.00 0.00 0.00 175.10 175.99 2dpt s THR 90 N 0.27 1.23 -0.07 3.92 -4.23 0.53 -0.48 115.64 116.81 2dpt s THR 90 Ca -0.02 -2.06 0.05 0.00 -1.18 0.00 0.00 61.69 58.47 2dpt s THR 90 Cb -0.14 -2.32 -0.01 0.00 1.34 0.00 0.00 72.50 71.37 2dpt s THR 90 CO 0.03 -0.36 -0.23 -0.32 -0.54 0.00 0.00 174.62 173.19 2dpt s MET 91 N -3.81 2.70 -0.96 3.99 -2.45 0.96 0.10 119.30 119.83 2dpt s MET 91 Ca 0.27 -0.87 -0.00 0.00 -1.25 0.00 0.00 55.69 53.84 2dpt s MET 91 Cb 0.05 -2.24 0.00 0.00 1.25 0.00 0.00 34.83 33.89 2dpt s MET 91 CO 0.09 0.35 0.00 0.09 1.05 0.00 0.00 175.02 176.60 2dpt n ASN 92 N 3.05 -3.64 0.10 1.11 3.02 0.16 -2.43 115.26 116.63 2dpt n ASN 92 Ca -0.18 0.22 -0.21 0.00 -0.03 0.00 0.00 54.58 54.39 2dpt n ASN 92 Cb 0.52 -3.11 -0.15 0.00 -0.61 0.00 0.00 39.78 36.43 2dpt n ASN 92 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 2dpt h TYR 93 N -0.01 0.69 -1.23 3.10 -1.99 -1.85 -3.43 116.97 112.26 2dpt h TYR 93 Ca -0.27 -0.51 -0.39 0.00 2.00 0.00 0.00 58.73 59.57 2dpt h TYR 93 Cb 1.20 -0.03 -0.31 0.00 2.00 0.00 0.00 36.73 39.59 2dpt h TYR 93 CO 0.72 1.49 -0.92 0.00 -0.00 0.00 0.00 178.16 179.44 2dpt n ALA 94 N -2.70 1.10 -0.26 3.88 0.00 -1.26 -4.97 120.51 116.28 2dpt n ALA 94 Ca -0.17 -2.68 0.08 0.00 0.00 0.00 0.00 53.44 50.67 2dpt n ALA 94 Cb 1.07 -1.01 0.21 0.00 0.00 0.00 0.00 19.45 19.72 2dpt n ALA 94 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2dpt h PHE 95 N 2.98 0.35 -0.53 0.00 3.57 -1.92 0.10 116.94 121.48 2dpt h PHE 95 Ca 0.01 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 2dpt h PHE 95 Cb 1.03 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.71 2dpt h PHE 95 CO 0.41 -0.08 0.31 0.78 -2.23 0.00 0.00 178.31 177.49 2dpt h GLY 96 N 0.29 0.77 1.80 2.40 0.00 -1.99 -1.44 103.07 104.91 2dpt h GLY 96 Ca 0.45 -0.32 -0.21 0.00 0.00 0.00 0.00 47.33 47.25 2dpt h GLY 96 CO -0.53 0.31 -0.96 1.46 0.00 0.00 0.00 176.54 176.82 2dpt h GLN 97 N 0.73 0.17 0.19 4.80 4.20 -1.27 -2.77 115.11 121.17 2dpt h GLN 97 Ca 0.19 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 2dpt h GLN 97 Cb -0.01 0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.84 2dpt h GLN 97 CO -0.03 1.01 -0.09 0.28 -0.67 0.00 0.00 178.83 179.32 2dpt h VAL 98 N 0.08 0.90 -0.78 -0.54 2.07 -0.78 -0.61 116.25 116.59 2dpt h VAL 98 Ca -0.05 -0.84 0.06 0.00 0.82 0.00 0.00 66.70 66.69 2dpt h VAL 98 Cb 1.63 1.37 -0.05 0.00 -1.52 0.00 0.00 31.29 32.72 2dpt h VAL 98 CO 0.15 0.18 0.51 -0.29 0.02 0.00 0.00 177.57 178.14 2dpt h ILE 99 N -0.70 1.04 -0.51 4.57 2.10 -1.39 0.23 117.51 122.84 2dpt h ILE 99 Ca -0.03 -0.29 -0.08 0.00 1.08 0.00 0.00 64.86 65.54 2dpt h ILE 99 Cb 0.49 0.12 -0.02 0.00 -1.09 0.00 0.00 36.82 36.32 2dpt h ILE 99 CO 0.04 0.15 -0.01 -0.08 -1.08 0.00 0.00 178.15 177.18 2dpt h GLU 100 N 0.84 0.87 -0.25 2.19 4.57 -1.41 -0.15 114.58 121.23 2dpt h GLU 100 Ca 0.34 -0.25 -0.00 0.00 -1.18 0.00 0.00 59.36 58.26 2dpt h GLU 100 Cb 0.24 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.72 2dpt h GLU 100 CO -0.12 0.88 0.15 0.78 -1.18 0.00 0.00 179.01 179.52 2dpt h GLY 101 N 0.99 0.37 1.02 1.92 0.00 0.10 -2.36 103.07 105.12 2dpt h GLY 101 Ca 0.15 -0.16 -0.03 0.00 0.00 0.00 0.00 47.33 47.29 2dpt h GLY 101 CO 0.02 0.16 0.36 0.00 0.00 0.00 0.00 176.54 177.08 2dpt n ALA 103 N -2.39 1.38 0.49 0.00 0.00 -0.09 -1.75 120.51 118.15 2dpt n ALA 103 Ca 0.07 -0.02 0.05 0.00 0.00 0.00 0.00 53.44 53.53 2dpt n ALA 103 Cb 0.14 -1.09 -0.05 0.00 0.00 0.00 0.00 19.45 18.45 2dpt n ALA 103 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2dpt n SER 104 N -1.37 0.62 0.11 0.00 7.64 -0.78 -4.32 113.62 115.52 2dpt n SER 104 Ca 0.02 -0.81 0.04 0.00 1.01 0.00 0.00 58.87 59.13 2dpt n SER 104 Cb 0.05 0.91 0.21 0.00 -1.01 0.00 0.00 64.21 64.38 2dpt n SER 104 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2dpt n ASP 105 N -1.08 0.20 0.00 6.43 2.03 -0.72 -4.76 116.55 118.66 2dpt n ASP 105 Ca 0.02 0.44 0.00 0.00 0.52 0.00 0.00 54.79 55.77 2dpt n ASP 105 Cb 0.17 -0.39 0.00 0.00 -0.72 0.00 0.00 41.12 40.18 2dpt n ASP 105 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2dpt n ARG 106 N -1.77 0.00 -0.04 -0.67 1.74 -1.26 -4.39 116.66 110.26 2dpt n ARG 106 Ca -0.01 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.92 2dpt n ARG 106 Cb 0.32 -1.01 -0.07 0.00 -1.02 0.00 0.00 32.46 30.68 2dpt n ARG 106 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2dpt h GLU 107 N 0.00 0.67 0.00 5.56 4.81 -1.94 -3.43 114.58 120.24 2dpt h GLU 107 Ca 0.00 -0.49 -0.06 0.00 -0.13 0.00 0.00 59.36 58.68 2dpt h GLU 107 Cb 0.00 0.09 -0.05 0.00 0.63 0.00 0.00 28.75 29.41 2dpt h GLU 107 CO 0.00 1.11 -0.08 -1.91 -0.73 0.00 0.00 179.01 177.41 2dpt n GLU 108 N -4.13 0.45 -0.02 1.92 2.13 -1.26 -4.87 120.64 114.86 2dpt n