#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d7m s SER 2 N 0.00 6.48 0.06 1.61 0.15 -1.26 -5.00 113.70 115.74 2d7m s SER 2 Ca 0.00 0.40 0.04 0.00 0.70 0.00 0.00 55.95 57.09 2d7m s SER 2 Cb 0.00 -2.55 -0.03 0.00 -1.71 0.00 0.00 66.02 61.73 2d7m s SER 2 CO 0.00 -1.40 -0.13 -0.55 1.20 0.00 0.00 173.24 172.36 2d7m s SER 3 N 3.05 1.47 -0.99 5.45 0.15 -1.26 -4.86 113.70 116.71 2d7m s SER 3 Ca 0.49 -0.60 -0.17 0.00 0.70 0.00 0.00 55.95 56.37 2d7m s SER 3 Cb -0.09 -0.03 0.02 0.00 -1.71 0.00 0.00 66.02 64.22 2d7m s SER 3 CO 0.29 -0.11 0.33 0.61 1.20 0.00 0.00 173.24 175.57 2d7m n GLY 4 N 1.33 -0.43 3.39 9.45 0.00 -1.26 -4.89 105.19 112.77 2d7m n GLY 4 Ca -0.22 0.21 0.02 0.00 0.00 0.00 0.00 46.02 46.03 2d7m n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d7m s SER 5 N -3.95 -0.33 -1.26 1.61 0.15 -1.26 -5.08 113.70 103.58 2d7m s SER 5 Ca 0.24 0.47 -0.16 0.00 0.70 0.00 0.00 55.95 57.20 2d7m s SER 5 Cb -0.14 1.33 0.11 0.00 -1.71 0.00 0.00 66.02 65.61 2d7m s SER 5 CO 0.73 -0.07 1.60 -0.44 1.20 0.00 0.00 173.24 176.27 2d7m s SER 6 N 2.00 6.94 -0.82 5.45 0.01 -1.26 -4.62 113.70 121.40 2d7m s SER 6 Ca -0.03 -2.67 -0.19 0.00 1.31 0.00 0.00 55.95 54.36 2d7m s SER 6 Cb -0.03 -2.50 0.03 0.00 0.21 0.00 0.00 66.02 63.72 2d7m s SER 6 CO -0.16 -0.99 0.49 0.61 0.41 0.00 0.00 173.24 173.60 2d7m n GLY 7 N 4.86 -0.71 3.26 3.44 0.00 -1.26 -4.80 105.19 109.97 2d7m n GLY 7 Ca 0.43 0.30 -0.44 0.00 0.00 0.00 0.00 46.02 46.32 2d7m n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d7m n ALA 8 N -3.50 4.40 -3.05 4.61 0.00 -1.26 -4.94 120.51 116.76 2d7m n ALA 8 Ca -0.13 -4.38 -0.12 0.00 0.00 0.00 0.00 53.44 48.81 2d7m n ALA 8 Cb 0.44 -2.89 -0.12 0.00 0.00 0.00 0.00 19.45 16.88 2d7m n ALA 8 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 2d7m s HIS 9 N 0.47 -0.19 -0.42 0.00 -0.00 -1.26 -3.03 115.29 110.86 2d7m s HIS 9 Ca 0.39 0.46 0.04 0.00 -0.00 0.00 0.00 55.06 55.95 2d7m s HIS 9 Cb -0.00 0.06 0.11 0.00 -0.00 0.00 0.00 32.58 32.75 2d7m s HIS 9 CO -0.00 -0.09 0.15 -0.51 -0.00 0.00 0.00 174.74 174.29 2d7m s ASP 10 N 0.10 4.57 0.45 7.38 1.11 -0.12 -4.89 116.67 125.26 2d7m s ASP 10 Ca -0.00 -2.55 0.12 0.00 0.18 0.00 0.00 52.55 50.29 2d7m s ASP 10 Cb -0.01 -1.64 1.01 0.00 1.07 0.00 0.00 42.92 43.35 2d7m s ASP 10 CO 0.00 -0.31 2.06 0.00 1.18 0.00 0.00 175.17 178.09 2d7m h ALA 11 N 7.10 1.77 0.00 5.23 0.00 -1.85 -0.83 119.26 130.68 2d7m h ALA 11 Ca -0.06 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2d7m h ALA 11 Cb 0.96 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.68 2d7m h ALA 11 CO 0.60 0.18 0.00 0.43 0.00 0.00 0.00 179.25 180.46 2d7m n SER 12 N -4.44 0.00 -1.20 0.00 7.64 -1.26 -0.72 113.62 113.64 2d7m n SER 12 Ca -0.01 0.44 0.09 0.00 1.01 0.00 0.00 58.87 60.40 2d7m n SER 12 Cb 0.13 -0.45 0.28 0.00 -1.01 0.00 0.00 64.21 63.16 2d7m n SER 12 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2d7m n LYS 13 N -1.45 2.65 -3.50 1.43 4.76 -0.32 -4.88 118.16 116.86 2d7m n LYS 13 Ca 0.01 -2.25 -0.38 0.00 -2.87 0.00 0.00 58.31 52.82 2d7m n LYS 13 Cb 0.05 -1.56 -0.09 0.00 -1.84 0.00 0.00 35.03 31.58 2d7m n LYS 13 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2d7m s VAL 14 N -1.35 5.25 -0.26 -0.18 1.01 0.10 -4.31 120.40 120.66 2d7m s VAL 14 Ca 0.41 0.42 -0.11 0.00 0.00 0.00 0.00 61.98 62.71 2d7m s VAL 14 Cb 0.23 -3.62 -0.05 0.00 0.00 0.00 0.00 36.38 32.94 2d7m s VAL 14 CO 0.26 0.24 0.17 -0.13 0.00 0.00 0.00 175.10 175.64 2d7m s ARG 15 N 1.62 3.99 -0.28 2.72 3.00 -0.97 -5.00 118.95 124.02 2d7m s ARG 15 Ca 0.12 -0.31 -0.08 0.00 0.00 0.00 0.00 55.73 55.46 2d7m s ARG 15 Cb -0.15 -3.59 -0.02 0.00 0.00 0.00 0.00 34.95 31.19 2d7m s ARG 15 CO 0.08 -0.08 0.11 0.00 0.00 0.00 0.00 175.30 175.42 2d7m s ALA 16 N 1.45 3.23 0.16 2.13 0.00 -1.26 -1.33 121.76 126.13 