#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ed9 s SER 2 N 0.00 -0.06 0.38 1.61 0.15 -1.26 -5.19 113.70 109.33 2ed9 s SER 2 Ca 0.00 -0.28 0.04 0.00 0.70 0.00 0.00 55.95 56.41 2ed9 s SER 2 Cb 0.00 0.27 -0.05 0.00 -1.71 0.00 0.00 66.02 64.53 2ed9 s SER 2 CO 0.00 -0.51 0.06 -0.94 1.20 0.00 0.00 173.24 173.05 2ed9 s SER 3 N -3.18 2.89 0.00 5.45 1.04 -1.26 -5.15 113.70 113.50 2ed9 s SER 3 Ca 0.18 -1.47 0.00 0.00 0.48 0.00 0.00 55.95 55.14 2ed9 s SER 3 Cb 0.02 0.06 0.00 0.00 0.10 0.00 0.00 66.02 66.19 2ed9 s SER 3 CO -0.01 -0.68 0.00 0.61 0.98 0.00 0.00 173.24 174.14 2ed9 n GLY 4 N -0.84 4.47 3.64 7.32 0.00 -1.26 -5.17 105.19 113.35 2ed9 n GLY 4 Ca -0.05 -1.21 -0.07 0.00 0.00 0.00 0.00 46.02 44.69 2ed9 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ed9 s SER 5 N 0.00 -0.46 0.35 1.61 0.01 -1.26 -5.19 113.70 108.77 2ed9 s SER 5 Ca 0.00 0.84 0.02 0.00 1.31 0.00 0.00 55.95 58.12 2ed9 s SER 5 Cb 0.00 0.93 -0.01 0.00 0.21 0.00 0.00 66.02 67.15 2ed9 s SER 5 CO 0.00 -0.14 0.07 -1.20 0.41 0.00 0.00 173.24 172.38 2ed9 n SER 6 N 2.55 1.94 -4.13 2.44 7.64 -1.26 -5.18 113.62 117.63 2ed9 n SER 6 Ca -0.14 -2.74 -0.15 0.00 1.01 0.00 0.00 58.87 56.85 2ed9 n SER 6 Cb 0.56 0.60 -0.10 0.00 -1.01 0.00 0.00 64.21 64.27 2ed9 n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2ed9 s GLY 7 N -3.07 1.72 0.21 0.23 0.00 -1.26 -5.17 107.32 99.98 2ed9 s GLY 7 Ca 0.10 -1.79 -0.22 0.00 0.00 0.00 0.00 44.72 42.81 2ed9 s GLY 7 CO 0.07 -1.50 0.93 0.21 0.00 0.00 0.00 173.10 172.80 2ed9 s ASN 8 N -3.27 -0.11 -0.30 1.64 2.47 -1.26 -5.17 114.94 108.95 2ed9 s ASN 8 Ca 0.38 -0.62 -0.16 0.00 0.42 0.00 0.00 52.86 52.87 2ed9 s ASN 8 Cb 0.06 0.58 0.18 0.00 -1.45 0.00 0.00 41.25 40.62 2ed9 s ASN 8 CO 0.15 -1.11 1.11 0.00 -3.72 0.00 0.00 177.10 173.53 2ed9 s ARG 9 N -2.89 0.20 0.28 0.43 1.70 -1.26 -5.18 118.95 112.23 2ed9 s ARG 9 Ca 0.15 0.44 -0.20 0.00 -0.47 0.00 0.00 55.73 55.66 2ed9 s ARG 9 Cb -0.03 0.19 0.05 0.00 -0.57 0.00 0.00 34.95 34.59 2ed9 s ARG 9 CO 0.05 -0.06 0.84 0.71 -1.08 0.00 0.00 175.30 175.77 2ed9 s TYR 10 N 1.87 -0.01 0.00 5.89 2.02 -1.26 -5.15 117.35 120.71 2ed9 s TYR 10 Ca -0.04 -0.50 0.00 0.00 -0.37 0.00 0.00 57.07 56.16 2ed9 s TYR 10 Cb -0.04 0.75 0.00 0.00 -0.40 0.00 0.00 41.96 42.27 2ed9 s TYR 10 CO -0.15 -1.25 0.00 0.41 -1.57 0.00 0.00 175.55 172.99 2ed9 n GLY 11 N -0.53 -0.50 3.59 0.71 0.00 -1.26 -5.18 105.19 102.03 2ed9 n GLY 11 Ca -0.06 0.63 -0.30 0.00 0.00 0.00 0.00 46.02 46.29 2ed9 n GLY 11 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ed9 s PRO 12 N 0.00 -1.31 -0.20 1.61 0.04 -1.26 -5.08 135.00 128.80 2ed9 s PRO 12 Ca 0.00 -0.10 -0.04 0.00 0.04 0.00 0.00 61.00 60.90 2ed9 s PRO 12 Cb 0.00 -1.59 0.10 0.00 0.04 0.00 0.00 34.50 33.05 2ed9 s PRO 12 CO 0.00 -3.76 0.23 0.20 0.04 0.00 0.00 177.00 173.71 2ed9 s GLY 13 N -3.92 -0.02 -0.11 0.56 0.00 -1.26 -5.12 107.32 97.45 2ed9 s GLY 13 Ca 0.71 0.30 -0.04 0.00 0.00 0.00 0.00 44.72 45.69 2ed9 s GLY 13 CO 0.56 2.18 0.17 0.14 0.00 0.00 0.00 173.10 176.15 2ed9 s VAL 14 N 2.34 -0.27 0.03 1.40 1.01 -1.26 -5.15 120.40 118.51 2ed9 s VAL 14 Ca 0.07 0.23 -0.08 0.00 0.00 0.00 0.00 61.98 62.21 2ed9 s VAL 14 Cb -0.16 -0.39 -0.00 0.00 0.00 0.00 0.00 36.38 35.83 2ed9 s VAL 14 CO -0.12 0.05 0.15 -0.55 0.00 0.00 0.00 175.10 174.63 2ed9 s SER 15 N 2.29 0.08 0.23 3.32 0.15 -1.26 -5.18 113.70 113.34 2ed9 s SER 15 Ca 0.04 -0.39 -0.04 0.00 0.70 0.00 0.00 55.95 56.25 2ed9 s SER 15 Cb -0.13 0.25 -0.02 0.00 -1.71 0.00 0.00 66.02 64.40 2ed9 s SER 15 CO -0.07 -0.50 0.28 0.42 1.20 0.00 0.00 173.24 174.56 2ed9 s THR 16 N -2.32 0.00 -0.30 6.45 -4.23 -1.26 -5.16 115.64 108.82 2ed9 s THR 16 Ca -0.07 -1.78 -0.13 0.00 -1.18 0.00 0.00 61.69 58.52 2ed9 s THR 16 Cb -0.03 -2.42 0.16 0.00 1.34 0.00 0.00 72.50 71.55 2ed9 s THR 16 CO -0.03 0.00 0.89 1.51 -0.54 0.00 0.00 174.62 176.45 2ed9 s ASP 17 N -3.13 -0.75 -0.27 3.99 -4.77 -1.26 -5.15 116.67 105.33 2ed9 s ASP 17 Ca 0.33 0.99 -0.07 0.00 -3.30 0.00 0.00 52.55 50.50 2ed9 s ASP 17 Cb 0.04 1.84 0.13 0.00 -1.09 0.00 0.00 42.92 43.83 2ed9 s ASP 17 CO 0.13 -0.14 0.57 1.51 0.70 0.00 0.00 175.17 