GLU 108 Ca -0.07 -0.45 0.12 0.00 0.66 0.00 0.00 57.16 57.43 2dpt n GLU 108 Cb 0.62 0.13 0.22 0.00 0.27 0.00 0.00 31.44 32.68 2dpt n GLU 108 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2dpt n GLY 109 N -0.52 0.80 0.11 8.31 0.00 -1.26 -4.03 105.19 108.60 2dpt n GLY 109 Ca -0.07 -0.63 0.10 0.00 0.00 0.00 0.00 46.02 45.42 2dpt n GLY 109 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dpt n THR 110 N 1.05 1.01 0.32 2.61 -2.24 -1.26 -1.29 114.28 114.48 2dpt n THR 110 Ca 0.16 0.40 0.12 0.00 -2.27 0.00 0.00 64.05 62.46 2dpt n THR 110 Cb 0.53 -1.34 0.19 0.00 -2.10 0.00 0.00 70.33 67.61 2dpt n THR 110 CO 0.00 0.00 0.00 4.11 -0.57 0.00 0.00 175.07 178.61 2dpt h TRP 111 N 0.00 0.00 -0.76 4.78 5.08 -1.84 -3.40 115.95 119.80 2dpt h TRP 111 Ca 0.00 0.00 -0.58 0.00 1.08 0.00 0.00 58.89 59.39 2dpt h TRP 111 Cb 0.21 0.00 -0.07 0.00 -3.00 0.00 0.00 29.16 26.30 2dpt h TRP 111 CO 0.00 0.00 1.87 0.42 -1.28 0.00 0.00 178.44 179.45 2dpt s ILE 112 N -3.21 3.95 0.59 0.12 1.01 -0.41 -4.71 121.20 118.54 2dpt s ILE 112 Ca 0.06 -1.60 -0.09 0.00 0.00 0.00 0.00 60.65 59.03 2dpt s ILE 112 Cb 0.08 -5.02 -0.02 0.00 0.01 0.00 0.00 42.46 37.51 2dpt s ILE 112 CO 0.68 -1.74 0.95 0.42 0.00 0.00 0.00 174.94 175.26 2dpt s THR 113 N 6.13 4.45 0.34 2.92 -4.23 -1.26 -4.75 115.64 119.23 2dpt s THR 113 Ca 0.58 0.51 0.11 0.00 -1.18 0.00 0.00 61.69 61.71 2dpt s THR 113 Cb 0.02 -3.76 0.36 0.00 1.34 0.00 0.00 72.50 70.47 2dpt s THR 113 CO 0.09 -0.90 1.60 -0.09 -0.54 0.00 0.00 174.62 174.77 2dpt h ARG 114 N -0.19 0.07 -0.69 3.99 9.65 -1.98 0.71 114.38 125.94 2dpt h ARG 114 Ca -0.45 -0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 58.37 2dpt h ARG 114 Cb 1.21 -0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 29.75 2dpt h ARG 114 CO 0.62 0.04 0.22 0.78 2.80 0.00 0.00 179.97 184.43 2dpt h GLY 115 N 0.07 1.15 1.07 2.80 0.00 -1.97 -0.72 103.07 105.46 2dpt h GLY 115 Ca 0.72 -0.68 -0.12 0.00 0.00 0.00 0.00 47.33 47.24 2dpt h GLY 115 CO -0.79 0.63 -0.21 -2.08 0.00 0.00 0.00 176.54 174.10 2dpt h VAL 116 N 1.00 1.27 -0.49 4.60 2.07 -0.04 -1.83 116.25 122.83 2dpt h VAL 116 Ca 0.22 -1.36 0.01 0.00 0.82 0.00 0.00 66.70 66.39 2dpt h VAL 116 Cb 0.30 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 2dpt h VAL 116 CO -0.01 0.46 0.32 0.58 0.02 0.00 0.00 177.57 178.95 2dpt h VAL 117 N 0.76 1.11 -0.19 2.57 2.07 -0.57 -1.72 116.25 120.28 2dpt h VAL 117 Ca 0.10 -0.22 -0.09 0.00 0.82 0.00 0.00 66.70 67.30 2dpt h VAL 117 Cb 0.78 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 2dpt h VAL 117 CO 0.06 0.12 -0.29 -0.33 0.02 0.00 0.00 177.57 177.16 2dpt h GLU 118 N 0.65 0.38 0.10 1.57 5.08 -1.07 -2.44 114.58 118.85 2dpt h GLU 118 Ca 0.18 -0.14 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2dpt h GLU 118 Cb -0.06 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.17 2dpt h GLU 118 CO -0.05 0.63 -0.05 0.00 -1.00 0.00 0.00 179.01 178.55 2dpt h ALA 119 N 1.37 -0.13 0.00 3.43 0.00 -0.60 -2.21 119.26 121.12 2dpt h ALA 119 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2dpt h ALA 119 Cb 0.68 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2dpt h ALA 119 CO 0.05 -0.57 0.00 0.66 0.00 0.00 0.00 179.25 179.39 2dpt n TYR 120 N -5.14 0.00 -0.02 0.00 4.02 -0.72 -2.71 117.16 112.59 2dpt n TYR 120 Ca -0.08 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.64 2dpt n TYR 120 Cb 0.08 -0.48 -0.08 0.00 -0.02 0.00 0.00 39.34 38.85 2dpt n TYR 120 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 2dpt h HIS 121 N 0.00 0.90 -0.66 -0.72 2.76 -0.96 -1.89 115.15 114.57 2dpt h HIS 121 Ca 0.00 -0.40 -0.02 0.00 -2.20 0.00 0.00 60.37 57.75 2dpt h HIS 121 Cb 0.45 -0.14 -0.03 0.00 1.55 0.00 0.00 27.41 29.24 2dpt h HIS 121 CO 0.00 1.21 0.33 0.00 -1.30 0.00 0.00 177.93 178.17 2dpt h ARG 122 N 0.33 0.95 0.00 5.26 3.08 -1.20 0.21 114.38 123.02 2dpt h ARG 122 Ca -0.05 -0.14 -0.05 0.00 0.07 0.00 0.00 59.98 59.81 2dpt h ARG 122 Cb 1.30 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.17 2dpt h ARG 122 CO 0.14 0.75 -0.25 -0.07 -1.07 0.00 0.00 179.97 179.46 2dpt h LEU 123 N 0.92 0.00 -0.11 3.04 3.38 -1.46 0.14 115.31 121.21 2dpt h LEU 123 Ca 0.23 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.98 2dpt h LEU 123 Cb 0.11 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.87 2dpt h LEU 123 CO -0.03 0.25 -0.80 -0.74 0.09 0.00 0.00 178.44 177.22 2dpt h HIS 124 N 0.00 1.01 -0.31 1.13 2.76 -0.52 0.66 115.15 119.88 2dpt h HIS 124 Ca -0.00 -0.47 -0.03 0.00 -2.20 0.00 0.00 60.37 57.66 2dpt h HIS 124 Cb 0.45 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.25 2dpt h HIS 124 CO 0.00 1.30 0.06 0.93 -1.30 0.00 0.00 177.93 178.92 2dpt h GLU 125 N 0.43 0.51 0.00 5.26 5.08 -0.52 -1.92 114.58 