#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 5.38 0.18 1.61 0.15 -1.26 -5.08 113.70 114.69 2d7m s SER 2 Ca 0.00 -1.53 0.10 0.00 0.70 0.00 0.00 55.95 55.22 2d7m s SER 2 Cb 0.00 -1.89 -0.04 0.00 -1.71 0.00 0.00 66.02 62.38 2d7m s SER 2 CO 0.00 -0.46 -0.21 -0.94 1.20 0.00 0.00 173.24 172.83 2d7m s SER 3 N 1.79 3.09 -0.93 5.45 1.04 -1.26 -4.85 113.70 118.04 2d7m s SER 3 Ca 0.02 -0.87 -0.06 0.00 0.48 0.00 0.00 55.95 55.52 2d7m s SER 3 Cb -0.22 -0.21 -0.03 0.00 0.10 0.00 0.00 66.02 65.66 2d7m s SER 3 CO 0.00 0.05 0.79 0.61 0.98 0.00 0.00 173.24 175.67 2d7m n GLY 4 N 0.23 -1.18 4.00 7.32 0.00 -1.26 -5.02 105.19 109.29 2d7m n GLY 4 Ca -0.12 0.52 -0.22 0.00 0.00 0.00 0.00 46.02 46.20 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 -3.22 4.60 -1.13 1.61 0.15 -1.26 -5.03 113.70 109.41 2d7m s SER 5 Ca 0.25 -0.48 -0.09 0.00 0.70 0.00 0.00 55.95 56.33 2d7m s SER 5 Cb -0.05 0.03 0.27 0.00 -1.71 0.00 0.00 66.02 64.55 2d7m s SER 5 CO 0.78 -1.68 1.25 -0.24 1.20 0.00 0.00 173.24 174.54 2d7m n SER 6 N -2.64 5.62 -3.05 5.45 2.88 -1.26 -4.92 113.62 115.69 2d7m n SER 6 Ca 0.15 -3.09 0.00 0.00 -1.33 0.00 0.00 58.87 54.60 2d7m n SER 6 Cb 0.61 -1.39 0.00 0.00 -0.75 0.00 0.00 64.21 62.67 2d7m n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d7m n GLY 7 N 2.66 -0.23 2.94 0.46 0.00 -1.26 -4.94 105.19 104.81 2d7m n GLY 7 Ca 0.27 -1.55 -0.43 0.00 0.00 0.00 0.00 46.02 44.31 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 -3.00 5.33 -3.09 4.61 0.00 -1.26 -4.95 120.51 118.15 2d7m n ALA 8 Ca 0.00 -4.72 -0.13 0.00 0.00 0.00 0.00 53.44 48.60 2d7m n ALA 8 Cb 0.00 -2.42 -0.12 0.00 0.00 0.00 0.00 19.45 16.91 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 -2.54 -0.22 -0.36 0.00 -0.00 -1.26 -3.16 115.29 107.76 2d7m s HIS 9 Ca 0.33 0.53 0.03 0.00 -0.00 0.00 0.00 55.06 55.95 2d7m s HIS 9 Cb 0.07 0.07 0.10 0.00 -0.00 0.00 0.00 32.58 32.83 2d7m s HIS 9 CO 0.07 -0.12 0.09 -0.51 -0.00 0.00 0.00 174.74 174.28 2d7m s ASP 10 N 0.04 4.50 0.37 7.38 1.11 0.28 -4.89 116.67 125.46 2d7m s ASP 10 Ca -0.01 -2.15 0.05 0.00 0.18 0.00 0.00 52.55 50.62 2d7m s ASP 10 Cb -0.02 -1.42 0.71 0.00 1.07 0.00 0.00 42.92 43.26 2d7m s ASP 10 CO 0.00 -0.37 1.97 0.00 1.18 0.00 0.00 175.17 177.96 2d7m h ALA 11 N 7.56 1.53 0.00 5.23 0.00 -1.84 -1.61 119.26 130.13 2d7m h ALA 11 Ca -0.06 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2d7m h ALA 11 Cb 1.00 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2d7m h ALA 11 CO 0.52 0.37 0.18 -1.13 0.00 0.00 0.00 179.25 179.19 2d7m n SER 12 N -4.38 0.38 -1.84 0.00 3.41 -1.26 0.10 113.62 110.02 2d7m n SER 12 Ca 0.03 0.61 -0.05 0.00 -0.26 0.00 0.00 58.87 59.20 2d7m n SER 12 Cb 0.14 -0.60 0.27 0.00 -0.26 0.00 0.00 64.21 63.76 2d7m n SER 12 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2d7m n LYS 13 N -2.05 3.43 -4.22 4.33 4.76 -0.60 -4.89 118.16 118.92 2d7m n LYS 13 Ca -0.01 -2.65 -0.34 0.00 -2.87 0.00 0.00 58.31 52.44 2d7m n LYS 13 Cb 0.20 -2.10 -0.12 0.00 -1.84 0.00 0.00 35.03 31.17 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 -2.63 3.97 0.25 -0.18 1.01 0.11 -4.21 120.40 118.73 2d7m s VAL 14 Ca 0.48 -0.32 -0.07 0.00 0.00 0.00 0.00 61.98 62.06 2d7m s VAL 14 Cb 0.38 -2.77 -0.06 0.00 0.00 0.00 0.00 36.38 33.93 2d7m s VAL 14 CO 0.12 0.46 0.54 -0.60 0.00 0.00 0.00 175.10 175.62 2d7m s ARG 15 N 0.68 3.72 -0.12 2.72 6.06 -0.76 -5.00 118.95 126.25 2d7m s ARG 15 Ca -0.01 0.15 -0.04 0.00 -2.50 0.00 0.00 55.73 53.34 2d7m s ARG 15 Cb -0.14 -2.65 0.05 0.00 0.06 0.00 0.00 34.95 32.27 2d7m s ARG 15 CO 0.02 0.28 0.11 0.00 -2.50 0.00 0.00 175.30 173.20 2d7m s ALA 16 N -1.93 0.19 -0.10 6.12 0.00 -1.26 -3.09 121.76 121.69 2d7m s ALA 