177.93 2ed9 s ASP 18 N 2.59 -0.87 -0.01 2.11 1.47 -1.26 -5.16 116.67 115.54 2ed9 s ASP 18 Ca -0.03 1.24 -0.01 0.00 1.18 0.00 0.00 52.55 54.93 2ed9 s ASP 18 Cb -0.08 1.97 0.00 0.00 -0.34 0.00 0.00 42.92 44.47 2ed9 s ASP 18 CO -0.18 -0.23 0.03 0.27 0.68 0.00 0.00 175.17 175.74 2ed9 s ILE 19 N 2.80 0.01 -0.19 2.11 -4.36 -1.26 -5.14 121.20 115.17 2ed9 s ILE 19 Ca 0.00 -0.06 -0.04 0.00 -0.26 0.00 0.00 60.65 60.29 2ed9 s ILE 19 Cb -0.13 -0.07 0.09 0.00 1.25 0.00 0.00 42.46 43.60 2ed9 s ILE 19 CO -0.18 -0.03 0.20 0.42 0.24 0.00 0.00 174.94 175.59 2ed9 s THR 20 N -0.09 -0.28 1.29 8.37 -4.23 -1.26 -5.15 115.64 114.29 2ed9 s THR 20 Ca -0.01 -0.10 -0.18 0.00 -1.18 0.00 0.00 61.69 60.22 2ed9 s THR 20 Cb -0.01 -0.64 0.30 0.00 1.34 0.00 0.00 72.50 73.49 2ed9 s THR 20 CO 0.00 -0.20 0.78 1.33 -0.54 0.00 0.00 174.62 175.99 2ed9 n VAL 21 N 5.31 0.00 -3.51 2.29 0.24 -1.26 -4.95 118.33 116.45 2ed9 n VAL 21 Ca -0.06 -0.25 -0.42 0.00 -2.04 0.00 0.00 64.34 61.57 2ed9 n VAL 21 Cb 0.49 -0.91 -0.06 0.00 -1.47 0.00 0.00 33.84 31.90 2ed9 n VAL 21 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2ed9 s VAL 22 N -2.24 4.71 0.04 3.34 1.01 -1.26 -5.04 120.40 120.97 2ed9 s VAL 22 Ca 0.64 -2.61 0.04 0.00 0.00 0.00 0.00 61.98 60.04 2ed9 s VAL 22 Cb -0.17 -3.98 -0.02 0.00 0.00 0.00 0.00 36.38 32.21 2ed9 s VAL 22 CO 0.60 -0.94 -0.11 -0.89 0.00 0.00 0.00 175.10 173.75 2ed9 s THR 23 N 0.17 0.85 -0.22 3.92 2.01 -1.26 -5.14 115.64 115.98 2ed9 s THR 23 Ca 0.16 -1.03 -0.05 0.00 0.31 0.00 0.00 61.69 61.08 2ed9 s THR 23 Cb -0.16 -0.83 -0.02 0.00 0.01 0.00 0.00 72.50 71.51 2ed9 s THR 23 CO -0.06 -0.17 -0.01 -1.48 -0.69 0.00 0.00 174.62 172.21 2ed9 s LEU 24 N -1.35 3.10 0.29 4.42 2.34 -1.26 -5.11 118.68 121.11 2ed9 s LEU 24 Ca -0.03 -0.30 0.04 0.00 0.06 0.00 0.00 54.13 53.90 2ed9 s LEU 24 Cb -0.09 -1.79 -0.03 0.00 -0.56 0.00 0.00 46.19 43.72 2ed9 s LEU 24 CO 0.01 0.01 0.44 -0.44 -1.06 0.00 0.00 176.35 175.31 2ed9 s SER 25 N 1.31 6.27 -0.26 1.48 0.01 -1.26 -5.01 113.70 116.23 2ed9 s SER 25 Ca 0.04 0.18 0.12 0.00 1.31 0.00 0.00 55.95 57.60 2ed9 s SER 25 Cb -0.15 -1.86 0.65 0.00 0.21 0.00 0.00 66.02 64.87 2ed9 s SER 25 CO -0.00 -0.18 1.63 0.47 0.41 0.00 0.00 173.24 175.56 2ed9 n ASP 26 N -1.57 4.29 -4.78 2.44 9.92 -1.26 -5.01 116.55 120.59 2ed9 n ASP 26 Ca -0.07 -3.21 -0.34 0.00 -0.53 0.00 0.00 54.79 50.64 2ed9 n ASP 26 Cb 0.57 -0.66 0.02 0.00 -0.64 0.00 0.00 41.12 40.41 2ed9 n ASP 26 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 2ed9 s VAL 27 N -2.96 3.27 0.72 2.53 -7.23 -1.26 -4.69 120.40 110.78 2ed9 s VAL 27 Ca 0.49 0.68 -0.13 0.00 -1.81 0.00 0.00 61.98 61.22 2ed9 s VAL 27 Cb 0.40 -3.22 0.03 0.00 0.56 0.00 0.00 36.38 34.16 2ed9 s VAL 27 CO 0.10 -0.27 1.10 -2.16 -0.31 0.00 0.00 175.10 173.56 2ed9 s PRO 28 N -3.71 2.51 -0.01 4.82 0.04 -1.26 -4.99 135.00 132.41 2ed9 s PRO 28 Ca 0.69 1.27 0.08 0.00 0.04 0.00 0.00 61.00 63.08 2ed9 s PRO 28 Cb -0.22 -1.92 -0.11 0.00 0.04 0.00 0.00 34.50 32.30 2ed9 s PRO 28 CO 0.34 -1.46 0.23 0.45 0.04 0.00 0.00 177.00 176.60 2ed9 n SER 29 N -3.00 2.18 -4.50 6.66 2.88 -1.26 -4.37 113.62 112.20 2ed9 n SER 29 Ca 0.10 -0.25 -0.36 0.00 -1.33 0.00 0.00 58.87 57.03 2ed9 n SER 29 Cb 0.52 1.23 -0.12 0.00 -0.75 0.00 0.00 64.21 65.10 2ed9 n SER 29 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ed9 s ALA 30 N -2.25 3.22 1.01 -1.46 0.00 -1.26 -4.94 121.76 116.07 2ed9 s ALA 30 Ca -0.01 -1.00 -0.12 0.00 0.00 0.00 0.00 51.96 50.83 2ed9 s ALA 30 Cb 0.05 -1.99 0.19 0.00 0.00 0.00 0.00 23.12 21.37 2ed9 s ALA 30 CO 0.32 -0.25 1.09 -1.25 0.00 0.00 0.00 175.76 175.68 2ed9 s PRO 31 N 1.17 0.34 0.61 0.00 0.04 -1.26 -4.85 135.00 131.05 2ed9 s PRO 31 Ca 0.04 0.49 -0.17 0.00 0.04 0.00 0.00 61.00 61.41 2ed9 s PRO 31 Cb -0.14 -1.73 -0.02 0.00 0.04 0.00 0.00 34.50 32.64 2ed9 s PRO 31 CO 0.03 -2.79 1.12 -1.25 0.04 0.00 0.00 177.00 174.15 2ed9 s PRO 32 N -4.96 3.03 0.49 0.56 0.04 -1.26 -4.63 135.00 128.26 2ed9 s PRO 32 Ca 0.65 1.48 0.08 0.00 0.04 0.00 0.00 61.00 63.25 2ed9 s PRO 32 Cb -0.19 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 32.41 2ed9 s PRO 32 CO 0.58 -1.09 0.54 -0.65 0.04 0.00 0.00 177.00 176.42 2ed9 s GLN 33 N -3.77 2.47 -1.44 4.56 -0.21 -0.97 -4.64 119.66 115.66 2ed9 s GLN 33 Ca 0.69 -1.61 -0.02 0.00 0.02 0.00 0.00 55.36 54.44 2ed9 s GLN 33 Cb -0.22 -2.47 0.00 0.00 1.00 0.00 0.00 33.01 31.32 2ed9 s GLN 33 CO 0.36 -0.48 0.28 0.09 -2.12 0.00 0.00 175.29 173.41 2ed9 n ASN 34 N -1.85 -0.13 -4.34 5.90 3.02 -1.26 -1.97 115.26 114.62 2ed9 n ASN 34 Ca 0.07 -1.12 -0.46 0.00 -0.03 0.00 0.00 54.58 53.03 2ed9 n ASN 34 Cb 0.62 -2.45 -0.01 0.00 -0.61 0.00 0.00 39.78 37.32 2ed9 n ASN 34 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2ed9 s VAL 35 N -4.09 5.72 0.19 2.41 1.01 -1.26 -4.13 120.40 120.24 2ed9 s VAL 35 Ca 0.04 -2.83 0.06 0.00 0.00 0.00 0.00 61.98 59.25 2ed9 s VAL 35 Cb -0.02 -4.55 -0.05 0.00 0.00 0.00 0.00 36.38 31.76 2ed9 s VAL 35 CO 0.93 -1.13 -0.11 -0.55 0.00 0.00 0.00 175.10 174.24 2ed9 s SER 36 N 1.90 2.23 0.24 3.32 0.15 -1.26 -4.91 113.70 115.37 2ed9 s SER 36 Ca 0.25 -1.04 0.10 0.00 0.70 0.00 0.00 55.95 55.96 2ed9 s SER 36 Cb -0.10 -0.08 -0.04 0.00 -1.71 0.00 0.00 66.02 64.09 2ed9 s SER 36 CO -0.08 -0.26 -0.09 -0.76 1.20 0.00 0.00 173.24 173.25 2ed9 s LEU 37 N -3.26 2.96 0.01 3.45 1.43 -1.26 -3.84 118.68 118.16 2ed9 s LEU 37 Ca 0.21 -0.72 0.03 0.00 -1.03 0.00 0.00 54.13 52.62 2ed9 s LEU 37 Cb 0.01 -1.54 -0.01 0.00 0.03 0.00 0.00 46.19 44.68 2ed9 s LEU 37 CO 0.05 0.05 -0.08 -0.70 0.23 0.00 0.00 176.35 175.89 2ed9 s GLU 38 N -3.33 0.62 -0.60 1.70 2.12 -0.55 -5.04 118.70 113.61 2ed9 s GLU 38 Ca 0.29 -0.44 -0.20 0.00 0.36 0.00 0.00 54.97 54.98 2ed9 s GLU 38 Cb -0.07 -0.56 0.10 0.00 0.26 0.00 0.00 34.13 33.86 2ed9 s GLU 38 CO 0.17 0.14 0.75 0.08 -0.54 0.00 0.00 175.26 175.86 2ed9 s VAL 39 N -0.53 4.73 -0.06 3.70 1.01 -1.26 -1.75 120.40 126.24 2ed9 s VAL 39 Ca -0.00 -0.88 -0.24 0.00 0.00 0.00 0.00 61.98 60.86 2ed9 s VAL 39 Cb -0.05 -4.53 -0.28 0.00 0.00 0.00 0.00 36.38 31.53 2ed9 s VAL 39 CO 0.00 -1.19 0.92 0.58 0.00 0.00 0.00 175.10 175.41 2ed9 h VAL 40 N 5.93 1.57 -3.23 2.92 2.07 -1.86 -3.48 116.25 120.18 2ed9 h VAL 40 Ca -0.29 -2.33 -0.07 0.00 0.82 0.00 0.00 66.70 64.82 2ed9 h VAL 40 Cb 1.08 3.10 -0.01 0.00 -1.52 0.00 0.00 31.29 33.94 2ed9 h VAL 40 CO 1.12 0.65 0.18 0.20 0.02 0.00 0.00 177.57 179.74 2ed9 s ASN 41 N -6.66 0.20 0.33 0.57 0.01 0.79 -4.94 114.94 105.24 2ed9 s ASN 41 Ca -0.15 -1.22 0.26 0.00 -0.71 0.00 0.00 52.86 51.04 2ed9 s ASN 41 Cb 0.00 0.82 1.06 0.00 0.41 0.00 0.00 41.25 43.55 2ed9 s ASN 41 CO 0.78 -1.62 1.78 0.77 -1.51 0.00 0.00 177.10 177.30 2ed9 h SER 42 N 2.02 0.00 0.00 -1.22 4.64 -1.86 -2.96 113.55 114.17 2ed9 h SER 42 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 2ed9 h SER 42 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2ed9 h SER 42 CO 0.40 0.00 -0.02 -2.11 -0.87 0.00 0.00 176.83 174.24 2ed9 n ARG 43 N -2.44 1.51 -3.86 4.77 1.85 -1.26 -3.96 116.66 113.26 2ed9 n ARG 43 Ca 0.02 -1.07 -0.12 0.00 -1.00 0.00 0.00 57.85 55.67 2ed9 n ARG 43 Cb 0.25 -0.78 -0.14 0.00 -1.05 0.00 0.00 32.46 30.75 2ed9 n ARG 43 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 2ed9 s SER 44 N -0.62 -0.02 -0.04 2.89 0.01 -1.12 1.00 113.70 115.80 2ed9 s SER 44 Ca 0.01 0.04 -0.01 0.00 1.31 0.00 0.00 55.95 57.30 2ed9 s SER 44 Cb 0.01 0.05 0.03 0.00 0.21 0.00 0.00 66.02 66.32 2ed9 s SER 44 CO 0.00 -0.01 0.08 -0.63 0.41 0.00 0.00 173.24 173.08 2ed9 s ILE 45 N -0.01 -0.06 -0.04 1.44 1.01 -0.45 -0.15 121.20 122.95 2ed9 s ILE 45 Ca -0.00 0.21 -0.17 0.00 0.00 0.00 0.00 60.65 60.69 2ed9 s ILE 45 Cb -0.00 -0.14 -0.05 0.00 0.01 0.00 0.00 42.46 42.27 2ed9 s ILE 45 CO 0.00 0.09 0.48 -0.75 0.00 0.00 0.00 174.94 174.76 2ed9 s LYS 46 N 1.15 4.17 0.06 2.79 2.47 -0.72 -1.88 119.74 127.79 2ed9 s LYS 46 Ca -0.09 0.51 0.05 0.00 -1.56 0.00 0.00 55.97 54.89 2ed9 s LYS 46 Cb -0.12 -3.32 -0.03 0.00 -1.46 0.00 0.00 37.83 32.90 2ed9 s LYS 46 CO -0.04 0.44 -0.15 0.08 0.16 0.00 0.00 175.35 175.84 2ed9 s VAL 47 N -0.31 1.19 0.25 4.02 1.01 -1.19 -1.48 120.40 123.88 2ed9 s VAL 47 Ca 0.26 -1.18 -0.10 0.00 0.00 0.00 0.00 61.98 60.95 2ed9 s VAL 47 Cb -0.17 -1.10 -0.01 0.00 0.00 0.00 0.00 36.38 35.10 2ed9 