123.43 2dpt h GLU 125 Ca -0.07 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2dpt h GLU 125 Cb 1.44 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.63 2dpt h GLU 125 CO 0.16 0.60 0.00 1.28 -1.00 0.00 0.00 179.01 180.05 2dpt n LEU 126 N -4.63 0.27 0.00 1.33 4.77 0.44 -4.88 117.00 114.30 2dpt n LEU 126 Ca -0.02 0.58 0.00 0.00 -0.03 0.00 0.00 56.01 56.54 2dpt n LEU 126 Cb 0.21 -0.56 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 2dpt n LEU 126 CO 0.38 -0.47 0.00 0.61 -1.33 0.00 0.00 177.39 176.57 2dpt n GLY 127 N -0.41 0.70 0.10 -0.72 0.00 -0.68 -4.99 105.19 99.20 2dpt n GLY 127 Ca 0.02 -0.50 -0.13 0.00 0.00 0.00 0.00 46.02 45.41 2dpt n GLY 127 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dpt n HIS 128 N -2.48 0.00 -3.65 1.61 8.25 0.22 -4.95 115.22 114.22 2dpt n HIS 128 Ca 0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.11 2dpt n HIS 128 Cb 0.00 -0.89 -0.05 0.00 1.12 0.00 0.00 29.99 30.17 2dpt n HIS 128 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2dpt s ALA 129 N -2.45 3.77 0.18 -1.41 0.00 -0.69 -0.53 121.76 120.63 2dpt s ALA 129 Ca -0.22 -0.45 0.01 0.00 0.00 0.00 0.00 51.96 51.30 2dpt s ALA 129 Cb 0.07 -2.19 -0.04 0.00 0.00 0.00 0.00 23.12 20.95 2dpt s ALA 129 CO 0.62 0.59 0.05 -1.01 0.00 0.00 0.00 175.76 176.01 2dpt s HIS 130 N -1.34 1.15 0.01 0.00 3.76 0.57 -4.31 115.29 115.13 2dpt s HIS 130 Ca 0.30 -1.15 -0.03 0.00 -0.15 0.00 0.00 55.06 54.03 2dpt s HIS 130 Cb -0.14 -0.65 -0.01 0.00 1.11 0.00 0.00 32.58 32.90 2dpt s HIS 130 CO 0.17 -0.37 0.05 -1.54 -0.85 0.00 0.00 174.74 172.20 2dpt s SER 131 N -3.16 0.12 -0.18 1.40 1.04 -1.26 -1.16 113.70 110.50 2dpt s SER 131 Ca 0.28 -0.31 -0.01 0.00 0.48 0.00 0.00 55.95 56.39 2dpt s SER 131 Cb 0.07 0.15 0.00 0.00 0.10 0.00 0.00 66.02 66.34 2dpt s SER 131 CO 0.06 -0.30 -0.14 -0.63 0.98 0.00 0.00 173.24 173.21 2dpt s ILE 132 N -1.26 2.68 -0.07 -1.02 1.09 0.20 0.39 121.20 123.22 2dpt s ILE 132 Ca -0.14 -0.74 -0.03 0.00 -1.10 0.00 0.00 60.65 58.64 2dpt s ILE 132 Cb -0.08 -2.16 -0.04 0.00 -1.06 0.00 0.00 42.46 39.12 2dpt s ILE 132 CO 0.00 0.50 0.06 -1.61 -0.10 0.00 0.00 174.94 173.79 2dpt s GLU 133 N 1.14 3.12 -0.19 2.79 8.01 0.11 -1.03 118.70 132.65 2dpt s GLU 133 Ca 0.01 -0.37 -0.01 0.00 0.01 0.00 0.00 54.97 54.61 2dpt s GLU 133 Cb -0.14 -2.91 0.01 0.00 -4.31 0.00 0.00 34.13 26.77 2dpt s GLU 133 CO -0.05 0.70 -0.13 0.08 0.01 0.00 0.00 175.26 175.87 2dpt s VAL 134 N -1.03 2.67 0.00 2.63 1.01 -0.89 -0.35 120.40 124.44 2dpt s VAL 134 Ca 0.17 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.45 2dpt s VAL 134 Cb -0.12 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 34.07 2dpt s VAL 134 CO 0.07 0.49 -0.11 0.26 0.00 0.00 0.00 175.10 175.81 2dpt s TRP 135 N 1.29 2.76 -0.31 5.22 0.52 0.35 -1.40 118.94 127.37 2dpt s TRP 135 Ca 0.04 -0.12 0.02 0.00 0.02 0.00 0.00 56.10 56.05 2dpt s TRP 135 Cb -0.14 -1.57 0.08 0.00 -1.15 0.00 0.00 33.47 30.69 2dpt s TRP 135 CO -0.07 0.31 0.00 0.50 0.02 0.00 0.00 176.95 177.71 2dpt s ARG 136 N -1.30 2.00 5.20 4.98 6.06 -0.01 0.02 118.95 135.90 2dpt s ARG 136 Ca 0.15 -1.56 0.00 0.00 -2.50 0.00 0.00 55.73 51.82 2dpt s ARG 136 Cb -0.11 -3.14 0.00 0.00 0.06 0.00 0.00 34.95 31.76 2dpt s ARG 136 CO 0.06 -0.76 0.00 -0.85 -2.50 0.00 0.00 175.30 171.24 2dpt n GLU 137 N 4.43 0.00 -0.18 5.12 0.28 -1.26 -1.23 120.64 127.80 2dpt n GLU 137 Ca -0.06 0.00 0.11 0.00 -0.16 0.00 0.00 57.16 57.05 2dpt n GLU 137 Cb 0.42 0.00 0.25 0.00 1.43 0.00 0.00 31.44 33.55 2dpt n GLU 137 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 2dpt n ASP 138 N 7.20 3.07 -4.68 -1.84 5.75 -1.26 -4.93 116.55 119.86 2dpt n ASP 138 Ca 0.00 -1.94 -0.34 0.00 -0.01 0.00 0.00 54.79 52.50 2dpt n ASP 138 Cb 0.00 -0.24 -0.09 0.00 -1.03 0.00 0.00 41.12 39.76 2dpt n ASP 138 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 2dpt s GLU 139 N -1.52 2.93 -0.39 0.11 2.56 -0.37 -5.07 118.70 116.96 2dpt s GLU 139 Ca 0.38 -0.46 -0.27 0.00 0.00 0.00 0.00 54.97 54.62 2dpt s GLU 139 Cb 0.21 -2.76 0.02 0.00 2.00 0.00 0.00 34.13 33.60 2dpt s GLU 139 CO 0.30 0.68 1.00 -1.17 -0.56 0.00 0.00 175.26 175.52 2dpt s LEU 140 N -1.04 3.91 -0.03 2.70 2.96 -1.26 -0.83 118.68 125.08 2dpt s LEU 140 Ca 0.15 0.62 0.11 0.00 -0.22 0.00 0.00 54.13 54.79 2dpt s LEU 140 Cb -0.11 -3.38 0.31 0.00 0.50 0.00 0.00 46.19 43.51 2dpt s LEU 140 CO 0.04 -0.96 1.26 1.33 -1.32 0.00 0.00 176.35 176.70 2dpt n VAL 141 N 6.17 1.19 -1.15 1.68 0.24 -0.49 -4.93 118.33 121.04 2dpt n VAL 141 Ca 0.09 -1.14 0.00 0.00 -2.04 0.00 0.00 64.34 61.26 2dpt n VAL 141 Cb 0.48 0.39 0.00 0.00 -1.47 0.00 0.00 33.84 33.24 2dpt n VAL 141 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dpt n GLY 142 N 0.27 -1.99 0.00 7.63 0.00 -1.20 0.14 105.19 