2d7m s ALA 16 Ca 0.07 -1.26 -0.08 0.00 0.00 0.00 0.00 51.96 50.70 2d7m s ALA 16 Cb -0.15 -2.24 -0.01 0.00 0.00 0.00 0.00 23.12 20.72 2d7m s ALA 16 CO 0.08 -0.70 0.25 -1.12 0.00 0.00 0.00 175.76 174.27 2d7m s SER 17 N 1.62 0.09 0.00 0.00 0.01 -1.11 -5.04 113.70 109.26 2d7m s SER 17 Ca 0.05 -0.93 0.00 0.00 1.31 0.00 0.00 55.95 56.38 2d7m s SER 17 Cb -0.16 0.41 0.00 0.00 0.21 0.00 0.00 66.02 66.48 2d7m s SER 17 CO 0.05 -0.87 0.00 0.61 0.41 0.00 0.00 173.24 173.44 2d7m n GLY 18 N -0.20 0.81 0.18 3.44 0.00 -1.26 -1.06 105.19 107.10 2d7m n GLY 18 Ca -0.07 -2.28 -0.13 0.00 0.00 0.00 0.00 46.02 43.54 2d7m n GLY 18 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d7m h PRO 19 N 8.69 0.56 -0.22 1.61 0.13 -1.97 -3.08 132.00 137.72 2d7m h PRO 19 Ca 0.00 -0.30 0.06 0.00 -0.87 0.00 0.00 66.00 64.90 2d7m h PRO 19 Cb 0.00 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.13 2d7m h PRO 19 CO 0.00 0.89 0.21 0.78 -0.23 0.00 0.00 178.00 179.64 2d7m h GLY 20 N 0.26 0.00 -3.52 1.56 0.00 -1.88 -0.61 103.07 98.87 2d7m h GLY 20 Ca 0.04 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.86 2d7m h GLY 20 CO 0.06 0.00 0.32 1.04 0.00 0.00 0.00 176.54 177.95 2d7m n LEU 21 N -4.02 6.21 -4.67 3.11 4.77 -1.17 -4.95 117.00 116.28 2d7m n LEU 21 Ca 0.02 -4.11 -0.43 0.00 -0.03 0.00 0.00 56.01 51.47 2d7m n LEU 21 Cb 0.34 -0.76 -0.02 0.00 -2.33 0.00 0.00 43.42 40.65 2d7m n LEU 21 CO 0.30 1.44 0.84 0.21 -1.33 0.00 0.00 177.39 178.86 2d7m s ASN 22 N -2.18 7.14 0.30 -1.43 2.47 -0.24 -4.77 114.94 116.23 2d7m s ASN 22 Ca 0.56 1.42 0.24 0.00 0.42 0.00 0.00 52.86 55.50 2d7m s ASN 22 Cb 0.46 -2.54 0.39 0.00 -1.45 0.00 0.00 41.25 38.12 2d7m s ASN 22 CO 0.03 -0.56 1.51 0.00 -3.72 0.00 0.00 177.10 174.36 2d7m h ALA 23 N 7.31 0.85 0.00 1.71 0.00 -1.90 -3.22 119.26 124.02 2d7m h ALA 23 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2d7m h ALA 23 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2d7m h ALA 23 CO 0.92 0.00 0.00 0.77 0.00 0.00 0.00 179.25 180.94 2d7m h SER 24 N 0.00 0.00 0.00 0.00 0.02 -1.93 -3.44 113.55 108.20 2d7m h SER 24 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2d7m h SER 24 Cb 0.90 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.44 2d7m h SER 24 CO 0.00 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.30 2d7m n GLY 25 N 0.79 3.64 3.37 -3.77 0.00 -1.22 -5.00 105.19 103.01 2d7m n GLY 25 Ca 0.03 -1.46 -0.30 0.00 0.00 0.00 0.00 46.02 44.30 2d7m n GLY 25 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2d7m s ILE 26 N -0.66 2.26 -0.29 -0.61 -4.36 0.18 -4.92 121.20 112.81 2d7m s ILE 26 Ca 0.00 -1.44 -0.29 0.00 -0.26 0.00 0.00 60.65 58.66 2d7m s ILE 26 Cb 0.00 -1.92 -0.02 0.00 1.25 0.00 0.00 42.46 41.77 2d7m s ILE 26 CO 0.00 0.30 1.66 -2.16 0.24 0.00 0.00 174.94 174.98 2d7m s PRO 27 N -1.45 3.59 1.36 0.37 0.04 -1.26 -0.90 135.00 136.75 2d7m s PRO 27 Ca 0.13 1.48 -0.20 0.00 0.04 0.00 0.00 61.00 62.45 2d7m s PRO 27 Cb -0.10 -4.10 0.35 0.00 0.04 0.00 0.00 34.50 30.69 2d7m s PRO 27 CO 0.03 -1.55 0.95 0.00 0.04 0.00 0.00 177.00 176.48 2d7m s ALA 28 N 5.88 -0.81 -1.33 8.56 0.00 -0.28 -3.99 121.76 129.78 2d7m s ALA 28 Ca 0.73 -0.57 -0.00 0.00 0.00 0.00 0.00 51.96 52.12 2d7m s ALA 28 Cb -0.22 -3.05 0.00 0.00 0.00 0.00 0.00 23.12 19.85 2d7m s ALA 28 CO 0.31 -4.45 0.64 -1.13 0.00 0.00 0.00 175.76 171.14 2d7m n SER 29 N -5.47 -1.04 -3.63 0.00 3.41 -0.90 -4.53 113.62 101.45 2d7m n SER 29 Ca 0.09 -0.86 -0.11 0.00 -0.26 0.00 0.00 58.87 57.73 2d7m n SER 29 Cb 0.58 -3.83 -0.07 0.00 -0.26 0.00 0.00 64.21 60.64 2d7m n SER 29 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2d7m s LEU 30 N -6.75 -0.72 -0.53 1.04 2.96 -1.26 -4.52 118.68 108.89 2d7m s LEU 30 Ca 0.02 1.31 -0.27 0.00 -0.22 0.00 0.00 54.13 54.97 2d7m s LEU 30 Cb -0.01 2.29 -0.02 0.00 0.50 0.00 