#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 0.16 0.21 1.61 1.04 -1.26 -5.03 113.70 110.43 2ed9 s SER 2 Ca 0.00 0.96 0.01 0.00 0.48 0.00 0.00 55.95 57.40 2ed9 s SER 2 Cb 0.00 -1.41 -0.04 0.00 0.10 0.00 0.00 66.02 64.67 2ed9 s SER 2 CO 0.00 -4.63 0.39 -0.55 0.98 0.00 0.00 173.24 169.43 2ed9 s SER 3 N -3.23 6.36 0.00 7.02 0.15 -1.26 -4.97 113.70 117.78 2ed9 s SER 3 Ca 0.69 0.32 0.00 0.00 0.70 0.00 0.00 55.95 57.66 2ed9 s SER 3 Cb -0.15 -1.97 0.00 0.00 -1.71 0.00 0.00 66.02 62.18 2ed9 s SER 3 CO 0.59 -0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.58 2ed9 n GLY 4 N -0.87 -2.03 3.43 9.45 0.00 -1.26 -5.17 105.19 108.74 2ed9 n GLY 4 Ca -0.06 0.61 -0.22 0.00 0.00 0.00 0.00 46.02 46.35 2ed9 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ed9 s SER 5 N -0.42 2.25 0.36 1.61 0.15 -1.26 -5.18 113.70 111.21 2ed9 s SER 5 Ca 0.00 -1.60 -0.11 0.00 0.70 0.00 0.00 55.95 54.94 2ed9 s SER 5 Cb 0.00 0.40 0.03 0.00 -1.71 0.00 0.00 66.02 64.74 2ed9 s SER 5 CO 0.00 -0.89 0.65 -0.44 1.20 0.00 0.00 173.24 173.76 2ed9 s SER 6 N -3.50 0.35 0.00 5.45 0.01 -1.26 -5.16 113.70 109.60 2ed9 s SER 6 Ca 0.30 -1.25 0.00 0.00 1.31 0.00 0.00 55.95 56.32 2ed9 s SER 6 Cb 0.04 0.76 0.00 0.00 0.21 0.00 0.00 66.02 67.03 2ed9 s SER 6 CO 0.16 -1.49 0.00 0.61 0.41 0.00 0.00 173.24 172.93 2ed9 n GLY 7 N -0.53 3.30 3.65 3.44 0.00 -1.26 -5.18 105.19 108.60 2ed9 n GLY 7 Ca -0.04 -0.36 -0.01 0.00 0.00 0.00 0.00 46.02 45.61 2ed9 n GLY 7 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2ed9 s ASN 8 N 0.00 -0.32 0.56 1.61 2.47 -1.26 -5.17 114.94 112.84 2ed9 s ASN 8 Ca 0.00 0.51 -0.11 0.00 0.42 0.00 0.00 52.86 53.68 2ed9 s ASN 8 Cb 0.00 1.09 -0.05 0.00 -1.45 0.00 0.00 41.25 40.84 2ed9 s ASN 8 CO 0.00 -0.08 0.96 -0.13 -3.72 0.00 0.00 177.10 174.13 2ed9 s ARG 9 N 1.14 3.67 0.20 0.43 3.00 -1.26 -5.08 118.95 121.04 2ed9 s ARG 9 Ca -0.08 0.67 -0.23 0.00 0.00 0.00 0.00 55.73 56.09 2ed9 s ARG 9 Cb -0.03 -2.16 0.05 0.00 0.00 0.00 0.00 34.95 32.80 2ed9 s ARG 9 CO -0.13 -0.42 0.81 0.71 0.00 0.00 0.00 175.30 176.27 2ed9 s TYR 10 N -2.95 -0.22 0.20 -0.53 2.02 -1.26 -5.18 117.35 109.43 2ed9 s TYR 10 Ca 0.54 -0.13 0.11 0.00 -0.37 0.00 0.00 57.07 57.21 2ed9 s TYR 10 Cb -0.11 0.66 -0.04 0.00 -0.40 0.00 0.00 41.96 42.06 2ed9 s TYR 10 CO 0.47 -1.00 -0.18 0.20 -1.57 0.00 0.00 175.55 173.47 2ed9 s GLY 11 N -2.88 1.73 0.77 0.71 0.00 -1.26 -5.13 107.32 101.26 2ed9 s GLY 11 Ca 0.10 -1.61 -0.11 0.00 0.00 0.00 0.00 44.72 43.11 2ed9 s GLY 11 CO 0.02 -1.64 1.09 2.56 0.00 0.00 0.00 173.10 175.13 2ed9 s PRO 12 N -2.83 2.26 0.00 2.90 0.04 -1.26 -5.06 135.00 131.05 2ed9 s PRO 12 Ca 0.23 1.18 0.00 0.00 0.04 0.00 0.00 61.00 62.46 2ed9 s PRO 12 Cb -0.08 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.56 2ed9 s PRO 12 CO 0.12 -1.64 0.00 0.41 0.04 0.00 0.00 177.00 175.93 2ed9 n GLY 13 N -1.16 5.19 3.58 0.56 0.00 -1.26 -5.16 105.19 106.94 2ed9 n GLY 13 Ca 0.09 -0.93 -0.33 0.00 0.00 0.00 0.00 46.02 44.85 2ed9 n GLY 13 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ed9 s VAL 14 N 2.96 3.61 0.49 1.61 1.01 -1.26 -5.13 120.40 123.68 2ed9 s VAL 14 Ca 0.00 -0.68 0.08 0.00 0.00 0.00 0.00 61.98 61.38 2ed9 s VAL 14 Cb 0.00 -2.53 0.04 0.00 0.00 0.00 0.00 36.38 33.90 2ed9 s VAL 14 CO 0.00 0.48 0.66 -0.94 0.00 0.00 0.00 175.10 175.30 2ed9 s SER 15 N -1.17 5.42 0.11 3.32 1.04 -1.26 -5.14 113.70 116.03 2ed9 s SER 15 Ca 0.15 -0.57 0.03 0.00 0.48 0.00 0.00 55.95 56.04 2ed9 s SER 15 Cb -0.11 -0.30 -0.04 0.00 0.10 0.00 0.00 66.02 65.67 2ed9 s SER 15 CO 0.05 -1.00 -0.08 -0.89 0.98 0.00 0.00 173.24 172.29 2ed9 s THR 16 N -2.49 0.88 0.11 2.02 2.01 -1.26 -5.16 115.64 111.75 2ed9 s THR 16 Ca 0.58 -1.90 0.05 0.00 0.31 0.00 0.00 61.69 60.72 2ed9 s THR 16 Cb -0.08 -1.65 -0.04 0.00 0.01 0.00 0.00 72.50 70.74 2ed9 s THR 16 CO 0.36 -0.77 0.05 1.51 -0.69 0.00 0.00 174.62 175.07 2ed9 s ASP 17 N -2.94 5.23 0.49 3.53 -4.77 -1.26 -5.13 116.67 111.82 2ed9 s ASP 17 Ca 0.12 -0.15 0.02 0.00 -3.30 0.00 0.00 52.55 49.23 2ed9 s ASP 17 Cb 0.03 -1.30 -0.01 0.00 -1.09 0.00 0.00 42.92 40.55 2ed9 s ASP 17 CO -0.02 0.14 0.05 