s VAL 47 CO 0.13 -0.09 0.43 -0.55 0.00 0.00 0.00 175.10 175.03 2ed9 s SER 48 N -1.45 0.01 0.00 3.32 0.15 -1.25 -2.46 113.70 112.02 2ed9 s SER 48 Ca 0.01 -1.03 -0.29 0.00 0.70 0.00 0.00 55.95 55.33 2ed9 s SER 48 Cb -0.09 0.57 0.10 0.00 -1.71 0.00 0.00 66.02 64.89 2ed9 s SER 48 CO 0.02 -1.12 0.97 -1.66 1.20 0.00 0.00 173.24 172.65 2ed9 s TRP 49 N -3.95 -0.25 0.09 3.44 -2.14 -1.11 -4.20 118.94 110.82 2ed9 s TRP 49 Ca 0.25 0.10 0.04 0.00 2.66 0.00 0.00 56.10 59.15 2ed9 s TRP 49 Cb 0.00 0.56 -0.03 0.00 -3.10 0.00 0.00 33.47 30.90 2ed9 s TRP 49 CO 0.10 -0.54 -0.11 -0.51 -2.66 0.00 0.00 176.95 173.23 2ed9 s LEU 50 N -2.57 2.39 0.84 -4.66 2.01 -0.83 -4.90 118.68 110.96 2ed9 s LEU 50 Ca 0.08 -0.78 -0.11 0.00 0.01 0.00 0.00 54.13 53.32 2ed9 s LEU 50 Cb -0.01 -0.34 0.10 0.00 0.01 0.00 0.00 46.19 45.95 2ed9 s LEU 50 CO -0.06 -0.23 1.09 -2.16 1.01 0.00 0.00 176.35 176.00 2ed9 s PRO 51 N -2.62 1.70 0.98 1.29 0.04 -1.26 -2.29 135.00 132.84 2ed9 s PRO 51 Ca 0.04 0.97 -0.12 0.00 0.04 0.00 0.00 61.00 61.94 2ed9 s PRO 51 Cb -0.04 -1.85 0.18 0.00 0.04 0.00 0.00 34.50 32.83 2ed9 s PRO 51 CO 0.01 -1.97 1.09 -1.25 0.04 0.00 0.00 177.00 174.91 2ed9 s PRO 52 N -4.92 0.59 0.20 0.56 0.04 -1.26 -4.27 135.00 125.94 2ed9 s PRO 52 Ca 0.62 0.58 -0.30 0.00 0.04 0.00 0.00 61.00 61.95 2ed9 s PRO 52 Cb -0.18 -1.75 -0.09 0.00 0.04 0.00 0.00 34.50 32.53 2ed9 s PRO 52 CO 0.57 -2.64 1.30 -1.25 0.04 0.00 0.00 177.00 175.02 2ed9 s PRO 53 N -4.96 4.39 -0.38 0.56 0.04 -1.26 -4.89 135.00 128.50 2ed9 s PRO 53 Ca 0.65 2.05 -0.40 0.00 0.04 0.00 0.00 61.00 63.33 2ed9 s PRO 53 Cb -0.18 -3.20 -0.16 0.00 0.04 0.00 0.00 34.50 31.00 2ed9 s PRO 53 CO 0.57 -0.25 1.98 -1.13 0.04 0.00 0.00 177.00 178.22 2ed9 n SER 54 N 2.62 1.76 0.00 6.66 3.41 -1.26 -2.42 113.62 124.39 2ed9 n SER 54 Ca 0.06 0.76 0.00 0.00 -0.26 0.00 0.00 58.87 59.43 2ed9 n SER 54 Cb 0.43 -1.09 0.00 0.00 -0.26 0.00 0.00 64.21 63.29 2ed9 n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ed9 n GLY 55 N 5.84 0.66 0.00 5.00 0.00 -1.26 -4.96 105.19 110.47 2ed9 n GLY 55 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.41 2ed9 n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ed9 n THR 56 N 0.00 0.37 -1.75 2.61 -2.24 -1.02 -4.75 114.28 107.51 2ed9 n THR 56 Ca 0.00 -0.54 -0.32 0.00 -2.27 0.00 0.00 64.05 60.91 2ed9 n THR 56 Cb 0.00 0.95 0.05 0.00 -2.10 0.00 0.00 70.33 69.23 2ed9 n THR 56 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ed9 n GLN 57 N -0.19 3.01 -0.33 -0.78 10.64 -1.26 -4.60 117.38 123.88 2ed9 n GLN 57 Ca 0.00 -3.69 0.02 0.00 -1.83 0.00 0.00 57.00 51.50 2ed9 n GLN 57 Cb 0.20 -2.28 0.08 0.00 -0.86 0.00 0.00 30.24 27.38 2ed9 n GLN 57 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 2ed9 n ASN 58 N -0.74 -0.45 -4.73 2.61 5.15 -1.26 -4.22 115.26 111.62 2ed9 n ASN 58 Ca 0.54 1.54 -0.41 0.00 -0.60 0.00 0.00 54.58 55.65 2ed9 n ASN 58 Cb 0.65 -0.41 -0.04 0.00 -0.53 0.00 0.00 39.78 39.45 2ed9 n ASN 58 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2ed9 s GLY 59 N -3.88 2.96 -0.62 8.20 0.00 -1.26 -4.93 107.32 107.79 2ed9 s GLY 59 Ca -0.13 0.61 -0.26 0.00 0.00 0.00 0.00 44.72 44.94 2ed9 s GLY 59 CO 0.66 1.52 2.44 0.33 0.00 0.00 0.00 173.10 178.06 2ed9 n PHE 60 N 2.87 1.24 -1.60 1.90 7.35 -1.26 -4.50 117.46 123.46 2ed9 n PHE 60 Ca 0.03 0.12 -0.55 0.00 -0.76 0.00 0.00 57.45 56.29 2ed9 n PHE 60 Cb 0.49 -2.54 -0.07 0.00 0.35 0.00 0.00 39.48 37.71 2ed9 n PHE 60 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 2ed9 n ILE 61 N 8.02 0.06 -0.10 -2.13 5.41 -1.26 -3.26 119.36 126.09 2ed9 n ILE 61 Ca 0.43 -0.01 -0.17 0.00 1.00 0.00 0.00 62.75 64.00 2ed9 n ILE 61 Cb 0.46 -0.71 -0.09 0.00 -0.71 0.00 0.00 39.64 38.59 2ed9 n ILE 61 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2ed9 n THR 62 N 2.79 1.16 -2.41 1.39 -2.24 -1.19 -4.92 114.28 108.85 2ed9 n THR 62 Ca 0.21 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 2ed9 n THR 62 Cb 0.14 -1.43 0.00 0.00 -2.10 0.00 0.00 70.33 66.95 2ed9 n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ed9 n GLY 63 N 2.21 2.67 3.17 3.38 0.00 -1.26 -4.99 105.19 110.38 2ed9 n