0.00 46.19 48.95 2d7m s LEU 30 CO 0.83 -0.22 1.81 -2.16 -1.32 0.00 0.00 176.35 175.29 2d7m s PRO 31 N 0.71 2.85 -0.02 0.98 0.04 -1.26 -4.19 135.00 134.12 2d7m s PRO 31 Ca -0.02 0.81 0.03 0.00 0.04 0.00 0.00 61.00 61.86 2d7m s PRO 31 Cb -0.05 -4.32 -0.03 0.00 0.04 0.00 0.00 34.50 30.14 2d7m s PRO 31 CO -0.06 -2.45 -0.09 0.54 0.04 0.00 0.00 177.00 174.98 2d7m s VAL 32 N 8.32 3.52 -0.01 -0.36 0.11 0.58 -4.92 120.40 127.65 2d7m s VAL 32 Ca 0.69 -0.72 -0.01 0.00 -2.93 0.00 0.00 61.98 59.01 2d7m s VAL 32 Cb -0.15 -2.48 0.01 0.00 -1.53 0.00 0.00 36.38 32.22 2d7m s VAL 32 CO 0.24 0.47 0.02 -1.83 -3.33 0.00 0.00 175.10 170.67 2d7m s GLU 33 N -1.17 0.01 0.43 1.54 -1.05 -1.26 -0.01 118.70 117.19 2d7m s GLU 33 Ca 0.15 0.05 0.05 0.00 -0.15 0.00 0.00 54.97 55.06 2d7m s GLU 33 Cb -0.11 -0.02 0.05 0.00 -0.44 0.00 0.00 34.13 33.60 2d7m s GLU 33 CO 0.05 -0.02 0.38 1.97 0.95 0.00 0.00 175.26 178.58 2d7m n PHE 34 N 3.21 -1.12 -3.87 4.83 -1.74 0.33 -4.03 117.46 115.08 2d7m n PHE 34 Ca -0.14 -1.77 -0.25 0.00 -0.56 0.00 0.00 57.45 54.74 2d7m n PHE 34 Cb 0.59 -0.36 -0.17 0.00 1.52 0.00 0.00 39.48 41.05 2d7m n PHE 34 CO 0.00 0.00 0.00 0.99 -0.56 0.00 0.00 176.76 177.19 2d7m s THR 35 N -2.04 0.70 -0.78 1.97 2.01 -0.23 -2.40 115.64 114.86 2d7m s THR 35 Ca 0.29 -0.09 -0.16 0.00 0.31 0.00 0.00 61.69 62.04 2d7m s THR 35 Cb -0.02 -0.78 0.18 0.00 0.01 0.00 0.00 72.50 71.89 2d7m s THR 35 CO 0.18 0.31 0.80 -0.63 -0.69 0.00 0.00 174.62 174.59 2d7m s ILE 36 N 1.78 5.30 -0.89 1.82 -1.09 0.76 -2.75 121.20 126.12 2d7m s ILE 36 Ca 0.04 -2.01 -0.25 0.00 -2.23 0.00 0.00 60.65 56.20 2d7m s ILE 36 Cb -0.13 -4.52 0.04 0.00 -1.58 0.00 0.00 42.46 36.28 2d7m s ILE 36 CO -0.06 -1.11 1.39 -1.81 -1.23 0.00 0.00 174.94 172.11 2d7m s ASP 37 N 2.79 6.32 -0.15 3.58 1.11 -0.44 -0.50 116.67 129.38 2d7m s ASP 37 Ca 0.18 -0.98 -0.00 0.00 0.18 0.00 0.00 52.55 51.93 2d7m s ASP 37 Cb -0.13 -2.56 0.03 0.00 1.07 0.00 0.00 42.92 41.33 2d7m s ASP 37 CO -0.06 -1.68 -0.08 0.00 1.18 0.00 0.00 175.17 174.53 2d7m s ALA 38 N 5.44 1.51 -0.18 5.23 0.00 -0.45 -2.30 121.76 131.01 2d7m s ALA 38 Ca 0.42 -0.77 -0.14 0.00 0.00 0.00 0.00 51.96 51.47 2d7m s ALA 38 Cb -0.04 -1.05 -0.07 0.00 0.00 0.00 0.00 23.12 21.96 2d7m s ALA 38 CO 0.02 -0.61 -0.22 0.54 0.00 0.00 0.00 175.76 175.49 2d7m n ARG 39 N 4.87 0.51 -1.20 0.00 3.00 -1.18 -3.70 116.66 118.96 2d7m n ARG 39 Ca -0.13 0.39 -0.27 0.00 -0.01 0.00 0.00 57.85 57.83 2d7m n ARG 39 Cb 0.49 -1.58 0.13 0.00 0.00 0.00 0.00 32.46 31.49 2d7m n ARG 39 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2d7m n ASP 40 N -4.50 5.42 0.30 0.55 8.00 -1.26 -4.53 116.55 120.52 2d7m n ASP 40 Ca -0.17 -3.58 0.17 0.00 0.71 0.00 0.00 54.79 51.92 2d7m n ASP 40 Cb 0.47 -0.89 0.91 0.00 -0.02 0.00 0.00 41.12 41.59 2d7m n ASP 40 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2d7m h ALA 41 N 1.46 1.21 0.00 2.24 0.00 -1.79 -3.31 119.26 119.08 2d7m h ALA 41 Ca 0.58 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.45 2d7m h ALA 41 Cb 1.88 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.66 2d7m h ALA 41 CO 1.23 0.05 0.00 0.41 0.00 0.00 0.00 179.25 180.95 2d7m n GLY 42 N -0.85 2.50 2.60 0.00 0.00 -1.26 -0.95 105.19 107.24 2d7m n GLY 42 Ca -0.02 -2.07 -0.38 0.00 0.00 0.00 0.00 46.02 43.55 2d7m n GLY 42 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2d7m n GLU 43 N -1.23 4.07 0.00 1.61 2.13 -1.17 -4.91 120.64 121.14 2d7m n GLU 43 Ca 0.00 -3.58 0.00 0.00 0.66 0.00 0.00 57.16 54.24 2d7m n GLU 43 Cb 0.00 -2.42 0.00 0.00 0.27 0.00 0.00 31.44 29.29 2d7m n GLU 43 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2d7m n GLY 44 N 0.64 5.93 3.31 8.31 0.00 -1.26 -4.96 105.19 117.16 2d7m n GLY 44 Ca 0.54 -1.59 -0.32 0.00 0.00 0.00 0.00 46.02 44.65 2d7m n GLY 44 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2d7m