110.04 2dpt n GLY 142 Ca 0.12 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.97 2dpt n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dpt n GLY 143 N -0.44 -2.10 3.41 -0.02 0.00 -1.01 -2.10 105.19 102.93 2dpt n GLY 143 Ca 0.00 -1.41 -0.16 0.00 0.00 0.00 0.00 46.02 44.46 2dpt n GLY 143 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2dpt s MET 144 N -1.88 0.95 0.13 1.61 0.23 -0.20 -1.88 119.30 118.27 2dpt s MET 144 Ca 0.00 0.01 -0.00 0.00 -1.03 0.00 0.00 55.69 54.67 2dpt s MET 144 Cb 0.00 0.44 -0.04 0.00 -1.53 0.00 0.00 34.83 33.70 2dpt s MET 144 CO 0.00 -0.30 0.03 1.52 -2.03 0.00 0.00 175.02 174.23 2dpt s TYR 145 N -1.56 0.92 -0.03 3.16 1.13 -0.95 0.61 117.35 120.63 2dpt s TYR 145 Ca -0.10 -1.14 -0.29 0.00 -1.41 0.00 0.00 57.07 54.12 2dpt s TYR 145 Cb -0.02 -0.53 0.10 0.00 -1.10 0.00 0.00 41.96 40.41 2dpt s TYR 145 CO 0.05 -0.40 1.30 0.20 -2.51 0.00 0.00 175.55 174.19 2dpt s GLY 146 N -3.07 -0.20 -0.30 5.49 0.00 -0.31 -1.97 107.32 106.97 2dpt s GLY 146 Ca 0.22 0.19 -0.10 0.00 0.00 0.00 0.00 44.72 45.03 2dpt s GLY 146 CO 0.01 4.58 0.16 0.14 0.00 0.00 0.00 173.10 177.99 2dpt s VAL 147 N -2.08 4.73 0.37 1.40 1.01 -0.60 -0.31 120.40 124.91 2dpt s VAL 147 Ca 0.27 -0.29 -0.26 0.00 0.00 0.00 0.00 61.98 61.70 2dpt s VAL 147 Cb 0.01 -3.37 -0.09 0.00 0.00 0.00 0.00 36.38 32.93 2dpt s VAL 147 CO -0.02 0.12 1.12 0.00 0.00 0.00 0.00 175.10 176.32 2dpt s ALA 148 N 1.64 3.20 -0.44 5.51 0.00 0.31 -1.68 121.76 130.31 2dpt s ALA 148 Ca 0.05 0.87 0.06 0.00 0.00 0.00 0.00 51.96 52.95 2dpt s ALA 148 Cb -0.17 -3.33 0.21 0.00 0.00 0.00 0.00 23.12 19.83 2dpt s ALA 148 CO 0.07 -0.34 0.58 0.94 0.00 0.00 0.00 175.76 177.01 2dpt n GLN 149 N 0.33 0.52 0.00 0.00 7.27 -0.06 -4.88 117.38 120.56 2dpt n GLN 149 Ca 0.03 -2.68 0.00 0.00 0.07 0.00 0.00 57.00 54.42 2dpt n GLN 149 Cb 0.47 -1.46 0.00 0.00 2.41 0.00 0.00 30.24 31.66 2dpt n GLN 149 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2dpt n GLY 150 N 2.22 1.27 0.90 1.69 0.00 -1.26 -2.27 105.19 107.73 2dpt n GLY 150 Ca 0.21 -0.54 0.10 0.00 0.00 0.00 0.00 46.02 45.78 2dpt n GLY 150 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dpt n THR 151 N 0.00 0.53 -4.23 2.61 -2.24 -0.67 -4.65 114.28 105.63 2dpt n THR 151 Ca 0.00 -0.62 -0.31 0.00 -2.27 0.00 0.00 64.05 60.86 2dpt n THR 151 Cb 0.00 0.48 -0.09 0.00 -2.10 0.00 0.00 70.33 68.62 2dpt n THR 151 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2dpt s LEU 152 N -1.24 3.33 -0.06 3.22 2.96 -0.96 -0.20 118.68 125.73 2dpt s LEU 152 Ca 0.35 -0.19 0.02 0.00 -0.22 0.00 0.00 54.13 54.08 2dpt s LEU 152 Cb 0.19 -2.03 0.02 0.00 0.50 0.00 0.00 46.19 44.86 2dpt s LEU 152 CO 0.26 0.21 -0.09 0.12 -1.32 0.00 0.00 176.35 175.53 2dpt s PHE 153 N -1.20 1.16 -0.40 5.38 5.36 -0.09 -0.88 117.98 127.31 2dpt s PHE 153 Ca 0.22 -0.41 -0.15 0.00 -0.96 0.00 0.00 56.93 55.64 2dpt s PHE 153 Cb -0.11 -0.91 0.01 0.00 -0.34 0.00 0.00 43.02 41.67 2dpt s PHE 153 CO 0.14 -0.25 0.32 0.00 -1.46 0.00 0.00 175.22 173.97 2dpt s GLY 155 N 1.72 2.57 -0.22 0.00 0.00 0.67 -1.55 107.32 110.50 2dpt s GLY 155 Ca 0.07 1.00 -0.11 0.00 0.00 0.00 0.00 44.72 45.68 2dpt s GLY 155 CO 0.11 1.95 -0.28 1.18 0.00 0.00 0.00 173.10 176.06 2dpt n GLU 156 N 2.67 0.46 -3.62 2.90 -0.58 -0.83 -4.65 120.64 116.99 2dpt n GLU 156 Ca 0.05 0.20 -0.04 0.00 -0.42 0.00 0.00 57.16 56.96 2dpt n GLU 156 Cb 0.44 -1.28 -0.01 0.00 -0.57 0.00 0.00 31.44 30.02 2dpt n GLU 156 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2dpt s SER 157 N -6.96 -0.20 0.19 1.62 0.15 -1.21 -5.05 113.70 102.24 2dpt s SER 157 Ca -0.31 -0.15 -0.12 0.00 0.70 0.00 0.00 55.95 56.07 2dpt s SER 157 Cb 0.12 0.32 0.00 0.00 -1.71 0.00 0.00 66.02 64.75 2dpt s SER 157 CO 0.39 -0.56 0.40 0.00 1.20 0.00 0.00 173.24 174.67 2dpt s MET 158 N -2.88 1.32 0.15 5.44 0.23 -1.26 -2.23 119.30 120.06 2dpt s MET 158 Ca 0.10 -1.11 -0.15 0.00 -1.03 0.00 0.00 55.69 53.50 2dpt s MET 158 Cb 0.00 0.44 0.03 0.00 -1.53 0.00 0.00 34.83 33.77 2dpt s MET 158 CO -0.04 -0.52 0.42 -0.59 -2.03 0.00 0.00 175.02 172.25 2dpt s PHE 159 N -3.95 -0.10 -0.10 3.16 -0.12 -0.79 -4.80 117.98 111.28 2dpt s PHE 159 Ca 0.16 -0.23 -0.05 0.00 -0.05 0.00 0.00 56.93 56.76 2dpt s PHE 159 Cb 0.01 0.25 0.04 0.00 -0.63 0.00 0.00 43.02 42.69 2dpt s PHE 159 CO 0.02 -0.76 0.23 0.45 -0.05 0.00 0.00 175.22 175.11 2dpt s SER 160 N -2.84 -0.24 0.00 1.98 0.15 -1.26 -2.41 113.70 109.07 2dpt s SER 160 Ca 0.06 0.49 0.05 0.00 0.70 0.00 0.00 55.95 57.25 2dpt s SER 160 Cb 0.01 0.39 0.03 0.00 -1.71 0.00 0.00 66.02 64.74 2dpt s SER 160 CO -0.08 -0.15 0.61 0.54 1.20 0.00 0.00 173.24 175.36 2dpt n ARG 161 N 4.05 0.21 -3.77 5.44 5.12 0.12 -4.96 116.66 122.87 2dpt n ARG 161 Ca -0.24 -0.71 -0.13 0.00 -1.93 0.00 0.00 