GLY 63 Ca -0.38 -0.87 -0.13 0.00 0.00 0.00 0.00 46.02 44.64 2ed9 n GLY 63 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ed9 s TYR 64 N -5.24 1.00 -0.19 1.61 1.51 -1.26 -2.34 117.35 112.44 2ed9 s TYR 64 Ca 0.00 -0.73 -0.02 0.00 -1.01 0.00 0.00 57.07 55.31 2ed9 s TYR 64 Cb 0.00 -0.55 -0.01 0.00 -0.11 0.00 0.00 41.96 41.29 2ed9 s TYR 64 CO 0.00 -0.04 -0.09 0.21 -1.11 0.00 0.00 175.55 174.52 2ed9 s LYS 65 N -3.09 3.32 -0.24 -0.62 2.47 -0.51 -4.06 119.74 117.00 2ed9 s LYS 65 Ca 0.07 -0.67 -0.05 0.00 -1.56 0.00 0.00 55.97 53.76 2ed9 s LYS 65 Cb -0.01 -2.83 -0.01 0.00 -1.46 0.00 0.00 37.83 33.52 2ed9 s LYS 65 CO -0.01 -0.09 -0.00 0.42 0.16 0.00 0.00 175.35 175.83 2ed9 s ILE 66 N 1.14 3.66 0.01 5.43 1.01 1.00 -1.32 121.20 132.13 2ed9 s ILE 66 Ca 0.01 -0.45 0.08 0.00 0.00 0.00 0.00 60.65 60.29 2ed9 s ILE 66 Cb -0.14 -2.71 -0.02 0.00 0.01 0.00 0.00 42.46 39.59 2ed9 s ILE 66 CO -0.03 0.35 -0.25 -0.13 0.00 0.00 0.00 174.94 174.89 2ed9 s ARG 67 N 1.51 1.87 0.05 2.79 0.52 -0.21 -1.27 118.95 124.20 2ed9 s ARG 67 Ca 0.05 -0.99 0.00 0.00 -0.52 0.00 0.00 55.73 54.28 2ed9 s ARG 67 Cb -0.15 -1.93 -0.03 0.00 0.52 0.00 0.00 34.95 33.37 2ed9 s ARG 67 CO -0.01 0.51 -0.05 -3.38 0.02 0.00 0.00 175.30 172.40 2ed9 s HIS 68 N -0.70 0.53 -0.01 -0.53 -3.43 -1.24 0.89 115.29 110.81 2ed9 s HIS 68 Ca 0.10 -0.75 -0.09 0.00 -0.80 0.00 0.00 55.06 53.53 2ed9 s HIS 68 Cb -0.10 -0.35 0.01 0.00 -1.43 0.00 0.00 32.58 30.71 2ed9 s HIS 68 CO 0.01 -0.22 0.18 -0.98 -2.00 0.00 0.00 174.74 171.73 2ed9 s ARG 69 N -2.61 0.49 -0.10 -0.38 1.70 -1.21 -3.08 118.95 113.76 2ed9 s ARG 69 Ca -0.03 -0.26 -0.04 0.00 -0.47 0.00 0.00 55.73 54.92 2ed9 s ARG 69 Cb -0.02 0.21 -0.04 0.00 -0.57 0.00 0.00 34.95 34.53 2ed9 s ARG 69 CO -0.04 -0.12 0.07 0.21 -1.08 0.00 0.00 175.30 174.35 2ed9 s LYS 70 N -1.16 3.21 0.51 3.89 2.20 -1.26 -2.57 119.74 124.55 2ed9 s LYS 70 Ca -0.12 -0.27 0.30 0.00 -0.36 0.00 0.00 55.97 55.51 2ed9 s LYS 70 Cb -0.06 -2.99 1.41 0.00 -1.51 0.00 0.00 37.83 34.67 2ed9 s LYS 70 CO 0.02 0.74 1.84 1.79 -0.36 0.00 0.00 175.35 179.37 2ed9 h THR 71 N 4.02 0.51 -2.38 3.43 1.35 -1.96 -3.42 112.91 114.45 2ed9 h THR 71 Ca -0.53 -0.03 -0.25 0.00 -0.55 0.00 0.00 66.41 65.04 2ed9 h THR 71 Cb 1.21 0.40 0.15 0.00 -1.73 0.00 0.00 68.15 68.17 2ed9 h THR 71 CO 0.57 0.02 -0.10 0.35 -0.25 0.00 0.00 175.52 176.11 2ed9 n THR 72 N -4.32 0.00 -1.19 6.82 -2.24 -1.26 -4.88 114.28 107.20 2ed9 n THR 72 Ca 0.22 -0.04 -0.38 0.00 -2.27 0.00 0.00 64.05 61.58 2ed9 n THR 72 Cb 1.03 -0.74 0.02 0.00 -2.10 0.00 0.00 70.33 68.54 2ed9 n THR 72 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2ed9 n ARG 73 N -4.55 0.03 -1.01 -0.78 1.74 -1.26 -4.75 116.66 106.08 2ed9 n ARG 73 Ca 0.10 0.01 -0.32 0.00 -0.77 0.00 0.00 57.85 56.87 2ed9 n ARG 73 Cb 0.41 -1.07 0.01 0.00 -1.02 0.00 0.00 32.46 30.80 2ed9 n ARG 73 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2ed9 n ARG 74 N 1.57 0.00 0.00 5.56 1.74 -1.26 -4.84 116.66 119.43 2ed9 n ARG 74 Ca 0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 2ed9 n ARG 74 Cb 0.49 -0.84 0.00 0.00 -1.02 0.00 0.00 32.46 31.09 2ed9 n ARG 74 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ed9 n GLY 75 N 2.27 0.00 3.78 -0.13 0.00 -1.26 -5.03 105.19 104.83 2ed9 n GLY 75 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 2ed9 n GLY 75 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ed9 s GLU 76 N 0.00 2.84 0.21 1.61 2.02 -1.26 -4.60 118.70 119.51 2ed9 s GLU 76 Ca 0.00 1.29 -0.10 0.00 0.02 0.00 0.00 54.97 56.18 2ed9 s GLU 76 Cb 0.00 -1.96 -0.01 0.00 0.10 0.00 0.00 34.13 32.26 2ed9 s GLU 76 CO 0.00 -1.21 0.37 -1.64 0.02 0.00 0.00 175.26 172.80 2ed9 s MET 77 N -4.26 1.35 -0.03 1.61 -1.94 -1.18 -5.04 119.30 109.81 2ed9 s MET 77 Ca 0.65 -1.24 0.01 0.00 -1.71 0.00 0.00 55.69 53.40 2ed9 s MET 77 Cb -0.19 0.42 0.02 0.00 2.01 0.00 0.00 34.83 37.09 2ed9 s MET 77 CO 0.43 -0.53 -0.03 -1.21 -0.01 0.00 0.00 175.02 173.68 2ed9 s GLU 78 N -4.01 0.50 -0.15 2.03 2.02 -1.26 -3.63 118.70 114.19 2ed9 s GLU 78 Ca 0.21 -0.05 -0.14 0.00 0.02 0.00 0.00 54.97 55.01 2ed9 s GLU 78 Cb 0.02 -0.57 0.04 0.00 0.10 