s LEU 45 N 0.00 2.39 0.35 0.99 0.05 -1.26 -4.84 118.68 116.36 2d7m s LEU 45 Ca 0.00 -0.43 -0.26 0.00 0.05 0.00 0.00 54.13 53.49 2d7m s LEU 45 Cb 0.00 -1.50 -0.09 0.00 -2.05 0.00 0.00 46.19 42.55 2d7m s LEU 45 CO 0.00 0.19 1.06 -0.22 -0.55 0.00 0.00 176.35 176.83 2d7m s LEU 46 N 0.18 4.30 -0.01 1.48 2.96 -1.26 -1.81 118.68 124.52 2d7m s LEU 46 Ca -0.11 2.11 0.03 0.00 -0.22 0.00 0.00 54.13 55.94 2d7m s LEU 46 Cb -0.16 -3.98 -0.00 0.00 0.50 0.00 0.00 46.19 42.55 2d7m s LEU 46 CO 0.06 -0.35 -0.09 0.42 -1.32 0.00 0.00 176.35 175.07 2d7m s THR 47 N -1.47 0.75 -0.02 3.68 -4.23 -0.24 -4.97 115.64 109.13 2d7m s THR 47 Ca 0.53 -0.39 0.02 0.00 -1.18 0.00 0.00 61.69 60.67 2d7m s THR 47 Cb -0.26 -0.64 0.00 0.00 1.34 0.00 0.00 72.50 72.95 2d7m s THR 47 CO 0.32 0.22 -0.07 -0.69 -0.54 0.00 0.00 174.62 173.86 2d7m s VAL 48 N -0.11 0.59 -0.01 2.29 1.01 -1.26 -1.77 120.40 121.14 2d7m s VAL 48 Ca 0.02 -0.26 -0.01 0.00 0.00 0.00 0.00 61.98 61.73 2d7m s VAL 48 Cb -0.05 -0.54 0.01 0.00 0.00 0.00 0.00 36.38 35.80 2d7m s VAL 48 CO -0.00 0.19 0.03 -1.58 0.00 0.00 0.00 175.10 173.74 2d7m s GLN 49 N 0.19 0.02 -0.06 2.72 2.00 -0.75 -4.83 119.66 118.95 2d7m s GLN 49 Ca -0.02 0.08 0.05 0.00 -2.00 0.00 0.00 55.36 53.47 2d7m s GLN 49 Cb -0.07 -0.05 -0.00 0.00 0.80 0.00 0.00 33.01 33.68 2d7m s GLN 49 CO 0.00 -0.05 -0.22 0.42 -0.50 0.00 0.00 175.29 174.95 2d7m s ILE 50 N 0.29 1.80 -0.25 -2.34 1.01 -1.26 -0.18 121.20 120.27 2d7m s ILE 50 Ca -0.02 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.72 2d7m s ILE 50 Cb -0.03 -1.54 0.04 0.00 0.01 0.00 0.00 42.46 40.94 2d7m s ILE 50 CO -0.01 0.50 -0.10 -0.76 0.00 0.00 0.00 174.94 174.58 2d7m s LEU 51 N 0.04 3.18 1.00 2.97 1.43 -0.54 -0.62 118.68 126.14 2d7m s LEU 51 Ca -0.07 -1.07 -0.19 0.00 -1.03 0.00 0.00 54.13 51.76 2d7m s LEU 51 Cb -0.14 -1.59 -0.14 0.00 0.03 0.00 0.00 46.19 44.34 2d7m s LEU 51 CO 0.04 -0.14 -0.90 -0.90 0.23 0.00 0.00 176.35 174.68 2d7m n ASP 52 N 4.57 -4.99 0.00 2.29 5.75 -0.52 -2.77 116.55 120.88 2d7m n ASP 52 Ca -0.16 0.14 0.03 0.00 -0.01 0.00 0.00 54.79 54.78 2d7m n ASP 52 Cb 0.45 -0.73 0.15 0.00 -1.03 0.00 0.00 41.12 39.96 2d7m n ASP 52 CO 0.00 0.00 0.00 -0.81 -0.11 0.00 0.00 177.20 176.28 2d7m n PRO 53 N 2.13 0.49 -0.08 0.11 -0.04 -1.26 -2.33 135.00 134.02 2d7m n PRO 53 Ca -0.01 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.36 2d7m n PRO 53 Cb 0.61 -1.16 -0.11 0.00 -0.04 0.00 0.00 33.50 32.80 2d7m n PRO 53 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2d7m n GLU 54 N -0.66 1.37 0.00 0.54 -0.58 -1.26 -4.89 120.64 115.16 2d7m n GLU 54 Ca 0.04 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.80 2d7m n GLU 54 Cb 0.02 -1.37 0.00 0.00 -0.57 0.00 0.00 31.44 29.52 2d7m n GLU 54 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2d7m n GLY 55 N 2.22 1.13 3.19 0.62 0.00 -0.98 -5.15 105.19 106.21 2d7m n GLY 55 Ca -0.26 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.59 2d7m n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d7m s LYS 56 N -0.01 0.88 0.21 1.61 -0.14 -1.26 -4.97 119.74 116.05 2d7m s LYS 56 Ca 0.00 -1.08 -0.30 0.00 -1.36 0.00 0.00 55.97 53.23 2d7m s LYS 56 Cb 0.00 -0.75 -0.09 0.00 -1.68 0.00 0.00 37.83 35.31 2d7m s LYS 56 CO 0.00 0.15 1.29 -1.25 -0.76 0.00 0.00 175.35 174.78 2d7m s PRO 57 N -2.28 4.40 0.46 -1.68 0.04 -1.26 -1.43 135.00 133.26 2d7m s PRO 57 Ca 0.03 2.04 0.05 0.00 0.04 0.00 0.00 61.00 63.16 2d7m s PRO 57 Cb -0.07 -3.19 0.05 0.00 0.04 0.00 0.00 34.50 31.33 2d7m s PRO 57 CO 0.02 -0.22 0.42 1.63 0.04 0.00 0.00 177.00 178.89 2d7m n LYS 58 N 2.43 0.78 -3.81 4.56 4.76 0.21 -4.86 118.16 122.24 2d7m n LYS 58 Ca 0.05 -2.81 -0.36 0.00 -2.87 0.00 0.00 58.31 52.32 2d7m n LYS 58 Cb 0.43 0.19 -0.13 0.00 -1.84 0.00 0.00 35.03 33.68 2d7m n LYS 58 