57.85 54.84 2dpt n ARG 161 Cb 0.54 -1.06 -0.10 0.00 -1.16 0.00 0.00 32.46 30.68 2dpt n ARG 161 CO 0.00 0.00 0.00 1.41 -1.93 0.00 0.00 177.63 177.11 2dpt s MET 162 N -0.49 0.44 -0.13 5.56 1.75 -1.19 -5.03 119.30 120.21 2dpt s MET 162 Ca 0.05 0.27 -0.40 0.00 -1.25 0.00 0.00 55.69 54.36 2dpt s MET 162 Cb 0.04 0.21 -0.18 0.00 2.84 0.00 0.00 34.83 37.74 2dpt s MET 162 CO 0.07 -0.08 1.43 -1.91 -0.65 0.00 0.00 175.02 173.88 2dpt n GLU 163 N 2.50 0.69 -0.78 4.11 4.07 -1.26 -1.17 120.64 128.81 2dpt n GLU 163 Ca -0.15 0.25 0.00 0.00 -0.06 0.00 0.00 57.16 57.20 2dpt n GLU 163 Cb 0.57 -1.85 0.00 0.00 -0.06 0.00 0.00 31.44 30.10 2dpt n GLU 163 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2dpt n ASN 164 N 3.29 -0.59 0.14 4.31 3.02 -1.26 -4.92 115.26 119.25 2dpt n ASN 164 Ca 0.23 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.68 2dpt n ASN 164 Cb 0.11 -1.36 -0.06 0.00 -0.61 0.00 0.00 39.78 37.85 2dpt n ASN 164 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dpt h ALA 165 N 0.00 -0.94 0.00 5.41 0.00 -1.47 -1.22 119.26 121.04 2dpt h ALA 165 Ca 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2dpt h ALA 165 Cb 0.07 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 2dpt h ALA 165 CO 0.00 -0.97 -0.03 0.66 0.00 0.00 0.00 179.25 178.91 2dpt h SER 166 N -0.55 0.00 -0.28 0.00 4.64 -1.80 -1.25 113.55 114.31 2dpt h SER 166 Ca -0.03 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.27 2dpt h SER 166 Cb 0.50 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 2dpt h SER 166 CO -0.08 0.03 0.08 0.11 -0.87 0.00 0.00 176.83 176.10 2dpt h LYS 167 N 0.00 0.44 -0.12 4.77 1.57 -1.84 -2.11 116.57 119.28 2dpt h LYS 167 Ca -0.00 -0.10 -0.08 0.00 -1.87 0.00 0.00 60.65 58.60 2dpt h LYS 167 Cb 0.05 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 2dpt h LYS 167 CO 0.00 0.50 -0.28 1.79 -0.57 0.00 0.00 179.45 180.90 2dpt h THR 168 N 0.29 1.25 -0.69 -0.16 1.35 -0.30 0.94 112.91 115.59 2dpt h THR 168 Ca 0.09 -1.17 0.07 0.00 -0.55 0.00 0.00 66.41 64.85 2dpt h THR 168 Cb 0.25 1.47 -0.06 0.00 -1.73 0.00 0.00 68.15 68.08 2dpt h THR 168 CO -0.00 0.35 0.38 0.00 -0.25 0.00 0.00 175.52 176.00 2dpt h ALA 169 N 1.52 0.94 0.07 6.62 0.00 -0.83 0.16 119.26 127.74 2dpt h ALA 169 Ca 0.03 0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.70 2dpt h ALA 169 Cb 0.60 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.29 2dpt h ALA 169 CO 0.04 0.05 -1.12 1.25 0.00 0.00 0.00 179.25 179.48 2dpt h LEU 170 N 0.69 0.65 0.58 0.00 5.85 -0.89 -2.18 115.31 120.00 2dpt h LEU 170 Ca 0.32 -0.58 -0.02 0.00 0.84 0.00 0.00 57.88 58.43 2dpt h LEU 170 Cb 0.22 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.05 2dpt h LEU 170 CO -0.20 1.40 -0.34 0.25 -0.34 0.00 0.00 178.44 179.21 2dpt h LEU 171 N 0.22 -0.84 -1.05 2.25 5.85 -0.17 0.78 115.31 122.35 2dpt h LEU 171 Ca -0.13 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 2dpt h LEU 171 Cb 1.78 0.24 -0.04 0.00 0.37 0.00 0.00 40.66 43.01 2dpt h LEU 171 CO 0.20 -0.54 0.50 0.58 -0.34 0.00 0.00 178.44 178.84 2dpt h VAL 172 N -0.86 1.24 -0.05 1.05 2.07 -0.81 -2.51 116.25 116.38 2dpt h VAL 172 Ca -0.07 -0.53 -0.00 0.00 0.82 0.00 0.00 66.70 66.91 2dpt h VAL 172 Cb 0.69 0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 2dpt h VAL 172 CO 0.09 0.25 0.02 0.15 0.02 0.00 0.00 177.57 178.10 2dpt h PHE 173 N 1.17 0.07 -0.68 1.57 3.57 -1.07 -2.48 116.94 119.09 2dpt h PHE 173 Ca 0.30 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.86 2dpt h PHE 173 Cb -0.03 -0.02 -0.06 0.00 2.79 0.00 0.00 35.95 38.63 2dpt h PHE 173 CO 0.01 0.16 0.37 0.00 -2.23 0.00 0.00 178.31 176.62 2dpt h GLU 175 N 0.68 -0.68 -0.51 0.00 5.08 -1.32 0.26 114.58 118.09 2dpt h GLU 175 Ca 0.31 0.05 0.10 0.00 -1.00 0.00 0.00 59.36 58.82 2dpt h GLU 175 Cb 0.21 0.15 -0.10 0.00 0.50 0.00 0.00 28.75 29.52 2dpt h GLU 175 CO -0.19 -0.45 -0.13 1.49 -1.00 0.00 0.00 179.01 178.73 2dpt h GLU 176 N -0.70 0.00 0.29 2.33 4.57 -1.17 -0.52 114.58 119.37 2dpt h GLU 176 Ca -0.04 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2dpt h GLU 176 Cb 0.61 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.17 2dpt h GLU 176 CO -0.05 0.00 -0.35 0.35 -1.18 0.00 0.00 179.01 177.78 2dpt h PHE 177 N 0.00 -0.96 0.48 0.92 3.57 0.29 -2.60 116.94 118.64 2dpt h PHE 177 Ca 0.25 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.74 2dpt h PHE 177 Cb 0.37 0.38 -0.01 0.00 2.79 0.00 0.00 35.95 39.48 2dpt h PHE 177 CO -0.43 -0.48 -0.36 0.82 -2.23 0.00 0.00 178.31 175.62 2dpt h ILE 178 N -0.69 0.26 -0.94 1.41 2.04 -0.18 0.17 117.51 119.59 2dpt h ILE 178 Ca -0.01 0.00 0.27 0.00 1.00 0.00 0.00 64.86 66.12 2dpt h ILE 178 Cb 0.64 0.26 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 2dpt h ILE 178 