1.51 0.70 0.00 0.00 175.17 177.55 2ed9 s ASP 18 N -2.56 3.73 0.01 2.11 1.47 -1.26 -5.16 116.67 115.00 2ed9 s ASP 18 Ca 0.28 -1.71 0.04 0.00 1.18 0.00 0.00 52.55 52.34 2ed9 s ASP 18 Cb -0.11 0.65 -0.01 0.00 -0.34 0.00 0.00 42.92 43.10 2ed9 s ASP 18 CO 0.20 -0.94 -0.14 0.27 0.68 0.00 0.00 175.17 175.24 2ed9 s ILE 19 N -3.00 1.09 -0.10 2.11 -5.25 -1.26 -5.15 121.20 109.65 2ed9 s ILE 19 Ca 0.08 -0.73 -0.12 0.00 -0.99 0.00 0.00 60.65 58.89 2ed9 s ILE 19 Cb 0.01 -0.94 0.03 0.00 2.95 0.00 0.00 42.46 44.51 2ed9 s ILE 19 CO 0.06 0.20 0.33 0.42 -1.79 0.00 0.00 174.94 174.15 2ed9 s THR 20 N -0.51 0.01 -0.34 8.37 -4.23 -1.26 -5.13 115.64 112.56 2ed9 s THR 20 Ca 0.04 -0.12 0.01 0.00 -1.18 0.00 0.00 61.69 60.44 2ed9 s THR 20 Cb -0.06 -0.50 0.11 0.00 1.34 0.00 0.00 72.50 73.38 2ed9 s THR 20 CO 0.00 -0.07 0.11 0.54 -0.54 0.00 0.00 174.62 174.66 2ed9 s VAL 21 N -0.20 1.39 -0.40 2.29 0.11 -1.26 -4.97 120.40 117.35 2ed9 s VAL 21 Ca -0.03 -1.87 0.01 0.00 -2.93 0.00 0.00 61.98 57.16 2ed9 s VAL 21 Cb -0.03 -2.03 0.45 0.00 -1.53 0.00 0.00 36.38 33.23 2ed9 s VAL 21 CO 0.01 -0.68 1.82 0.55 -3.33 0.00 0.00 175.10 173.47 2ed9 n VAL 22 N 4.47 2.89 -2.78 2.04 3.14 -1.26 -4.96 118.33 121.87 2ed9 n VAL 22 Ca 0.01 -1.78 -0.39 0.00 -2.96 0.00 0.00 64.34 59.22 2ed9 n VAL 22 Cb 0.41 -0.84 -0.06 0.00 -1.06 0.00 0.00 33.84 32.29 2ed9 n VAL 22 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 2ed9 s THR 23 N -2.93 4.13 -0.09 1.55 2.01 -1.26 -5.06 115.64 113.99 2ed9 s THR 23 Ca 0.45 1.98 0.02 0.00 0.31 0.00 0.00 61.69 64.46 2ed9 s THR 23 Cb 0.37 -4.23 0.01 0.00 0.01 0.00 0.00 72.50 68.67 2ed9 s THR 23 CO 0.05 0.40 -0.16 -0.22 -0.69 0.00 0.00 174.62 174.00 2ed9 s LEU 24 N -1.42 1.79 0.27 4.42 2.96 -1.26 -5.12 118.68 120.32 2ed9 s LEU 24 Ca 0.43 -0.42 -0.20 0.00 -0.22 0.00 0.00 54.13 53.72 2ed9 s LEU 24 Cb -0.24 -1.09 0.06 0.00 0.50 0.00 0.00 46.19 45.42 2ed9 s LEU 24 CO 0.29 0.05 0.90 -0.94 -1.32 0.00 0.00 176.35 175.33 2ed9 s SER 25 N 0.75 -0.05 0.00 3.68 1.04 -1.26 -5.05 113.70 112.82 2ed9 s SER 25 Ca -0.12 -0.81 0.00 0.00 0.48 0.00 0.00 55.95 55.50 2ed9 s SER 25 Cb -0.16 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.62 2ed9 s SER 25 CO 0.02 -1.29 0.47 0.47 0.98 0.00 0.00 173.24 173.90 2ed9 n ASP 26 N -1.11 0.94 -4.25 7.02 8.00 -1.26 -5.08 116.55 120.81 2ed9 n ASP 26 Ca -0.06 -1.06 -0.38 0.00 0.71 0.00 0.00 54.79 54.00 2ed9 n ASP 26 Cb 0.60 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.72 2ed9 n ASP 26 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2ed9 n VAL 27 N -0.03 0.32 -1.42 2.53 0.24 -1.26 -4.64 118.33 114.07 2ed9 n VAL 27 Ca 0.00 -0.49 -0.32 0.00 -2.04 0.00 0.00 64.34 61.49 2ed9 n VAL 27 Cb 0.05 -0.11 0.08 0.00 -1.47 0.00 0.00 33.84 32.39 2ed9 n VAL 27 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2ed9 s PRO 28 N -1.35 2.43 0.00 7.34 0.04 -1.26 -4.89 135.00 137.31 2ed9 s PRO 28 Ca 0.56 1.24 0.12 0.00 0.04 0.00 0.00 61.00 62.97 2ed9 s PRO 28 Cb -0.44 -1.91 0.32 0.00 0.04 0.00 0.00 34.50 32.51 2ed9 s PRO 28 CO 0.67 -1.52 1.25 0.43 0.04 0.00 0.00 177.00 177.87 2ed9 n SER 29 N -3.16 2.94 -3.82 6.66 7.64 -1.26 -4.31 113.62 118.32 2ed9 n SER 29 Ca 0.10 -1.95 -0.12 0.00 1.01 0.00 0.00 58.87 57.90 2ed9 n SER 29 Cb 0.53 -0.23 -0.13 0.00 -1.01 0.00 0.00 64.21 63.36 2ed9 n SER 29 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ed9 s ALA 30 N -1.01 -0.36 0.98 -0.43 0.00 -1.26 -5.00 121.76 114.69 2ed9 s ALA 30 Ca 0.25 0.43 -0.12 0.00 0.00 0.00 0.00 51.96 52.52 2ed9 s ALA 30 Cb 0.13 -0.26 0.18 0.00 0.00 0.00 0.00 23.12 23.18 2ed9 s ALA 30 CO 0.18 -0.08 1.09 -1.25 0.00 0.00 0.00 175.76 175.70 2ed9 s PRO 31 N 0.14 0.57 0.00 0.00 0.04 -1.26 -4.64 135.00 129.85 2ed9 s PRO 31 Ca -0.01 0.57 0.00 0.00 0.04 0.00 0.00 61.00 61.61 2ed9 s PRO 31 Cb -0.02 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.77 2ed9 s PRO 31 CO -0.00 -2.65 0.00 -0.35 0.04 0.00 0.00 177.00 174.04 2ed9 n PRO 32 N -4.13 0.22 -4.27 0.56 -0.04 -1.26 -4.57 135.00 121.51 2ed9 n PRO 32 Ca 0.06 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.37 2ed9 n PRO 32 Cb 0.57 