#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eak s ALA 8 N 0.00 2.66 0.66 1.69 0.00 -1.26 -4.46 121.76 121.05 2eak s ALA 8 Ca 0.00 0.88 -0.13 0.00 0.00 0.00 0.00 51.96 52.71 2eak s ALA 8 Cb 0.00 -3.38 -0.00 0.00 0.00 0.00 0.00 23.12 19.73 2eak s ALA 8 CO 0.00 -0.87 1.06 -1.25 0.00 0.00 0.00 175.76 174.71 2eak s PRO 9 N -3.28 3.01 -0.51 0.00 0.04 -1.26 -4.87 135.00 128.13 2eak s PRO 9 Ca 0.74 1.09 -0.25 0.00 0.04 0.00 0.00 61.00 62.62 2eak s PRO 9 Cb -0.26 -2.00 0.03 0.00 0.04 0.00 0.00 34.50 32.32 2eak s PRO 9 CO 0.29 -1.05 0.94 0.71 0.04 0.00 0.00 177.00 177.93 2eak s TYR 10 N -2.78 2.84 -0.09 0.56 2.02 0.27 -4.96 117.35 115.21 2eak s TYR 10 Ca 0.61 0.17 -0.21 0.00 -0.37 0.00 0.00 57.07 57.27 2eak s TYR 10 Cb -0.15 -4.03 -0.04 0.00 -0.40 0.00 0.00 41.96 37.34 2eak s TYR 10 CO 0.48 -1.24 0.59 -0.51 -1.57 0.00 0.00 175.55 173.29 2eak s LEU 11 N 3.89 4.29 -1.43 -1.29 1.02 -1.26 -1.89 118.68 122.00 2eak s LEU 11 Ca 0.34 0.99 -0.05 0.00 0.02 0.00 0.00 54.13 55.43 2eak s LEU 11 Cb -0.11 -2.88 0.04 0.00 0.02 0.00 0.00 46.19 43.25 2eak s LEU 11 CO 0.23 -0.06 0.69 -1.20 0.02 0.00 0.00 176.35 176.03 2eak n SER 12 N 3.74 -2.01 -4.74 2.29 7.64 -0.24 -4.90 113.62 115.42 2eak n SER 12 Ca -0.04 -0.89 -0.41 0.00 1.01 0.00 0.00 58.87 58.54 2eak n SER 12 Cb 0.51 -3.58 -0.04 0.00 -1.01 0.00 0.00 64.21 60.09 2eak n SER 12 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2eak s PRO 13 N -6.40 4.56 0.28 1.43 0.04 -1.26 -4.98 135.00 128.67 2eak s PRO 13 Ca 0.24 1.76 -0.29 0.00 0.04 0.00 0.00 61.00 62.74 2eak s PRO 13 Cb -0.12 -3.27 -0.10 0.00 0.04 0.00 0.00 34.50 31.05 2eak s PRO 13 CO 0.85 0.03 1.23 0.00 0.04 0.00 0.00 177.00 179.14 2eak s ALA 14 N -0.16 3.47 -0.16 8.56 0.00 -1.26 -4.28 121.76 127.93 2eak s ALA 14 Ca 0.50 1.08 -0.10 0.00 0.00 0.00 0.00 51.96 53.45 2eak s ALA 14 Cb -0.30 -3.42 -0.05 0.00 0.00 0.00 0.00 23.12 19.35 2eak s ALA 14 CO 0.35 -0.43 0.17 0.08 0.00 0.00 0.00 175.76 175.93 2eak s VAL 15 N -0.81 5.42 0.36 0.00 1.01 -1.26 -3.11 120.40 121.99 2eak s VAL 15 Ca 0.49 0.27 -0.27 0.00 0.00 0.00 0.00 61.98 62.47 2eak s VAL 15 Cb -0.36 -3.47 -0.09 0.00 0.00 0.00 0.00 36.38 32.45 2eak s VAL 15 CO 0.45 0.51 1.23 -2.16 0.00 0.00 0.00 175.10 175.12 2eak s PRO 16 N -0.21 4.24 -0.02 2.72 0.04 -1.26 -4.98 135.00 135.54 2eak s PRO 16 Ca 0.12 2.03 0.07 0.00 0.04 0.00 0.00 61.00 63.25 2eak s PRO 16 Cb -0.12 -2.91 -0.02 0.00 0.04 0.00 0.00 34.50 31.49 2eak s PRO 16 CO 0.02 -0.22 -0.21 0.12 0.04 0.00 0.00 177.00 176.75 2eak s PHE 17 N -1.25 1.90 -0.01 0.56 5.36 0.39 -4.99 117.98 119.94 2eak s PHE 17 Ca 0.52 -0.36 0.01 0.00 -0.96 0.00 0.00 56.93 56.14 2eak s PHE 17 Cb -0.35 -1.22 0.01 0.00 -0.34 0.00 0.00 43.02 41.11 2eak s PHE 17 CO 0.46 -0.03 -0.03 -1.12 -1.46 0.00 0.00 175.22 173.04 2eak s SER 18 N -0.51 0.50 0.01 6.13 0.01 -1.26 -0.78 113.70 117.79 2eak s SER 18 Ca 0.08 -0.07 -0.17 0.00 1.31 0.00 0.00 55.95 57.10 2eak s SER 18 Cb -0.08 -0.14 0.03 0.00 0.21 0.00 0.00 66.02 66.04 2eak s SER 18 CO -0.01 0.00 0.38 -0.83 0.41 0.00 0.00 173.24 173.19 2eak s GLY 19 N 0.30 -0.23 0.44 3.44 0.00 -0.53 -5.01 107.32 105.73 2eak s GLY 19 Ca -0.03 0.37 -0.25 0.00 0.00 0.00 0.00 44.72 44.81 2eak s GLY 19 CO -0.01 0.13 1.38 -1.59 0.00 0.00 0.00 173.10 173.02 2eak s THR 20 N -1.87 2.25 -0.39 0.90 2.01 -1.26 -0.75 115.64 116.53 2eak s THR 20 Ca -0.09 0.22 -0.13 0.00 0.31 0.00 0.00 61.69 62.00 2eak s THR 20 Cb -0.03 -3.13 0.02 0.00 0.01 0.00 0.00 72.50 69.38 2eak s THR 20 CO 0.02 0.03 0.25 -0.63 -0.69 0.00 0.00 174.62 173.60 2eak s ILE 21 N -1.23 4.94 0.13 1.82 1.01 0.13 -4.79 121.20 123.22 2eak s ILE 21 Ca 0.60 -0.74 -0.31 0.00 0.00 0.00 0.00 60.65 60.20 2eak s ILE 21 Cb -0.42 -3.75 -0.10 0.00 0.01 0.00 0.00 42.46 38.20 2eak s ILE 21 CO 0.53 -0.27 1.72 -1.10 0.00 0.00 0.00 174.94 175.83 2eak s GLN 22 N 1.62 4.16 0.00 2.79 -0.21 -1.26 -1.02 119.66 125.74 2eak s GLN 22 Ca 0.04 2.49 0.00 0.00 0.02 0.00 0.00 55.36 57.91 2eak s GLN 22 Cb -0.19 -3.41 0.00 0.00 1.00 0.00 0.00 33.01 30.41 2eak s GLN 22 CO 0.08 -0.76 0.00 0.41 -2.12 0.00 0.00 175.29 172.91 2eak n GLY 23 N 4.04 2.69 0.33 3.09 0.00 -1.26 -4.87 105.19 109.22 2eak n GLY 23 Ca 0.16 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.23 2eak n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eak n GLY 24 N -2.00 -1.57 3.75 -0.02 0.00 -0.19 -4.81 105.19 100.35 2eak n GLY 24 Ca 0.00 -1.44 -0.41 0.00 0.00 0.00 0.00 46.02 44.17 2eak n GLY 24 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2eak s LEU 25 N -3.71 4.41 0.03 0.99 1.43 -0.47 -5.00 118.68 116.35 2eak s LEU 25 Ca 0.00 2.61 -0.00 0.00 -1.03 0.00 0.00 54.13 55.71 2eak s LEU 25 Cb 0.00 