#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 -0.71 0.01 1.61 0.01 -1.26 -5.18 113.70 108.18 2ed9 s SER 2 Ca 0.00 1.32 -0.28 0.00 1.31 0.00 0.00 55.95 58.29 2ed9 s SER 2 Cb 0.00 1.32 0.10 0.00 0.21 0.00 0.00 66.02 67.65 2ed9 s SER 2 CO 0.00 -0.28 0.89 -0.55 0.41 0.00 0.00 173.24 173.71 2ed9 s SER 3 N 0.21 -0.35 0.34 2.44 0.15 -1.26 -5.19 113.70 110.04 2ed9 s SER 3 Ca -0.01 -0.03 -0.12 0.00 0.70 0.00 0.00 55.95 56.49 2ed9 s SER 3 Cb -0.04 0.39 0.03 0.00 -1.71 0.00 0.00 66.02 64.69 2ed9 s SER 3 CO 0.02 -0.64 0.66 -0.83 1.20 0.00 0.00 173.24 173.64 2ed9 s GLY 4 N -2.51 0.63 -0.46 9.45 0.00 -1.26 -5.12 107.32 108.05 2ed9 s GLY 4 Ca 0.05 -0.92 0.03 0.00 0.00 0.00 0.00 44.72 43.88 2ed9 s GLY 4 CO -0.08 -0.51 0.25 -0.45 0.00 0.00 0.00 173.10 172.31 2ed9 s SER 5 N -3.09 3.75 0.09 1.64 0.15 -1.26 -5.01 113.70 109.98 2ed9 s SER 5 Ca 0.20 -2.74 -0.18 0.00 0.70 0.00 0.00 55.95 53.93 2ed9 s SER 5 Cb -0.03 -1.14 -0.04 0.00 -1.71 0.00 0.00 66.02 63.09 2ed9 s SER 5 CO 0.13 -0.25 1.10 -0.24 1.20 0.00 0.00 173.24 175.18 2ed9 n SER 6 N 3.41 -0.62 -1.41 5.45 2.88 -1.26 -4.90 113.62 117.17 2ed9 n SER 6 Ca 0.09 1.24 0.17 0.00 -1.33 0.00 0.00 58.87 59.03 2ed9 n SER 6 Cb 0.34 -0.24 -0.09 0.00 -0.75 0.00 0.00 64.21 63.48 2ed9 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ed9 n GLY 7 N -1.15 -3.11 3.16 0.46 0.00 -1.26 -5.02 105.19 98.27 2ed9 n GLY 7 Ca 0.01 -0.96 0.05 0.00 0.00 0.00 0.00 46.02 45.13 2ed9 n GLY 7 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ed9 s ASN 8 N -7.17 -0.50 0.70 1.61 -0.87 -1.26 -5.18 114.94 102.28 2ed9 s ASN 8 Ca 0.00 0.33 -0.03 0.00 -1.57 0.00 0.00 52.86 51.60 2ed9 s ASN 8 Cb 0.00 1.43 0.10 0.00 -0.02 0.00 0.00 41.25 42.75 2ed9 s ASN 8 CO 0.00 -0.09 0.64 0.54 -2.57 0.00 0.00 177.10 175.61 2ed9 n ARG 9 N 5.44 -0.07 -4.33 -0.60 1.74 -1.26 -5.13 116.66 112.44 2ed9 n ARG 9 Ca -0.07 -1.48 -0.24 0.00 -0.77 0.00 0.00 57.85 55.29 2ed9 n ARG 9 Cb 0.54 -0.50 -0.07 0.00 -1.02 0.00 0.00 32.46 31.40 2ed9 n ARG 9 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2ed9 n TYR 10 N -2.47 -0.03 0.00 -1.55 4.02 -1.26 -5.12 117.16 110.75 2ed9 n TYR 10 Ca 0.10 -2.61 0.00 0.00 -0.01 0.00 0.00 57.90 55.37 2ed9 n TYR 10 Cb 0.34 0.05 0.00 0.00 -0.02 0.00 0.00 39.34 39.71 2ed9 n TYR 10 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2ed9 n GLY 11 N -0.74 -1.41 0.00 2.72 0.00 -1.26 -5.18 105.19 99.32 2ed9 n GLY 11 Ca -0.03 0.65 0.00 0.00 0.00 0.00 0.00 46.02 46.64 2ed9 n GLY 11 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ed9 n PRO 12 N 0.00 -0.97 -4.29 1.61 -0.04 -1.26 -5.08 135.00 124.96 2ed9 n PRO 12 Ca 0.00 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.28 2ed9 n PRO 12 Cb 0.00 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.32 2ed9 n PRO 12 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2ed9 s GLY 13 N -2.46 0.46 0.30 0.55 0.00 -1.26 -5.15 107.32 99.75 2ed9 s GLY 13 Ca 0.00 -0.45 0.05 0.00 0.00 0.00 0.00 44.72 44.32 2ed9 s GLY 13 CO 0.00 -0.41 0.44 -1.34 0.00 0.00 0.00 173.10 