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.93 2ed9 n PRO 32 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2ed9 s GLN 33 N -1.16 1.15 -1.20 0.54 -0.21 0.22 -4.85 119.66 114.16 2ed9 s GLN 33 Ca 0.00 -1.54 -0.01 0.00 0.02 0.00 0.00 55.36 53.84 2ed9 s GLN 33 Cb 0.00 -0.54 -0.01 0.00 1.00 0.00 0.00 33.01 33.46 2ed9 s GLN 33 CO 0.00 -0.02 0.95 -1.71 -2.12 0.00 0.00 175.29 172.39 2ed9 n ASN 34 N -0.27 -2.35 -4.36 5.90 5.15 -1.26 0.93 115.26 119.00 2ed9 n ASN 34 Ca -0.08 -0.66 -0.46 0.00 -0.60 0.00 0.00 54.58 52.79 2ed9 n ASN 34 Cb 0.62 -4.99 -0.03 0.00 -0.53 0.00 0.00 39.78 34.85 2ed9 n ASN 34 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2ed9 s VAL 35 N -3.40 5.22 0.15 3.44 1.01 -1.26 -3.68 120.40 121.88 2ed9 s VAL 35 Ca 0.04 -1.86 -0.11 0.00 0.00 0.00 0.00 61.98 60.05 2ed9 s VAL 35 Cb -0.01 -4.52 0.00 0.00 0.00 0.00 0.00 36.38 31.85 2ed9 s VAL 35 CO 0.74 -1.13 0.32 -0.94 0.00 0.00 0.00 175.10 174.09 2ed9 s SER 36 N 2.95 -0.02 0.15 3.32 1.04 -1.26 -5.01 113.70 114.86 2ed9 s SER 36 Ca 0.18 -0.72 0.05 0.00 0.48 0.00 0.00 55.95 55.94 2ed9 s SER 36 Cb -0.14 0.45 -0.04 0.00 0.10 0.00 0.00 66.02 66.39 2ed9 s SER 36 CO -0.04 -0.89 0.08 -0.76 0.98 0.00 0.00 173.24 172.61 2ed9 s LEU 37 N -2.92 3.66 -0.07 2.42 1.43 -1.26 -4.24 118.68 117.70 2ed9 s LEU 37 Ca 0.12 -0.18 -0.01 0.00 -1.03 0.00 0.00 54.13 53.03 2ed9 s LEU 37 Cb 0.03 -2.30 0.03 0.00 0.03 0.00 0.00 46.19 43.98 2ed9 s LEU 37 CO -0.03 0.10 0.01 -0.70 0.23 0.00 0.00 176.35 175.95 2ed9 s GLU 38 N -2.90 0.55 -0.78 1.70 2.12 -0.83 -5.04 118.70 113.52 2ed9 s GLU 38 Ca 0.29 0.12 -0.21 0.00 0.36 0.00 0.00 54.97 55.54 2ed9 s GLU 38 Cb -0.10 -0.92 0.09 0.00 0.26 0.00 0.00 34.13 33.46 2ed9 s GLU 38 CO 0.22 -0.30 1.05 0.08 -0.54 0.00 0.00 175.26 175.77 2ed9 s VAL 39 N 1.94 4.47 0.13 3.70 1.01 -1.26 -0.87 120.40 129.51 2ed9 s VAL 39 Ca 0.04 -0.86 -0.04 0.00 0.00 0.00 0.00 61.98 61.12 2ed9 s VAL 39 Cb -0.12 -4.74 -0.17 0.00 0.00 0.00 0.00 36.38 31.35 2ed9 s VAL 39 CO -0.05 -1.50 1.32 0.58 0.00 0.00 0.00 175.10 175.45 2ed9 h VAL 40 N 5.96 1.39 -2.56 2.92 2.07 -1.81 -3.49 116.25 120.75 2ed9 h VAL 40 Ca -0.09 -2.40 -0.02 0.00 0.82 0.00 0.00 66.70 65.01 2ed9 h VAL 40 Cb 1.05 2.37 0.00 0.00 -1.52 0.00 0.00 31.29 33.19 2ed9 h VAL 40 CO 1.17 0.72 0.13 0.59 0.02 0.00 0.00 177.57 180.19 2ed9 n ASN 41 N -3.76 -1.18 0.26 0.57 3.02 -0.28 -4.95 115.26 108.93 2ed9 n ASN 41 Ca -0.06 -1.85 0.15 0.00 -0.03 0.00 0.00 54.58 52.79 2ed9 n ASN 41 Cb 0.82 1.97 0.49 0.00 -0.61 0.00 0.00 39.78 42.45 2ed9 n ASN 41 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2ed9 h SER 42 N 1.04 0.00 0.00 6.41 4.64 -1.90 -3.20 113.55 120.55 2ed9 h SER 42 Ca -0.17 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.10 2ed9 h SER 42 Cb 0.65 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.63 2ed9 h SER 42 CO 0.22 0.00 -0.54 -2.11 -0.87 0.00 0.00 176.83 173.54 2ed9 n ARG 43 N -3.10 0.66 -3.72 4.77 1.85 -1.26 -4.40 116.66 111.46 2ed9 n ARG 43 Ca 0.02 -2.17 -0.12 0.00 -1.00 0.00 0.00 57.85 54.58 2ed9 n ARG 43 Cb 0.39 -0.85 -0.12 0.00 -1.05 0.00 0.00 32.46 30.84 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 -2.22 -0.39 -0.04 2.89 0.01 -1.21 -1.18 113.70 111.55 2ed9 s SER 44 Ca 0.25 0.71 -0.01 0.00 1.31 0.00 0.00 55.95 58.21 2ed9 s SER 44 Cb 0.26 0.61 0.03 0.00 0.21 0.00 0.00 66.02 67.13 2ed9 s SER 44 CO -0.06 -0.17 0.03 -0.63 0.41 0.00 0.00 173.24 172.83 2ed9 s ILE 45 N 1.15 0.06 0.12 1.44 1.01 -0.37 -1.13 121.20 123.49 2ed9 s ILE 45 Ca -0.08 0.28 -0.15 0.00 0.00 0.00 0.00 60.65 60.70 2ed9 s ILE 45 Cb -0.08 -0.26 -0.07 0.00 0.01 0.00 0.00 42.46 42.06 2ed9 s ILE 45 CO -0.09 0.19 0.54 -0.75 0.00 0.00 0.00 174.94 174.83 2ed9 s LYS 46 N 1.83 4.01 -0.00 2.79 2.47 -0.05 -1.08 119.74 129.71 2ed9 s LYS 46 Ca 0.01 0.53 0.01 0.00 -1.56 0.00 0.00 55.97 54.96 2ed9 s LYS 46 Cb -0.12 -3.00 -0.00 0.00 -1.46 0.00 0.00 37.83 33.24 2ed9 s LYS 46 CO -0.03 0.52 -0.05 0.08 0.16 0.00 0.00 175.35 176.03 2ed9 s VAL 47 N -1.38 0.38 0.22 4.02 1.01 -1.01 -1.97 120.40 121.69 2ed9 s VAL 47 Ca 0.35 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.09 