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.57 2eak s LEU 25 CO 0.00 -0.61 -0.03 -1.10 0.23 0.00 0.00 176.35 174.83 2eak s GLN 26 N -0.75 0.43 0.19 1.70 -1.52 -1.26 -4.12 119.66 114.32 2eak s GLN 26 Ca 0.55 -0.82 -0.33 0.00 -1.95 0.00 0.00 55.36 52.82 2eak s GLN 26 Cb -0.40 0.10 -0.14 0.00 -0.22 0.00 0.00 33.01 32.35 2eak s GLN 26 CO 0.45 -0.06 1.53 -3.47 -0.25 0.00 0.00 175.29 173.49 2eak n ASP 27 N 1.12 3.02 0.00 5.90 2.03 -1.26 -1.60 116.55 125.75 2eak n ASP 27 Ca -0.21 1.10 0.00 0.00 0.52 0.00 0.00 54.79 56.21 2eak n ASP 27 Cb 0.57 -1.43 0.00 0.00 -0.72 0.00 0.00 41.12 39.54 2eak n ASP 27 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2eak n GLY 28 N 3.00 2.11 3.75 0.27 0.00 0.13 -5.02 105.19 109.42 2eak n GLY 28 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 2eak n GLY 28 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2eak s LEU 29 N 0.00 4.36 -0.17 0.99 2.96 -0.63 -4.75 118.68 121.44 2eak s LEU 29 Ca 0.00 2.86 0.01 0.00 -0.22 0.00 0.00 54.13 56.78 2eak s LEU 29 Cb 0.00 -3.63 0.02 0.00 0.50 0.00 0.00 46.19 43.08 2eak s LEU 29 CO 0.00 -0.85 -0.20 -1.10 -1.32 0.00 0.00 176.35 172.88 2eak s GLN 30 N -0.41 3.02 -0.20 1.98 -0.21 -1.26 -1.05 119.66 121.53 2eak s GLN 30 Ca 0.62 -0.82 -0.02 0.00 0.02 0.00 0.00 55.36 55.16 2eak s GLN 30 Cb -0.46 -2.56 -0.00 0.00 1.00 0.00 0.00 33.01 30.98 2eak s GLN 30 CO 0.46 -0.17 -0.08 0.42 -2.12 0.00 0.00 175.29 173.80 2eak s ILE 31 N 1.20 3.05 -0.15 1.08 1.09 -0.16 -0.98 121.20 126.33 2eak s ILE 31 Ca 0.03 -0.61 -0.06 0.00 -1.10 0.00 0.00 60.65 58.91 2eak s ILE 31 Cb -0.14 -2.36 -0.04 0.00 -1.06 0.00 0.00 42.46 38.86 2eak s ILE 31 CO -0.10 0.46 0.05 -0.89 -0.10 0.00 0.00 174.94 174.35 2eak s THR 32 N 1.35 4.70 -0.32 2.92 2.01 0.03 -0.37 115.64 125.95 2eak s THR 32 Ca 0.04 -0.08 -0.03 0.00 0.31 0.00 0.00 61.69 61.94 2eak s THR 32 Cb -0.14 -3.07 0.06 0.00 0.01 0.00 0.00 72.50 69.35 2eak s THR 32 CO -0.05 0.52 0.05 -0.69 -0.69 0.00 0.00 174.62 173.76 2eak s VAL 33 N -0.09 3.14 -0.21 3.82 1.01 0.27 -1.43 120.40 126.91 2eak s VAL 33 Ca 0.06 -1.47 -0.03 0.00 0.00 0.00 0.00 61.98 60.55 2eak s VAL 33 Cb -0.12 -2.87 -0.00 0.00 0.00 0.00 0.00 36.38 33.39 2eak s VAL 33 CO 0.01 -0.22 -0.08 0.21 0.00 0.00 0.00 175.10 175.03 2eak s ASN 34 N 1.36 4.05 0.00 3.32 3.84 -0.03 -0.73 114.94 126.74 2eak s ASN 34 Ca -0.02 -0.44 0.00 0.00 0.21 0.00 0.00 52.86 52.61 2eak s ASN 34 Cb -0.20 -1.68 0.00 0.00 -0.55 0.00 0.00 41.25 38.82 2eak s ASN 34 CO -0.01 -0.00 0.00 0.61 -2.79 0.00 0.00 177.10 174.91 2eak n GLY 35 N 4.66 2.99 3.02 1.21 0.00 -0.90 0.68 105.19 116.86 2eak n GLY 35 Ca -0.19 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 45.17 2eak n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eak s THR 36 N -1.60 -0.03 0.41 2.61 2.01 0.78 -0.37 115.64 119.45 2eak s THR 36 Ca 0.00 0.11 -0.24 0.00 0.31 0.00 0.00 61.69 61.86 2eak s THR 36 Cb 0.00 -0.31 -0.08 0.00 0.01 0.00 0.00 72.50 72.12 2eak s THR 36 CO 0.00 0.04 1.13 -0.69 -0.69 0.00 0.00 174.62 174.41 2eak s VAL 37 N 0.85 3.31 0.45 3.82 1.01 -1.11 -1.10 120.40 127.63 2eak s VAL 37 Ca -0.06 1.04 -0.20 0.00 0.00 0.00 0.00 61.98 62.76 2eak s VAL 37 Cb -0.08 -3.56 -0.10 0.00 0.00 0.00 0.00 36.38 32.64 2eak s VAL 37 CO -0.05 0.04 0.96 -0.76 0.00 0.00 0.00 175.10 175.30 2eak s LEU 38 N -2.66 3.90 -0.08 3.92 1.43 -0.68 -2.80 118.68 121.71 2eak s LEU 38 Ca 0.59 1.70 -0.27 0.00 -1.03 0.00 0.00 54.13 55.13 2eak s LEU 38 Cb -0.28 -4.54 -0.24 0.00 0.03 0.00 0.00 46.19 41.16 2eak s LEU 38 CO 0.34 -0.43 0.95 0.28 0.23 0.00 0.00 176.35 177.72 2eak h SER 39 N 1.77 0.10 -4.32 2.29 0.02 -1.91 -3.33 113.55 108.17 2eak h SER 39 Ca -0.49 -0.83 -0.48 0.00 -0.84 0.00 0.00 61.79 59.15 2eak h SER 39 Cb 1.18 -0.03 -0.24 0.00 0.14 0.00 0.00 62.40 63.45 2eak h SER 39 CO 0.61 0.92 -0.81 -0.55 -1.14 0.00 0.00 176.83 175.86 2eak s SER 40 N -6.20 1.95 0.00 3.07 0.15 -1.26 -4.87 113.70 106.54 2eak s SER 40 Ca -0.17 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 55.96 2eak s SER 40 Cb -0.01 -0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.18 2eak s SER 40 CO 0.71 0.05 0.00 -0.24 1.20 0.00 0.00 173.24 174.96 2eak n SER 41 N 1.71 0.00 -1.07 5.45 2.88 -1.26 -5.10 113.62 116.22 2eak n SER 41 Ca -0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 2eak n SER 41 Cb 0.54 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 2eak n SER 41 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2eak n GLY 42 N 0.00 0.52 0.08 0.46 0.00 -1.26 -5.00 105.19 99.99 2eak n GLY 42 Ca 0.00 -0.82 0.03 0.00 0.00 0.00 0.00 46.02 45.22 2eak n GLY 42 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2eak n THR 43 N -0.02 0.96 -3.82 2.61 -2.24 -1.26 -4.93 114.28 105.58 2eak n THR 43 Ca 0.00 -1.07 -0.12 0.00 -2.27 0.00 0.00 64.05 60.59 2eak n THR 43 Cb 0.01 0.38 -0.10 0.00 -2.10 0.00 0.00 70.33 68.53 2eak n THR 43 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2eak s ARG 44 N -1.24 0.53 0.05 -0.78 0.52 -1.26 0.67 118.95 117.43 2eak s ARG 44 Ca 0.09 -0.21 -0.06 0.00 -0.52 0.00 0.00 55.73 55.03 2eak s ARG 44 Cb 0.08 0.23 -0.01 0.00 0.52 0.00 0.00 34.95 35.77 2eak s ARG 44 CO 0.01 -0.13 0.11 -0.59 0.02 0.00 0.00 175.30 174.71 2eak s PHE 45 N -1.14 0.21 0.01 -0.53 -0.12 -0.96 -0.51 117.98 114.95 2eak s PHE 45 Ca -0.12 -0.54 0.03 0.00 -0.05 0.00 0.00 56.93 56.25 2eak s PHE 45 Cb -0.06 -0.14 -0.01 0.00 -0.63 0.00 0.00 43.02 42.18 2eak s PHE 45 CO 0.02 -0.39 -0.10 0.00 -0.05 0.00 0.00 175.22 174.70 2eak s ALA 46 N -2.87 0.81 -0.12 1.99 0.00 -0.05 -2.76 121.76 118.75 2eak s ALA 46 Ca -0.03 -0.55 0.00 0.00 0.00 0.00 0.00 51.96 51.39 2eak s ALA 46 Cb 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 23.12 22.96 2eak s ALA 46 CO -0.06 0.16 -0.14 0.08 0.00 0.00 0.00 175.76 175.80 2eak s VAL 47 N -0.55 2.95 -0.11 0.00 1.01 0.05 -2.02 120.40 121.73 2eak s VAL 47 Ca 0.01 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.31 2eak s VAL 47 Cb -0.05 -2.22 0.01 0.00 0.00 0.00 0.00 36.38 34.11 2eak s VAL 47 CO 0.00 0.53 -0.18 0.20 0.00 0.00 0.00 175.10 175.65 2eak s ASN 48 N 0.29 2.63 -0.37 3.32 0.02 0.10 -0.10 114.94 120.84 2eak s ASN 48 Ca -0.11 -0.48 -0.12 0.00 -1.02 0.00 0.00 52.86 51.14 2eak s ASN 48 Cb -0.16 -1.20 0.02 0.00 0.02 0.00 0.00 41.25 39.93 2eak s ASN 48 CO 0.06 0.06 0.22 -0.36 0.02 0.00 0.00 177.10 177.09 2eak s PHE 49 N 0.80 3.23 0.23 2.20 0.08 0.32 -0.92 117.98 123.93 2eak s PHE 49 Ca -0.10 -0.81 0.00 0.00 0.12 0.00 0.00 56.93 56.15 2eak s PHE 49 Cb -0.16 -2.45 -0.05 0.00 -0.57 0.00 0.00 43.02 39.79 2eak s PHE 49 CO 0.01 -0.60 0.11 1.14 -0.10 0.00 0.00 175.22 175.78 2eak s GLN 50 N 1.59 1.33 -0.35 0.44 -2.07 0.01 -0.08 119.66 120.52 2eak s GLN 50 Ca 0.03 -1.71 -0.13 0.00 -1.82 0.00 0.00 55.36 51.73 2eak s GLN 50 Cb -0.19 -0.03 -0.01 0.00 -1.09 0.00 0.00 33.01 31.69 2eak s GLN 50 CO 0.07 -0.34 0.26 0.99 -1.32 0.00 0.00 175.29 174.96 2eak s THR 51 N -3.92 5.27 0.00 3.63 2.01 -0.22 -1.92 115.64 120.49 2eak s THR 51 Ca 0.38 -0.26 0.00 0.00 0.31 0.00 0.00 61.69 62.12 2eak s THR 51 Cb 0.07 -3.76 0.00 0.00 0.01 0.00 0.00 72.50 68.82 2eak s THR 51 CO 0.13 -0.07 0.00 0.61 -0.69 0.00 0.00 174.62 174.60 2eak n GLY 52 N 5.10 -1.00 0.16 4.40 0.00 -1.26 -4.57 105.19 108.02 2eak n GLY 52 Ca -0.12 -1.13 0.08 0.00 0.00 0.00 0.00 46.02 44.85 2eak n GLY 52 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2eak n PHE 53 N -0.80 0.00 -0.20 1.61 3.72 -1.26 -4.54 117.46 115.99 2eak n PHE 53 Ca 0.00 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.37 2eak n PHE 53 Cb 0.00 0.00 0.17 0.00 -0.94 0.00 0.00 39.48 38.71 2eak n PHE 53 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2eak h SER 54 N 0.79 0.89 0.00 4.37 4.64 -1.98 -3.47 113.55 118.80 2eak h SER 54 Ca 0.00 -0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 2eak h SER 54 Cb 0.45 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2eak h SER 54 CO 0.00 0.79 0.00 0.61 -0.87 0.00 0.00 176.83 177.36 2eak n GLY 55 N -1.02 0.76 0.18 -0.77 0.00 -1.26 -4.94 105.19 98.13 2eak n GLY 55 Ca 0.06 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.12 2eak n GLY 55 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2eak h ASN 56 N 0.00 0.00 -3.23 1.61 4.21 -1.91 -3.40 115.58 112.86 2eak h ASN 56 Ca 0.00 0.00 -0.59 0.00 1.21 0.00 0.00 56.30 56.92 2eak h ASN 56 Cb 0.00 0.00 -0.40 0.00 -1.12 0.00 0.00 38.32 36.80 2eak h ASN 56 CO 0.00 0.43 -0.76 -1.81 -1.29 0.00 0.00 177.43 174.00 2eak s ASP 57 N -6.55 3.83 -0.25 5.81 1.01 -1.26 -0.67 116.67 118.59 2eak s ASP 57 Ca -0.00 -2.02 0.01 0.00 0.71 0.00 0.00 52.55 51.24 2eak s ASP 57 Cb 0.12 -0.89 0.04 0.00 1.01 0.00 0.00 42.92 43.19 2eak s ASP 57 CO 0.70 -0.36 -0.10 -0.63 0.21 0.00 0.00 175.17 175.00 2eak s ILE 58 N 1.14 2.48 0.23 0.77 1.01 -0.26 -1.05 121.20 125.52 2eak s ILE 58 Ca 0.13 -1.28 -0.01 0.00 0.00 0.00 0.00 60.65 59.50 2eak s ILE 58 Cb -0.20 -2.32 -0.00 0.00 0.01 0.00 0.00 42.46 39.95 2eak s ILE 58 CO -0.14 0.14 1.60 0.00 0.00 0.00 0.00 174.94 176.53 2eak h ALA 59 N 7.91 0.87 -2.29 9.38 0.00 -0.73 0.14 119.26 134.53 2eak h ALA 59 Ca -0.29 -0.45 -0.21 0.00 0.00 0.00 0.00 54.91 53.96 2eak h ALA 59 Cb 1.08 -0.10 -0.32 0.00 0.00 0.00 0.00 17.79 18.45 2eak h ALA 59 CO 0.54 0.64 -0.53 0.12 0.00 0.00 0.00 179.25 180.02 2eak s PHE 60 N -4.20 -0.58 -0.29 0.00 5.36 -1.09 -4.46 117.98 112.74 2eak s PHE 60 Ca -0.07 0.69 -0.09 0.00 -0.96 0.00 0.00 56.93 56.50 2eak s PHE 60 Cb 0.12 -0.10 -0.02 0.00 -0.34 0.00 0.00 43.02 42.68 2eak s PHE 60 CO 0.82 -0.61 0.12 -1.58 -1.46 0.00 0.00 175.22 172.51 2eak s HIS 61 N 2.46 3.15 -0.27 10.12 5.65 0.46 -0.52 115.29 136.33 2eak s HIS 61 Ca 0.08 -0.50 -0.01 0.00 0.25 0.00 0.00 55.06 54.88 2eak s HIS 61 Cb -0.15 -2.31 0.04 0.00 -1.18 0.00 0.00 32.58 28.98 2eak s HIS 61 CO -0.13 -0.41 -0.03 0.12 -0.65 0.00 0.00 174.74 173.63 2eak s PHE 62 N 1.62 3.17 -0.50 3.88 5.36 0.85 -2.06 117.98 130.30 2eak s PHE 62 Ca 0.05 -1.74 0.04 0.00 -0.96 0.00 0.00 56.93 54.32 2eak s PHE 62 Cb -0.16 -2.07 0.17 0.00 -0.34 0.00 0.00 43.02 40.61 2eak s PHE 62 CO 0.05 -0.77 0.38 1.21 -1.46 0.00 0.00 175.22 174.64 2eak s ASN 63 N 1.28 2.62 0.25 6.13 2.47 0.18 -0.77 114.94 127.11 2eak s ASN 63 Ca -0.03 -3.28 -0.30 0.00 0.42 0.00 0.00 52.86 49.67 2eak s ASN 63 Cb -0.18 -0.84 -0.10 0.00 -1.45 0.00 0.00 41.25 38.68 2eak s ASN 63 CO -0.03 -0.15 1.39 -2.84 -3.72 0.00 0.00 177.10 171.75 2eak s PRO 64 N -0.39 4.31 -0.10 0.43 0.02 -1.11 -1.16 135.00 137.00 2eak s PRO 64 Ca 0.29 2.23 -0.00 0.00 0.02 0.00 0.00 61.00 63.54 2eak s PRO 64 Cb -0.01 -3.12 0.02 0.00 0.02 0.00 0.00 34.50 31.42 2eak s PRO 64 CO -0.18 -0.34 -0.07 1.03 -0.33 0.00 0.00 177.00 177.11 2eak s ARG 65 N -0.54 1.40 -1.40 5.54 0.52 0.53 -2.26 118.95 122.73 2eak s ARG 65 Ca 0.57 -0.22 -0.07 0.00 -0.52 0.00 0.00 55.73 55.49 2eak s ARG 65 Cb -0.40 -1.45 0.07 0.00 0.52 0.00 0.00 34.95 33.68 2eak s ARG 65 CO 0.44 -0.23 2.53 1.19 0.02 0.00 0.00 175.30 179.25 2eak n PHE 66 N 4.78 2.56 -3.95 -0.53 3.72 0.21 -1.81 117.46 122.44 2eak n PHE 66 Ca -0.14 -2.89 -0.10 0.00 -0.05 0.00 0.00 57.45 54.27 2eak n PHE 66 Cb 0.50 -2.01 -0.12 0.00 -0.94 0.00 0.00 39.48 36.92 2eak n PHE 66 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 2eak s GLU 67 N -0.29 0.23 -1.52 -1.08 2.02 -1.26 -4.79 118.70 112.01 2eak s GLU 67 Ca 0.58 -0.45 -0.13 0.00 0.02 0.00 0.00 54.97 54.98 2eak s GLU 67 Cb 0.18 0.07 0.09 0.00 0.10 0.00 0.00 34.13 34.57 2eak s GLU 67 CO -0.09 -0.03 0.87 -0.25 0.02 0.00 0.00 175.26 175.78 2eak n ASP 68 N 1.99 -4.59 0.00 -0.19 8.00 -1.26 -1.51 116.55 118.99 2eak n ASP 68 Ca -0.21 -0.72 0.00 0.00 0.71 0.00 0.00 54.79 54.57 2eak n ASP 68 Cb 0.56 -3.69 0.00 0.00 -0.02 0.00 0.00 41.12 37.98 2eak n ASP 68 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2eak n GLY 69 N -1.57 0.65 0.10 0.44 0.00 -1.26 -4.85 105.19 98.69 2eak n GLY 69 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2eak n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eak n GLY 70 N -2.00 -0.37 3.50 -0.02 0.00 -0.57 -4.82 105.19 100.92 2eak n GLY 70 Ca 0.00 -1.13 -0.11 0.00 0.00 0.00 0.00 46.02 44.78 2eak n GLY 70 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2eak s TYR 71 N -0.17 -0.43 -0.08 1.61 -0.85 -0.75 -4.22 117.35 112.47 2eak s TYR 71 Ca 0.00 0.16 0.04 0.00 -0.52 0.00 0.00 57.07 56.75 2eak s TYR 71 Cb 0.00 0.56 -0.00 0.00 0.38 0.00 0.00 41.96 42.90 2eak s TYR 71 CO 0.00 -0.92 -0.23 0.08 -1.52 0.00 0.00 175.55 172.96 2eak s VAL 72 N -3.79 1.93 -0.18 -3.49 1.01 0.80 -0.35 120.40 116.33 2eak s VAL 72 Ca 0.04 -0.96 -0.10 0.00 0.00 0.00 0.00 61.98 60.96 2eak s VAL 72 Cb -0.02 -1.66 -0.05 0.00 0.00 0.00 0.00 36.38 34.65 2eak s VAL 72 CO -0.08 0.53 0.14 -0.69 0.00 0.00 0.00 175.10 175.00 2eak s VAL 73 N 0.22 5.43 -0.12 2.92 1.01 -0.31 -1.11 120.40 128.44 2eak s VAL 73 Ca -0.14 0.21 0.02 0.00 0.00 0.00 0.00 61.98 62.07 2eak s VAL 73 Cb -0.16 -3.46 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 2eak s VAL 73 CO 0.07 0.48 -0.18 0.00 0.00 0.00 0.00 175.10 175.46 2eak s ASN 75 N 0.47 -0.22 -0.04 0.00 3.84 -0.87 -1.20 114.94 116.91 2eak s ASN 75 Ca -0.13 -0.67 0.04 0.00 0.21 0.00 0.00 52.86 52.31 2eak s ASN 75 Cb -0.17 0.69 -0.00 0.00 -0.55 0.00 0.00 41.25 41.22 2eak s ASN 75 CO 0.05 -1.29 -0.17 -0.89 -2.79 0.00 0.00 177.10 172.01 2eak s THR 76 N -3.94 1.45 -0.18 -5.21 2.01 -1.26 -0.40 115.64 108.10 2eak s THR 76 Ca 0.14 -0.73 -0.06 0.00 0.31 0.00 0.00 61.69 61.35 2eak s THR 76 Cb -0.05 -1.24 -0.03 0.00 0.01 0.00 0.00 72.50 71.19 2eak s THR 76 CO 0.07 0.42 0.02 -0.60 -0.69 0.00 0.00 174.62 173.83 2eak s ARG 77 N 0.02 3.80 -0.08 4.92 3.52 0.47 -1.38 118.95 130.23 2eak s ARG 77 Ca -0.03 -0.44 0.00 0.00 -0.13 0.00 0.00 55.73 55.13 2eak s ARG 77 Cb -0.11 -3.09 0.02 0.00 -1.56 0.00 0.00 34.95 30.20 2eak s ARG 77 CO 0.02 0.21 -0.06 -0.65 -0.81 0.00 0.00 175.30 174.01 2eak s GLN 78 N 0.51 1.17 -1.65 5.12 -0.21 0.62 -1.10 119.66 124.11 2eak s GLN 78 Ca 0.00 -0.16 -0.17 0.00 0.02 0.00 0.00 55.36 55.05 2eak s GLN 78 Cb -0.13 -1.21 0.14 0.00 1.00 0.00 0.00 33.01 32.80 2eak s GLN 78 CO 0.02 -0.17 0.84 0.09 -2.12 0.00 0.00 175.29 173.95 2eak n ASN 79 N 4.53 -3.70 0.00 5.90 4.13 -1.09 -1.33 115.26 123.70 2eak n ASN 79 Ca -0.17 -0.95 0.00 0.00 1.68 0.00 0.00 54.58 55.15 2eak n ASN 79 Cb 0.51 -3.08 0.00 0.00 -1.54 0.00 0.00 39.78 35.66 2eak n ASN 79 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2eak n GLY 80 N -1.49 1.44 3.61 7.41 0.00 0.15 -5.03 105.19 111.27 2eak n GLY 80 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 2eak n GLY 80 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eak s SER 81 N -3.19 5.37 0.31 1.61 0.01 -0.44 -5.05 113.70 112.31 2eak s SER 81 Ca 0.00 0.04 -0.27 0.00 1.31 0.00 0.00 55.95 57.03 2eak s SER 81 Cb 0.00 -1.86 -0.10 0.00 0.21 0.00 0.00 66.02 64.27 2eak s SER 81 CO 0.00 0.20 0.96 0.26 0.41 0.00 0.00 173.24 175.07 2eak s TRP 82 N 0.18 3.72 0.00 2.43 0.52 -1.26 -0.28 118.94 124.25 2eak s TRP 82 Ca 0.02 1.80 0.00 0.00 0.02 0.00 0.00 56.10 57.94 2eak s TRP 82 Cb -0.13 -2.97 0.00 0.00 -1.15 0.00 0.00 33.47 29.23 2eak s TRP 82 CO 0.01 0.17 0.00 0.41 0.02 0.00 0.00 176.95 177.56 2eak n GLY 83 N 0.76 0.56 3.75 0.98 0.00 -0.48 -4.97 105.19 105.81 2eak n GLY 83 Ca 0.01 -1.84 -0.41 0.00 0.00 0.00 0.00 46.02 43.78 2eak n GLY 83 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2eak s PRO 84 N 1.09 4.41 0.07 1.61 0.02 -1.26 -4.88 135.00 136.05 2eak s PRO 84 Ca 0.00 2.09 -0.28 0.00 0.02 0.00 0.00 61.00 62.84 2eak s PRO 84 Cb 0.00 -3.14 -0.05 0.00 0.02 0.00 0.00 34.50 31.32 2eak s PRO 84 CO 0.00 -0.17 0.87 -1.21 -0.33 0.00 0.00 177.00 176.16 2eak s GLU 85 N -0.96 4.60 -0.23 5.54 2.02 -1.26 -4.75 118.70 123.66 2eak s GLU 85 Ca 0.52 1.27 -0.10 0.00 0.02 0.00 0.00 54.97 56.68 2eak s GLU 85 Cb -0.37 -3.37 -0.05 0.00 0.10 0.00 0.00 34.13 30.43 2eak s GLU 85 CO 0.44 0.23 0.16 -1.21 0.02 0.00 0.00 175.26 174.90 2eak s GLU 86 N 0.02 4.10 -0.09 1.61 2.02 -0.34 -4.97 118.70 121.05 2eak s GLU 86 Ca 0.43 -0.25 0.03 0.00 0.02 0.00 0.00 54.97 55.20 2eak s GLU 86 Cb -0.22 -3.51 -0.01 0.00 0.10 0.00 0.00 34.13 30.49 2eak s GLU 86 CO 0.27 0.12 -0.19 1.03 0.02 0.00 0.00 175.26 176.50 2eak s ARG 87 N 0.88 2.98 -0.11 1.61 0.52 -1.26 -0.31 118.95 123.26 2eak s ARG 87 Ca 0.08 -0.80 0.01 0.00 -0.52 0.00 0.00 55.73 54.50 2eak s ARG 87 Cb -0.13 -2.39 -0.01 0.00 0.52 0.00 0.00 34.95 32.94 2eak s ARG 87 CO 0.03 0.30 -0.15 0.21 0.02 0.00 0.00 175.30 175.71 2eak s LYS 88 N 0.09 3.18 0.00 3.54 2.20 -0.26 -4.95 119.74 123.54 2eak s LYS 88 Ca -0.09 -0.72 0.00 0.00 -0.36 0.00 0.00 55.97 54.81 2eak s LYS 88 Cb -0.15 -2.54 0.00 0.00 -1.51 0.00 0.00 37.83 33.63 2eak s LYS 88 CO 0.06 0.28 0.00 0.25 -0.36 0.00 0.00 175.35 175.58 2eak n THR 89 N 3.31 0.00 -3.60 3.43 -2.24 -1.26 -0.14 114.28 113.78 2eak n THR 89 Ca -0.18 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.40 2eak n THR 89 Cb 0.53 -1.46 0.05 0.00 -2.10 0.00 0.00 70.33 67.35 2eak n THR 89 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2eak n HIS 90 N -1.23 -2.02 -0.99 4.78 8.25 -1.26 -4.86 115.22 117.90 2eak n HIS 90 Ca 0.00 0.85 -0.40 0.00 -0.26 0.00 0.00 57.72 57.90 2eak n HIS 90 Cb 0.00 -4.50 -0.07 0.00 1.12 0.00 0.00 29.99 26.54 2eak n HIS 90 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 2eak n MET 91 N -4.16 0.00 -0.12 -0.41 1.56 -1.26 -4.87 117.12 107.87 2eak n MET 91 Ca -0.27 0.00 0.07 0.00 -0.27 0.00 0.00 57.70 57.23 2eak n MET 91 Cb 0.67 -0.92 0.25 0.00 2.15 0.00 0.00 33.22 35.37 2eak n MET 91 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 2eak n PRO 92 N 3.09 1.69 -4.31 2.12 -0.04 -1.26 -4.89 135.00 131.39 2eak n PRO 92 Ca 0.23 -1.05 -0.26 0.00 -0.04 0.00 0.00 63.50 62.38 2eak n PRO 92 Cb -0.03 -1.30 -0.09 0.00 -0.04 0.00 0.00 33.50 32.03 2eak n PRO 92 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2eak s PHE 93 N -1.68 2.59 -0.01 0.54 0.08 -1.26 -4.99 117.98 113.24 2eak s PHE 93 Ca 0.26 -0.24 0.00 0.00 0.12 0.00 0.00 56.93 57.07 2eak s PHE 93 Cb 0.14 -1.25 0.01 0.00 -0.57 0.00 0.00 43.02 41.34 2eak s PHE 93 CO 0.19 0.53 -0.00 -1.14 -0.10 0.00 0.00 175.22 174.70 2eak s GLN 94 N -2.92 0.07 0.04 0.44 0.74 -1.26 -5.11 119.66 111.66 2eak s GLN 94 Ca 0.25 0.01 -0.33 0.00 0.05 0.00 0.00 55.36 55.34 2eak s GLN 94 Cb -0.08 -0.12 -0.12 0.00 1.10 0.00 0.00 33.01 33.79 2eak s GLN 94 CO 0.15 -0.02 1.82 1.63 -0.55 0.00 0.00 175.29 178.32 2eak n LYS 95 N 3.29 2.43 0.00 1.67 5.02 -1.26 -1.90 118.16 127.41 2eak n LYS 95 Ca -0.15 0.89 0.00 0.00 -2.02 0.00 0.00 58.31 57.02 2eak n LYS 95 Cb 0.58 -2.74 0.00 0.00 -0.02 0.00 0.00 35.03 32.84 2eak n LYS 95 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2eak n GLY 96 N 4.16 1.70 3.69 0.72 0.00 -1.12 -4.88 105.19 109.46 2eak n GLY 96 