16 Ca 0.46 0.06 -0.21 0.00 0.00 0.00 0.00 51.96 52.26 2d7m s ALA 16 Cb -0.11 -0.89 0.05 0.00 0.00 0.00 0.00 23.12 22.17 2d7m s ALA 16 CO 0.25 -0.85 0.52 0.45 0.00 0.00 0.00 175.76 176.12 2d7m s SER 17 N 2.20 -0.49 0.00 0.00 0.15 -1.14 -5.05 113.70 109.37 2d7m s SER 17 Ca 0.04 0.69 0.00 0.00 0.70 0.00 0.00 55.95 57.38 2d7m s SER 17 Cb -0.14 0.71 0.00 0.00 -1.71 0.00 0.00 66.02 64.88 2d7m s SER 17 CO -0.07 -0.38 0.00 0.61 1.20 0.00 0.00 173.24 174.60 2d7m n GLY 18 N 1.81 -0.09 0.26 9.45 0.00 -1.26 -1.76 105.19 113.59 2d7m n GLY 18 Ca -0.17 -1.72 -0.13 0.00 0.00 0.00 0.00 46.02 43.99 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 4.53 0.90 -0.05 1.61 0.13 -1.97 -3.10 132.00 134.05 2d7m h PRO 19 Ca 0.00 -0.48 -0.03 0.00 -0.87 0.00 0.00 66.00 64.62 2d7m h PRO 19 Cb 0.00 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.14 2d7m h PRO 19 CO 0.00 1.13 -0.13 0.78 -0.23 0.00 0.00 178.00 179.55 2d7m h GLY 20 N 0.71 0.08 -3.72 1.56 0.00 -1.88 -2.10 103.07 97.73 2d7m h GLY 20 Ca 0.06 -0.04 -0.45 0.00 0.00 0.00 0.00 47.33 46.89 2d7m h GLY 20 CO 0.09 0.04 0.57 1.04 0.00 0.00 0.00 176.54 178.29 2d7m n LEU 21 N -4.34 6.26 -4.65 3.11 4.77 -1.18 -4.95 117.00 116.02 2d7m n LEU 21 Ca -0.02 -3.34 -0.43 0.00 -0.03 0.00 0.00 56.01 52.20 2d7m n LEU 21 Cb 0.22 -0.80 -0.02 0.00 -2.33 0.00 0.00 43.42 40.49 2d7m n LEU 21 CO 0.36 0.99 1.11 0.21 -1.33 0.00 0.00 177.39 178.73 2d7m s ASN 22 N -0.98 6.87 0.26 -1.43 2.47 -0.79 -4.78 114.94 116.56 2d7m s ASN 22 Ca 0.49 1.63 0.14 0.00 0.42 0.00 0.00 52.86 55.54 2d7m s ASN 22 Cb 0.41 -2.54 0.08 0.00 -1.45 0.00 0.00 41.25 37.76 2d7m s ASN 22 CO 0.09 -0.84 1.45 0.00 -3.72 0.00 0.00 177.10 174.08 2d7m h ALA 23 N 8.51 0.65 0.00 1.71 0.00 -1.90 -3.18 119.26 125.04 2d7m h ALA 23 Ca -0.27 -0.53 -0.05 0.00 0.00 0.00 0.00 54.91 54.07 2d7m h ALA 23 Cb 1.11 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 2d7m h ALA 23 CO 0.98 0.72 -0.22 1.03 0.00 0.00 0.00 179.25 181.77 2d7m h SER 24 N 0.00 0.00 0.00 0.00 0.87 -1.93 -3.43 113.55 109.05 2d7m h SER 24 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 2d7m h SER 24 Cb 1.40 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.36 2d7m h SER 24 CO 0.08 0.22 0.00 0.61 -0.53 0.00 0.00 176.83 177.20 2d7m n GLY 25 N 0.13 4.04 3.56 5.77 0.00 -1.20 -4.98 105.19 112.52 2d7m n GLY 25 Ca 0.00 -1.24 -0.32 0.00 0.00 0.00 0.00 46.02 44.47 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 -0.59 3.44 -0.41 -0.61 -4.36 0.71 -4.89 121.20 114.48 2d7m s ILE 26 Ca 0.00 -0.90 -0.28 0.00 -0.26 0.00 0.00 60.65 59.21 2d7m s ILE 26 Cb 0.00 -2.49 -0.01 0.00 1.25 0.00 0.00 42.46 41.20 2d7m s ILE 26 CO 0.00 0.36 1.73 -2.16 0.24 0.00 0.00 174.94 175.11 2d7m s PRO 27 N -1.48 3.22 1.34 0.37 0.04 -1.26 -0.29 135.00 136.94 2d7m s PRO 27 Ca 0.17 1.13 -0.20 0.00 0.04 0.00 0.00 61.00 62.14 2d7m s PRO 27 Cb -0.11 -4.21 0.33 0.00 0.04 0.00 0.00 34.50 30.55 2d7m s PRO 27 CO 0.08 -2.00 0.82 0.00 0.04 0.00 0.00 177.00 175.93 2d7m n ALA 28 N 10.56 -4.14 -3.86 8.56 0.00 0.55 -3.81 120.51 128.37 2d7m n ALA 28 Ca 0.21 -1.64 -0.29 0.00 0.00 0.00 0.00 53.44 51.72 2d7m n ALA 28 Cb 0.48 -1.63 0.03 0.00 0.00 0.00 0.00 19.45 18.33 2d7m n ALA 28 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2d7m n SER 29 N -4.95 -4.47 -3.65 0.00 7.64 -1.07 -4.43 113.62 102.69 2d7m n SER 29 Ca 0.09 -0.76 -0.12 0.00 1.01 0.00 0.00 58.87 59.08 2d7m n SER 29 Cb 0.56 -4.00 -0.08 0.00 -1.01 0.00 0.00 64.21 59.68 2d7m n SER 29 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2d7m s LEU 30 N -7.21 -0.55 -0.56 -3.43 2.96 -1.25 -4.52 118.68 104.12 2d7m s LEU 30 Ca 0.57 1.32 -0.27 0.00 -0.22 0.00 0.00 54.13 55.53 2d7m s LEU 30 Cb -0.28 2.19 -0.02 0.00 0.50 0.00 0.00 46.19 48.58 2d7m s LEU 30 CO 0.82 -0.23 1.83 -2.16 -1.32 0.00 0.00 176.35 175.29 2d7m s PRO 31 N 0.71 2.78 -0.04 0.98 0.04 -1.26 -4.25 135.00 133.96 2d7m s PRO 31 Ca -0.03 0.75 -0.00 0.00 0.04 0.00 0.00 61.00 61.76 2d7m s PRO 31 Cb -0.05 -4.34 -0.03 0.00 0.04 0.00 0.00 34.50 30.12 2d7m s PRO 31 CO -0.05 -2.54 0.01 0.54 0.04 0.00 0.00 177.00 175.00 2d7m s VAL 32 N 8.56 4.27 0.01 -0.36 0.11 -0.13 -4.91 120.40 127.95 2d7m s VAL 32 Ca 0.69 -0.44 0.00 0.00 -2.93 0.00 0.00 61.98 59.31 2d7m s VAL 32 Cb -0.14 -2.86 -0.01 0.00 -1.53 0.00 0.00 36.38 31.83 2d7m s VAL 32 CO 0.23 0.47 -0.02 -1.83 -3.33 0.00 0.00 175.10 170.62 2d7m s GLU 33 N -1.29 0.19 0.41 1.54 4.04 -1.26 -0.12 118.70 122.20 2d7m s GLU 33 Ca 0.17 -0.31 0.02 0.00 0.04 0.00 0.00 54.97 54.89 2d7m s GLU 33 Cb -0.11 -0.00 0.02 0.00 0.02 0.00 0.00 34.13 34.05 2d7m s GLU 33 CO 0.07 -0.01 0.16 1.97 -1.84 0.00 0.00 175.26 175.61 2d7m n PHE 34 N 2.36 0.06 -4.04 4.83 -1.74 0.20 -3.79 117.46 115.35 2d7m n PHE 34 Ca -0.18 -1.86 -0.26 0.00 -0.56 0.00 0.00 57.45 54.59 2d7m n PHE 34 Cb 0.57 -0.30 -0.17 0.00 1.52 0.00 0.00 39.48 41.11 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 -2.25 1.00 -0.80 1.97 2.01 -0.72 -2.43 115.64 114.41 2d7m s THR 35 Ca 0.12 -0.30 -0.09 0.00 0.31 0.00 0.00 61.69 61.73 2d7m s THR 35 Cb -0.01 -1.00 0.21 0.00 0.01 0.00 0.00 72.50 71.71 2d7m s THR 35 CO 0.07 0.35 0.71 -0.63 -0.69 0.00 0.00 174.62 174.44 2d7m s ILE 36 N 1.49 4.95 -0.68 1.82 -1.09 0.11 -2.89 121.20 124.91 2d7m s ILE 36 Ca 0.01 -2.87 -0.27 0.00 -2.23 0.00 0.00 60.65 55.29 2d7m s ILE 36 Cb -0.13 -4.09 0.04 0.00 -1.58 0.00 0.00 42.46 36.70 2d7m s ILE 36 CO -0.06 -1.01 1.20 -1.81 -1.23 0.00 0.00 174.94 172.04 2d7m s ASP 37 N 1.37 6.23 -0.15 3.58 1.01 -1.18 -0.28 116.67 127.25 2d7m s ASP 37 Ca 0.20 -0.39 -0.00 0.00 0.71 0.00 0.00 52.55 53.06 2d7m s ASP 37 Cb -0.13 -2.53 0.03 0.00 1.01 0.00 0.00 42.92 41.30 2d7m s ASP 37 CO -0.07 -1.68 -0.07 0.00 0.21 0.00 0.00 175.17 173.55 2d7m s ALA 38 N 5.26 1.53 -0.18 5.23 0.00 0.26 -1.83 121.76 132.03 2d7m s ALA 38 Ca 0.35 -0.80 -0.14 0.00 0.00 0.00 0.00 51.96 51.37 2d7m s ALA 38 Cb -0.09 -1.07 -0.07 0.00 0.00 0.00 0.00 23.12 21.88 2d7m s ALA 38 CO 0.17 -0.64 -0.21 0.54 0.00 0.00 0.00 175.76 175.61 2d7m n ARG 39 N 4.86 0.51 -1.27 0.00 3.00 -1.16 -3.82 116.66 118.78 2d7m n ARG 39 Ca -0.13 0.39 -0.28 0.00 -0.01 0.00 0.00 57.85 57.82 2d7m n ARG 39 Cb 0.48 -1.59 0.14 0.00 0.00 0.00 0.00 32.46 31.50 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 5.39 0.29 0.55 9.92 -1.26 -4.52 116.55 122.42 2d7m n ASP 40 Ca -0.17 -3.69 0.19 0.00 -0.53 0.00 0.00 54.79 50.58 2d7m n ASP 40 Cb 0.47 -0.89 0.82 0.00 -0.64 0.00 0.00 41.12 40.88 2d7m n ASP 40 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2d7m h ALA 41 N 1.42 1.00 0.00 2.24 0.00 -1.74 -3.35 119.26 118.83 2d7m h ALA 41 Ca 0.62 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.53 2d7m h ALA 41 Cb 1.99 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.78 2d7m h ALA 41 CO 1.30 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.96 2d7m n GLY 42 N -0.24 1.84 3.03 0.00 0.00 -1.26 -0.55 105.19 108.00 2d7m n GLY 42 Ca -0.00 -2.15 -0.42 0.00 0.00 0.00 0.00 46.02 43.45 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 -1.22 4.02 0.00 1.61 2.13 -1.19 -4.95 120.64 121.05 2d7m n GLU 43 Ca 0.00 -4.54 0.00 0.00 0.66 0.00 0.00 57.16 53.28 2d7m n GLU 43 Cb 0.00 -2.49 0.00 0.00 0.27 0.00 0.00 31.44 29.22 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 1.62 4.31 3.29 8.31 0.00 -1.26 -4.98 105.19 116.48 2d7m n GLY 44 Ca 0.26 -0.91 -0.31 0.00 0.00 0.00 0.00 46.02 45.05 