2ed9 s VAL 47 Cb -0.16 -0.33 -0.04 0.00 0.00 0.00 0.00 36.38 35.85 2ed9 s VAL 47 CO 0.19 0.08 0.16 -0.94 0.00 0.00 0.00 175.10 174.58 2ed9 s SER 48 N -0.19 0.45 0.17 3.32 1.04 -1.26 -0.84 113.70 116.39 2ed9 s SER 48 Ca 0.01 -1.46 -0.24 0.00 0.48 0.00 0.00 55.95 54.75 2ed9 s SER 48 Cb -0.02 0.41 0.07 0.00 0.10 0.00 0.00 66.02 66.57 2ed9 s SER 48 CO -0.00 -0.88 0.99 -1.66 0.98 0.00 0.00 173.24 172.67 2ed9 s TRP 49 N -4.02 -0.05 0.06 5.02 -2.14 -0.68 -4.36 118.94 112.76 2ed9 s TRP 49 Ca 0.39 -0.30 -0.06 0.00 2.66 0.00 0.00 56.10 58.80 2ed9 s TRP 49 Cb 0.06 0.67 -0.02 0.00 -3.10 0.00 0.00 33.47 31.08 2ed9 s TRP 49 CO 0.15 -0.87 0.10 -0.51 -2.66 0.00 0.00 176.95 173.16 2ed9 s LEU 50 N -3.10 1.83 0.75 -4.66 1.43 0.26 -4.87 118.68 110.33 2ed9 s LEU 50 Ca 0.16 -0.71 -0.11 0.00 -1.03 0.00 0.00 54.13 52.43 2ed9 s LEU 50 Cb -0.02 0.68 0.05 0.00 0.03 0.00 0.00 46.19 46.93 2ed9 s LEU 50 CO 0.03 -0.63 1.09 -2.16 0.23 0.00 0.00 176.35 174.92 2ed9 s PRO 51 N -3.51 2.34 0.92 1.29 0.04 -1.26 -0.61 135.00 134.21 2ed9 s PRO 51 Ca 0.03 1.21 -0.12 0.00 0.04 0.00 0.00 61.00 62.16 2ed9 s PRO 51 Cb 0.04 -1.91 0.14 0.00 0.04 0.00 0.00 34.50 32.82 2ed9 s PRO 51 CO -0.09 -1.58 1.09 -1.25 0.04 0.00 0.00 177.00 175.21 2ed9 s PRO 52 N -4.77 1.09 0.55 0.56 0.04 -1.26 -4.17 135.00 127.05 2ed9 s PRO 52 Ca 0.62 0.76 -0.19 0.00 0.04 0.00 0.00 61.00 62.23 2ed9 s PRO 52 Cb -0.18 -1.79 -0.05 0.00 0.04 0.00 0.00 34.50 32.51 2ed9 s PRO 52 CO 0.54 -2.34 1.13 -1.25 0.04 0.00 0.00 177.00 175.12 2ed9 s PRO 53 N -4.94 3.32 1.05 0.56 0.04 -1.26 -4.89 135.00 128.88 2ed9 s PRO 53 Ca 0.64 1.59 -0.17 0.00 0.04 0.00 0.00 61.00 63.10 2ed9 s PRO 53 Cb -0.18 -2.00 0.06 0.00 0.04 0.00 0.00 34.50 32.41 2ed9 s PRO 53 CO 0.57 -0.87 0.05 -1.13 0.04 0.00 0.00 177.00 175.66 2ed9 n SER 54 N -1.38 -2.44 0.00 6.66 3.41 -1.26 -3.14 113.62 115.47 2ed9 n SER 54 Ca 0.11 0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 2ed9 n SER 54 Cb 0.51 -1.02 0.00 0.00 -0.26 0.00 0.00 64.21 63.44 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 1.96 1.55 0.22 5.00 0.00 -1.26 -4.46 105.19 108.20 2ed9 n GLY 55 Ca 0.03 -0.04 0.04 0.00 0.00 0.00 0.00 46.02 46.05 2ed9 n GLY 55 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2ed9 h THR 56 N 0.00 1.16 -1.69 2.61 1.35 -1.94 -3.43 112.91 110.97 2ed9 h THR 56 Ca 0.00 -0.76 -0.65 0.00 -0.55 0.00 0.00 66.41 64.45 2ed9 h THR 56 Cb 0.00 1.37 0.01 0.00 -1.73 0.00 0.00 68.15 67.79 2ed9 h THR 56 CO 0.00 0.22 1.19 0.00 -0.25 0.00 0.00 175.52 176.69 2ed9 n GLN 57 N -4.28 1.70 0.01 4.72 6.02 -1.23 -4.51 117.38 119.81 2ed9 n GLN 57 Ca -0.02 0.58 -0.02 0.00 -0.01 0.00 0.00 57.00 57.53 2ed9 n GLN 57 Cb 0.28 -2.57 -0.10 0.00 1.02 0.00 0.00 30.24 28.87 2ed9 n GLN 57 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2ed9 n ASN 58 N 7.80 0.79 -3.51 1.08 4.05 -1.26 -4.98 115.26 119.24 2ed9 n ASN 58 Ca 0.29 0.35 -0.16 0.00 0.45 0.00 0.00 54.58 55.51 2ed9 n ASN 58 Cb 0.27 0.22 -0.05 0.00 1.23 0.00 0.00 39.78 41.44 2ed9 n ASN 58 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 2ed9 s GLY 59 N -4.88 -0.57 -0.20 8.20 0.00 -1.26 -5.02 107.32 103.59 2ed9 s GLY 59 Ca -0.04 1.23 -0.35 0.00 0.00 0.00 0.00 44.72 45.56 2ed9 s GLY 59 CO 0.82 0.83 1.99 0.33 0.00 0.00 0.00 173.10 177.06 2ed9 n PHE 60 N 0.68 2.06 -1.55 1.90 7.35 -1.26 -4.74 117.46 121.90 2ed9 n PHE 60 Ca -0.18 0.12 -0.39 0.00 -0.76 0.00 0.00 57.45 56.25 2ed9 n PHE 60 Cb 0.58 -2.61 -0.04 0.00 0.35 0.00 0.00 39.48 37.76 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 5.93 0.01 0.04 -2.13 -0.00 -1.26 -4.33 119.36 117.62 2ed9 n ILE 61 Ca 0.29 -0.65 -0.02 0.00 -0.00 0.00 0.00 62.75 62.37 2ed9 n ILE 61 Cb 0.27 -2.52 0.25 0.00 -0.00 0.00 0.00 39.64 37.63 2ed9 n ILE 61 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.55 177.26 2ed9 h THR 62 N 7.60 1.25 -0.14 1.39 1.35 -1.76 -3.48 112.91 119.12 2ed9 h THR 62 Ca -0.26 -1.16 0.00 0.00 -0.55 0.00 0.00 66.41 64.44 2ed9 h THR 62 Cb 1.27 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 69.01 2ed9 h THR 62 CO 1.13 0.37 0.00 0.61 -0.25 