171.78 2ed9 s VAL 14 N -0.40 4.69 -0.29 1.40 -7.23 -1.26 -5.12 120.40 112.18 2ed9 s VAL 14 Ca 0.01 -0.93 -0.19 0.00 -1.81 0.00 0.00 61.98 59.06 2ed9 s VAL 14 Cb -0.04 -3.65 0.18 0.00 0.56 0.00 0.00 36.38 33.42 2ed9 s VAL 14 CO -0.00 -0.27 1.19 -0.44 -0.31 0.00 0.00 175.10 175.27 2ed9 s SER 15 N -4.08 -0.24 -0.04 4.85 0.01 -1.26 -5.10 113.70 107.85 2ed9 s SER 15 Ca 0.40 0.40 -0.02 0.00 1.31 0.00 0.00 55.95 58.04 2ed9 s SER 15 Cb -0.09 0.84 -0.01 0.00 0.21 0.00 0.00 66.02 66.97 2ed9 s SER 15 CO 0.31 -0.07 -0.03 0.71 0.41 0.00 0.00 173.24 174.57 2ed9 h THR 16 N 4.35 0.00 -2.48 1.44 1.35 -2.10 -3.51 112.91 111.96 2ed9 h THR 16 Ca -0.27 -0.37 0.18 0.00 -0.55 0.00 0.00 66.41 65.40 2ed9 h THR 16 Cb 1.18 0.00 -0.04 0.00 -1.73 0.00 0.00 68.15 67.56 2ed9 h THR 16 CO 0.19 0.00 0.60 1.51 -0.25 0.00 0.00 175.52 177.58 2ed9 s ASP 17 N -4.14 -0.01 -0.14 5.36 -4.77 -1.26 -5.16 116.67 106.56 2ed9 s ASP 17 Ca -0.03 -0.62 -0.05 0.00 -3.30 0.00 0.00 52.55 48.56 2ed9 s ASP 17 Cb 0.00 0.47 0.07 0.00 -1.09 0.00 0.00 42.92 42.37 2ed9 s ASP 17 CO 0.04 -0.93 0.26 -1.81 0.70 0.00 0.00 175.17 173.42 2ed9 s ASP 18 N -3.40 0.47 -0.06 2.11 1.11 -1.26 -5.15 116.67 110.49 2ed9 s ASP 18 Ca 0.22 0.50 -0.11 0.00 0.18 0.00 0.00 52.55 53.33 2ed9 s ASP 18 Cb -0.02 0.66 -0.05 0.00 1.07 0.00 0.00 42.92 44.58 2ed9 s ASP 18 CO 0.05 -0.25 0.27 0.27 1.18 0.00 0.00 175.17 176.69 2ed9 s ILE 19 N 2.41 5.28 0.00 0.77 -5.25 -1.26 -5.10 121.20 118.05 2ed9 s ILE 19 Ca 0.02 0.51 0.03 0.00 -0.99 0.00 0.00 60.65 60.23 2ed9 s ILE 19 Cb -0.12 -3.55 -0.01 0.00 2.95 0.00 0.00 42.46 41.72 2ed9 s ILE 19 CO -0.09 0.60 -0.11 0.42 -1.79 0.00 0.00 174.94 173.97 2ed9 s THR 20 N -1.02 0.84 -0.70 8.37 -4.23 -1.26 -5.10 115.64 112.53 2ed9 s THR 20 Ca 0.19 -0.58 -0.19 0.00 -1.18 0.00 0.00 61.69 59.93 2ed9 s THR 20 Cb -0.14 -0.72 0.12 0.00 1.34 0.00 0.00 72.50 73.09 2ed9 s THR 20 CO 0.08 0.14 0.85 -0.69 -0.54 0.00 0.00 174.62 174.46 2ed9 s VAL 21 N -0.42 4.80 -0.97 2.29 1.01 -1.26 -4.96 120.40 120.88 2ed9 s VAL 21 Ca 0.03 -1.16 -0.03 0.00 0.00 0.00 0.00 61.98 60.81 2ed9 s VAL 21 Cb -0.05 -4.59 0.25 0.00 0.00 0.00 0.00 36.38 31.99 2ed9 s VAL 21 CO -0.00 -1.26 0.96 0.52 0.00 0.00 0.00 175.10 175.32 2ed9 n VAL 22 N 5.44 3.68 -0.53 2.92 0.31 -1.26 -4.76 118.33 124.12 2ed9 n VAL 22 Ca 0.01 -5.29 0.06 0.00 -0.01 0.00 0.00 64.34 59.11 2ed9 n VAL 22 Cb 0.45 -2.39 0.15 0.00 -0.91 0.00 0.00 33.84 31.14 2ed9 n VAL 22 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2ed9 n THR 23 N 2.20 1.53 -4.34 2.52 -1.04 -1.26 -5.02 114.28 108.87 2ed9 n THR 23 Ca 0.23 -1.47 -0.18 0.00 -2.04 0.00 0.00 64.05 60.59 2ed9 n THR 23 Cb 0.37 0.15 -0.10 0.00 -1.82 0.00 0.00 70.33 68.94 2ed9 n THR 23 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2ed9 s LEU 24 N -1.85 1.69 -0.55 -4.42 1.43 -1.26 -5.09 118.68 108.62 2ed9 s LEU 24 Ca 0.26 -1.50 0.06 0.00 -1.03 0.00 0.00 54.13 51.92 2ed9 s LEU 24 Cb 0.19 0.10 0.33 0.00 0.03 0.00 0.00 46.19 46.84 2ed9 s LEU 24 CO 0.08 -0.83 0.90 -1.20 0.23 0.00 0.00 176.35 175.54 