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 2eak n GLY 96 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2eak s MET 97 N -0.87 3.13 0.83 1.61 -1.94 -0.80 -4.87 119.30 116.39 2eak s MET 97 Ca 0.00 -0.38 -0.12 0.00 -1.71 0.00 0.00 55.69 53.48 2eak s MET 97 Cb 0.00 -2.87 0.09 0.00 2.01 0.00 0.00 34.83 34.06 2eak s MET 97 CO 0.00 0.66 1.16 -1.25 -0.01 0.00 0.00 175.02 175.58 2eak s PRO 98 N -0.76 1.62 0.05 2.03 0.04 -1.26 -2.74 135.00 133.98 2eak s PRO 98 Ca 0.12 1.56 -0.11 0.00 0.04 0.00 0.00 61.00 62.62 2eak s PRO 98 Cb -0.12 -1.79 0.01 0.00 0.04 0.00 0.00 34.50 32.64 2eak s PRO 98 CO 0.02 -2.19 0.23 -0.59 0.04 0.00 0.00 177.00 174.51 2eak s PHE 99 N -2.46 0.02 -0.23 0.56 -0.12 0.50 -4.91 117.98 111.34 2eak s PHE 99 Ca 0.68 -0.25 0.01 0.00 -0.05 0.00 0.00 56.93 57.32 2eak s PHE 99 Cb -0.24 0.01 0.06 0.00 -0.63 0.00 0.00 43.02 42.21 2eak s PHE 99 CO 0.53 -0.47 -0.07 0.34 -0.05 0.00 0.00 175.22 175.50 2eak s ASP 100 N -2.21 3.89 -0.20 1.98 2.15 -1.26 -2.11 116.67 118.90 2eak s ASP 100 Ca -0.03 -1.17 -0.06 0.00 0.43 0.00 0.00 52.55 51.71 2eak s ASP 100 Cb -0.00 -1.25 -0.03 0.00 -0.30 0.00 0.00 42.92 41.34 2eak s ASP 100 CO -0.05 -0.22 0.03 -0.22 -0.17 0.00 0.00 175.17 174.55 2eak s LEU 101 N 1.35 3.47 -0.10 -1.34 2.96 0.09 -0.63 118.68 124.48 2eak s LEU 101 Ca -0.06 -0.11 0.02 0.00 -0.22 0.00 0.00 54.13 53.76 2eak s LEU 101 Cb -0.19 -1.89 0.02 0.00 0.50 0.00 0.00 46.19 44.63 2eak s LEU 101 CO -0.06 0.08 -0.13 0.00 -1.32 0.00 0.00 176.35 174.92 2eak s PHE 103 N 0.98 3.02 -0.23 0.00 0.08 0.50 -0.40 117.98 121.92 2eak s PHE 103 Ca -0.08 -0.63 -0.08 0.00 0.12 0.00 0.00 56.93 56.26 2eak s PHE 103 Cb -0.15 -2.14 -0.04 0.00 -0.57 0.00 0.00 43.02 40.12 2eak s PHE 103 CO -0.01 -0.40 0.09 -1.17 -0.10 0.00 0.00 175.22 173.63 2eak s LEU 104 N 1.39 3.70 -0.25 -0.37 2.96 0.76 -0.99 118.68 125.88 2eak s LEU 104 Ca 0.05 -0.05 -0.28 0.00 -0.22 0.00 0.00 54.13 53.63 2eak s LEU 104 Cb -0.15 -1.98 0.01 0.00 0.50 0.00 0.00 46.19 44.58 2eak s LEU 104 CO 0.01 0.05 1.00 -0.69 -1.32 0.00 0.00 176.35 175.40 2eak s VAL 105 N 1.12 4.68 0.36 1.68 1.01 -0.21 -0.55 120.40 128.49 2eak s VAL 105 Ca 0.05 1.86 0.09 0.00 0.00 0.00 0.00 61.98 63.98 2eak s VAL 105 Cb -0.14 -4.29 -0.06 0.00 0.00 0.00 0.00 36.38 31.89 2eak s VAL 105 CO 0.04 -0.22 0.04 -1.10 0.00 0.00 0.00 175.10 173.85 2eak s GLN 106 N 3.22 2.09 0.31 2.72 -0.21 -0.12 0.17 119.66 127.84 2eak s GLN 106 Ca 0.42 -1.80 0.01 0.00 0.02 0.00 0.00 55.36 54.02 2eak s GLN 106 Cb -0.14 -1.91 0.54 0.00 1.00 0.00 0.00 33.01 32.49 2eak s GLN 106 CO 0.08 0.08 1.92 0.77 -2.12 0.00 0.00 175.29 176.02 2eak h SER 107 N 1.74 0.89 0.17 5.90 0.02 -1.98 -3.19 113.55 117.09 2eak h SER 107 Ca -0.43 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.37 2eak h SER 107 Cb 1.25 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 63.57 2eak h SER 107 CO 0.69 0.58 -1.99 -1.20 -1.14 0.00 0.00 176.83 173.77 2eak n SER 108 N -4.48 0.18 -3.89 3.07 7.64 -1.26 -4.92 113.62 109.96 2eak n SER 108 Ca 0.13 0.08 -0.08 0.00 1.01 0.00 0.00 58.87 60.01 2eak n SER 108 Cb 0.19 1.28 -0.03 0.00 -1.01 0.00 0.00 64.21 64.63 2eak n SER 108 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 2eak s ASP 109 N -5.10 -0.22 -0.08 6.43 -4.77 -1.21 -1.73 116.67 109.98 2eak s ASP 109 Ca -0.07 -0.69 -0.20 0.00 -3.30 0.00 0.00 52.55 48.28 2eak s ASP 109 Cb 0.10 0.69 -0.04 0.00 -1.09 0.00 0.00 42.92 42.58 2eak s ASP 109 CO 0.86 -1.29 0.56 -0.36 0.70 0.00 0.00 175.17 175.64 2eak s PHE 110 N -3.94 3.56 -0.26 2.11 0.08 0.65 -0.94 117.98 119.23 2eak s PHE 110 Ca 0.14 1.04 -0.10 0.00 0.12 0.00 0.00 56.93 58.13 2eak s PHE 110 Cb -0.05 -2.63 -0.05 0.00 -0.57 0.00 0.00 43.02 39.73 2eak s PHE 110 CO 0.07 0.18 0.16 0.21 -0.10 0.00 0.00 175.22 175.74 2eak s LYS 111 N 0.54 3.93 -0.26 0.44 2.20 0.29 -0.59 119.74 126.28 2eak s LYS 111 Ca 0.30 -0.34 -0.04 0.00 -0.36 0.00 0.00 55.97 55.54 2eak s LYS 111 Cb -0.16 -3.56 0.01 0.00 -1.51 0.00 0.00 37.83 32.61 2eak s LYS 111 CO 0.14 -0.11 -0.00 0.08 -0.36 0.00 0.00 175.35 175.10 2eak s VAL 112 N 1.52 3.41 -0.13 4.02 1.01 0.37 -0.17 120.40 130.43 2eak s VAL 112 Ca 0.07 -0.78 -0.04 0.00 0.00 0.00 0.00 61.98 61.22 2eak s VAL 112 Cb -0.15 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 2eak s VAL 112 CO 0.08 0.20 0.04 -0.04 0.00 0.00 0.00 175.10 175.37 2eak s MET 113 N 1.43 3.42 -0.21 2.72 -1.94 0.46 0.12 119.30 125.29 2eak s MET 113 Ca 0.02 -0.36 -0.00 0.00 -1.71 0.00 0.00 55.69 53.64 2eak s MET 113 Cb -0.16 -2.99 0.02 0.00 2.01 0.00 0.00 34.83 33.71 2eak s MET 113 CO -0.01 0.54 -0.14 0.08 -0.01 0.00 0.00 175.02 175.48 2eak s VAL 114 N -0.41 2.46 -1.40 -6.03 1.01 0.25 -0.78 120.40 115.51 