0.00 0.00 175.52 177.38 2ed9 n GLY 63 N -0.49 2.35 3.26 5.82 0.00 -1.25 -4.95 105.19 109.93 2ed9 n GLY 63 Ca -0.00 -0.45 -0.11 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.36 -0.08 -0.08 1.61 2.02 -1.26 -2.80 117.35 115.39 2ed9 s TYR 64 Ca 0.00 -0.13 0.02 0.00 -0.37 0.00 0.00 57.07 56.59 2ed9 s TYR 64 Cb 0.00 0.10 0.01 0.00 -0.40 0.00 0.00 41.96 41.67 2ed9 s TYR 64 CO 0.00 -0.54 -0.15 0.21 -1.57 0.00 0.00 175.55 173.50 2ed9 s LYS 65 N -2.98 2.07 -0.25 -0.62 2.20 -1.10 -3.82 119.74 115.25 2ed9 s LYS 65 Ca -0.02 -0.53 -0.05 0.00 -0.36 0.00 0.00 55.97 55.01 2ed9 s LYS 65 Cb 0.01 -1.70 -0.00 0.00 -1.51 0.00 0.00 37.83 34.62 2ed9 s LYS 65 CO -0.06 0.02 0.01 0.42 -0.36 0.00 0.00 175.35 175.38 2ed9 s ILE 66 N 0.73 3.67 -0.23 5.43 1.01 0.10 -2.00 121.20 129.91 2ed9 s ILE 66 Ca -0.13 -0.53 -0.08 0.00 0.00 0.00 0.00 60.65 59.92 2ed9 s ILE 66 Cb -0.16 -2.76 -0.04 0.00 0.01 0.00 0.00 42.46 39.51 2ed9 s ILE 66 CO 0.03 0.30 0.09 -0.13 0.00 0.00 0.00 174.94 175.23 2ed9 s ARG 67 N 1.50 3.83 0.01 2.79 1.81 -0.76 -2.45 118.95 125.68 2ed9 s ARG 67 Ca 0.05 -0.40 0.00 0.00 -1.72 0.00 0.00 55.73 53.66 2ed9 s ARG 67 Cb -0.15 -3.36 -0.01 0.00 -0.45 0.00 0.00 34.95 30.98 2ed9 s ARG 67 CO -0.00 -0.02 -0.02 -3.38 -0.68 0.00 0.00 175.30 171.19 2ed9 s HIS 68 N 1.21 0.20 -0.05 -0.53 -3.43 -1.23 -0.43 115.29 111.02 2ed9 s HIS 68 Ca 0.05 -0.21 -0.25 0.00 -0.80 0.00 0.00 55.06 53.85 2ed9 s HIS 68 Cb -0.14 -0.14 0.06 0.00 -1.43 0.00 0.00 32.58 30.93 2ed9 s HIS 68 CO 0.04 -0.06 0.57 -0.98 -2.00 0.00 0.00 174.74 172.30 2ed9 s ARG 69 N -0.58 0.92 0.43 -0.38 1.70 -1.19 -2.82 118.95 117.03 2ed9 s ARG 69 Ca -0.05 0.18 -0.12 0.00 -0.47 0.00 0.00 55.73 55.27 2ed9 s ARG 69 Cb -0.04 0.43 -0.07 0.00 -0.57 0.00 0.00 34.95 34.70 2ed9 s ARG 69 CO -0.00 -0.27 0.82 0.21 -1.08 0.00 0.00 175.30 174.98 2ed9 s LYS 70 N -1.10 3.82 -1.05 3.89 2.20 -1.25 -2.96 119.74 123.29 2ed9 s LYS 70 Ca -0.11 0.58 -0.19 0.00 -0.36 0.00 0.00 55.97 55.89 2ed9 s LYS 70 Cb -0.02 -2.34 -0.08 0.00 -1.51 0.00 0.00 37.83 33.89 2ed9 s LYS 70 CO 0.08 -0.08 2.03 -2.37 -0.36 0.00 0.00 175.35 174.64 2ed9 n THR 71 N -1.33 2.48 -4.30 3.43 5.66 -1.26 -4.81 114.28 114.15 2ed9 n THR 71 Ca 0.03 -2.20 -0.16 0.00 -3.05 0.00 0.00 64.05 58.68 2ed9 n THR 71 Cb 0.54 -2.42 -0.10 0.00 -1.55 0.00 0.00 70.33 66.80 2ed9 n THR 71 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2ed9 s THR 72 N 4.60 1.03 0.19 1.09 2.01 -1.26 -5.04 115.64 118.27 2ed9 s THR 72 Ca 0.54 -2.04 -0.10 0.00 0.31 0.00 0.00 61.69 60.41 2ed9 s THR 72 Cb 0.13 -2.17 0.25 0.00 0.01 0.00 0.00 72.50 70.72 2ed9 s THR 72 CO 0.04 -0.47 1.16 0.54 -0.69 0.00 0.00 174.62 175.21 2ed9 n ARG 73 N -0.33 -0.13 -3.63 4.92 3.00 -1.26 -4.54 116.66 114.68 2ed9 n ARG 73 Ca -0.07 1.15 -0.11 0.00 -0.01 0.00 0.00 57.85 58.81 2ed9 n ARG 73 Cb 0.63 -1.72 -0.07 0.00 0.00 0.00 0.00 32.46 31.30 2ed9 n ARG 73 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 2ed9 s ARG 74 N -5.81 0.68 0.00 5.56 1.70 -1.26 -5.13 118.95 114.69 2ed9 s ARG 74 Ca -0.11 0.84 0.00 0.00 -0.47 0.00 0.00 55.73 56.00 2ed9 s ARG 74 Cb 0.17 0.31 0.00 0.00 -0.57 0.00 0.00 34.95 34.87 2ed9 s ARG 74 CO 0.55 -0.09 0.00 0.41 -1.08 0.00 0.00 175.30 175.10 2ed9 n GLY 75 N 2.66 -0.02 3.09 3.88 0.00 -1.26 -5.08 105.19 108.46 2ed9 n GLY 75 Ca -0.14 0.50 -0.22 0.00 0.00 0.00 0.00 46.02 46.16 2ed9 n GLY 75 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ed9 s GLU 76 N 0.00 1.16 0.28 1.61 2.12 -1.26 -3.75 118.70 118.86 2ed9 s GLU 76 Ca 0.00 -0.48 0.10 0.00 0.36 0.00 0.00 54.97 54.95 2ed9 s GLU 76 Cb 0.00 -1.10 -0.05 0.00 0.26 0.00 0.00 34.13 33.23 2ed9 s GLU 76 CO 0.00 0.27 -0.14 1.41 -0.54 0.00 0.00 175.26 176.26 2ed9 s MET 77 N -0.23 1.63 0.07 4.30 -2.45 -1.13 -5.05 119.30 116.43 2ed9 s MET 77 Ca 0.04 -1.78 0.09 0.00 -1.25 0.00 0.00 55.69 52.79 2ed9 s MET 77 Cb -0.06 -1.54 -0.03 0.00 1.25 0.00 0.00 34.83 34.44 2ed9 s MET 77 CO -0.00 0.22 -0.23 -1.21 1.05 0.00 0.00 175.02 174.85 2ed9 s GLU 78 N -3.59 1.82 -0.24 4.11 8.01 -1.26 -3.57 118.70 123.98 2ed9 s GLU 78 Ca 0.29 -1.12 -0.15 0.00 0.01 0.00 0.00 