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 2.11 0.20 0.99 0.05 -1.26 -4.86 118.68 115.91 2d7m s LEU 45 Ca 0.00 -0.48 -0.28 0.00 0.05 0.00 0.00 54.13 53.42 2d7m s LEU 45 Cb 0.00 -1.38 -0.08 0.00 -2.05 0.00 0.00 46.19 42.67 2d7m s LEU 45 CO 0.00 0.26 0.86 -0.22 -0.55 0.00 0.00 176.35 176.70 2d7m s LEU 46 N -0.26 4.62 0.02 1.48 2.96 -1.26 -1.05 118.68 125.19 2d7m s LEU 46 Ca -0.01 1.80 0.06 0.00 -0.22 0.00 0.00 54.13 55.76 2d7m s LEU 46 Cb -0.13 -3.46 -0.02 0.00 0.50 0.00 0.00 46.19 43.08 2d7m s LEU 46 CO 0.03 0.18 -0.17 0.42 -1.32 0.00 0.00 176.35 175.49 2d7m s THR 47 N -1.13 1.34 -0.02 3.68 -4.23 0.03 -4.98 115.64 110.34 2d7m s THR 47 Ca 0.39 -0.96 0.01 0.00 -1.18 0.00 0.00 61.69 59.95 2d7m s THR 47 Cb -0.25 -1.17 0.01 0.00 1.34 0.00 0.00 72.50 72.44 2d7m s THR 47 CO 0.29 0.19 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.85 2d7m s VAL 48 N -0.68 0.26 -0.01 2.29 1.01 -1.26 -1.82 120.40 120.19 2d7m s VAL 48 Ca 0.05 -0.06 0.01 0.00 0.00 0.00 0.00 61.98 61.98 2d7m s VAL 48 Cb -0.08 -0.27 0.01 0.00 0.00 0.00 0.00 36.38 36.04 2d7m s VAL 48 CO 0.01 0.11 -0.01 -1.58 0.00 0.00 0.00 175.10 173.63 2d7m s GLN 49 N 0.40 0.22 -0.08 2.72 2.00 -0.21 -4.87 119.66 119.84 2d7m s GLN 49 Ca -0.04 -0.03 0.03 0.00 -2.00 0.00 0.00 55.36 53.32 2d7m s GLN 49 Cb -0.07 -0.28 0.01 0.00 0.80 0.00 0.00 33.01 33.47 2d7m s GLN 49 CO -0.01 -0.01 -0.18 0.42 -0.50 0.00 0.00 175.29 175.01 2d7m s ILE 50 N 0.29 1.58 -0.27 -2.34 1.01 -1.26 0.24 121.20 120.47 2d7m s ILE 50 Ca -0.03 -0.74 -0.01 0.00 0.00 0.00 0.00 60.65 59.87 2d7m s ILE 50 Cb -0.05 -1.40 0.04 0.00 0.01 0.00 0.00 42.46 41.06 2d7m s ILE 50 CO -0.01 0.45 -0.05 -0.76 0.00 0.00 0.00 174.94 174.58 2d7m s LEU 51 N 0.48 3.45 1.00 2.97 1.43 -0.48 -0.30 118.68 127.23 2d7m s LEU 51 Ca -0.16 -1.07 -0.18 0.00 -1.03 0.00 0.00 54.13 51.69 2d7m s LEU 51 Cb -0.17 -1.66 -0.08 0.00 0.03 0.00 0.00 46.19 44.31 2d7m s LEU 51 CO 0.06 -0.18 -0.51 -0.90 0.23 0.00 0.00 176.35 175.05 2d7m n ASP 52 N 4.62 -4.13 0.00 2.29 5.68 -0.40 -2.65 116.55 121.96 2d7m n ASP 52 Ca -0.15 0.16 0.03 0.00 -0.50 0.00 0.00 54.79 54.33 2d7m n ASP 52 Cb 0.45 -0.86 0.17 0.00 -1.14 0.00 0.00 41.12 39.74 2d7m n ASP 52 CO 0.00 0.00 0.00 -0.81 -1.33 0.00 0.00 177.20 175.06 2d7m n PRO 53 N 0.89 0.49 -0.05 0.11 -0.04 -1.25 -2.14 135.00 133.00 2d7m n PRO 53 Ca 0.01 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.45 2d7m n PRO 53 Cb 0.59 -1.18 -0.12 0.00 -0.04 0.00 0.00 33.50 32.74 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 -0.68 1.14 0.00 0.54 1.02 -1.26 -4.91 120.64 116.48 2d7m n GLU 54 Ca 0.04 -0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 2d7m n GLU 54 Cb 0.02 -1.39 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 2d7m n GLU 54 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2d7m n GLY 55 N 1.88 1.22 3.16 0.62 0.00 -0.91 -5.14 105.19 106.01 2d7m n GLY 55 Ca -0.17 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.10 0.80 0.23 1.61 -0.14 -1.26 -4.97 119.74 115.92 2d7m s LYS 56 Ca 0.00 -1.02 -0.30 0.00 -1.36 0.00 0.00 55.97 53.29 2d7m s LYS 56 Cb 0.00 -0.66 -0.09 0.00 -1.68 0.00 0.00 37.83 35.40 2d7m s LYS 56 CO 0.00 0.13 1.28 -1.25 -0.76 0.00 0.00 175.35 174.75 2d7m s PRO 57 N -2.16 4.41 0.44 -1.68 0.04 -1.26 -1.28 135.00 133.51 2d7m s PRO 57 Ca 0.00 2.05 0.05 0.00 0.04 0.00 0.00 61.00 63.14 2d7m s PRO 57 Cb -0.07 -3.17 0.05 0.00 0.04 0.00 0.00 34.50 31.35 2d7m s PRO 57 CO 0.01 -0.18 0.41 1.63 0.04 0.00 0.00 177.00 178.91 2d7m n LYS 58 N 2.13 0.81 -4.09 4.56 4.76 0.59 -4.85 118.16 122.06 2d7m n LYS 58 Ca 0.04 -2.61 -0.34 0.00 -2.87 0.00 0.00 58.31 52.52 2d7m n LYS 58 Cb 0.43 0.15 -0.15 0.00 -1.84 0.00 0.00 35.03 33.62 