2eak s VAL 114 Ca 0.09 -0.96 -0.08 0.00 0.00 0.00 0.00 61.98 61.03 2eak s VAL 114 Cb -0.12 -2.14 0.04 0.00 0.00 0.00 0.00 36.38 34.15 2eak s VAL 114 CO 0.02 0.39 0.98 0.59 0.00 0.00 0.00 175.10 177.08 2eak n ASN 115 N 4.64 -4.14 0.00 3.32 3.02 0.20 -1.79 115.26 120.52 2eak n ASN 115 Ca -0.19 -0.70 0.00 0.00 -0.03 0.00 0.00 54.58 53.66 2eak n ASN 115 Cb 0.49 -4.39 0.00 0.00 -0.61 0.00 0.00 39.78 35.27 2eak n ASN 115 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2eak n GLY 116 N -1.69 0.61 3.12 7.41 0.00 -1.26 -5.02 105.19 108.36 2eak n GLY 116 Ca -0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.65 2eak n GLY 116 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2eak s ILE 117 N -2.54 1.65 -0.16 -0.61 1.01 -0.74 -5.07 121.20 114.74 2eak s ILE 117 Ca 0.00 -0.77 -0.35 0.00 0.00 0.00 0.00 60.65 59.53 2eak s ILE 117 Cb 0.00 -1.46 -0.12 0.00 0.01 0.00 0.00 42.46 40.89 2eak s ILE 117 CO 0.00 0.47 1.91 -0.11 0.00 0.00 0.00 174.94 177.21 2eak n LEU 118 N 3.79 3.12 -0.13 2.97 7.94 -1.26 -0.58 117.00 132.86 2eak n LEU 118 Ca -0.20 0.90 -0.26 0.00 -1.11 0.00 0.00 56.01 55.33 2eak n LEU 118 Cb 0.52 -1.33 -0.09 0.00 0.53 0.00 0.00 43.42 43.06 2eak n LEU 118 CO 0.26 -0.21 -1.32 0.33 -1.11 0.00 0.00 177.39 175.34 2eak n PHE 119 N 7.00 0.00 -3.62 1.96 7.35 0.12 -4.87 117.46 125.40 2eak n PHE 119 Ca 0.26 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.83 2eak n PHE 119 Cb 0.26 -0.89 -0.05 0.00 0.35 0.00 0.00 39.48 39.15 2eak n PHE 119 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2eak s VAL 120 N -2.52 0.05 -0.02 -2.13 0.11 -1.08 -5.02 120.40 109.78 2eak s VAL 120 Ca -0.36 -0.43 0.06 0.00 -2.93 0.00 0.00 61.98 58.32 2eak s VAL 120 Cb 0.13 -1.04 -0.02 0.00 -1.53 0.00 0.00 36.38 33.91 2eak s VAL 120 CO 0.45 -0.24 -0.19 -1.10 -3.33 0.00 0.00 175.10 170.70 2eak s GLN 121 N -3.05 2.30 -0.23 1.54 -0.21 -1.26 -0.48 119.66 118.26 2eak s GLN 121 Ca -0.02 -0.82 0.01 0.00 0.02 0.00 0.00 55.36 54.55 2eak s GLN 121 Cb 0.00 -2.23 0.06 0.00 1.00 0.00 0.00 33.01 31.84 2eak s GLN 121 CO -0.07 0.59 -0.05 -0.47 -2.12 0.00 0.00 175.29 173.17 2eak s TYR 122 N -0.72 2.33 0.22 0.91 5.04 0.24 -4.95 117.35 120.41 2eak s TYR 122 Ca 0.11 -1.71 -0.30 0.00 -2.44 0.00 0.00 57.07 52.73 2eak s TYR 122 Cb -0.10 -1.55 -0.09 0.00 0.35 0.00 0.00 41.96 40.57 2eak s TYR 122 CO 0.01 -0.77 1.22 -0.06 -1.34 0.00 0.00 175.55 174.61 2eak s PHE 123 N 1.42 3.37 0.25 4.97 0.08 -1.26 -0.25 117.98 126.55 2eak s PHE 123 Ca -0.06 1.42 -0.30 0.00 0.12 0.00 0.00 56.93 58.11 2eak s PHE 123 Cb -0.19 -3.47 -0.10 0.00 -0.57 0.00 0.00 43.02 38.69 2eak s PHE 123 CO -0.06 -1.32 1.51 -1.01 -0.10 0.00 0.00 175.22 174.24 2eak s HIS 124 N -0.30 2.95 -0.03 0.36 3.76 -0.71 -4.90 115.29 116.42 2eak s HIS 124 Ca 0.52 0.87 0.14 0.00 -0.15 0.00 0.00 55.06 56.44 2eak s HIS 124 Cb -0.34 -3.92 -0.22 0.00 1.11 0.00 0.00 32.58 29.21 2eak s HIS 124 CO 0.39 -3.11 0.28 0.54 -0.85 0.00 0.00 174.74 172.00 2eak n ARG 125 N 2.62 0.61 -4.25 1.40 1.74 -1.26 -4.98 116.66 112.53 2eak n ARG 125 Ca 0.09 -0.12 -0.15 0.00 -0.77 0.00 0.00 57.85 56.90 2eak n ARG 125 Cb 0.39 -1.35 -0.10 0.00 -1.02 0.00 0.00 32.46 30.38 2eak n ARG 125 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2eak s VAL 126 N -2.92 1.22 0.15 1.55 -7.23 -1.26 -5.11 120.40 106.80 2eak s VAL 126 Ca -0.05 -2.04 -0.32 0.00 -1.81 0.00 0.00 61.98 57.76 2eak s VAL 126 Cb 0.09 -1.83 -0.11 0.00 0.56 0.00 0.00 36.38 35.09 2eak s VAL 126 CO 0.60 -0.71 1.78 -2.65 -0.31 0.00 0.00 175.10 173.81 2eak n PRO 127 N -0.14 2.72 0.19 4.82 -0.02 -1.26 -4.87 135.00 136.44 2eak n PRO 127 Ca -0.11 0.99 0.07 0.00 -2.02 0.00 0.00 63.50 62.43 2eak n PRO 127 Cb 0.60 -2.85 0.29 0.00 -0.02 0.00 0.00 33.50 31.52 2eak n PRO 127 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2eak h PHE 128 N 7.77 0.00 0.00 6.00 -5.15 -1.97 -3.02 116.94 120.58 2eak h PHE 128 Ca -0.45 0.00 -0.00 0.00 -0.20 0.00 0.00 57.97 57.32 2eak h PHE 128 Cb 1.22 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.39 2eak h PHE 128 CO 0.73 0.34 -0.01 1.12 -2.00 0.00 0.00 178.31 178.49 2eak h HIS 129 N 0.00 0.00 0.00 6.09 2.07 -1.90 -1.26 115.15 120.15 2eak h HIS 129 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2eak h HIS 129 Cb 0.98 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.96 2eak h HIS 129 CO 0.00 0.01 0.00 0.54 -3.07 0.00 0.00 177.93 175.41 2eak n ARG 130 N -3.14 0.61 -2.71 5.12 1.74 -1.14 -4.34 116.66 112.79 2eak n ARG 130 Ca -0.02 0.01 -0.43 0.00 -0.77 0.00 0.00 57.85 56.64 2eak n ARG 130 Cb 0.16 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.08 2eak n ARG 130 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2eak s