54.97 54.00 2ed9 s GLU 78 Cb -0.01 -2.05 0.07 0.00 -4.31 0.00 0.00 34.13 27.82 2ed9 s GLU 78 CO 0.13 0.51 0.59 0.99 0.01 0.00 0.00 175.26 177.49 2ed9 s THR 79 N -0.93 -0.01 0.00 3.63 2.01 -1.02 -5.05 115.64 114.27 2ed9 s THR 79 Ca 0.14 0.03 0.02 0.00 0.31 0.00 0.00 61.69 62.19 2ed9 s THR 79 Cb -0.10 -0.85 -0.01 0.00 0.01 0.00 0.00 72.50 71.55 2ed9 s THR 79 CO 0.05 0.01 -0.07 -1.48 -0.69 0.00 0.00 174.62 172.44 2ed9 s LEU 80 N 1.28 2.06 -0.29 4.42 0.05 -1.26 0.03 118.68 124.96 2ed9 s LEU 80 Ca -0.08 -0.19 -0.02 0.00 0.05 0.00 0.00 54.13 53.89 2ed9 s LEU 80 Cb -0.06 -0.29 0.09 0.00 -2.05 0.00 0.00 46.19 43.88 2ed9 s LEU 80 CO -0.13 0.02 0.10 -0.70 -0.55 0.00 0.00 176.35 175.09 2ed9 s GLU 81 N -0.42 0.54 0.29 1.48 2.56 -1.25 -4.99 118.70 116.90 2ed9 s GLU 81 Ca 0.00 -0.80 0.07 0.00 0.00 0.00 0.00 54.97 54.24 2ed9 s GLU 81 Cb -0.04 -1.75 0.43 0.00 2.00 0.00 0.00 34.13 34.77 2ed9 s GLU 81 CO -0.00 -0.94 1.68 -1.00 -0.56 0.00 0.00 175.26 174.43 2ed9 h PRO 82 N 8.21 0.19 -0.01 4.30 0.13 -1.92 -3.33 132.00 139.58 2ed9 h PRO 82 Ca -0.16 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2ed9 h PRO 82 Cb 1.03 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.16 2ed9 h PRO 82 CO 0.44 0.62 -0.01 -0.91 -0.23 0.00 0.00 178.00 177.92 2ed9 h ASN 83 N 0.16 -0.03 -1.88 1.44 2.35 -1.96 -3.44 115.58 112.22 2ed9 h ASN 83 Ca 0.01 0.00 -0.61 0.00 -0.55 0.00 0.00 56.30 55.15 2ed9 h ASN 83 Cb 0.88 0.01 -0.13 0.00 0.05 0.00 0.00 38.32 39.13 2ed9 h ASN 83 CO 0.07 -0.00 -0.62 0.20 -1.65 0.00 0.00 177.43 175.42 2ed9 s ASN 84 N -2.83 3.70 -0.26 5.81 0.01 -1.25 -5.03 114.94 115.09 2ed9 s ASN 84 Ca -0.00 -1.32 0.03 0.00 -0.71 0.00 0.00 52.86 50.86 2ed9 s ASN 84 Cb 0.00 -0.36 0.43 0.00 0.41 0.00 0.00 41.25 41.73 2ed9 s ASN 84 CO 0.01 -0.40 1.52 0.18 -1.51 0.00 0.00 177.10 176.90 2ed9 n LEU 85 N -0.89 5.09 -3.80 0.60 4.77 -1.26 -4.77 117.00 116.73 2ed9 n LEU 85 Ca -0.05 -2.67 -0.13 0.00 -0.03 0.00 0.00 56.01 53.14 2ed9 n LEU 85 Cb 0.66 -0.69 -0.12 0.00 -2.33 0.00 0.00 43.42 40.93 2ed9 n LEU 85 CO 0.47 0.78 -0.14 -1.66 -1.33 0.00 0.00 177.39 175.51 2ed9 s TRP 86 N -2.04 -0.23 -0.05 -1.77 1.48 -1.26 -1.69 118.94 113.38 2ed9 s TRP 86 Ca 0.35 0.56 -0.01 0.00 -1.06 0.00 0.00 56.10 55.94 2ed9 s TRP 86 Cb 0.29 0.07 0.03 0.00 -1.16 0.00 0.00 33.47 32.70 2ed9 s TRP 86 CO 0.07 -0.12 0.02 -0.47 -4.06 0.00 0.00 176.95 172.39 2ed9 s TYR 87 N 0.22 0.40 -0.14 1.66 6.14 -0.02 -4.96 117.35 120.66 2ed9 s TYR 87 Ca -0.01 -0.00 -0.07 0.00 0.64 0.00 0.00 57.07 57.63 2ed9 s TYR 87 Cb -0.02 -0.61 -0.04 0.00 0.42 0.00 0.00 41.96 41.71 2ed9 s TYR 87 CO -0.01 -0.24 0.12 -1.17 0.64 0.00 0.00 175.55 174.90 2ed9 s LEU 88 N 1.77 4.21 -0.16 6.97 0.20 -1.26 -2.39 118.68 128.03 2ed9 s LEU 88 Ca 0.01 0.35 -0.03 0.00 0.69 0.00 0.00 54.13 55.15 2ed9 s LEU 88 Cb -0.13 -2.04 -0.02 0.00 -0.43 0.00 0.00 46.19 43.57 2ed9 s LEU 88 CO -0.04 0.33 -0.06 -0.36 -0.29 0.00 0.00 176.35 175.94 2ed9 s PHE 89 N -0.58 2.96 0.19 5.38 0.40 -0.24 -4.95 117.98 121.14 2ed9 s PHE 89 Ca 0.12 -0.47 0.09 0.00 -0.60 0.00 0.00 56.93 56.08 2ed9 s PHE 89 Cb -0.12 -1.95 -0.04 0.00 0.51 0.00 0.00 43.02 41.42 2ed9 s PHE 89 CO 0.02 -0.15 -0.19 0.95 0.70 0.00 0.00 175.22 176.55 2ed9 s THR 90 N 0.50 2.00 0.00 0.64 -4.23 -1.26 -1.24 115.64 112.06 2ed9 s THR 90 Ca -0.05 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.45 2ed9 s THR 90 Cb -0.15 -1.97 0.00 0.00 1.34 0.00 0.00 72.50 71.72 2ed9 s THR 90 CO 0.03 -0.30 0.00 0.61 -0.54 0.00 0.00 174.62 174.42 2ed9 n GLY 91 N 0.15 1.14 3.98 3.99 0.00 -0.33 -4.99 105.19 109.14 2ed9 n GLY 91 Ca -0.12 -0.25 -0.20 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.22 4.02 0.60 0.99 1.43 -1.24 -5.08 118.68 119.17 2ed9 s LEU 92 Ca 0.00 -0.10 -0.07 0.00 -1.03 0.00 0.00 54.13 52.93 2ed9 s LEU 92 Cb 0.00 -2.81 -0.00 0.00 0.03 0.00 0.00 46.19 43.41 2ed9 s LEU 92 CO 0.00 -0.38 0.94 -1.61 0.23 0.00 0.00 176.35 175.52 2ed9 s GLU 93 N -4.17 3.10 0.46 1.70 0.41 -1.26 -4.48 118.70 114.45 2ed9 s GLU 93 Ca 0.43 0.21 -0.08 0.00 -0.41 0.00 0.00 54.97 55.13 2ed9 s GLU 93 Cb -0.09 -2.22 -0.05 0.00 -1.78 