CO -0.10 0.00 1.00 1.23 0.00 0.00 0.00 178.15 180.27 2dpt h GLY 179 N -0.82 0.00 -1.45 5.37 0.00 -1.00 0.83 103.07 105.99 2dpt h GLY 179 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.28 2dpt h GLY 179 CO 0.01 0.00 0.00 1.42 0.00 0.00 0.00 176.54 177.97 2dpt n HIS 180 N -3.47 0.76 0.00 5.60 8.25 -0.90 -4.96 115.22 120.50 2dpt n HIS 180 Ca 0.20 -0.75 0.00 0.00 -0.26 0.00 0.00 57.72 56.92 2dpt n HIS 180 Cb 1.30 -0.21 0.00 0.00 1.12 0.00 0.00 29.99 32.19 2dpt n HIS 180 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dpt n GLY 181 N -0.18 0.48 3.64 -1.41 0.00 0.28 -4.43 105.19 103.57 2dpt n GLY 181 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2dpt n GLY 181 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dpt n GLY 182 N -1.69 0.08 0.00 -0.02 0.00 0.56 -4.87 105.19 99.26 2dpt n GLY 182 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2dpt n GLY 182 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2dpt n LYS 183 N 0.13 1.98 -3.67 1.61 3.00 0.72 -4.53 118.16 117.40 2dpt n LYS 183 Ca 0.08 0.00 -0.14 0.00 -0.00 0.00 0.00 58.31 58.26 2dpt n LYS 183 Cb 0.39 -0.96 -0.07 0.00 0.00 0.00 0.00 35.03 34.39 2dpt n LYS 183 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 2dpt s LEU 184 N -4.24 0.35 -0.18 3.14 0.20 -1.06 -4.53 118.68 112.36 2dpt s LEU 184 Ca 0.00 0.15 0.01 0.00 0.69 0.00 0.00 54.13 54.98 2dpt s LEU 184 Cb 0.00 1.74 0.03 0.00 -0.43 0.00 0.00 46.19 47.53 2dpt s LEU 184 CO 0.00 -0.59 -0.14 -0.63 -0.29 0.00 0.00 176.35 174.70 2dpt s ILE 185 N -1.91 1.75 -0.16 6.68 1.01 -0.81 -0.91 121.20 126.85 2dpt s ILE 185 Ca -0.09 -0.89 -0.29 0.00 0.00 0.00 0.00 60.65 59.37 2dpt s ILE 185 Cb -0.02 -1.70 -0.00 0.00 0.01 0.00 0.00 42.46 40.75 2dpt s ILE 185 CO 0.02 0.35 1.05 -0.62 0.00 0.00 0.00 174.94 175.74 2dpt s ASP 186 N 1.38 7.15 -0.10 3.58 2.15 0.18 -0.60 116.67 130.42 2dpt s ASP 186 Ca 0.02 1.50 0.15 0.00 0.43 0.00 0.00 52.55 54.65 2dpt s ASP 186 Cb -0.14 -2.55 0.53 0.00 -0.30 0.00 0.00 42.92 40.45 2dpt s ASP 186 CO -0.10 -0.57 1.44 0.00 -0.17 0.00 0.00 175.17 175.77 2dpt n GLN 188 N 0.36 0.00 -4.34 0.00 6.02 -1.19 -4.38 117.38 113.85 2dpt n GLN 188 Ca 0.20 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.85 2dpt n GLN 188 Cb 0.75 0.00 -0.11 0.00 1.02 0.00 0.00 30.24 31.90 2dpt n GLN 188 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2dpt s VAL 189 N 0.00 4.11 0.28 5.09 1.01 -1.26 -0.57 120.40 129.07 2dpt s VAL 189 Ca 0.00 -0.29 -0.29 0.00 0.00 0.00 0.00 61.98 61.40 2dpt s VAL 189 Cb 0.00 -2.79 -0.10 0.00 0.00 0.00 0.00 36.38 33.49 2dpt s VAL 189 CO 0.00 0.51 1.12 -0.22 0.00 0.00 0.00 175.10 176.51 2dpt s LEU 190 N 0.08 4.54 0.26 3.92 1.98 -1.26 -4.91 118.68 123.29 2dpt s LEU 190 Ca 0.01 2.31 -0.03 0.00 -2.89 0.00 0.00 54.13 53.53 2dpt s LEU 190 Cb -0.13 -3.63 -0.02 0.00 0.66 0.00 0.00 46.19 43.07 2dpt s LEU 190 CO 0.02 -0.18 0.30 0.54 -1.89 0.00 0.00 176.35 175.14 2dpt s ASN 191 N -0.84 0.43 0.16 3.68 2.20 -1.26 -5.03 114.94 114.28 2dpt s ASN 191 Ca 0.45 -1.34 -0.19 0.00 -0.94 0.00 0.00 52.86 50.84 2dpt s ASN 191 Cb -0.33 0.51 0.06 0.00 -2.00 0.00 0.00 41.25 39.49 2dpt s ASN 191 CO 0.42 -1.03 1.66 0.44 -2.94 0.00 0.00 177.10 175.65 2dpt h ASP 192 N 2.37 -0.44 0.52 3.54 3.32 -1.98 -0.24 116.42 123.50 2dpt h ASP 192 Ca -0.31 0.11 -0.02 0.00 0.02 0.00 0.00 57.03 56.84 2dpt h ASP 192 Cb 1.25 0.25 0.00 0.00 0.22 0.00 0.00 39.33 41.05 2dpt h ASP 192 CO 0.44 -0.16 -0.27 -0.74 -1.72 0.00 0.00 179.24 176.78 2dpt h HIS 193 N -0.07 -0.70 -0.35 4.55 2.76 -1.99 -1.87 115.15 117.48 2dpt h HIS 193 Ca 0.16 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.32 2dpt h HIS 193 Cb 0.31 0.24 -0.02 0.00 1.55 0.00 0.00 27.41 29.49 2dpt h HIS 193 CO -0.34 -0.43 0.22 0.00 -1.30 0.00 0.00 177.93 176.09 2dpt h THR 194 N -0.73 1.10 -0.09 6.26 1.03 -1.96 -2.41 112.91 116.12 2dpt h THR 194 Ca -0.07 -0.19 -0.16 0.00 -0.01 0.00 0.00 66.41 65.98 2dpt h THR 194 Cb 0.57 0.59 -0.01 0.00 -1.07 0.00 0.00 68.15 68.23 2dpt h THR 194 CO 0.10 0.10 -0.62 0.00 -0.01 0.00 0.00 175.52 175.08 2dpt h ALA 195 N 1.77 0.76 0.00 0.00 0.00 -0.85 -1.96 119.26 118.98 2dpt h ALA 195 Ca 0.13 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2dpt h ALA 195 Cb -0.04 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2dpt h ALA 195 CO -0.03 0.73 0.00 0.66 0.00 0.00 0.00 179.25 180.61 2dpt h SER 196 N 0.24 0.00 0.28 0.00 4.64 -0.85 -2.32 113.55 115.54 2dpt h SER 196 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2dpt h SER 196 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2dpt h SER 196 CO 0.10 0.00 -0.13 0.18 -0.87 0.00 0.00 176.83 176.11 2dpt n LEU 197 N -2.48 0.69 0.00 5.97 4.77 -0.96 -4.74 117.00 120.25 2dpt n LEU 197 Ca 0.03 