2ed9 n SER 25 N -0.78 3.89 -2.20 2.29 7.64 -1.26 -4.84 113.62 118.36 2ed9 n SER 25 Ca 0.00 -3.57 -0.23 0.00 1.01 0.00 0.00 58.87 56.09 2ed9 n SER 25 Cb 0.65 -0.58 0.19 0.00 -1.01 0.00 0.00 64.21 63.46 2ed9 n SER 25 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2ed9 n ASP 26 N -0.06 3.77 -4.36 6.43 8.00 -1.26 -4.94 116.55 124.13 2ed9 n ASP 26 Ca 0.30 -3.60 -0.19 0.00 0.71 0.00 0.00 54.79 52.01 2ed9 n ASP 26 Cb 0.43 -0.83 -0.10 0.00 -0.02 0.00 0.00 41.12 40.60 2ed9 n ASP 26 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2ed9 s VAL 27 N -3.29 1.76 1.15 2.53 -7.23 -1.26 -4.35 120.40 109.72 2ed9 s VAL 27 Ca 0.57 -2.21 -0.17 0.00 -1.81 0.00 0.00 61.98 58.35 2ed9 s VAL 27 Cb 0.48 -2.10 0.26 0.00 0.56 0.00 0.00 36.38 35.59 2ed9 s VAL 27 CO 0.11 -0.56 1.11 -2.16 -0.31 0.00 0.00 175.10 173.29 2ed9 s PRO 28 N -3.65 -0.83 -0.05 4.82 0.04 -1.26 -4.96 135.00 129.11 2ed9 s PRO 28 Ca 0.24 0.08 0.09 0.00 0.04 0.00 0.00 61.00 61.44 2ed9 s PRO 28 Cb -0.01 -1.63 0.16 0.00 0.04 0.00 0.00 34.50 33.06 2ed9 s PRO 28 CO 0.08 -3.48 1.07 0.43 0.04 0.00 0.00 177.00 175.14 2ed9 n SER 29 N -4.62 0.86 -3.70 6.66 7.64 -1.26 -4.67 113.62 114.53 2ed9 n SER 29 Ca 0.11 -2.41 -0.13 0.00 1.01 0.00 0.00 58.87 57.45 2ed9 n SER 29 Cb 0.59 -0.29 -0.09 0.00 -1.01 0.00 0.00 64.21 63.40 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 -0.97 -1.23 1.00 -0.43 0.00 -1.26 -5.07 121.76 113.80 2ed9 s ALA 30 Ca 0.15 1.37 -0.12 0.00 0.00 0.00 0.00 51.96 53.36 2ed9 s ALA 30 Cb 0.15 -0.77 0.19 0.00 0.00 0.00 0.00 23.12 22.68 2ed9 s ALA 30 CO -0.02 -0.24 1.09 -1.25 0.00 0.00 0.00 175.76 175.35 2ed9 s PRO 31 N 0.19 0.40 0.55 0.00 0.04 -1.26 -4.80 135.00 130.12 2ed9 s PRO 31 Ca -0.01 0.51 -0.09 0.00 0.04 0.00 0.00 61.00 61.46 2ed9 s PRO 31 Cb -0.03 -1.73 0.14 0.00 0.04 0.00 0.00 34.50 32.91 2ed9 s PRO 31 CO 0.01 -2.75 0.49 -0.35 0.04 0.00 0.00 177.00 174.44 2ed9 n PRO 32 N -4.19 -1.98 -4.37 0.56 -0.04 -1.26 -4.57 135.00 119.16 2ed9 n PRO 32 Ca 0.05 -0.78 -0.22 0.00 -0.04 0.00 0.00 63.50 62.52 2ed9 n PRO 32 Cb 0.57 -0.73 -0.11 0.00 -0.04 0.00 0.00 33.50 33.20 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 -4.10 1.38 -1.16 0.54 -0.21 0.60 -4.79 119.66 111.91 2ed9 s GLN 33 Ca 0.32 -1.54 -0.01 0.00 0.02 0.00 0.00 55.36 54.15 2ed9 s GLN 33 Cb -0.03 -1.38 0.00 0.00 1.00 0.00 0.00 33.01 32.60 2ed9 s GLN 33 CO 0.24 0.26 0.98 -1.71 -2.12 0.00 0.00 175.29 172.94 2ed9 n ASN 34 N -0.07 -2.75 -4.41 5.90 5.15 -1.26 0.12 115.26 117.94 2ed9 n ASN 34 Ca -0.10 -0.57 -0.45 0.00 -0.60 0.00 0.00 54.58 52.86 2ed9 n ASN 34 Cb 0.58 -4.86 -0.02 0.00 -0.53 0.00 0.00 39.78 34.95 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 -3.33 5.07 0.04 3.44 1.01 -1.26 -3.72 120.40 121.65 2ed9 s VAL 35 Ca 0.10 -1.94 -0.04 0.00 0.00 0.00 0.00 61.98 60.10 2ed9 s VAL 35 Cb -0.04 -4.67 -0.02 0.00 0.00 0.00 0.00 36.38 31.65 2ed9 s VAL 35 CO 0.69 -1.33 0.05 -0.55 0.00 0.00 0.00 175.10 173.96 2ed9 s SER 36 N 3.05 0.26 -0.12 3.32 0.15 -1.26 -5.03 113.70 114.07 2ed9 s SER 36 Ca 0.27 -0.66 -0.06 0.00 0.70 0.00 0.00 55.95 56.21 2ed9 s SER 36 Cb -0.07 0.21 -0.04 0.00 -1.71 0.00 0.00 66.02 64.41 2ed9 s SER 36 CO -0.09 -0.52 0.11 -0.76 1.20 0.00 0.00 173.24 173.18 2ed9 s LEU 37 N -2.28 4.18 -0.26 3.45 1.43 -1.26 -4.19 118.68 119.76 2ed9 s LEU 37 Ca -0.03 0.37 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 2ed9 s LEU 37 Cb 0.00 -2.01 0.07 0.00 0.03 0.00 0.00 46.19 44.28 2ed9 s LEU 37 CO -0.06 0.38 0.01 -0.70 0.23 0.00 0.00 176.35 176.21 2ed9 s GLU 38 N -0.85 1.21 -0.10 1.70 2.12 -0.95 -5.06 118.70 116.78 2ed9 s GLU 38 Ca 0.14 -1.02 -0.29 0.00 0.36 0.00 0.00 54.97 54.16 2ed9 s GLU 38 Cb -0.12 -2.43 -0.01 0.00 0.26 0.00 0.00 34.13 31.83 2ed9 s GLU 38 CO 0.03 -0.74 1.00 0.08 -0.54 0.00 0.00 175.26 175.09 2ed9 s VAL 39 N 1.47 4.79 -0.16 3.70 1.01 -1.26 -1.31 120.40 128.65 2ed9 s VAL 39 Ca 0.01 2.03 0.01 0.00 0.00 0.00 0.00 61.98 64.03 2ed9 s VAL 39 Cb -0.18 -4.31 -0.10 0.00 0.00 0.00 0.00 36.38 31.79 2ed9 s VAL 39 CO -0.11 0.02 -0.14 0.52 0.00 0.00 0.00 175.10 175.38 2ed9 n VAL 40 N 4.49 0.90 -4.09 2.92 0.31 -1.14 -4.97 118.33 116.76 2ed9 n VAL 40 Ca 0.08 -0.34 -0.09 0.00 -0.01 0.00 0.00 64.34 63.99 2ed9 n VAL 40 Cb 0.49 -1.11 -0.09 0.00 -0.91 0.00 0.00 33.84 32.22 2ed9 n VAL 40 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2ed9 s ASN 41 N -5.60 0.31 0.42 4.52 -0.87 -0.44 -4.97 114.94 108.30 2ed9 s ASN 41 Ca -0.21 -1.07 0.29 0.00 -1.57 0.00 0.00 52.86 50.30 2ed9 s ASN 41 Cb 0.06 0.29 1.46 0.00 -0.02 0.00 0.00 41.25 43.04 2ed9 s ASN 41 CO 0.36 -0.72 1.89 0.28 -2.57 0.00 0.00 177.10 176.34 2ed9 h SER 42 N 2.89 0.00 0.00 -1.22 0.02 -1.89 -2.14 113.55 111.22 2ed9 h SER 42 Ca -0.34 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 2ed9 h SER 42 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 2ed9 h SER 42 CO 0.59 0.00 -0.16 -2.11 -1.14 0.00 0.00 176.83 174.01 2ed9 n ARG 43 N -2.57 0.98 -3.80 3.45 1.85 -1.26 -3.98 116.66 111.34 2ed9 n ARG 43 Ca -0.01 -1.60 -0.13 0.00 -1.00 0.00 0.00 57.85 55.12 2ed9 n ARG 43 Cb 0.12 -0.95 -0.13 0.00 -1.05 0.00 0.00 32.46 30.45 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 -1.55 -0.17 -0.07 2.89 0.01 -0.80 -0.23 113.70 113.78 2ed9 s SER 44 Ca 0.12 0.34 -0.07 0.00 1.31 0.00 0.00 55.95 57.66 2ed9 s SER 44 Cb 0.10 0.32 0.02 0.00 0.21 0.00 0.00 66.02 66.68 2ed9 s SER 44 CO 0.01 -0.08 0.19 -0.63 0.41 0.00 0.00 173.24 173.14 2ed9 s ILE 45 N 0.30 0.00 -0.09 1.44 1.01 -0.76 -1.33 121.20 121.77 2ed9 s ILE 45 Ca -0.02 -0.00 -0.02 0.00 0.00 0.00 0.00 60.65 60.61 2ed9 s ILE 45 Cb -0.03 -0.27 -0.03 0.00 0.01 0.00 0.00 42.46 42.14 2ed9 s ILE 45 CO -0.01 -0.00 0.01 -0.75 0.00 0.00 0.00 174.94 174.18 2ed9 s LYS 46 N 0.09 3.05 -0.12 2.79 2.20 -0.42 -0.58 119.74 126.73 2ed9 s LYS 46 Ca -0.00 -0.40 -0.01 0.00 -0.36 0.00 0.00 55.97 55.20 2ed9 s LYS 46 Cb -0.01 -2.82 0.04 0.00 -1.51 0.00 0.00 37.83 33.52 2ed9 s LYS 46 CO 0.00 0.68 -0.02 0.08 -0.36 0.00 0.00 175.35 175.73 2ed9 s VAL 47 N -0.82 0.73 0.49 4.02 1.01 -0.97 -2.23 120.40 122.63 2ed9 s VAL 47 Ca 0.13 -0.27 0.05 0.00 