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2d7m s LYS 59 N -3.95 3.38 0.12 1.97 2.20 -1.26 -4.72 119.74 117.47 2d7m s LYS 59 Ca 0.32 -0.65 0.08 0.00 -0.36 0.00 0.00 55.97 55.36 2d7m s LYS 59 Cb -0.03 -3.24 -0.04 0.00 -1.51 0.00 0.00 37.83 33.02 2d7m s LYS 59 CO 0.20 -0.27 -0.21 0.00 -0.36 0.00 0.00 175.35 174.71 2d7m s ALA 60 N 1.53 1.89 0.10 3.13 0.00 -1.26 -4.57 121.76 122.59 2d7m s ALA 60 Ca 0.05 -1.31 0.10 0.00 0.00 0.00 0.00 51.96 50.80 2d7m s ALA 60 Cb -0.15 -0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.68 2d7m s ALA 60 CO 0.01 0.36 -0.23 -0.80 0.00 0.00 0.00 175.76 175.10 2d7m s ASN 61 N -2.05 3.57 -0.01 0.00 0.01 -0.94 -5.03 114.94 110.50 2d7m s ASN 61 Ca 0.09 -0.62 0.04 0.00 -0.71 0.00 0.00 52.86 51.65 2d7m s ASN 61 Cb -0.09 -0.39 -0.01 0.00 0.41 0.00 0.00 41.25 41.16 2d7m s ASN 61 CO 0.05 0.20 -0.13 -0.63 -1.51 0.00 0.00 177.10 175.08 2d7m s ILE 62 N -1.05 0.99 0.01 0.60 1.01 -1.26 -2.69 121.20 118.81 2d7m s ILE 62 Ca 0.15 -0.54 0.04 0.00 0.00 0.00 0.00 60.65 60.30 2d7m s ILE 62 Cb -0.10 -0.83 -0.01 0.00 0.01 0.00 0.00 42.46 41.53 2d7m s ILE 62 CO 0.07 0.27 -0.12 -0.60 0.00 0.00 0.00 174.94 174.56 2d7m s ARG 63 N -0.31 0.90 -0.22 2.79 6.06 0.56 -5.01 118.95 123.73 2d7m s ARG 63 Ca 0.05 -0.55 -0.13 0.00 -2.50 0.00 0.00 55.73 52.60 2d7m s ARG 63 Cb -0.05 -0.88 -0.05 0.00 0.06 0.00 0.00 34.95 34.04 2d7m s ARG 63 CO -0.00 0.23 0.25 -0.51 -2.50 0.00 0.00 175.30 172.77 2d7m s ASP 64 N -0.66 6.26 -0.10 -2.12 1.01 -1.26 -2.02 116.67 117.78 2d7m s ASP 64 Ca 0.03 0.30 -0.02 0.00 0.71 0.00 0.00 52.55 53.57 2d7m s ASP 64 Cb -0.06 -2.15 -0.25 0.00 1.01 0.00 0.00 42.92 41.46 2d7m s ASP 64 CO 0.00 0.03 0.42 0.59 0.21 0.00 0.00 175.17 176.43 2d7m n ASN 65 N 4.22 1.80 0.00 0.27 3.02 -1.14 -4.98 115.26 118.45 2d7m n ASN 65 Ca -0.13 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.68 2d7m n ASN 65 Cb 0.52 -0.64 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 2d7m n ASN 65 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2d7m n GLY 66 N 1.89 2.99 1.34 7.41 0.00 -1.25 -4.84 105.19 112.73 2d7m n GLY 66 Ca -0.29 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.67 2d7m n GLY 66 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2d7m n ASP 67 N 0.25 3.36 -0.41 1.61 2.03 -1.26 -4.74 116.55 117.39 2d7m n ASP 67 Ca 0.00 -2.43 -0.04 0.00 0.52 0.00 0.00 54.79 52.84 2d7m n ASP 67 Cb 0.00 -0.62 -0.01 0.00 -0.72 0.00 0.00 41.12 39.78 2d7m n ASP 67 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2d7m n GLY 68 N 0.13 0.33 3.49 0.27 0.00 -1.26 -4.98 105.19 103.16 2d7m n GLY 68 Ca 0.15 -0.77 -0.12 0.00 0.00 0.00 0.00 46.02 45.29 2d7m n GLY 68 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2d7m s THR 69 N -2.18 0.00 0.12 2.61 -4.23 -1.24 -1.35 115.64 109.37 2d7m s THR 69 Ca 0.00 -1.58 -0.07 0.00 -1.18 0.00 0.00 61.69 58.86 2d7m s THR 69 Cb 0.00 -2.44 -0.01 0.00 1.34 0.00 0.00 72.50 71.39 2d7m s THR 69 CO 0.00 0.00 0.19 -0.31 -0.54 0.00 0.00 174.62 173.96 2d7m s TYR 70 N -3.62 0.35 -0.03 3.99 1.51 0.35 -2.89 117.35 117.01 2d7m s TYR 70 Ca 0.28 -0.76 0.02 0.00 -1.01 0.00 0.00 57.07 55.60 2d7m s TYR 70 Cb 0.01 -0.13 0.01 0.00 -0.11 0.00 0.00 41.96 41.73 2d7m s TYR 70 CO 0.14 -0.60 -0.08 0.99 -1.11 0.00 0.00 175.55 174.90 2d7m s THR 71 N -3.93 0.68 -0.05 -0.71 2.01 -0.85 -0.17 115.64 112.62 2d7m s THR 71 Ca 0.12 -0.29 0.02 0.00 0.31 0.00 0.00 61.69 61.84 2d7m s THR 71 Cb 0.05 -0.62 0.02 0.00 0.01 0.00 0.00 72.50 71.95 2d7m s THR 71 CO -0.05 0.22 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.34 2d7m s VAL 72 N 0.30 0.74 0.10 3.82 1.01 -1.01 -0.32 120.40 125.04 2d7m s VAL 72 Ca -0.04 -0.26 0.10 0.00 0.00 0.00 0.00 61.98 61.78 2d7m s VAL 72 Cb -0.09 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.55 2d7m s VAL 72 CO 0.00 