0.00 0.00 34.13 33.72 2ed9 s GLU 78 CO 0.05 -0.05 0.41 0.99 0.02 0.00 0.00 175.26 176.68 2ed9 s THR 79 N 0.68 0.00 0.13 3.63 2.01 -0.40 -5.01 115.64 116.68 2ed9 s THR 79 Ca -0.08 -0.01 0.09 0.00 0.31 0.00 0.00 61.69 62.00 2ed9 s THR 79 Cb -0.11 -0.58 -0.04 0.00 0.01 0.00 0.00 72.50 71.78 2ed9 s THR 79 CO -0.01 -0.01 -0.21 -1.48 -0.69 0.00 0.00 174.62 172.23 2ed9 s LEU 80 N 0.18 2.36 -0.25 4.42 0.05 -1.26 -0.00 118.68 124.18 2ed9 s LEU 80 Ca -0.00 -0.77 -0.03 0.00 0.05 0.00 0.00 54.13 53.38 2ed9 s LEU 80 Cb -0.03 -0.90 0.08 0.00 -2.05 0.00 0.00 46.19 43.29 2ed9 s LEU 80 CO 0.01 0.04 0.09 -0.70 -0.55 0.00 0.00 176.35 175.23 2ed9 s GLU 81 N -2.29 0.46 0.35 1.48 2.12 -1.26 -5.00 118.70 114.56 2ed9 s GLU 81 Ca 0.11 -0.57 0.14 0.00 0.36 0.00 0.00 54.97 55.01 2ed9 s GLU 81 Cb -0.08 -1.78 0.63 0.00 0.26 0.00 0.00 34.13 33.16 2ed9 s GLU 81 CO 0.06 -0.84 1.75 -1.00 -0.54 0.00 0.00 175.26 174.69 2ed9 h PRO 82 N 8.27 0.00 0.00 4.30 0.13 -1.94 -3.33 132.00 139.43 2ed9 h PRO 82 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 2ed9 h PRO 82 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2ed9 h PRO 82 CO 0.39 0.44 0.00 0.09 -0.23 0.00 0.00 178.00 178.69 2ed9 n ASN 83 N -3.87 0.00 -3.80 1.44 3.02 -1.26 -4.83 115.26 105.95 2ed9 n ASN 83 Ca -0.01 0.97 -0.15 0.00 -0.03 0.00 0.00 54.58 55.35 2ed9 n ASN 83 Cb 0.48 -0.47 -0.09 0.00 -0.61 0.00 0.00 39.78 39.10 2ed9 n ASN 83 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2ed9 s ASN 84 N -2.85 0.85 -0.11 6.41 0.01 -1.25 -5.03 114.94 112.97 2ed9 s ASN 84 Ca 0.00 -1.55 0.02 0.00 -0.71 0.00 0.00 52.86 50.62 2ed9 s ASN 84 Cb 0.00 0.47 0.21 0.00 0.41 0.00 0.00 41.25 42.34 2ed9 s ASN 84 CO 0.00 -0.95 1.13 0.18 -1.51 0.00 0.00 177.10 175.95 2ed9 n LEU 85 N -0.44 3.51 -3.93 0.60 4.77 -1.26 -4.80 117.00 115.46 2ed9 n LEU 85 Ca 0.04 -1.80 -0.12 0.00 -0.03 0.00 0.00 56.01 54.10 2ed9 n LEU 85 Cb 0.64 -0.58 -0.13 0.00 -2.33 0.00 0.00 43.42 41.02 2ed9 n LEU 85 CO 0.32 0.56 -0.37 -1.66 -1.33 0.00 0.00 177.39 174.91 2ed9 s TRP 86 N -1.16 0.19 -0.21 -1.77 1.48 -1.26 -2.76 118.94 113.44 2ed9 s TRP 86 Ca 0.16 -0.18 -0.03 0.00 -1.06 0.00 0.00 56.10 54.99 2ed9 s TRP 86 Cb 0.13 -0.12 0.07 0.00 -1.16 0.00 0.00 33.47 32.39 2ed9 s TRP 86 CO 0.04 -0.06 0.04 -0.47 -4.06 0.00 0.00 176.95 172.45 2ed9 s TYR 87 N -0.49 1.09 -0.55 1.66 6.14 -1.03 -5.01 117.35 119.15 2ed9 s TYR 87 Ca -0.04 -0.96 -0.23 0.00 0.64 0.00 0.00 57.07 56.48 2ed9 s TYR 87 Cb -0.04 -1.10 0.05 0.00 0.42 0.00 0.00 41.96 41.29 2ed9 s TYR 87 CO -0.00 -0.65 0.86 -1.17 0.64 0.00 0.00 175.55 175.23 2ed9 s LEU 88 N 1.84 4.38 0.23 6.97 1.98 -1.26 -3.16 118.68 129.66 2ed9 s LEU 88 Ca 0.00 -0.60 -0.19 0.00 -2.89 0.00 0.00 54.13 50.46 2ed9 s LEU 88 Cb -0.17 -2.67 -0.08 0.00 0.66 0.00 0.00 46.19 43.93 2ed9 s LEU 88 CO -0.11 -1.17 0.71 -0.36 -1.89 0.00 0.00 176.35 173.54 2ed9 s PHE 89 N 3.61 3.62 0.05 5.38 0.08 -0.79 -4.94 117.98 124.99 2ed9 s PHE 89 Ca 0.25 1.35 -0.04 0.00 0.12 0.00 0.00 56.93 58.62 2ed9 s PHE 89 Cb -0.15 -2.60 -0.02 0.00 -0.57 0.00 0.00 43.02 39.68 2ed9 s PHE 89 CO 0.16 0.32 0.05 0.95 -0.10 0.00 0.00 175.22 176.59 2ed9 s THR 90 N -1.56 0.17 0.00 0.64 -4.23 -1.26 -1.34 115.64 108.07 2ed9 s THR 90 Ca 0.44 -1.43 0.00 0.00 -1.18 0.00 0.00 61.69 59.52 2ed9 s THR 90 Cb -0.16 -1.23 0.00 0.00 1.34 0.00 0.00 72.50 72.45 2ed9 s THR 90 CO 0.21 -0.79 0.00 0.61 -0.54 0.00 0.00 174.62 174.11 2ed9 n GLY 91 N 0.35 0.66 3.95 3.99 0.00 0.28 -4.95 105.19 109.47 2ed9 n GLY 91 Ca -0.16 -0.49 -0.22 0.00 0.00 0.00 0.00 46.02 45.15 2ed9 n GLY 91 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ed9 s LEU 92 N -1.39 3.07 0.10 0.99 1.43 -0.93 -5.04 118.68 116.90 2ed9 s LEU 92 Ca 0.00 -0.94 0.02 0.00 -1.03 0.00 0.00 54.13 52.18 2ed9 s LEU 92 Cb 0.00 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.53 2ed9 s LEU 92 CO 0.00 -1.05 0.18 -1.61 0.23 0.00 0.00 176.35 174.10 2ed9 s GLU 93 N -4.38 3.23 0.48 1.70 8.01 -1.26 -4.45 118.70 122.03 2ed9 s GLU 93 Ca 0.48 -0.60 -0.02 0.00 0.01 0.00 0.00 54.97 54.85 2ed9 s GLU 93 Cb -0.04 -2.89 -0.00 0.00 -4.31 0.00 0.00 34.13 26.88 2ed9 s