VAL 131 N -2.37 4.75 0.00 1.55 1.01 -0.48 -4.40 120.40 120.47 2eak s VAL 131 Ca 0.34 1.95 0.00 0.00 0.00 0.00 0.00 61.98 64.27 2eak s VAL 131 Cb 0.20 -4.28 0.00 0.00 0.00 0.00 0.00 36.38 32.31 2eak s VAL 131 CO 0.41 -0.09 0.54 -0.90 0.00 0.00 0.00 175.10 175.06 2eak n ASP 132 N 5.79 0.98 -3.86 3.32 5.68 -0.83 -1.37 116.55 126.27 2eak n ASP 132 Ca 0.10 -1.27 -0.12 0.00 -0.50 0.00 0.00 54.79 53.00 2eak n ASP 132 Cb 0.47 0.00 -0.14 0.00 -1.14 0.00 0.00 41.12 40.31 2eak n ASP 132 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2eak s THR 133 N -0.27 -0.01 -0.13 2.12 2.01 -0.81 0.18 115.64 118.74 2eak s THR 133 Ca 0.00 0.02 -0.00 0.00 0.31 0.00 0.00 61.69 62.02 2eak s THR 133 Cb 0.00 -0.02 -0.02 0.00 0.01 0.00 0.00 72.50 72.47 2eak s THR 133 CO 0.00 0.01 -0.12 -0.51 -0.69 0.00 0.00 174.62 173.31 2eak s ILE 134 N 0.11 3.19 0.00 1.82 2.07 0.07 -0.81 121.20 127.66 2eak s ILE 134 Ca -0.01 -0.62 0.08 0.00 -1.41 0.00 0.00 60.65 58.69 2eak s ILE 134 Cb -0.01 -2.34 -0.02 0.00 0.13 0.00 0.00 42.46 40.21 2eak s ILE 134 CO -0.00 0.53 -0.24 -0.55 -1.91 0.00 0.00 174.94 172.77 2eak s SER 135 N 0.24 2.80 -0.05 4.50 0.15 -0.09 -1.45 113.70 119.80 2eak s SER 135 Ca -0.08 -0.47 0.02 0.00 0.70 0.00 0.00 55.95 56.13 2eak s SER 135 Cb -0.15 -0.29 0.01 0.00 -1.71 0.00 0.00 66.02 63.88 2eak s SER 135 CO 0.05 0.27 -0.10 -0.69 1.20 0.00 0.00 173.24 173.96 2eak s VAL 136 N -0.63 0.95 0.16 4.45 1.01 0.04 0.02 120.40 126.40 2eak s VAL 136 Ca 0.09 -0.40 -0.07 0.00 0.00 0.00 0.00 61.98 61.61 2eak s VAL 136 Cb -0.09 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.41 2eak s VAL 136 CO -0.00 0.30 0.23 0.54 0.00 0.00 0.00 175.10 176.17 2eak s ASN 137 N 0.49 0.11 0.00 3.32 2.20 -0.86 -0.46 114.94 119.74 2eak s ASN 137 Ca -0.09 -0.99 0.00 0.00 -0.94 0.00 0.00 52.86 50.83 2eak s ASN 137 Cb -0.13 0.41 0.00 0.00 -2.00 0.00 0.00 41.25 39.53 2eak s ASN 137 CO 0.02 -0.86 0.00 0.61 -2.94 0.00 0.00 177.10 173.93 2eak n GLY 138 N -0.20 -0.32 2.67 0.45 0.00 -1.26 -0.87 105.19 105.65 2eak n GLY 138 Ca -0.06 -1.90 -0.41 0.00 0.00 0.00 0.00 46.02 43.65 2eak n GLY 138 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2eak n SER 139 N 0.00 6.16 -3.72 1.61 7.64 0.34 -4.85 113.62 120.81 2eak n SER 139 Ca 0.00 -3.01 -0.14 0.00 1.01 0.00 0.00 58.87 56.73 2eak n SER 139 Cb 0.00 -1.48 -0.08 0.00 -1.01 0.00 0.00 64.21 61.63 2eak n SER 139 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2eak s VAL 140 N 0.62 0.04 0.05 0.44 0.11 -1.26 -1.68 120.40 118.71 2eak s VAL 140 Ca 0.48 -0.35 0.09 0.00 -2.93 0.00 0.00 61.98 59.27 2eak s VAL 140 Cb 0.14 -0.67 -0.03 0.00 -1.53 0.00 0.00 36.38 34.28 2eak s VAL 140 CO -0.05 -0.19 -0.24 -1.58 -3.33 0.00 0.00 175.10 169.72 2eak s GLN 141 N -1.16 1.88 -0.07 1.54 0.74 -0.26 -4.78 119.66 117.55 2eak s GLN 141 Ca -0.12 -1.07 0.02 0.00 0.05 0.00 0.00 55.36 54.24 2eak s GLN 141 Cb -0.04 -2.05 -0.02 0.00 1.10 0.00 0.00 33.01 32.00 2eak s GLN 141 CO 0.05 0.52 -0.12 -0.51 -0.55 0.00 0.00 175.29 174.68 2eak s LEU 142 N -1.33 2.86 -0.13 3.68 1.43 -1.26 -0.15 118.68 123.78 2eak s LEU 142 Ca 0.13 -0.18 -0.21 0.00 -1.03 0.00 0.00 54.13 52.84 2eak s LEU 142 Cb -0.10 -1.61 -0.26 0.00 0.03 0.00 0.00 46.19 44.26 2eak s LEU 142 CO 0.03 0.31 0.58 0.28 0.23 0.00 0.00 176.35 177.77 2eak h SER 143 N 5.64 0.21 -4.59 2.29 0.02 -0.07 -3.36 113.55 113.68 2eak h SER 143 Ca -0.42 -0.82 0.08 0.00 -0.84 0.00 0.00 61.79 59.79 2eak h SER 143 Cb 1.17 -0.07 -0.17 0.00 0.14 0.00 0.00 62.40 63.48 2eak h SER 143 CO 0.52 1.40 0.46 -0.72 -1.14 0.00 0.00 176.83 177.36 2eak s TYR 144 N -2.38 -0.39 -0.18 3.45 -0.85 -0.71 -1.07 117.35 115.22 2eak s TYR 144 Ca -0.21 0.37 0.01 0.00 -0.52 0.00 0.00 57.07 56.71 2eak s TYR 144 Cb 0.02 0.51 0.02 0.00 0.38 0.00 0.00 41.96 42.90 2eak s TYR 144 CO 0.71 -0.53 -0.18 0.42 -1.52 0.00 0.00 175.55 174.45 2eak s ILE 145 N -2.65 2.19 0.26 -3.49 1.01 -0.79 -0.85 121.20 116.87 2eak s ILE 145 Ca 0.02 -0.90 0.06 0.00 0.00 0.00 0.00 60.65 59.83 2eak s ILE 145 Cb -0.01 -1.93 -0.05 0.00 0.01 0.00 0.00 42.46 40.48 2eak s ILE 145 CO -0.06 0.52 -0.06 -0.94 0.00 0.00 0.00 174.94 174.41 2eak s SER 146 N 1.31 2.52 0.01 3.58 1.04 -0.52 -0.56 113.70 121.07 2eak s SER 146 Ca 0.05 -1.17 0.04 0.00 0.48 0.00 0.00 55.95 55.35 2eak s SER 146 Cb -0.13 -0.12 -0.01 0.00 0.10 0.00 0.00 66.02 65.85 2eak s SER 146 CO -0.12 -0.36 -0.12 -0.36 0.98 0.00 0.00 173.24 173.27 2eak s PHE 147 N -3.10 1.03 0.00 5.02 0.08 -1.26 -0.79 117.98 118.96 2eak s PHE 147 Ca 0.28 -0.24 0.00 0.00 0.12 0.00 0.00 56.93 57.09 2eak s PHE 147 Cb 0.04 -0.65 0.00 0.00 -0.57 0.00 0.00 43.02 41.84 2eak s PHE 147 CO 0.10 -0.01 0.00 0.94 -0.10 0.00 0.00 175.22 176.16