0.26 -0.26 -0.94 0.00 0.00 0.00 175.10 174.16 2d7m s SER 73 N 0.71 3.18 0.21 3.32 1.04 -1.09 -0.51 113.70 120.54 2d7m s SER 73 Ca -0.11 -0.68 -0.21 0.00 0.48 0.00 0.00 55.95 55.43 2d7m s SER 73 Cb -0.14 -0.24 0.04 0.00 0.10 0.00 0.00 66.02 65.79 2d7m s SER 73 CO 0.01 0.20 0.61 -0.72 0.98 0.00 0.00 173.24 174.32 2d7m s TYR 74 N -0.97 -0.30 -0.33 5.02 1.13 0.99 -2.21 117.35 120.67 2d7m s TYR 74 Ca 0.12 -0.02 0.00 0.00 -1.41 0.00 0.00 57.07 55.77 2d7m s TYR 74 Cb -0.10 0.55 0.11 0.00 -1.10 0.00 0.00 41.96 41.42 2d7m s TYR 74 CO 0.04 -0.98 0.11 -1.17 -2.51 0.00 0.00 175.55 171.04 2d7m s LEU 75 N -2.84 2.66 -1.07 -3.49 2.96 -1.26 -0.30 118.68 115.34 2d7m s LEU 75 Ca 0.06 -1.87 -0.23 0.00 -0.22 0.00 0.00 54.13 51.87 2d7m s LEU 75 Cb -0.02 -1.00 -0.07 0.00 0.50 0.00 0.00 46.19 45.60 2d7m s LEU 75 CO -0.04 -0.39 1.94 -2.16 -1.32 0.00 0.00 176.35 174.38 2d7m s PRO 76 N 1.32 2.52 0.13 0.98 0.04 -1.26 -4.82 135.00 133.91 2d7m s PRO 76 Ca 0.11 -0.81 -0.30 0.00 0.04 0.00 0.00 61.00 60.04 2d7m s PRO 76 Cb -0.19 -5.17 -0.07 0.00 0.04 0.00 0.00 34.50 29.11 2d7m s PRO 76 CO -0.19 -3.73 1.58 0.22 0.04 0.00 0.00 177.00 174.92 2d7m h ASP 77 N 10.36 -1.31 -4.29 6.66 1.82 -1.96 -2.39 116.42 125.30 2d7m h ASP 77 Ca 0.17 0.16 -0.48 0.00 -0.39 0.00 0.00 57.03 56.50 2d7m h ASP 77 Cb 0.97 0.52 0.08 0.00 0.68 0.00 0.00 39.33 41.58 2d7m h ASP 77 CO 1.22 -0.45 0.35 -0.04 -1.61 0.00 0.00 179.24 178.71 2d7m s MET 78 N -5.89 2.50 0.11 0.28 -1.94 -1.26 -4.10 119.30 109.00 2d7m s MET 78 Ca -0.16 0.18 0.08 0.00 -1.71 0.00 0.00 55.69 54.08 2d7m s MET 78 Cb 0.09 -2.06 -0.04 0.00 2.01 0.00 0.00 34.83 34.83 2d7m s MET 78 CO 0.64 -1.18 -0.14 -1.12 -0.01 0.00 0.00 175.02 173.20 2d7m s SER 79 N -4.44 4.15 0.00 3.03 0.01 -1.26 -4.74 113.70 110.44 2d7m s SER 79 Ca 0.59 -0.46 0.00 0.00 1.31 0.00 0.00 55.95 57.39 2d7m s SER 79 Cb -0.11 -0.70 0.00 0.00 0.21 0.00 0.00 66.02 65.42 2d7m s SER 79 CO 0.49 0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.93 2d7m n GLY 80 N 0.78 0.88 3.57 3.44 0.00 -0.68 -4.81 105.19 108.36 2d7m n GLY 80 Ca -0.15 -1.90 -0.43 0.00 0.00 0.00 0.00 46.02 43.55 2d7m n GLY 80 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2d7m s ARG 81 N -1.71 3.54 0.17 1.61 3.52 -1.26 -0.30 118.95 124.52 2d7m s ARG 81 Ca 0.00 0.16 -0.11 0.00 -0.13 0.00 0.00 55.73 55.65 2d7m s ARG 81 Cb 0.00 -3.92 -0.07 0.00 -1.56 0.00 0.00 34.95 29.40 2d7m s ARG 81 CO 0.00 -1.19 0.51 0.71 -0.81 0.00 0.00 175.30 174.52 2d7m s TYR 82 N 3.68 3.51 -0.37 5.12 1.51 0.47 -4.12 117.35 127.16 2d7m s TYR 82 Ca 0.36 0.90 -0.06 0.00 -1.01 0.00 0.00 57.07 57.26 2d7m s TYR 82 Cb -0.10 -2.26 0.07 0.00 -0.11 0.00 0.00 41.96 39.55 2d7m s TYR 82 CO 0.25 0.38 0.15 0.99 -1.11 0.00 0.00 175.55 176.21 2d7m s THR 83 N -1.62 3.72 -0.26 -0.71 2.01 -1.12 -3.01 115.64 114.66 2d7m s THR 83 Ca 0.41 -1.41 -0.11 0.00 0.31 0.00 0.00 61.69 60.90 2d7m s THR 83 Cb -0.13 -3.24 -0.05 0.00 0.01 0.00 0.00 72.50 69.09 2d7m s THR 83 CO 0.20 -0.36 0.17 -0.63 -0.69 0.00 0.00 174.62 173.31 2d7m s ILE 84 N 1.34 5.29 -0.35 1.82 1.01 -1.04 -1.47 121.20 127.81 2d7m s ILE 84 Ca 0.01 0.16 -0.05 0.00 0.00 0.00 0.00 60.65 60.77 2d7m s ILE 84 Cb -0.21 -3.49 0.06 0.00 0.01 0.00 0.00 42.46 38.82 2d7m s ILE 84 CO 0.01 0.30 0.11 -0.89 0.00 0.00 0.00 174.94 174.47 2d7m s THR 85 N 1.39 3.58 -0.23 2.92 2.01 0.75 -1.12 115.64 124.94 2d7m s THR 85 Ca 0.07 -1.35 -0.06 0.00 0.31 0.00 0.00 61.69 60.66 2d7m s THR 85 Cb -0.15 -3.11 -0.02 0.00 0.01 0.00 0.00 72.50 69.23 2d7m s THR 85 CO 0.07 -0.27 0.02 -0.63 -0.69 0.00 0.00 174.62 173.13 2d7m s ILE 86 N 1.33 4.01 -0.03 1.82 1.01 -1.26 -1.81 121.20 126.27 2d7m s ILE 86 Ca -0.01 -0.28 0.03 0.00 0.00 0.00 0.00 60.65 60.40 2d7m s ILE 86 Cb -0.20 -2.84 -0.00 0.00 0.01 0.00 0.00 42.46 39.42 2d7m s ILE 86 CO 0.01 0.39 -0.13 -0.54 0.00 0.00 0.00 174.94 174.66 2d7m s LYS 87 N 1.36 1.38 -0.24 2.79 1.02 -0.73 -2.71 119.74 122.62 2d7m s LYS 87 Ca 0.05 -0.46 -0.08 0.00 0.02 0.00 0.00 55.97 55.50 2d7m s LYS 87 Cb -0.15 -1.24 -0.03 0.00 -0.52 0.00 0.00 37.83 35.89 2d7m s LYS 87 CO 0.02 0.18 0.08 -0.47 -0.92 0.00 0.00 175.35 174.23 2d7m s TYR 88 N 0.11 3.11 -1.26 3.18 5.04 0.45 -1.08 117.35 126.91 2d7m s TYR 88 Ca -0.03 -0.33 -0.16 0.00 -2.44 0.00 0.00 57.07 54.11 2d7m s TYR 88 Cb -0.10 -2.23 0.16 0.00 0.35 0.00 0.00 41.96 40.14 2d7m s TYR 88 CO 0.01 -0.29 0.40 0.41 -1.34 0.00 0.00 175.55 174.74 2d7m n GLY 89 N 4.78 -0.37 1.02 8.97 0.00 -0.75 0.49 105.19 119.32 2d7m n GLY 89 Ca -0.16 0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2d7m n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d7m n GLY 90 N -0.86 0.90 2.86 -0.02 0.00 -1.26 -4.94 105.19 101.87 2d7m n GLY 90 Ca 0.08 -0.46 -0.12 0.00 0.00 0.00 0.00 46.02 45.51 2d7m n GLY 90 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2d7m s ASP 91 N -2.67 0.76 0.01 1.61 2.15 0.18 -5.13 116.67 113.58 2d7m s ASP 91 Ca 0.00 -0.21 -0.30 0.00 0.43 0.00 0.00 52.55 52.47 2d7m s ASP 91 Cb 0.00 0.88 -0.06 0.00 -0.30 0.00 0.00 42.92 43.43 2d7m s ASP 91 CO 0.00 -0.34 1.54 -0.70 -0.17 0.00 0.00 175.17 175.50 2d7m s GLU 92 N 2.47 4.23 0.73 4.34 2.12 -1.26 -0.41 118.70 130.92 2d7m s GLU 92 Ca 0.10 2.14 -0.16 0.00 0.36 0.00 0.00 54.97 57.42 2d7m s GLU 92 Cb -0.14 -3.66 0.03 0.00 0.26 0.00 0.00 34.13 30.61 2d7m s GLU 92 CO -0.23 -0.69 1.21 0.44 -0.54 0.00 0.00 175.26 175.45 2d7m n ILE 93 N 4.85 3.43 0.98 -3.70 -5.35 -1.10 -4.85 119.36 113.62 2d7m n ILE 93 Ca 0.15 -0.36 0.05 0.00 -0.27 0.00 0.00 62.75 62.32 2d7m n ILE 93 Cb 0.42 -1.31 0.30 0.00 -1.74 0.00 0.00 39.64 37.31 2d7m n ILE 93 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 2d7m n PRO 94 N -2.46 0.49 -0.00 6.28 -0.04 -1.26 -1.83 135.00 136.18 2d7m n PRO 94 Ca 0.15 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.66 2d7m n PRO 94 Cb 0.49 -1.32 -0.08 0.00 -0.04 0.00 0.00 33.50 32.55 2d7m n PRO 94 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2d7m n TYR 95 N -0.82 0.00 -3.68 0.54 4.02 -1.26 -5.00 117.16 110.96 2d7m n TYR 95 Ca 0.08 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.68 2d7m n TYR 95 Cb 0.03 -0.09 -0.03 0.00 -0.02 0.00 0.00 39.34 39.24 2d7m n TYR 95 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2d7m s SER 96 N -2.54 6.40 0.38 7.72 0.15 -0.76 -3.72 113.70 121.34 2d7m s SER 96 Ca 0.02 0.44 -0.26 0.00 0.70 0.00 0.00 55.95 56.84 2d7m s SER 96 Cb 0.09 -2.02 -0.09 0.00 -1.71 0.00 0.00 66.02 62.29 2d7m s SER 96 CO 0.51 -0.03 1.20 -2.16 1.20 0.00 0.00 173.24 173.96 2d7m s PRO 97 N -3.22 4.12 -0.02 5.44 0.04 -1.26 -4.86 135.00 135.25 2d7m s PRO 97 Ca 0.39 1.92 -0.24 0.00 0.04 0.00 0.00 61.00 63.10 2d7m s PRO 97 Cb -0.11 -2.77 -0.04 0.00 0.04 0.00 0.00 34.50 31.61 2d7m s PRO 97 CO 0.28 -0.29 0.75 -0.06 0.04 0.00 0.00 177.00 177.73 2d7m s PHE 98 N -1.34 3.65 -0.26 0.56 0.08 -0.28 -4.93 117.98 115.47 2d7m s PHE 98 Ca 0.55 1.37 -0.11 0.00 0.12 0.00 0.00 56.93 58.87 2d7m s PHE 98 Cb -0.33 -2.83 -0.05 0.00 -0.57 0.00 0.00 43.02 39.24 2d7m s PHE 98 CO 0.42 0.16 0.18 -0.98 -0.10 0.00 0.00 175.22 174.90 2d7m s ARG 99 N 0.46 4.02 0.01 0.44 3.03 -1.26 -2.48 118.95 123.17 2d7m s ARG 99 Ca 0.39 -0.28 0.03 0.00 2.03 0.00 0.00 55.73 57.90 2d7m s ARG 99 Cb -0.19 -3.59 -0.01 0.00 -1.03 0.00 0.00 34.95 30.13 2d7m s ARG 99 CO 0.21 -0.04 -0.09 0.42 -1.13 0.00 0.00 175.30 174.66 2d7m s ILE 100 N 1.35 0.73 -0.14 4.99 -1.09 -1.17 -4.78 121.20 121.10 2d7m s ILE 100 Ca 0.08 -0.65 -0.02 0.00 -2.23 0.00 0.00 60.65 57.83 2d7m s ILE 100 Cb -0.15 -0.66 -0.02 0.00 -1.58 0.00 0.00 42.46 40.06 2d7m s ILE 100 CO 0.07 0.02 -0.09 -2.28 -1.23 0.00 0.00 174.94 171.43 2d7m s