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 -3.85 3.29 0.14 1.97 2.20 -1.26 -4.71 119.74 117.51 2d7m s LYS 59 Ca 0.31 -0.68 0.08 0.00 -0.36 0.00 0.00 55.97 55.32 2d7m s LYS 59 Cb -0.02 -2.85 -0.04 0.00 -1.51 0.00 0.00 37.83 33.41 2d7m s LYS 59 CO 0.20 -0.14 -0.18 0.00 -0.36 0.00 0.00 175.35 174.87 2d7m s ALA 60 N 1.26 1.82 -0.05 3.13 0.00 -1.26 -4.46 121.76 122.20 2d7m s ALA 60 Ca 0.03 -1.37 0.04 0.00 0.00 0.00 0.00 51.96 50.66 2d7m s ALA 60 Cb -0.14 -0.17 -0.02 0.00 0.00 0.00 0.00 23.12 22.78 2d7m s ALA 60 CO -0.04 0.24 -0.16 -0.80 0.00 0.00 0.00 175.76 175.00 2d7m s ASN 61 N -2.40 3.92 -0.02 0.00 0.01 -0.43 -4.98 114.94 111.04 2d7m s ASN 61 Ca 0.11 -0.23 0.06 0.00 -0.71 0.00 0.00 52.86 52.09 2d7m s ASN 61 Cb -0.07 -0.83 -0.01 0.00 0.41 0.00 0.00 41.25 40.75 2d7m s ASN 61 CO 0.05 0.34 -0.20 -0.63 -1.51 0.00 0.00 177.10 175.15 2d7m s ILE 62 N -0.67 1.60 0.07 0.60 1.01 -1.26 -1.80 121.20 120.75 2d7m s ILE 62 Ca 0.10 -0.86 0.08 0.00 0.00 0.00 0.00 60.65 59.97 2d7m s ILE 62 Cb -0.11 -1.34 -0.03 0.00 0.01 0.00 0.00 42.46 40.99 2d7m s ILE 62 CO 0.01 0.45 -0.21 -0.60 0.00 0.00 0.00 174.94 174.59 2d7m s ARG 63 N -0.37 1.31 -0.36 2.79 6.06 0.15 -5.01 118.95 123.53 2d7m s ARG 63 Ca 0.05 -1.03 -0.09 0.00 -2.50 0.00 0.00 55.73 52.16 2d7m s ARG 63 Cb -0.09 -1.49 0.03 0.00 0.06 0.00 0.00 34.95 33.46 2d7m s ARG 63 CO 0.00 0.37 0.16 0.16 -2.50 0.00 0.00 175.30 173.49 2d7m s ASP 64 N -1.46 5.53 -0.09 -2.12 -4.77 -1.26 -3.02 116.67 109.48 2d7m s ASP 64 Ca 0.07 -1.08 -0.25 0.00 -3.30 0.00 0.00 52.55 48.00 2d7m s ASP 64 Cb -0.09 -1.95 -0.29 0.00 -1.09 0.00 0.00 42.92 39.50 2d7m s ASP 64 CO 0.03 -0.36 0.83 0.78 0.70 0.00 0.00 175.17 177.14 2d7m h ASN 65 N 8.33 0.26 0.00 2.11 2.35 -1.94 -3.48 115.58 123.21 2d7m h ASN 65 Ca -0.24 -0.97 0.00 0.00 -0.55 0.00 0.00 56.30 54.54 2d7m h ASN 65 Cb 1.09 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.38 2d7m h ASN 65 CO 0.64 1.24 0.00 0.61 -1.65 0.00 0.00 177.43 178.26 2d7m n GLY 66 N 1.64 2.85 1.27 2.83 0.00 -1.25 -4.88 105.19 107.64 2d7m n GLY 66 Ca -0.13 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.84 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 0.00 3.04 0.00 1.61 2.03 -1.26 -4.75 116.55 117.21 2d7m n ASP 67 Ca 0.00 -2.44 0.00 0.00 0.52 0.00 0.00 54.79 52.87 2d7m n ASP 67 Cb 0.00 -0.59 0.00 0.00 -0.72 0.00 0.00 41.12 39.81 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 0.04 0.42 3.42 0.27 0.00 -1.26 -4.97 105.19 103.11 2d7m n GLY 68 Ca 0.16 -1.03 -0.12 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.00 0.00 0.14 2.61 -4.23 -1.25 0.89 115.64 111.80 2d7m s THR 69 Ca 0.00 -1.69 -0.11 0.00 -1.18 0.00 0.00 61.69 58.71 2d7m s THR 69 Cb 0.00 -2.43 0.01 0.00 1.34 0.00 0.00 72.50 71.42 2d7m s THR 69 CO 0.00 0.00 0.31 -0.31 -0.54 0.00 0.00 174.62 174.08 2d7m s TYR 70 N -3.80 0.14 -0.01 3.99 1.51 0.61 -3.31 117.35 116.48 2d7m s TYR 70 Ca 0.31 -0.51 0.04 0.00 -1.01 0.00 0.00 57.07 55.90 2d7m s TYR 70 Cb 0.02 0.06 -0.01 0.00 -0.11 0.00 0.00 41.96 41.92 2d7m s TYR 70 CO 0.14 -0.68 -0.13 0.99 -1.11 0.00 0.00 175.55 174.75 2d7m s THR 71 N -3.89 1.05 0.02 -0.71 2.01 -1.17 0.08 115.64 113.02 2d7m s THR 71 Ca 0.09 -0.55 0.02 0.00 0.31 0.00 0.00 61.69 61.56 2d7m s THR 71 Cb 0.03 -0.88 -0.01 0.00 0.01 0.00 0.00 72.50 71.65 2d7m s THR 71 CO -0.06 0.30 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.40 2d7m s VAL 72 N -0.23 0.59 0.05 3.82 1.01 -1.02 -0.67 120.40 123.96 2d7m s VAL 72 Ca 0.04 -0.63 0.04 0.00 0.00 0.00 0.00 61.98 61.42 2d7m s VAL 72 Cb -0.06 -0.56 -0.02 0.00 0.00 0.00 0.00 36.38 35.74 2d7m s VAL 72 CO -0.00 -0.05 -0.11 -0.94 0.00 0.00 0.00 175.10 173.99 2d7m s SER 73 N -0.75 1.33 -0.03 3.32 1.04 -0.75 -0.63 113.70 117.23 2d7m s SER 73 Ca -0.02 -0.53 -0.27 0.00 0.48 0.00 0.00 55.95 55.61 2d7m s SER 73 Cb -0.06 -0.03 0.06 0.00 0.10 0.00 0.00 66.02 66.09 2d7m s SER 73 CO 0.00 -0.09 0.60 -0.72 0.98 0.00 0.00 173.24 174.01 2d7m s TYR 74 N -1.16 -0.56 -0.41 5.02 1.13 0.82 -1.31 117.35 120.89 2d7m s TYR 74 Ca -0.04 0.91 0.02 0.00 -1.41 0.00 0.00 57.07 56.56 2d7m s TYR 74 Cb -0.09 0.36 0.11 0.00 -1.10 0.00 0.00 41.96 41.24 2d7m s TYR 74 CO 0.01 -0.58 0.15 -1.17 -2.51 0.00 0.00 175.55 171.45 2d7m s LEU 75 N -1.32 4.79 -1.16 -3.49 2.96 -1.26 -0.96 118.68 118.23 2d7m s LEU 75 Ca -0.11 -2.37 -0.23 0.00 -0.22 0.00 0.00 54.13 51.21 2d7m s LEU 75 Cb -0.01 -1.68 -0.08 0.00 0.50 0.00 0.00 46.19 44.91 2d7m s LEU 75 CO 0.07 -0.38 1.94 -2.16 -1.32 0.00 0.00 176.35 174.50 2d7m s PRO 76 N 0.62 2.50 0.13 0.98 0.04 -1.26 -4.81 135.00 133.20 2d7m s PRO 76 Ca 0.12 -1.10 -0.32 0.00 0.04 0.00 0.00 61.00 59.74 2d7m s PRO 76 Cb -0.21 -5.23 -0.09 0.00 0.04 0.00 0.00 34.50 29.01 2d7m s PRO 76 CO -0.05 -3.95 1.56 0.22 0.04 0.00 0.00 177.00 174.82 2d7m h ASP 77 N 9.84 -1.74 -4.29 6.66 3.58 -1.96 -2.82 116.42 125.69 2d7m h ASP 77 Ca 0.21 0.23 -0.46 0.00 0.42 0.00 0.00 57.03 57.43 2d7m h ASP 77 Cb 0.94 0.71 0.13 0.00 1.72 0.00 0.00 39.33 42.84 2d7m h ASP 77 CO 1.22 -0.42 0.40 -0.04 -2.88 0.00 0.00 179.24 177.52 2d7m s MET 78 N -5.71 1.20 0.13 0.28 -1.94 -1.26 -4.16 119.30 107.84 2d7m s MET 78 Ca -0.15 -0.12 0.10 0.00 -1.71 0.00 0.00 55.69 53.82 2d7m s MET 78 Cb 0.09 -1.88 -0.04 0.00 2.01 0.00 0.00 34.83 35.00 2d7m s MET 78 CO 0.62 -2.08 -0.22 -1.54 -0.01 0.00 0.00 175.02 171.79 2d7m s SER 79 N -4.66 3.66 0.00 3.03 1.04 -1.26 -4.70 113.70 110.80 2d7m s SER 79 Ca 0.68 -0.65 0.00 0.00 0.48 0.00 0.00 55.95 56.46 2d7m s SER 79 Cb -0.08 -0.41 0.00 0.00 0.10 0.00 0.00 66.02 65.63 2d7m s SER 79 CO 0.51 0.18 0.00 0.61 0.98 0.00 0.00 173.24 175.52 2d7m n GLY 80 N 0.81 0.87 3.62 7.32 0.00 -0.89 -4.79 105.19 112.13 2d7m n GLY 80 Ca -0.16 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.45 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 -1.50 3.95 -0.09 1.61 3.52 -1.26 -0.53 118.95 124.65 2d7m s ARG 81 Ca 0.00 0.73 -0.10 0.00 -0.13 0.00 0.00 55.73 56.23 2d7m s ARG 81 Cb 0.00 -3.76 -0.05 0.00 -1.56 0.00 0.00 34.95 29.59 2d7m s ARG 81 CO 0.00 -0.83 0.23 0.71 -0.81 0.00 0.00 175.30 174.60 2d7m s TYR 82 N 3.33 3.62 -0.49 5.12 1.51 0.60 -3.94 117.35 127.10 2d7m s TYR 82 Ca 0.38 0.67 -0.15 0.00 -1.01 0.00 0.00 57.07 56.97 2d7m s TYR 82 Cb -0.13 -2.08 0.10 0.00 -0.11 0.00 0.00 41.96 39.73 2d7m s TYR 82 CO 0.15 0.66 0.41 0.99 -1.11 0.00 0.00 175.55 176.65 2d7m s THR 83 N -0.89 5.05 -0.44 -0.71 2.01 -1.08 -2.81 115.64 116.77 2d7m s THR 83 Ca 0.17 -1.29 -0.15 0.00 0.31 0.00 0.00 61.69 60.73 2d7m s THR 83 Cb -0.13 -4.11 0.05 0.00 0.01 0.00 0.00 72.50 68.31 2d7m s THR 83 CO 0.07 -0.68 0.36 -0.63 -0.69 0.00 0.00 174.62 173.04 2d7m s ILE 84 N 1.59 5.24 -0.37 1.82 1.01 -1.17 -1.39 121.20 127.93 2d7m s ILE 84 Ca 0.04 -0.85 -0.15 0.00 0.00 0.00 0.00 60.65 59.69 2d7m s ILE 84 Cb -0.26 -4.04 -0.00 0.00 0.01 0.00 0.00 42.46 38.17 2d7m s ILE 84 CO 0.04 -0.45 0.33 -0.89 0.00 0.00 0.00 174.94 173.97 2d7m s THR 85 N 1.69 5.21 -0.19 2.92 2.01 0.14 -1.82 115.64 125.59 2d7m s THR 85 Ca 0.05 -0.23 -0.02 0.00 0.31 0.00 0.00 61.69 61.80 2d7m s THR 85 Cb -0.22 -3.85 -0.01 0.00 0.01 0.00 0.00 72.50 68.44 2d7m s THR 85 CO 0.08 -0.16 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.14 2d7m s ILE 86 N 1.89 3.19 -0.02 1.82 1.01 -1.26 -1.04 121.20 126.78 2d7m s ILE 86 Ca 0.09 -0.57 0.04 0.00 0.00 0.00 0.00 60.65 60.21 2d7m s ILE 86 Cb -0.17 -2.41 -0.01 0.00 0.01 0.00 