GLU 93 CO 0.29 0.56 0.73 -1.59 0.01 0.00 0.00 175.26 175.27 2ed9 s LYS 94 N -2.72 3.08 -1.44 1.61 -2.85 -1.25 -4.35 119.74 111.81 2ed9 s LYS 94 Ca 0.33 -0.31 -0.09 0.00 -1.00 0.00 0.00 55.97 54.90 2ed9 s LYS 94 Cb -0.12 -2.47 0.03 0.00 -2.06 0.00 0.00 37.83 33.20 2ed9 s LYS 94 CO 0.26 -0.36 0.97 0.41 0.10 0.00 0.00 175.35 176.73 2ed9 n GLY 95 N -2.21 -0.53 3.40 0.59 0.00 -1.26 -4.98 105.19 100.21 2ed9 n GLY 95 Ca 0.02 0.21 -0.21 0.00 0.00 0.00 0.00 46.02 46.04 2ed9 n GLY 95 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ed9 s SER 96 N -3.13 1.97 -0.23 1.61 0.01 -1.26 -5.06 113.70 107.60 2ed9 s SER 96 Ca 0.53 -1.49 0.02 0.00 1.31 0.00 0.00 55.95 56.31 2ed9 s SER 96 Cb -0.24 0.23 0.05 0.00 0.21 0.00 0.00 66.02 66.27 2ed9 s SER 96 CO 0.65 -0.78 -0.11 -1.58 0.41 0.00 0.00 173.24 171.84 2ed9 s GLN 97 N -3.87 2.13 0.22 12.44 0.74 -1.26 -3.64 119.66 126.42 2ed9 s GLN 97 Ca 0.34 -1.09 0.09 0.00 0.05 0.00 0.00 55.36 54.74 2ed9 s GLN 97 Cb 0.06 -2.67 -0.04 0.00 1.10 0.00 0.00 33.01 31.45 2ed9 s GLN 97 CO 0.15 -0.50 -0.04 0.71 -0.55 0.00 0.00 175.29 175.06 2ed9 s TYR 98 N 1.26 2.69 0.19 1.67 2.02 -1.17 -3.39 117.35 120.61 2ed9 s TYR 98 Ca -0.05 -0.21 0.03 0.00 -0.37 0.00 0.00 57.07 56.47 2ed9 s TYR 98 Cb -0.18 -1.25 -0.05 0.00 -0.40 0.00 0.00 41.96 40.08 2ed9 s TYR 98 CO -0.07 0.57 -0.02 0.45 -1.57 0.00 0.00 175.55 174.91 2ed9 s SER 99 N -3.23 1.55 0.17 2.29 0.15 -1.06 -1.56 113.70 112.01 2ed9 s SER 99 Ca 0.28 -1.16 -0.05 0.00 0.70 0.00 0.00 55.95 55.72 2ed9 s SER 99 Cb -0.08 0.05 -0.02 0.00 -1.71 0.00 0.00 66.02 64.26 2ed9 s SER 99 CO 0.18 -0.51 0.20 -0.36 1.20 0.00 0.00 173.24 173.95 2ed9 s PHE 100 N -3.51 0.67 -0.22 3.44 0.40 -1.10 -3.33 117.98 114.33 2ed9 s PHE 100 Ca 0.24 -1.01 -0.20 0.00 -0.60 0.00 0.00 56.93 55.36 2ed9 s PHE 100 Cb 0.05 -0.25 0.06 0.00 0.51 0.00 0.00 43.02 43.39 2ed9 s PHE 100 CO 0.05 -0.67 0.58 -1.14 0.70 0.00 0.00 175.22 174.74 2ed9 s GLN 101 N -4.03 0.67 -0.04 0.44 0.74 0.26 -3.51 119.66 114.19 2ed9 s GLN 101 Ca 0.24 0.81 0.06 0.00 0.05 0.00 0.00 55.36 56.52 2ed9 s GLN 101 Cb 0.05 0.32 -0.01 0.00 1.10 0.00 0.00 33.01 34.47 2ed9 s GLN 101 CO 0.03 -0.08 -0.22 0.08 -0.55 0.00 0.00 175.29 174.56 2ed9 s VAL 102 N 0.36 1.75 -0.01 1.34 1.01 -1.26 -1.05 120.40 122.55 2ed9 s VAL 102 Ca -0.00 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.09 2ed9 s VAL 102 Cb -0.04 -1.48 -0.01 0.00 0.00 0.00 0.00 36.38 34.85 2ed9 s VAL 102 CO 0.00 0.49 -0.08 -0.44 0.00 0.00 0.00 175.10 175.08 2ed9 s SER 103 N -0.20 0.93 -0.34 3.32 0.01 -0.43 -1.98 113.70 115.01 2ed9 s SER 103 Ca -0.00 -0.15 -0.25 0.00 1.31 0.00 0.00 55.95 56.86 2ed9 s SER 103 Cb -0.11 -0.10 0.01 0.00 0.21 0.00 0.00 66.02 66.02 2ed9 s SER 103 CO 0.02 0.10 0.87 0.00 0.41 0.00 0.00 173.24 174.63 2ed9 s ALA 104 N -0.19 3.47 0.02 1.44 0.00 -1.26 -1.43 121.76 123.81 2ed9 s ALA 104 Ca 0.03 -0.42 -0.15 0.00 0.00 0.00 0.00 51.96 51.42 2ed9 s ALA 104 Cb -0.03 -3.43 -0.06 0.00 0.00 0.00 0.00 23.12 19.60 2ed9 s ALA 104 CO -0.00 -1.41 0.44 -1.64 0.00 0.00 0.00 175.76 173.14 2ed9 s MET 105 N 3.23 3.95 0.23 0.00 -1.94 -0.99 -0.28 119.30 123.50 2ed9 s MET 105 Ca 0.36 0.45 0.10 0.00 -1.71 0.00 0.00 55.69 54.88 2ed9 s MET 105 Cb -0.13 -3.19 -0.05 0.00 2.01 0.00 0.00 34.83 33.47 2ed9 s MET 105 CO 0.15 0.67 -0.17 0.95 -0.01 0.00 0.00 175.02 176.61 2ed9 s THR 106 N -1.13 2.05 0.62 2.05 -4.23 -0.06 -3.19 115.64 111.76 2ed9 s THR 106 Ca 0.26 -2.25 0.21 0.00 -1.18 0.00 0.00 61.69 58.74 2ed9 s THR 106 Cb -0.17 -2.12 0.29 0.00 1.34 0.00 0.00 72.50 71.84 2ed9 s THR 106 CO 0.15 -0.47 1.45 1.62 -0.54 0.00 0.00 174.62 176.83 2ed9 h VAL 107 N 2.56 0.08 0.00 2.29 3.04 -1.78 -2.54 116.25 119.89 2ed9 h VAL 107 Ca -0.40 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.29 2ed9 h VAL 107 Cb 1.23 0.23 0.00 0.00 -2.01 0.00 0.00 31.29 30.74 2ed9 h VAL 107 CO 0.59 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 177.74 2ed9 n ASN 108 N -3.12 0.00 -2.81 3.17 3.02 -1.26 -5.06 115.26 109.20 2ed9 n ASN 108 Ca 0.11 0.21 -0.14 0.00 -0.03 0.00 0.00 54.58 54.73 2ed9 n ASN 108 Cb 1.06 -0.36 -0.03 0.00 -0.61 0.00 