0.00 0.00 34.13 29.99 2ed9 s GLU 93 CO 0.31 -0.67 0.80 -1.59 -0.49 0.00 0.00 175.26 173.62 2ed9 s LYS 94 N -5.04 3.65 -1.45 1.61 -2.85 -1.26 -4.26 119.74 110.14 2ed9 s LYS 94 Ca 0.54 0.35 -0.04 0.00 -1.00 0.00 0.00 55.97 55.82 2ed9 s LYS 94 Cb -0.11 -2.36 0.00 0.00 -2.06 0.00 0.00 37.83 33.31 2ed9 s LYS 94 CO 0.47 -0.16 0.25 0.41 0.10 0.00 0.00 175.35 176.42 2ed9 n GLY 95 N -1.88 -0.26 3.35 0.59 0.00 -1.25 -4.95 105.19 100.79 2ed9 n GLY 95 Ca 0.02 0.20 -0.18 0.00 0.00 0.00 0.00 46.02 46.05 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 -4.26 1.90 0.12 1.61 0.01 -1.26 -4.98 113.70 106.84 2ed9 s SER 96 Ca 0.07 -1.25 0.07 0.00 1.31 0.00 0.00 55.95 56.14 2ed9 s SER 96 Cb -0.03 -0.00 -0.04 0.00 0.21 0.00 0.00 66.02 66.16 2ed9 s SER 96 CO 0.95 -0.54 -0.05 -1.58 0.41 0.00 0.00 173.24 172.44 2ed9 s GLN 97 N -3.87 2.31 0.10 12.44 0.74 -1.26 -2.47 119.66 127.64 2ed9 s GLN 97 Ca 0.30 -1.00 -0.15 0.00 0.05 0.00 0.00 55.36 54.56 2ed9 s GLN 97 Cb 0.06 -2.38 0.03 0.00 1.10 0.00 0.00 33.01 31.82 2ed9 s GLN 97 CO 0.10 0.50 0.37 0.71 -0.55 0.00 0.00 175.29 176.43 2ed9 s TYR 98 N -1.39 -0.17 0.15 1.67 2.02 -1.10 -4.32 117.35 114.22 2ed9 s TYR 98 Ca 0.24 -0.10 0.05 0.00 -0.37 0.00 0.00 57.07 56.89 2ed9 s TYR 98 Cb -0.11 0.20 -0.04 0.00 -0.40 0.00 0.00 41.96 41.61 2ed9 s TYR 98 CO 0.16 -0.65 -0.12 -1.12 -1.57 0.00 0.00 175.55 172.26 2ed9 s SER 99 N -2.62 1.92 0.22 2.29 0.01 -1.16 -2.12 113.70 112.25 2ed9 s SER 99 Ca 0.01 -0.96 -0.10 0.00 1.31 0.00 0.00 55.95 56.22 2ed9 s SER 99 Cb 0.02 -0.04 -0.01 0.00 0.21 0.00 0.00 66.02 66.20 2ed9 s SER 99 CO -0.10 -0.26 0.37 -0.36 0.41 0.00 0.00 173.24 173.30 2ed9 s PHE 100 N -2.96 0.51 0.08 2.43 0.40 -1.14 -3.14 117.98 114.15 2ed9 s PHE 100 Ca 0.15 -0.84 -0.26 0.00 -0.60 0.00 0.00 56.93 55.38 2ed9 s PHE 100 Cb 0.00 0.00 0.09 0.00 0.51 0.00 0.00 43.02 43.62 2ed9 s PHE 100 CO 0.02 -0.87 0.75 -1.14 0.70 0.00 0.00 175.22 174.68 2ed9 s GLN 101 N -4.03 1.05 -0.01 0.44 0.74 0.43 -3.61 119.66 114.67 2ed9 s GLN 101 Ca 0.24 -0.39 0.00 0.00 0.05 0.00 0.00 55.36 55.27 2ed9 s GLN 101 Cb 0.02 0.48 0.01 0.00 1.10 0.00 0.00 33.01 34.62 2ed9 s GLN 101 CO 0.07 -0.46 -0.00 0.08 -0.55 0.00 0.00 175.29 174.43 2ed9 s VAL 102 N -3.43 0.11 -0.08 1.34 1.01 -1.26 -1.84 120.40 116.25 2ed9 s VAL 102 Ca 0.03 0.04 -0.01 0.00 0.00 0.00 0.00 61.98 62.04 2ed9 s VAL 102 Cb -0.01 -0.16 0.03 0.00 0.00 0.00 0.00 36.38 36.23 2ed9 s VAL 102 CO -0.11 0.08 -0.03 -0.55 0.00 0.00 0.00 175.10 174.49 2ed9 s SER 103 N 0.54 1.72 -0.11 3.32 0.15 -0.85 -4.24 113.70 114.24 2ed9 s SER 103 Ca -0.05 -0.17 -0.29 0.00 0.70 0.00 0.00 55.95 56.14 2ed9 s SER 103 Cb -0.08 -0.59 -0.06 0.00 -1.71 0.00 0.00 66.02 63.59 2ed9 s SER 103 CO -0.01 -0.14 1.87 0.00 1.20 0.00 0.00 173.24 176.15 2ed9 s ALA 104 N 1.72 3.32 -0.04 5.45 0.00 -1.26 -2.70 121.76 128.24 2ed9 s ALA 104 Ca 0.02 0.90 -0.22 0.00 0.00 0.00 0.00 51.96 52.66 2ed9 s ALA 104 Cb -0.13 -3.88 -0.04 0.00 0.00 0.00 0.00 23.12 19.07 2ed9 s ALA 104 CO -0.05 -1.90 0.65 -1.64 0.00 0.00 0.00 175.76 172.81 2ed9 s MET 105 N 4.84 4.40 0.39 0.00 -1.94 -1.12 -0.24 119.30 125.63 2ed9 s MET 105 Ca 0.83 0.81 0.00 0.00 -1.71 0.00 0.00 55.69 55.63 2ed9 s MET 105 Cb -0.34 -3.41 0.00 0.00 2.01 0.00 0.00 34.83 33.10 2ed9 s MET 105 CO 0.35 0.19 0.02 0.25 -0.01 0.00 0.00 175.02 175.82 2ed9 n THR 106 N 3.36 0.00 0.15 2.05 -2.24 -0.10 -2.32 114.28 115.18 2ed9 n THR 106 Ca -0.04 -1.82 0.09 0.00 -2.27 0.00 0.00 64.05 60.01 2ed9 n THR 106 Cb 0.51 0.33 0.47 0.00 -2.10 0.00 0.00 70.33 69.53 2ed9 n THR 106 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2ed9 n VAL 107 N -1.01 0.93 -0.04 2.28 3.14 -1.26 -3.08 118.33 119.30 2ed9 n VAL 107 Ca -0.15 0.72 -0.04 0.00 -2.96 0.00 0.00 64.34 61.92 2ed9 n VAL 107 Cb 0.49 -1.72 -0.01 0.00 -1.06 0.00 0.00 33.84 31.53 2ed9 n VAL 107 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 2ed9 n ASN 108 N -2.13 0.84 -0.38 6.55 4.05 -1.26 -5.09 115.26 117.84 2ed9 n ASN 108 Ca -0.01 0.14 0.00 0.00 0.45 0.00 0.00 54.58 55.16 2ed9 n ASN 108 Cb 0.14 -0.57 0.00 0.00 1.23 0.00 0.00 39.78 40.58 2ed9 n