0.00 42.46 39.87 2d7m s ILE 86 CO 0.11 0.46 -0.15 -0.54 0.00 0.00 0.00 174.94 174.83 2d7m s LYS 87 N 1.12 1.35 -0.22 2.79 1.02 -0.76 -2.87 119.74 122.17 2d7m s LYS 87 Ca 0.01 -0.53 -0.06 0.00 0.02 0.00 0.00 55.97 55.41 2d7m s LYS 87 Cb -0.15 -1.25 -0.03 0.00 -0.52 0.00 0.00 37.83 35.88 2d7m s LYS 87 CO -0.02 0.27 0.04 -0.47 -0.92 0.00 0.00 175.35 174.26 2d7m s TYR 88 N -0.17 3.09 -0.14 3.18 5.04 0.46 -0.79 117.35 128.03 2d7m s TYR 88 Ca 0.02 -0.36 -0.02 0.00 -2.44 0.00 0.00 57.07 54.27 2d7m s TYR 88 Cb -0.08 -2.15 0.02 0.00 0.35 0.00 0.00 41.96 40.10 2d7m s TYR 88 CO 0.00 -0.23 0.04 0.41 -1.34 0.00 0.00 175.55 174.44 2d7m n GLY 89 N 4.42 -0.42 0.59 8.97 0.00 -0.21 0.11 105.19 118.64 2d7m n GLY 89 Ca -0.17 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.48 1.02 2.80 -0.02 0.00 -1.26 -4.83 105.19 102.42 2d7m n GLY 90 Ca 0.01 -0.27 -0.15 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.38 1.11 0.10 1.61 2.15 0.29 -4.77 116.67 114.78 2d7m s ASP 91 Ca 0.00 -0.24 -0.31 0.00 0.43 0.00 0.00 52.55 52.43 2d7m s ASP 91 Cb 0.00 0.64 -0.08 0.00 -0.30 0.00 0.00 42.92 43.18 2d7m s ASP 91 CO 0.00 -0.34 1.40 -0.70 -0.17 0.00 0.00 175.17 175.37 2d7m s GLU 92 N 2.40 4.31 0.68 4.34 2.12 -1.26 -0.40 118.70 130.88 2d7m s GLU 92 Ca 0.09 2.07 -0.16 0.00 0.36 0.00 0.00 54.97 57.33 2d7m s GLU 92 Cb -0.15 -3.31 0.01 0.00 0.26 0.00 0.00 34.13 30.94 2d7m s GLU 92 CO -0.19 -0.47 1.20 0.96 -0.54 0.00 0.00 175.26 176.22 2d7m s ILE 93 N 1.34 2.50 -2.00 -3.70 -4.36 -1.14 -4.83 121.20 109.01 2d7m s ILE 93 Ca 0.65 0.27 0.12 0.00 -0.26 0.00 0.00 60.65 61.43 2d7m s ILE 93 Cb -0.36 -2.92 0.35 0.00 1.25 0.00 0.00 42.46 40.78 2d7m s ILE 93 CO 0.30 -0.11 1.16 -0.81 0.24 0.00 0.00 174.94 175.71 2d7m n PRO 94 N -2.29 0.49 -0.01 0.37 -0.04 -1.26 -1.95 135.00 130.31 2d7m n PRO 94 Ca 0.13 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.67 2d7m n PRO 94 Cb 0.50 -1.39 -0.12 0.00 -0.04 0.00 0.00 33.50 32.45 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 -0.89 0.00 -3.18 0.54 4.02 -1.26 -4.99 117.16 111.40 2d7m n TYR 95 Ca 0.09 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.68 2d7m n TYR 95 Cb 0.04 -0.29 -0.04 0.00 -0.02 0.00 0.00 39.34 39.03 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 -3.57 6.53 0.41 7.72 0.15 -0.82 -3.85 113.70 120.27 2d7m s SER 96 Ca -0.04 0.93 -0.25 0.00 0.70 0.00 0.00 55.95 57.30 2d7m s SER 96 Cb 0.10 -2.23 -0.08 0.00 -1.71 0.00 0.00 66.02 62.10 2d7m s SER 96 CO 0.65 -0.24 1.18 -2.16 1.20 0.00 0.00 173.24 173.88 2d7m s PRO 97 N -3.47 3.97 -0.55 5.44 0.04 -1.26 -4.87 135.00 134.30 2d7m s PRO 97 Ca 0.48 1.86 -0.25 0.00 0.04 0.00 0.00 61.00 63.13 2d7m s PRO 97 Cb -0.11 -2.62 0.04 0.00 0.04 0.00 0.00 34.50 31.85 2d7m s PRO 97 CO 0.28 -0.39 0.98 -0.06 0.04 0.00 0.00 177.00 177.84 2d7m s PHE 98 N -1.43 2.77 -0.69 0.56 0.08 -0.76 -4.94 117.98 113.58 2d7m s PHE 98 Ca 0.59 0.06 -0.27 0.00 0.12 0.00 0.00 56.93 57.42 2d7m s PHE 98 Cb -0.31 -4.14 0.03 0.00 -0.57 0.00 0.00 43.02 38.03 2d7m s PHE 98 CO 0.39 -1.38 1.24 1.03 -0.10 0.00 0.00 175.22 176.39 2d7m s ARG 99 N 4.10 3.28 0.03 0.44 0.52 -1.26 -3.03 118.95 123.03 2d7m s ARG 99 Ca 0.32 -0.12 0.06 0.00 -0.52 0.00 0.00 55.73 55.47 2d7m s ARG 99 Cb -0.12 -4.13 -0.03 0.00 0.52 0.00 0.00 34.95 31.19 2d7m s ARG 99 CO 0.20 -1.99 -0.13 0.42 0.02 0.00 0.00 175.30 173.82 2d7m s ILE 100 N 5.42 3.16 -0.11 1.52 -1.09 -1.12 -4.88 121.20 124.10 2d7m s ILE 100 Ca 0.37 -1.04 -0.01 0.00 -2.23 0.00 0.00 60.65 57.74 2d7m s ILE 100 Cb -0.08 -2.36 -0.03 0.00 -1.58 0.00 0.00 42.46 38.41 2d7m s ILE 100 CO 0.18 0.34 -0.08 -2.28 -1.23 0.00 0.00 174.94 171.87 2d7m s HIS 101 N -0.98 2.92 -0.23 3.97 2.46 -1.26 -0.29 115.29 121.88 2d7m s HIS 101 Ca 0.16 -0.26 -0.04 0.00 0.47 0.00 0.00 55.06 55.40 2d7m s HIS 101 Cb -0.11 -1.82 -0.00 0.00 -0.13 0.00 0.00 32.58 30.52 2d7m s HIS 101 CO 0.07 0.07 -0.03 0.00 -2.47 0.00 0.00 174.74 172.38 2d7m s ALA 102 N -0.14 2.82 -0.05 1.58 0.00 0.31 -0.21 121.76 126.07 2d7m s ALA 102 Ca 0.01 -1.25 -0.12 0.00 0.00 0.00 0.00 51.96 50.60 2d7m s ALA 102 Cb -0.13 -1.75 -0.05 0.00 0.00 0.00 0.00 23.12 21.19 2d7m s ALA 102 CO 0.03 -0.54 0.31 -0.51 0.00 0.00 0.00 175.76 175.05 2d7m s LEU 103 N 1.46 4.43 -0.67 0.00 1.43 0.61 -2.09 118.68 123.84 2d7m s LEU 103 Ca 0.05 0.77 -0.26 0.00 -1.03 0.00 0.00 54.13 53.66 2d7m s LEU 103 Cb -0.15 -2.40 -0.03 0.00 0.03 0.00 0.00 46.19 43.64 2d7m s LEU 103 CO -0.03 0.34 1.88 -2.16 0.23 0.00 0.00 176.35 176.61 2d7m s PRO 104 N -0.96 2.61 0.36 1.29 0.04 -1.26 -0.33 135.00 136.75 2d7m s PRO 104 Ca 0.20 0.42 0.04 0.00 0.04 0.00 0.00 61.00 61.70 2d7m s PRO 104 Cb -0.15 -4.54 0.68 0.00 0.04 0.00 0.00 34.50 30.54 2d7m s PRO 104 CO 0.10 -2.88 1.99 0.00 0.04 0.00 0.00 177.00 176.25 2d7m h THR 105 N 6.97 1.10 0.00 1.26 1.03 -1.90 -3.45 112.91 117.92 2d7m h THR 105 Ca -0.18 -0.28 0.00 0.00 -0.01 0.00 0.00 66.41 65.94 2d7m h THR 105 Cb 1.13 0.22 0.00 0.00 -1.07 0.00 0.00 68.15 68.43 2d7m h THR 105 CO 1.22 0.15 0.00 0.61 -0.01 0.00 0.00 175.52 177.48 2d7m n GLY 106 N -1.44 0.08 3.75 2.99 0.00 -1.26 -4.86 105.19 104.44 2d7m n GLY 106 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 2d7m n GLY 106 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2d7m n ASP 107 N 0.00 -0.78 -0.32 1.61 8.00 -1.26 -4.71 116.55 119.10 2d7m n ASP 107 Ca 0.00 -0.91 0.09 0.00 0.71 0.00 0.00 54.79 54.68 2d7m n ASP 107 Cb 0.00 -1.16 0.20 0.00 -0.02 0.00 0.00 41.12 40.14 2d7m n ASP 107 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2d7m n ALA 108 N -3.23 0.34 -3.54 2.24 0.00 -1.26 -4.68 120.51 110.38 2d7m n ALA 108 Ca -0.00 0.97 -0.09 0.00 0.00 0.00 0.00 53.44 54.32 2d7m n ALA 108 Cb 0.38 -0.65 -0.03 0.00 0.00 0.00 0.00 19.45 19.14 2d7m n ALA 108 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2d7m s SER 109 N -5.12 -0.36 -0.77 0.00 0.01 -1.26 -5.09 113.70 101.11 2d7m s SER 109 Ca -0.12 0.19 -0.26 0.00 1.31 0.00 0.00 55.95 57.07 2d7m s SER 109 Cb 0.25 0.34 -0.02 0.00 0.21 0.00 0.00 66.02 66.81 2d7m s SER 109 CO 0.70 -0.48 1.78 -0.44 0.41 0.00 0.00 173.24 175.21 2d7m s SER 110 N -1.84 5.46 -0.65 2.44 0.01 -1.26 -4.00 113.70 113.86 2d7m s SER 110 Ca 0.02 -0.30 -0.05 0.00 1.31 0.00 0.00 55.95 56.93 2d7m s SER 110 Cb -0.01 -2.55 0.01 0.00 0.21 0.00 0.00 66.02 63.68 2d7m s SER 110 CO -0.04 -2.35 0.67 0.61 0.41 0.00 0.00 173.24 172.54 2d7m n GLY 111 N 6.19 -1.24 3.77 3.44 0.00 -1.26 -4.96 105.19 111.13 2d7m n GLY 111 Ca 0.26 0.71 -0.37 0.00 0.00 0.00 0.00 46.02 46.62 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 -2.96 3.79 -0.22 1.61 0.04 -1.26 -5.04 135.00 130.97 2d7m s PRO 112 Ca 0.07 1.79 -0.03 0.00 0.04 0.00 0.00 61.00 62.87 2d7m s PRO 112 Cb -0.02 -2.44 0.07 0.00 0.04 0.00 0.00 34.50 32.15 2d7m s PRO 112 CO 0.76 -0.53 0.08 -1.12 0.04 0.00 0.00 177.00 176.24 2d7m s SER 113 N -1.32 2.99 -0.07 6.66 0.01 -1.26 -4.42 113.70 116.28 2d7m s SER 113 Ca 0.63 -0.94 0.01 0.00 1.31 0.00 0.00 55.95 56.96 2d7m s SER 113 Cb -0.29 -0.47 0.02 0.00 0.21 0.00 0.00 66.02 65.49 2d7m s SER 113 CO 0.35 -0.36 -0.09 -0.94 0.41 0.00 0.00 173.24 172.61 2d7m s SER 114 N 1.96 1.62 0.00 2.44 1.04 -1.26 -5.19 113.70 114.31 2d7m s SER 114 Ca 0.03 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.21 2d7m s SER 114 Cb -0.17 -0.72 0.00 0.00 0.10 0.00 0.00 66.02 65.23 2d7m s SER 114 CO -0.16 -0.02 0.00 0.61 0.98 0.00 0.00 173.24 174.65