HIS 101 N -0.59 2.91 -0.28 3.97 2.46 -1.26 -0.39 115.29 122.10 2d7m s HIS 101 Ca 0.00 -0.48 -0.06 0.00 0.47 0.00 0.00 55.06 54.99 2d7m s HIS 101 Cb -0.06 -1.89 0.01 0.00 -0.13 0.00 0.00 32.58 30.52 2d7m s HIS 101 CO 0.00 -0.12 0.05 0.00 -2.47 0.00 0.00 174.74 172.20 2d7m s ALA 102 N 0.33 2.99 0.08 1.58 0.00 0.58 -0.64 121.76 126.68 2d7m s ALA 102 Ca -0.08 -1.44 -0.18 0.00 0.00 0.00 0.00 51.96 50.26 2d7m s ALA 102 Cb -0.15 -2.05 -0.07 0.00 0.00 0.00 0.00 23.12 20.85 2d7m s ALA 102 CO 0.04 -0.89 0.55 -0.51 0.00 0.00 0.00 175.76 174.95 2d7m s LEU 103 N 1.47 4.48 -0.65 0.00 1.43 -0.08 -1.69 118.68 123.65 2d7m s LEU 103 Ca 0.02 1.19 -0.26 0.00 -1.03 0.00 0.00 54.13 54.05 2d7m s LEU 103 Cb -0.17 -2.94 -0.02 0.00 0.03 0.00 0.00 46.19 43.09 2d7m s LEU 103 CO 0.01 0.25 1.87 -2.16 0.23 0.00 0.00 176.35 176.55 2d7m s PRO 104 N -1.29 2.61 0.10 1.29 0.04 -1.26 -1.13 135.00 135.37 2d7m s PRO 104 Ca 0.30 0.50 -0.15 0.00 0.04 0.00 0.00 61.00 61.69 2d7m s PRO 104 Cb -0.18 -4.47 -0.08 0.00 0.04 0.00 0.00 34.50 29.81 2d7m s PRO 104 CO 0.18 -2.81 1.44 0.00 0.04 0.00 0.00 177.00 175.85 2d7m h THR 105 N 6.93 1.30 0.00 1.26 1.03 -1.91 -3.47 112.91 118.04 2d7m h THR 105 Ca -0.22 -1.35 0.00 0.00 -0.01 0.00 0.00 66.41 64.83 2d7m h THR 105 Cb 1.14 1.53 0.00 0.00 -1.07 0.00 0.00 68.15 69.75 2d7m h THR 105 CO 1.22 0.43 0.00 0.61 -0.01 0.00 0.00 175.52 177.77 2d7m n GLY 106 N 0.06 2.11 0.26 2.99 0.00 -1.26 -4.84 105.19 104.51 2d7m n GLY 106 Ca -0.03 -0.40 0.20 0.00 0.00 0.00 0.00 46.02 45.78 2d7m n GLY 106 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2d7m n ASP 107 N 1.42 0.14 -4.18 1.61 -0.08 -1.26 -3.13 116.55 111.06 2d7m n ASP 107 Ca 0.00 1.30 -0.37 0.00 -1.51 0.00 0.00 54.79 54.20 2d7m n ASP 107 Cb 0.00 -0.57 -0.11 0.00 2.34 0.00 0.00 41.12 42.77 2d7m n ASP 107 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2d7m s ALA 108 N -5.37 3.14 -0.03 -1.67 0.00 -1.26 -4.97 121.76 111.59 2d7m s ALA 108 Ca -0.08 -2.27 -0.21 0.00 0.00 0.00 0.00 51.96 49.41 2d7m s ALA 108 Cb 0.25 -2.40 -0.14 0.00 0.00 0.00 0.00 23.12 20.83 2d7m s ALA 108 CO 0.60 -1.65 0.90 0.77 0.00 0.00 0.00 175.76 176.38 2d7m h SER 109 N 8.16 -0.33 0.30 0.00 0.02 -1.94 -3.37 113.55 116.39 2d7m h SER 109 Ca -0.18 -0.19 -0.33 0.00 -0.84 0.00 0.00 61.79 60.25 2d7m h SER 109 Cb 1.06 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.67 2d7m h SER 109 CO 0.69 0.13 -1.76 0.28 -1.14 0.00 0.00 176.83 175.04 2d7m h SER 110 N -0.94 0.37 -3.30 3.07 0.02 -1.93 -3.51 113.55 107.34 2d7m h SER 110 Ca -0.04 -0.66 0.00 0.00 -0.84 0.00 0.00 61.79 60.25 2d7m h SER 110 Cb 0.50 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.92 2d7m h SER 110 CO 0.07 1.57 0.00 0.61 -1.14 0.00 0.00 176.83 177.94 2d7m n GLY 111 N 1.79 2.74 3.59 -3.77 0.00 -1.26 -5.06 105.19 103.22 2d7m n GLY 111 Ca -0.23 -1.65 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 2d7m n GLY 111 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d7m s PRO 112 N -1.90 3.18 0.06 1.61 0.04 -1.26 -4.94 135.00 131.79 2d7m s PRO 112 Ca 0.00 1.10 -0.30 0.00 0.04 0.00 0.00 61.00 61.84 2d7m s PRO 112 Cb 0.00 -4.22 -0.09 0.00 0.04 0.00 0.00 34.50 30.23 2d7m s PRO 112 CO 0.00 -2.05 1.92 -1.54 0.04 0.00 0.00 177.00 175.37 2d7m s SER 113 N 6.27 6.44 -0.60 6.66 1.04 -1.26 -4.91 113.70 127.34 2d7m s SER 113 Ca 0.73 2.70 -0.28 0.00 0.48 0.00 0.00 55.95 59.58 2d7m s SER 113 Cb -0.18 -2.54 0.02 0.00 0.10 0.00 0.00 66.02 63.42 2d7m s SER 113 CO 0.30 -1.04 1.31 -0.55 0.98 0.00 0.00 173.24 174.24 2d7m s SER 114 N 3.88 6.25 0.00 7.02 0.15 -1.26 -5.24 113.70 124.49 2d7m s SER 114 Ca 0.86 0.08 0.00 0.00 0.70 0.00 0.00 55.95 57.59 2d7m s SER 114 Cb -0.44 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.32 2d7m s SER 114 CO 0.40 -1.65 0.00 0.61 1.20 0.00 0.00 173.24 173.80