ASN 108 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2ed9 n GLY 109 N 1.64 1.74 3.77 8.20 0.00 -1.18 -5.04 105.19 114.32 2ed9 n GLY 109 Ca -0.06 -0.77 -0.34 0.00 0.00 0.00 0.00 46.02 44.85 2ed9 n GLY 109 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ed9 s THR 110 N -2.56 3.05 0.00 2.61 -4.23 -1.26 -0.92 115.64 112.32 2ed9 s THR 110 Ca 0.00 0.57 0.00 0.00 -1.18 0.00 0.00 61.69 61.08 2ed9 s THR 110 Cb 0.00 -3.15 0.00 0.00 1.34 0.00 0.00 72.50 70.69 2ed9 s THR 110 CO 0.00 -0.22 0.00 0.61 -0.54 0.00 0.00 174.62 174.47 2ed9 n GLY 111 N -0.05 -0.19 3.76 3.99 0.00 0.67 -4.73 105.19 108.63 2ed9 n GLY 111 Ca 0.12 -1.74 -0.41 0.00 0.00 0.00 0.00 46.02 43.99 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 -0.08 4.46 -0.28 1.61 0.04 -1.26 -4.80 135.00 134.68 2ed9 s PRO 112 Ca 0.00 2.06 -0.29 0.00 0.04 0.00 0.00 61.00 62.81 2ed9 s PRO 112 Cb 0.00 -3.13 -0.02 0.00 0.04 0.00 0.00 34.50 31.39 2ed9 s PRO 112 CO 0.00 -0.06 1.66 -1.25 0.04 0.00 0.00 177.00 177.39 2ed9 s PRO 113 N -1.45 3.60 0.69 0.56 0.04 -1.26 -4.63 135.00 132.54 2ed9 s PRO 113 Ca 0.48 1.49 -0.12 0.00 0.04 0.00 0.00 61.00 62.90 2ed9 s PRO 113 Cb -0.37 -4.09 0.01 0.00 0.04 0.00 0.00 34.50 30.09 2ed9 s PRO 113 CO 0.47 -1.53 1.07 -1.54 0.04 0.00 0.00 177.00 175.51 2ed9 s SER 114 N 4.87 5.29 0.05 6.66 1.04 -1.26 -4.91 113.70 125.44 2ed9 s SER 114 Ca 0.73 1.71 -0.37 0.00 0.48 0.00 0.00 55.95 58.50 2ed9 s SER 114 Cb -0.23 -2.51 -0.19 0.00 0.10 0.00 0.00 66.02 63.19 2ed9 s SER 114 CO 0.31 -1.51 1.02 0.59 0.98 0.00 0.00 173.24 174.63 2ed9 n ASN 115 N -2.95 0.04 -4.57 7.02 3.02 -1.26 -4.79 115.26 111.77 2ed9 n ASN 115 Ca 0.08 1.15 -0.41 0.00 -0.03 0.00 0.00 54.58 55.37 2ed9 n ASN 115 Cb 0.53 -0.97 -0.03 0.00 -0.61 0.00 0.00 39.78 38.71 2ed9 n ASN 115 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 2ed9 s TRP 116 N -0.12 2.12 0.48 3.10 0.52 -1.26 -4.94 118.94 118.83 2ed9 s TRP 116 Ca 0.85 0.52 -0.08 0.00 0.02 0.00 0.00 56.10 57.41 2ed9 s TRP 116 Cb -1.16 -4.32 -0.05 0.00 -1.15 0.00 0.00 33.47 26.79 2ed9 s TRP 116 CO 0.56 -2.14 0.82 0.71 0.02 0.00 0.00 176.95 176.91 2ed9 s TYR 117 N 6.68 3.54 0.04 -1.98 1.51 -1.24 -4.99 117.35 120.92 2ed9 s TYR 117 Ca 0.57 0.97 0.01 0.00 -1.01 0.00 0.00 57.07 57.61 2ed9 s TYR 117 Cb -0.12 -2.41 -0.02 0.00 -0.11 0.00 0.00 41.96 39.29 2ed9 s TYR 117 CO 0.25 -0.28 -0.06 0.99 -1.11 0.00 0.00 175.55 175.34 2ed9 s THR 118 N -2.68 0.35 -0.02 -0.71 2.01 -1.26 -2.91 115.64 110.42 2ed9 s THR 118 Ca 0.50 -1.07 -0.03 0.00 0.31 0.00 0.00 61.69 61.40 2ed9 s THR 118 Cb -0.10 -0.54 0.00 0.00 0.01 0.00 0.00 72.50 71.87 2ed9 s THR 118 CO 0.42 -0.47 0.08 0.00 -0.69 0.00 0.00 174.62 173.95 2ed9 s ALA 119 N -1.60 -0.18 -0.06 7.40 0.00 -0.90 -4.95 121.76 121.47 2ed9 s ALA 119 Ca -0.11 0.04 0.01 0.00 0.00 0.00 0.00 51.96 51.89 2ed9 s ALA 119 Cb -0.09 -0.05 -0.03 0.00 0.00 0.00 0.00 23.12 22.95 2ed9 s ALA 119 CO -0.01 -0.09 -0.05 -1.21 0.00 0.00 0.00 175.76 174.40 2ed9 s GLU 120 N -0.45 2.78 0.22 0.00 2.02 -1.26 -2.69 118.70 119.32 2ed9 s GLU 120 Ca -0.05 -0.54 -0.21 0.00 0.02 0.00 0.00 54.97 54.19 2ed9 s GLU 120 Cb -0.03 -2.62 -0.08 0.00 0.10 0.00 0.00 34.13 31.49 2ed9 s GLU 120 CO 0.00 0.67 0.75 0.95 0.02 0.00 0.00 175.26 177.65 2ed9 s THR 121 N -0.84 4.50 -0.25 3.63 -4.23 -1.03 -4.97 115.64 112.44 2ed9 s THR 121 Ca 0.13 1.41 -0.29 0.00 -1.18 0.00 0.00 61.69 61.76 2ed9 s THR 121 Cb -0.11 -3.92 -0.02 0.00 1.34 0.00 0.00 72.50 69.79 2ed9 s THR 121 CO 0.02 0.26 1.63 -2.16 -0.54 0.00 0.00 174.62 173.84 2ed9 s PRO 122 N -1.83 3.70 0.41 3.99 0.04 -1.26 -3.95 135.00 136.10 2ed9 s PRO 122 Ca 0.42 1.57 0.26 0.00 0.04 0.00 0.00 61.00 63.30 2ed9 s PRO 122 Cb -0.18 -4.06 1.36 0.00 0.04 0.00 0.00 34.50 31.65 2ed9 s PRO 122 CO 0.22 -1.41 1.63 0.93 0.04 0.00 0.00 177.00 178.41 2ed9 h GLU 123 N 11.11 0.12 -0.00 4.56 5.08 -1.94 -3.41 114.58 130.09 2ed9 h GLU 123 Ca -0.33 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 2ed9 h GLU 123 Cb 1.15 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.38 2ed9 h GLU 123 CO 1.01 0.08 0.00 0.27 -1.00 0.00 0.00 179.01 179.37