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 2dpt n LEU 197 Cb 0.32 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 2dpt n LEU 197 CO 0.25 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 2dpt n GLY 198 N 1.27 0.88 3.77 -0.72 0.00 -0.87 -0.37 105.19 109.15 2dpt n GLY 198 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 2dpt n GLY 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dpt s ALA 199 N -2.00 2.68 0.29 4.61 0.00 -0.78 -4.71 121.76 121.85 2dpt s ALA 199 Ca 0.00 0.82 0.02 0.00 0.00 0.00 0.00 51.96 52.80 2dpt s ALA 199 Cb 0.00 -3.36 -0.03 0.00 0.00 0.00 0.00 23.12 19.73 2dpt s ALA 199 CO 0.00 -0.80 0.27 0.00 0.00 0.00 0.00 175.76 175.24 2dpt s GLU 201 N -3.64 3.30 0.28 0.00 2.02 -1.26 0.15 118.70 119.55 2dpt s GLU 201 Ca 0.38 -0.66 0.09 0.00 0.02 0.00 0.00 54.97 54.80 2dpt s GLU 201 Cb 0.03 -2.64 -0.06 0.00 0.10 0.00 0.00 34.13 31.57 2dpt s GLU 201 CO 0.21 0.28 -0.13 0.96 0.02 0.00 0.00 175.26 176.60 2dpt s ILE 202 N 0.18 2.09 0.37 -1.63 -4.36 -0.67 -4.88 121.20 112.31 2dpt s ILE 202 Ca -0.07 -2.25 -0.28 0.00 -0.26 0.00 0.00 60.65 57.79 2dpt s ILE 202 Cb -0.15 -2.39 -0.10 0.00 1.25 0.00 0.00 42.46 41.08 2dpt s ILE 202 CO 0.05 -0.36 1.37 -2.84 0.24 0.00 0.00 174.94 173.40 2dpt s PRO 203 N -3.61 4.15 0.28 0.37 0.02 -1.26 -0.43 135.00 134.52 2dpt s PRO 203 Ca 0.29 2.34 0.01 0.00 0.02 0.00 0.00 61.00 63.67 2dpt s PRO 203 Cb -0.00 -2.95 0.68 0.00 0.02 0.00 0.00 34.50 32.25 2dpt s PRO 203 CO 0.13 -0.41 1.66 -0.09 -0.33 0.00 0.00 177.00 177.97 2dpt h ARG 204 N 3.05 0.26 0.00 5.54 2.43 -1.86 0.39 114.38 124.19 2dpt h ARG 204 Ca -0.50 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 58.60 2dpt h ARG 204 Cb 1.24 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.72 2dpt h ARG 204 CO 0.64 0.17 -0.29 0.07 -1.51 0.00 0.00 179.97 179.05 2dpt h ARG 205 N 0.26 0.00 -0.03 0.20 0.11 -1.94 0.91 114.38 113.89 2dpt h ARG 205 Ca 0.53 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.59 2dpt h ARG 205 Cb 1.04 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.12 2dpt h ARG 205 CO -0.60 0.29 -0.07 -0.44 0.10 0.00 0.00 179.97 179.25 2dpt h ASP 206 N 0.00 0.11 -0.74 0.08 3.32 -0.65 -2.14 116.42 116.40 2dpt h ASP 206 Ca -0.00 -0.59 0.04 0.00 0.02 0.00 0.00 57.03 56.50 2dpt h ASP 206 Cb 0.52 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 39.99 2dpt h ASP 206 CO 0.04 0.67 0.45 0.22 -1.72 0.00 0.00 179.24 178.90 2dpt h TYR 207 N -0.46 0.84 -0.50 4.55 3.20 -0.81 -0.94 116.97 122.85 2dpt h TYR 207 Ca -0.00 0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.92 2dpt h TYR 207 Cb 0.66 -0.27 -0.04 0.00 1.54 0.00 0.00 36.73 38.62 2dpt h TYR 207 CO 0.13 0.45 0.29 -0.07 -1.64 0.00 0.00 178.16 177.32 2dpt h LEU 208 N 0.86 0.46 -0.00 2.82 3.38 -0.82 0.19 115.31 122.20 2dpt h LEU 208 Ca 0.31 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.30 2dpt h LEU 208 Cb 0.09 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2dpt h LEU 208 CO -0.14 0.32 -0.09 0.78 0.09 0.00 0.00 178.44 179.40 2dpt h ASN 209 N 0.57 -0.26 -0.70 -0.43 2.35 -0.66 -1.11 115.58 115.35 2dpt h ASN 209 Ca 0.21 0.04 0.11 0.00 -0.55 0.00 0.00 56.30 56.10 2dpt h ASN 209 Cb 0.04 0.11 -0.08 0.00 0.05 0.00 0.00 38.32 38.44 2dpt h ASN 209 CO -0.10 -0.13 0.30 1.88 -1.65 0.00 0.00 177.43 177.73 2dpt h TYR 210 N -0.15 0.53 -0.22 1.19 0.99 -0.70 -1.36 116.97 117.25 2dpt h TYR 210 Ca 0.04 0.03 0.05 0.00 2.00 0.00 0.00 58.73 60.85 2dpt h TYR 210 Cb 0.20 -0.13 -0.05 0.00 1.00 0.00 0.00 36.73 37.74 2dpt h TYR 210 CO -0.16 0.14 -0.12 1.25 -0.00 0.00 0.00 178.16 179.28 2dpt h LEU 211 N 0.50 -0.40 -1.01 3.88 6.46 0.20 0.62 115.31 125.55 2dpt h LEU 211 Ca 0.36 0.09 -0.05 0.00 -0.12 0.00 0.00 57.88 58.16 2dpt h LEU 211 Cb 0.45 0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 40.57 2dpt h LEU 211 CO -0.32 -0.16 0.17 0.78 -0.62 0.00 0.00 178.44 178.29 2dpt h ASN 212 N -0.10 0.82 0.01 1.25 -0.26 -0.27 0.04 115.58 117.07 2dpt h ASN 212 Ca 0.12 -0.14 -0.21 0.00 -0.56 0.00 0.00 56.30 55.51 2dpt h ASN 212 Cb 0.29 -0.21 0.01 0.00 -1.06 0.00 0.00 38.32 37.34 2dpt h ASN 212 CO -0.29 0.78 -0.78 1.56 -1.06 0.00 0.00 177.43 177.64 2dpt h GLN 213 N 0.85 0.65 0.03 0.81 7.50 -0.80 -3.34 115.11 120.81 2dpt h GLN 213 Ca 0.19 -0.54 -0.24 0.00 0.50 0.00 0.00 58.65 58.56 2dpt h GLN 213 Cb 0.27 0.12 -0.03 0.00 0.05 0.00 0.00 27.48 27.89 2dpt h GLN 213 CO -0.01 1.16 -1.20 0.52 -1.50 0.00 0.00 178.83 177.80 2dpt h MET 214 N 0.44 0.07 0.00 1.46 2.86 -0.74 -3.27 114.93 115.74 2dpt h MET 214 Ca -0.05 -0.12 -0.00 0.00 -2.06 0.00 0.00 59.70 57.47 2dpt h MET 214 Cb 1.39 0.04 -0.00 0.00 0.06 0.00 0.00 31.60 33.10 2dpt h MET 214 CO 0.15 0.97 -0.01 0.07 1.06 0.00 0.00 176.91 179.15 2dpt h ARG 215 N 0.02 0.00 