0.00 39.78 39.84 2ed9 n ASN 108 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ed9 n GLY 109 N 1.99 2.32 3.83 7.41 0.00 -0.96 -5.02 105.19 114.76 2ed9 n GLY 109 Ca 0.00 -1.63 -0.32 0.00 0.00 0.00 0.00 46.02 44.07 2ed9 n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ed9 s THR 110 N -2.83 4.21 0.49 2.61 2.01 -1.26 -0.88 115.64 119.99 2ed9 s THR 110 Ca 0.27 0.91 0.02 0.00 0.31 0.00 0.00 61.69 63.19 2ed9 s THR 110 Cb -0.01 -3.56 0.09 0.00 0.01 0.00 0.00 72.50 69.04 2ed9 s THR 110 CO 0.19 -0.76 0.67 0.61 -0.69 0.00 0.00 174.62 174.65 2ed9 n GLY 111 N -1.70 1.00 3.77 4.40 0.00 0.62 -4.54 105.19 108.73 2ed9 n GLY 111 Ca 0.07 -2.06 -0.38 0.00 0.00 0.00 0.00 46.02 43.65 2ed9 n GLY 111 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ed9 s PRO 112 N -4.19 4.01 -0.22 1.61 0.04 -1.26 -4.68 135.00 130.31 2ed9 s PRO 112 Ca 0.46 1.87 -0.29 0.00 0.04 0.00 0.00 61.00 63.08 2ed9 s PRO 112 Cb -0.03 -2.66 -0.03 0.00 0.04 0.00 0.00 34.50 31.82 2ed9 s PRO 112 CO 0.30 -0.36 1.61 -1.25 0.04 0.00 0.00 177.00 177.33 2ed9 s PRO 113 N -2.33 3.81 1.08 0.56 0.04 -1.26 -4.52 135.00 132.38 2ed9 s PRO 113 Ca 0.58 1.67 -0.12 0.00 0.04 0.00 0.00 61.00 63.17 2ed9 s PRO 113 Cb -0.31 -4.03 0.24 0.00 0.04 0.00 0.00 34.50 30.43 2ed9 s PRO 113 CO 0.40 -1.27 1.07 -1.54 0.04 0.00 0.00 177.00 175.69 2ed9 s SER 114 N 4.17 1.64 1.00 6.66 1.04 -0.84 -4.92 113.70 122.45 2ed9 s SER 114 Ca 0.71 1.73 -0.18 0.00 0.48 0.00 0.00 55.95 58.70 2ed9 s SER 114 Cb -0.25 -2.39 -0.12 0.00 0.10 0.00 0.00 66.02 63.36 2ed9 s SER 114 CO 0.29 -3.83 -0.71 -3.20 0.98 0.00 0.00 173.24 166.78 2ed9 n ASN 115 N -4.68 -5.03 -4.29 7.02 2.85 -1.26 -4.64 115.26 105.23 2ed9 n ASN 115 Ca 0.06 0.17 -0.45 0.00 -0.11 0.00 0.00 54.58 54.25 2ed9 n ASN 115 Cb 0.54 -0.80 -0.04 0.00 1.24 0.00 0.00 39.78 40.72 2ed9 n ASN 115 CO 0.00 0.00 0.00 0.26 -2.11 0.00 0.00 177.26 175.41 2ed9 s TRP 116 N -2.06 3.61 -0.24 1.20 0.52 -1.26 -4.68 118.94 116.02 2ed9 s TRP 116 Ca 0.42 -1.93 -0.28 0.00 0.02 0.00 0.00 56.10 54.33 2ed9 s TRP 116 Cb -0.15 -3.73 0.01 0.00 -1.15 0.00 0.00 33.47 28.45 2ed9 s TRP 116 CO 0.78 -0.98 0.99 0.71 0.02 0.00 0.00 176.95 178.47 2ed9 s TYR 117 N 0.48 3.31 -0.11 -1.98 1.51 -1.23 -4.90 117.35 114.42 2ed9 s TYR 117 Ca 0.14 1.34 -0.11 0.00 -1.01 0.00 0.00 57.07 57.44 2ed9 s TYR 117 Cb -0.16 -3.26 -0.05 0.00 -0.11 0.00 0.00 41.96 38.38 2ed9 s TYR 117 CO -0.06 -0.49 0.24 0.99 -1.11 0.00 0.00 175.55 175.12 2ed9 s THR 118 N 3.16 5.33 -0.08 -0.71 2.01 -1.26 -2.72 115.64 121.37 2ed9 s THR 118 Ca 0.42 0.44 0.03 0.00 0.31 0.00 0.00 61.69 62.89 2ed9 s THR 118 Cb -0.15 -3.54 0.00 0.00 0.01 0.00 0.00 72.50 68.83 2ed9 s THR 118 CO 0.07 0.54 -0.19 0.00 -0.69 0.00 0.00 174.62 174.35 2ed9 s ALA 119 N -0.53 1.76 -0.22 7.40 0.00 -0.60 -5.02 121.76 124.55 2ed9 s ALA 119 Ca 0.17 -0.73 -0.11 0.00 0.00 0.00 0.00 51.96 51.28 2ed9 s ALA 119 Cb -0.13 -0.68 -0.05 0.00 0.00 0.00 0.00 23.12 22.26 2ed9 s ALA 119 CO 0.06 0.23 0.20 -1.21 0.00 0.00 0.00 175.76 175.03 2ed9 s GLU 120 N 0.42 4.12 0.38 0.00 2.02 -1.26 -3.07 118.70 121.31 2ed9 s GLU 120 Ca -0.15 -0.17 -0.24 0.00 0.02 0.00 0.00 54.97 54.43 2ed9 s GLU 120 Cb -0.16 -3.51 -0.10 0.00 0.10 0.00 0.00 34.13 30.46 2ed9 s GLU 120 CO 0.06 0.11 0.98 0.95 0.02 0.00 0.00 175.26 177.38 2ed9 s THR 121 N 0.91 4.10 -0.40 3.63 -4.23 -1.24 -4.98 115.64 113.45 2ed9 s THR 121 Ca 0.10 1.55 -0.28 0.00 -1.18 0.00 0.00 61.69 61.88 2ed9 s THR 121 Cb -0.13 -3.77 -0.01 0.00 1.34 0.00 0.00 72.50 69.92 2ed9 s THR 121 CO 0.04 -0.05 1.72 -2.16 -0.54 0.00 0.00 174.62 173.63 2ed9 s PRO 122 N -2.56 3.27 0.41 3.99 0.04 -1.26 -4.09 135.00 134.79 2ed9 s PRO 122 Ca 0.57 1.18 0.27 0.00 0.04 0.00 0.00 61.00 63.05 2ed9 s PRO 122 Cb -0.17 -4.19 1.42 0.00 0.04 0.00 0.00 34.50 31.60 2ed9 s PRO 122 CO 0.21 -1.94 1.57 0.39 0.04 0.00 0.00 177.00 177.27 2ed9 n GLU 123 N 8.49 -0.05 0.00 4.56 4.71 -1.26 -4.63 120.64 132.46 2ed9 n GLU 123 Ca 0.21 1.32 0.00 0.00 -0.01 0.00 0.00 57.16 58.68 2ed9 n GLU 123 Cb 0.48 -2.48 0.00 0.00 -1.01 0.00 0.00 31.44 28.43 2ed9 n GLU 123 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31