0.00 1.72 0.11 -1.08 0.16 114.38 115.31 2dpt h ARG 215 Ca -0.10 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.98 2dpt h ARG 215 Cb 1.87 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.95 2dpt h ARG 215 CO 0.14 0.01 -0.56 -0.07 0.10 0.00 0.00 179.97 179.58 2dpt h LEU 216 N 0.00 0.00 0.00 0.08 3.38 -1.70 -3.38 115.31 113.70 2dpt h LEU 216 Ca -0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2dpt h LEU 216 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2dpt h LEU 216 CO 0.00 0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.16 2dpt n GLY 217 N 1.20 -3.35 3.60 0.83 0.00 0.46 -4.99 105.19 102.94 2dpt n GLY 217 Ca 0.02 -1.13 -0.09 0.00 0.00 0.00 0.00 46.02 44.82 2dpt n GLY 217 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2dpt s ARG 218 N -0.58 0.48 0.39 1.61 6.06 -1.26 -4.65 118.95 120.99 2dpt s ARG 218 Ca 0.00 0.23 0.08 0.00 -2.50 0.00 0.00 55.73 53.54 2dpt s ARG 218 Cb 0.00 0.23 -0.07 0.00 0.06 0.00 0.00 34.95 35.17 2dpt s ARG 218 CO 0.00 -0.13 0.02 -0.51 -2.50 0.00 0.00 175.30 172.19 2dpt s LEU 219 N -0.73 2.92 0.38 -0.88 1.43 -1.26 -4.83 118.68 115.70 2dpt s LEU 219 Ca 0.01 -1.22 -0.24 0.00 -1.03 0.00 0.00 54.13 51.66 2dpt s LEU 219 Cb -0.02 -1.10 -0.13 0.00 0.03 0.00 0.00 46.19 44.97 2dpt s LEU 219 CO -0.02 -0.39 0.66 -2.65 0.23 0.00 0.00 176.35 174.19 2dpt n PRO 220 N -0.99 0.72 0.10 1.29 -0.02 -1.26 -4.74 135.00 130.10 2dpt n PRO 220 Ca -0.04 0.26 0.06 0.00 -2.02 0.00 0.00 63.50 61.76 2dpt n PRO 220 Cb 0.65 -1.57 0.33 0.00 -0.02 0.00 0.00 33.50 32.90 2dpt n PRO 220 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2dpt n ASN 221 N 1.26 0.32 -0.10 2.55 2.85 -1.26 -1.73 115.26 119.14 2dpt n ASN 221 Ca 0.12 0.63 0.06 0.00 -0.11 0.00 0.00 54.58 55.27 2dpt n ASN 221 Cb 0.37 -0.67 0.08 0.00 1.24 0.00 0.00 39.78 40.80 2dpt n ASN 221 CO 0.00 0.00 0.00 -0.46 -2.11 0.00 0.00 177.26 174.69 2dpt n ASN 222 N -1.93 1.81 -0.29 1.20 6.94 -1.26 -4.80 115.26 116.94 2dpt n ASN 222 Ca -0.01 -2.55 0.10 0.00 -0.02 0.00 0.00 54.58 52.10 2dpt n ASN 222 Cb 0.05 -0.27 0.33 0.00 -2.36 0.00 0.00 39.78 37.53 2dpt n ASN 222 CO 0.00 0.00 0.00 0.15 -1.03 0.00 0.00 177.26 176.38 2dpt h PHE 223 N 0.00 0.92 -0.10 -2.53 3.57 -1.66 -2.77 116.94 114.36 2dpt h PHE 223 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2dpt h PHE 223 Cb 0.93 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 39.38 2dpt h PHE 223 CO 0.01 0.36 0.00 0.91 -2.23 0.00 0.00 178.31 177.37 2dpt n TRP 224 N -4.57 0.11 -1.86 0.41 7.02 -1.26 -4.95 117.44 112.34 2dpt n TRP 224 Ca 0.17 -0.06 -0.40 0.00 -1.02 0.00 0.00 57.50 56.19 2dpt n TRP 224 Cb 0.41 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.30 2dpt n TRP 224 CO 0.00 0.00 0.00 0.14 -2.02 0.00 0.00 177.69 175.81 2dpt s VAL 225 N -1.89 2.18 0.04 -0.99 -7.23 -1.05 -4.79 120.40 106.67 2dpt s VAL 225 Ca 0.34 0.18 -0.32 0.00 -1.81 0.00 0.00 61.98 60.37 2dpt s VAL 225 Cb 0.20 -3.11 -0.11 0.00 0.56 0.00 0.00 36.38 33.92 2dpt s VAL 225 CO 0.31 0.04 1.85 -0.81 -0.31 0.00 0.00 175.10 176.17 2dpt n PRO 226 N 0.24 2.51 -3.87 4.82 -0.04 -1.26 -4.88 135.00 132.52 2dpt n PRO 226 Ca 0.02 0.92 -0.07 0.00 -0.04 0.00 0.00 63.50 64.33 2dpt n PRO 226 Cb 0.41 -2.79 -0.02 0.00 -0.04 0.00 0.00 33.50 31.06 2dpt n PRO 226 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2dpt s ARG 227 N 3.33 1.83 -0.06 0.54 1.70 -1.02 -4.99 118.95 120.28 2dpt s ARG 227 Ca 0.87 -1.08 -0.18 0.00 -0.47 0.00 0.00 55.73 54.87 2dpt s ARG 227 Cb -0.57 0.60 -0.05 0.00 -0.57 0.00 0.00 34.95 34.36 2dpt s ARG 227 CO 0.43 -0.84 0.48 0.00 -1.08 0.00 0.00 175.30 174.30 2dpt n LEU 229 N 2.97 0.00 -3.69 0.00 4.77 0.37 -4.93 117.00 116.50 2dpt n LEU 229 Ca -0.09 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.79 2dpt n LEU 229 Cb 0.52 0.42 -0.10 0.00 -2.33 0.00 0.00 43.42 41.92 2dpt n LEU 229 CO 0.42 0.42 0.12 0.12 -1.33 0.00 0.00 177.39 177.13 2dpt s PHE 230 N -2.61 -0.66 -0.08 -1.77 2.19 -0.93 -4.98 117.98 109.14 2dpt s PHE 230 Ca -0.09 1.42 0.02 0.00 0.33 0.00 0.00 56.93 58.60 2dpt s PHE 230 Cb 0.07 0.31 -0.02 0.00 -1.31 0.00 0.00 43.02 42.07 2dpt s PHE 230 CO 0.81 -0.36 -0.12 -1.12 1.83 0.00 0.00 175.22 176.26 2dpt s SER 231 N 1.25 4.16 1.21 6.13 0.01 -1.26 -1.04 113.70 124.16 2dpt s SER 231 Ca -0.08 -0.21 -0.17 0.00 1.31 0.00 0.00 55.95 56.80 2dpt s SER 231 Cb -0.07 -1.18 0.25 0.00 0.21 0.00 0.00 66.02 65.23 2dpt s SER 231 CO -0.12 0.28 0.90 -0.81 0.41 0.00 0.00 173.24 173.90 2dpt n PRO 232 N 2.73 -2.83 0.00 12.44 -0.04 -1.18 -4.99 135.00 141.14 2dpt n PRO 232 Ca -0.18 -1.44 0.03 0.00 -0.04 0.00 0.00 63.50 61.88 2dpt n PRO 232 Cb 0.52 -1.36 0.03 0.00 -0.04 0.00 0.00 33.50 32.65 2dpt n PRO 232 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40