0.00 0.00 0.00 61.98 61.89 2ed9 s VAL 47 Cb -0.11 -0.92 -0.01 0.00 0.00 0.00 0.00 36.38 35.34 2ed9 s VAL 47 CO 0.02 0.18 0.20 -0.44 0.00 0.00 0.00 175.10 175.06 2ed9 s SER 48 N 1.81 4.40 0.12 3.32 0.01 -1.26 -1.56 113.70 120.53 2ed9 s SER 48 Ca 0.03 -1.31 -0.24 0.00 1.31 0.00 0.00 55.95 55.74 2ed9 s SER 48 Cb -0.14 0.13 0.08 0.00 0.21 0.00 0.00 66.02 66.30 2ed9 s SER 48 CO -0.07 -0.83 1.12 -1.66 0.41 0.00 0.00 173.24 172.21 2ed9 s TRP 49 N -2.74 0.06 0.07 2.43 -2.14 -1.06 -4.35 118.94 111.20 2ed9 s TRP 49 Ca 0.28 -0.36 -0.13 0.00 2.66 0.00 0.00 56.10 58.55 2ed9 s TRP 49 Cb 0.01 0.66 0.02 0.00 -3.10 0.00 0.00 33.47 31.06 2ed9 s TRP 49 CO 0.16 -0.71 0.30 -0.51 -2.66 0.00 0.00 176.95 173.53 2ed9 s LEU 50 N -3.52 0.91 0.63 -4.66 1.43 0.32 -4.87 118.68 108.92 2ed9 s LEU 50 Ca 0.24 -0.33 -0.16 0.00 -1.03 0.00 0.00 54.13 52.84 2ed9 s LEU 50 Cb -0.02 1.38 -0.02 0.00 0.03 0.00 0.00 46.19 47.57 2ed9 s LEU 50 CO 0.03 -0.70 1.12 -2.16 0.23 0.00 0.00 176.35 174.87 2ed9 s PRO 51 N -3.16 2.95 1.00 1.29 0.04 -1.26 -0.29 135.00 135.57 2ed9 s PRO 51 Ca -0.01 1.45 -0.12 0.00 0.04 0.00 0.00 61.00 62.36 2ed9 s PRO 51 Cb 0.01 -1.97 0.19 0.00 0.04 0.00 0.00 34.50 32.78 2ed9 s PRO 51 CO -0.07 -1.14 1.09 -1.25 0.04 0.00 0.00 177.00 175.67 2ed9 s PRO 52 N -3.87 0.42 0.00 0.56 0.04 -1.26 -4.31 135.00 126.57 2ed9 s PRO 52 Ca 0.69 0.52 -0.30 0.00 0.04 0.00 0.00 61.00 61.95 2ed9 s PRO 52 Cb -0.21 -1.74 -0.06 0.00 0.04 0.00 0.00 34.50 32.53 2ed9 s PRO 52 CO 0.37 -2.74 1.45 -1.25 0.04 0.00 0.00 177.00 174.87 2ed9 s PRO 53 N -4.96 4.26 0.15 0.56 0.04 -1.26 -4.91 135.00 128.88 2ed9 s PRO 53 Ca 0.65 2.02 -0.21 0.00 0.04 0.00 0.00 61.00 63.50 2ed9 s PRO 53 Cb -0.19 -3.60 -0.13 0.00 0.04 0.00 0.00 34.50 30.62 2ed9 s PRO 53 CO 0.58 -0.61 0.40 0.43 0.04 0.00 0.00 177.00 177.83 2ed9 n SER 54 N 5.51 -0.97 0.00 6.66 7.64 -1.26 -2.84 113.62 128.36 2ed9 n SER 54 Ca 0.14 0.87 0.00 0.00 1.01 0.00 0.00 58.87 60.88 2ed9 n SER 54 Cb 0.43 -0.73 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 2ed9 n SER 54 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ed9 n GLY 55 N 1.54 3.07 0.10 0.23 0.00 -1.26 -4.85 105.19 104.03 2ed9 n GLY 55 Ca 0.14 -1.08 0.04 0.00 0.00 0.00 0.00 46.02 45.11 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 0.33 -1.55 2.61 1.35 -1.90 -3.38 112.91 110.38 2ed9 h THR 56 Ca 0.00 -1.66 -0.71 0.00 -0.55 0.00 0.00 66.41 63.49 2ed9 h THR 56 Cb 0.00 1.86 -0.19 0.00 -1.73 0.00 0.00 68.15 68.09 2ed9 h THR 56 CO 0.00 0.19 1.44 0.00 -0.25 0.00 0.00 175.52 176.90 2ed9 n GLN 57 N -2.83 4.14 0.07 4.72 10.64 -1.26 -4.06 117.38 128.80 2ed9 n GLN 57 Ca -0.06 -3.57 0.05 0.00 -1.83 0.00 0.00 57.00 51.58 2ed9 n GLN 57 Cb 0.74 -2.44 0.26 0.00 -0.86 0.00 0.00 30.24 27.94 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 0.75 0.24 -4.39 2.61 5.15 -1.26 -4.39 115.26 113.97 2ed9 n ASN 58 Ca 0.54 0.60 -0.35 0.00 -0.60 0.00 0.00 54.58 54.77 2ed9 n ASN 58 Cb 0.31 -0.63 -0.13 0.00 -0.53 0.00 0.00 39.78 38.80 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 -3.21 1.67 0.10 8.20 0.00 -1.26 -5.06 107.32 107.77 2ed9 s GLY 59 Ca -0.01 -1.07 -0.26 0.00 0.00 0.00 0.00 44.72 43.38 2ed9 s GLY 59 CO 0.09 0.33 0.58 0.33 0.00 0.00 0.00 173.10 174.43 2ed9 n PHE 60 N 4.51 -0.07 -2.69 1.90 7.35 -1.26 -4.11 117.46 123.10 2ed9 n PHE 60 Ca -0.17 0.82 -0.41 0.00 -0.76 0.00 0.00 57.45 56.92 2ed9 n PHE 60 Cb 0.51 -1.64 -0.04 0.00 0.35 0.00 0.00 39.48 38.67 2ed9 n PHE 60 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 2ed9 s ILE 61 N -0.52 4.57 -0.13 -2.13 -1.09 -1.26 0.19 121.20 120.83 2ed9 s ILE 61 Ca 0.60 2.00 -0.00 0.00 -2.23 0.00 0.00 60.65 61.02 2ed9 s ILE 61 Cb -0.86 -4.28 -0.08 0.00 -1.58 0.00 0.00 42.46 35.66 2ed9 s ILE 61 CO 0.46 0.24 -0.12 0.35 -1.23 0.00 0.00 174.94 174.63 2ed9 n THR 62 N 3.27 0.75 -2.34 2.92 -2.24 -0.68 -4.90 114.28 111.06 2ed9 n THR 62 Ca 0.04 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 2ed9 n THR 62 Cb 0.49 -1.06 0.00 0.00 -2.10 0.00 0.00 70.33 67.66 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 2.77 1.10 2.99 3.38 0.00 -1.22 -4.91 105.19 109.31 2ed9 n GLY 63 Ca -0.24 -0.42 -0.13 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.50 -0.16 -0.28 1.61 1.51 -1.26 -1.10 117.35 116.17 2ed9 s TYR 64 Ca 0.00 0.42 -0.17 0.00 -1.01 0.00 0.00 57.07 56.31 2ed9 s TYR 64 Cb 0.00 0.01 -0.03 0.00 -0.11 0.00 0.00 41.96 41.84 2ed9 s TYR 64 CO 0.00 -0.11 0.47 0.21 -1.11 0.00 0.00 175.55 175.02 2ed9 s LYS 65 N 0.43 3.96 -0.35 -0.62 2.20 -0.29 -4.31 119.74 120.75 2ed9 s LYS 65 Ca -0.03 0.13 -0.08 0.00 -0.36 0.00 0.00 55.97 55.64 2ed9 s LYS 65 Cb -0.04 -3.69 0.04 0.00 -1.51 0.00 0.00 37.83 32.63 2ed9 s LYS 65 CO -0.02 -0.39 0.14 0.42 -0.36 0.00 0.00 175.35 175.14 2ed9 s ILE 66 N 2.26 4.00 -0.32 5.43 1.01 -1.20 -2.19 121.20 130.20 2ed9 s ILE 66 Ca 0.19 -1.07 -0.09 0.00 0.00 0.00 0.00 60.65 59.67 2ed9 s ILE 66 Cb -0.16 -3.26 0.00 0.00 0.01 0.00 0.00 42.46 39.05 2ed9 s ILE 66 CO 0.10 -0.20 0.15 -0.13 0.00 0.00 0.00 174.94 174.85 2ed9 s ARG 67 N 1.44 3.21 0.08 2.79 1.81 -0.90 -2.37 118.95 125.00 2ed9 s ARG 67 Ca -0.01 -0.80 0.07 0.00 -1.72 0.00 0.00 55.73 53.28 2ed9 s ARG 67 Cb -0.20 -3.55 -0.04 0.00 -0.45 0.00 0.00 34.95 30.71 2ed9 s ARG 67 CO 0.04 -0.47 -0.16 -3.38 -0.68 0.00 0.00 175.30 170.65 2ed9 s HIS 68 N 1.58 2.61 0.00 -0.53 -3.43 -1.07 -1.76 115.29 112.68 2ed9 s HIS 68 Ca 0.04 -0.23 -0.29 0.00 -0.80 0.00 0.00 55.06 53.78 2ed9 s HIS 68 Cb -0.17 -1.42 0.10 0.00 -1.43 0.00 0.00 32.58 29.65 2ed9 s HIS 68 CO 0.06 0.34 0.99 -0.98 -2.00 0.00 0.00 174.74 173.15 2ed9 s ARG 69 N -1.84 0.79 -0.08 -0.38 1.70 -0.69 -2.09 118.95 116.35 2ed9 s ARG 69 Ca 0.17 -0.35 -0.08 0.00 -0.47 0.00 0.00 55.73 55.00 2ed9 s ARG 69 Cb -0.11 0.32 -0.04 0.00 -0.57 0.00 0.00 34.95 34.55 2ed9 s ARG 69 CO 0.09 -0.35 0.21 0.21 -1.08 0.00 0.00 175.30 174.37 2ed9 s LYS 70 N -2.98 3.55 0.22 3.89 2.20 -1.24 -0.45 119.74 124.93 2ed9 s LYS 70 Ca 0.08 -0.02 -0.07 0.00 -0.36 0.00 0.00 55.97 55.60 2ed9 s LYS 70 Cb -0.01 -3.19 0.36 0.00 -1.51 0.00 0.00 37.83 33.49 2ed9 s LYS 70 CO -0.05 0.75 1.72 0.00 -0.36 0.00 0.00 175.35 177.41 2ed9 h THR 71 N 3.82 0.67 0.00 3.43 1.03 -1.90 -3.27 112.91 116.69 2ed9 h THR 71 Ca -0.54 -0.12 0.00 0.00 -0.01 0.00 0.00 66.41 65.74 2ed9 h THR 71 Cb 1.22 0.28 0.00 0.00 -1.07 0.00 0.00 68.15 68.58 2ed9 h THR 71 CO 0.60 0.07 0.00 0.35 -0.01 0.00 0.00 175.52 176.52 2ed9 n THR 72 N -5.05 0.00 -1.99 0.00 -2.24 -1.26 -4.62 114.28 99.11 2ed9 n THR 72 Ca 0.11 0.40 -0.29 0.00 -2.27 0.00 0.00 64.05 62.01 2ed9 n THR 72 Cb 0.35 -1.28 -0.06 0.00 -2.10 0.00 0.00 70.33 67.24 2ed9 n THR 72 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2ed9 n ARG 73 N -1.94 1.54 -1.04 -0.78 0.00 -1.25 -4.93 116.66 108.26 2ed9 n ARG 73 Ca 0.00 -2.41 -0.34 0.00 -0.00 0.00 0.00 57.85 55.10 2ed9 n ARG 73 Cb 0.00 -3.69 0.11 0.00 0.00 0.00 0.00 32.46 28.87 2ed9 n ARG 73 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 2ed9 n ARG 74 N 8.19 0.05 0.00 -0.14 -4.01 -1.23 -3.71 116.66 115.80 2ed9 n ARG 74 Ca 0.45 0.07 0.00 0.00 -1.04 0.00 0.00 57.85 57.33 2ed9 n ARG 74 Cb 0.46 -2.01 0.00 0.00 -3.04 0.00 0.00 32.46 27.87 2ed9 n ARG 74 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2ed9 n GLY 75 N 1.27 -1.23 3.27 2.89 0.00 -1.26 -4.88 105.19 105.25 2ed9 n GLY 75 Ca 0.10 0.42 -0.56 0.00 0.00 0.00 0.00 46.02 45.98 2ed9 n GLY 75 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ed9 n GLU 76 N 0.00 0.00 -3.89 1.61 -0.58 -1.26 -4.76 120.64 111.76 2ed9 n GLU 76 Ca 0.00 0.00 -0.27 0.00 -0.42 0.00 0.00 57.16 56.47 2ed9 n GLU 76 Cb 0.00 -1.39 -0.17 0.00 -0.57 0.00 0.00 31.44 29.31 2ed9 n GLU 76 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 2ed9 s MET 77 N 0.43 1.41 -0.04 3.49 -1.94 -0.89 -5.00 119.30 116.76 2ed9 s MET 77 Ca 0.86 -0.24 -0.19 0.00 -1.71 0.00 0.00 55.69 54.41 2ed9 s MET 77 Cb -1.21 -1.57 -0.05 0.00 2.01 0.00 0.00 34.83 34.01 2ed9 s MET 77 CO 0.56 -0.29 0.52 -2.00 -0.01 0.00 0.00 175.02 173.80 2ed9 s GLU 78 N 1.73 4.26 -0.30 2.03 -6.30 -1.26 -2.61 118.70 116.25 2ed9 s GLU 78 Ca 0.05 0.58 -0.01 0.00 -2.50 0.00 0.00 54.97 53.08 2ed9 s GLU 78 Cb -0.13 -3.35 0.19 0.00 0.00 0.00 0.00 34.13 30.83 2ed9 s GLU 78 CO -0.08 0.35 0.59 0.99 0.02 0.00 0.00 175.26 177.13 2ed9 s THR 79 N -0.05 -0.97 -0.02 -1.70 2.01 -1.00 -5.03 115.64 108.88 2ed9 s THR 79 Ca 0.28 -0.00 0.05 0.00 0.31 0.00 0.00 61.69 62.33 2ed9 s THR 79 Cb -0.17 -0.99 -0.03 0.00 0.01 0.00 0.00 72.50 71.33 2ed9 s THR 79 CO 0.14 -0.01 -0.17 -1.48 -0.69 0.00 0.00 174.62 172.41 2ed9 s LEU 80 N 2.84 2.57 -0.20 4.42 0.05 -1.26 -3.21 118.68 123.89 2ed9 s LEU 80 Ca 0.20 -0.31 0.00 0.00 0.05 0.00 0.00 54.13 54.08 2ed9 s LEU 80 Cb -0.15 -1.51 0.05 0.00 -2.05 0.00 0.00 46.19 42.53 2ed9 s LEU 80 CO -0.21 0.32 -0.07 -0.70 -0.55 0.00 0.00 176.35 175.14 2ed9 s GLU 81 N -0.91 1.73 0.16 1.48 2.12 -1.26 -5.01 118.70 117.01 2ed9 s GLU 81 Ca 0.12 -0.80 -0.09 0.00 0.36 0.00 0.00 54.97 54.57 2ed9 s GLU 81 Cb -0.10 -2.36 0.02 0.00 0.26 0.00 0.00 34.13 31.94 2ed9 s GLU 81 CO 0.02 -0.48 1.50 -1.00 -0.54 0.00 0.00 175.26 174.75 2ed9 h PRO 82 N 8.01 0.85 -0.30 4.30 0.13 -1.94 -3.33 132.00 139.73 2ed9 h PRO 82 Ca -0.24 -0.45 0.03 0.00 -0.87 0.00 0.00 66.00 64.47 2ed9 h PRO 82 Cb 1.09 0.02 -0.04 0.00 0.13 0.00 0.00 31.00 32.20 2ed9 h PRO 82 CO 0.43 1.09 -0.17 0.09 -0.23 0.00 0.00 178.00 179.21 2ed9 n ASN 83 N -4.05 -0.31 -2.99 1.44 3.02 -1.26 -4.75 115.26 106.36 2ed9 n ASN 83 Ca -0.02 1.05 -0.17 0.00 -0.03 0.00 0.00 54.58 55.41 2ed9 n ASN 83 Cb 0.54 -0.33 -0.06 0.00 -0.61 0.00 0.00 39.78 39.33 2ed9 n ASN 83 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2ed9 n ASN 84 N -3.61 0.32 -1.59 6.41 3.02 -1.25 -5.04 115.26 113.51 2ed9 n ASN 84 Ca 0.01 -2.65 0.07 0.00 -0.03 0.00 0.00 54.58 51.98 2ed9 n ASN 84 Cb 0.08 1.02 0.34 0.00 -0.61 0.00 0.00 39.78 40.60 2ed9 n ASN 84 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2ed9 n LEU 85 N 0.00 4.73 -4.18 3.41 4.77 -1.26 -4.71 117.00 119.75 2ed9 n LEU 85 Ca 0.01 -2.39 -0.23 0.00 -0.03 0.00 0.00 56.01 53.36 2ed9 n LEU 85 Cb 0.46 -0.61 -0.14 0.00 -2.33 0.00 0.00 43.42 40.80 2ed9 n LEU 85 CO 0.24 0.64 -0.49 -1.66 -1.33 0.00 0.00 177.39 174.79 2ed9 s TRP 86 N -2.20 1.52 -0.09 -1.77 1.48 -1.26 -2.58 118.94 114.03 2ed9 s TRP 86 Ca 0.46 -0.34 -0.03 0.00 -1.06 0.00 0.00 56.10 55.14 2ed9 s TRP 86 Cb 0.33 -0.92 0.04 0.00 -1.16 0.00 0.00 33.47 31.76 2ed9 s TRP 86 CO 0.17 0.04 0.06 -0.47 -4.06 0.00 0.00 176.95 172.69 2ed9 s TYR 87 N -0.70 0.26 -0.48 1.66 6.14 -0.60 -4.98 117.35 118.65 2ed9 s TYR 87 Ca 0.05 -0.03 -0.20 0.00 0.64 0.00 0.00 57.07 57.53 2ed9 s TYR 87 Cb -0.08 -0.63 0.04 0.00 0.42 0.00 0.00 41.96 41.72 2ed9 s TYR 87 CO 0.01 -0.32 0.62 -1.17 0.64 0.00 0.00 175.55 175.32 2ed9 s LEU 88 N 2.11 4.78 0.31 6.97 1.98 -1.26 -2.29 118.68 131.29 2ed9 s LEU 88 Ca 0.04 -0.70 -0.17 0.00 -2.89 0.00 0.00 54.13 50.41 2ed9 s LEU 88 Cb -0.13 -2.53 -0.09 0.00 0.66 0.00 0.00 46.19 44.09 2ed9 s LEU 88 CO -0.05 -0.83 0.77 -0.36 -1.89 0.00 0.00 176.35 173.98 2ed9 s PHE 89 N 2.68 3.44 -0.09 5.38 0.08 0.25 -4.92 117.98 124.80 2ed9 s PHE 89 Ca 0.17 1.33 -0.06 0.00 0.12 0.00 0.00 56.93 58.49 2ed9 s PHE 89 Cb -0.17 -2.61 0.03 0.00 -0.57 0.00 0.00 43.02 39.70 2ed9 s PHE 89 CO 0.14 0.13 0.22 0.95 -0.10 0.00 0.00 175.22 176.56 2ed9 s THR 90 N -1.89 -0.02 0.00 0.64 -4.23 -1.26 -1.83 115.64 107.05 2ed9 s THR 90 Ca 0.52 0.08 0.00 0.00 -1.18 0.00 0.00 61.69 61.11 2ed9 s THR 90 Cb -0.12 -0.32 0.00 0.00 1.34 0.00 0.00 72.50 73.40 2ed9 s THR 90 CO 0.18 0.03 0.00 0.61 -0.54 0.00 0.00 174.62 174.90 2ed9 n GLY 91 N 3.58 1.79 3.87 3.99 0.00 0.68 -5.00 105.19 114.09 2ed9 n GLY 91 Ca -0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 2ed9 n GLY 91 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ed9 n LEU 92 N 0.00 0.00 -5.02 0.99 4.77 -1.08 -5.06 117.00 111.60 2ed9 n LEU 92 Ca 0.00 -2.30 -0.18 0.00 -0.03 0.00 0.00 56.01 53.49 2ed9 n LEU 92 Cb 0.00 -0.52 0.03 0.00 -2.33 0.00 0.00 43.42 40.60 2ed9 n LEU 92 CO 0.00 -0.84 0.24 -1.61 -1.33 0.00 0.00 177.39 173.85 2ed9 s GLU 93 N -4.83 2.59 0.30 3.23 0.41 -1.26 -4.50 118.70 114.65 2ed9 s GLU 93 Ca 0.63 -1.39 0.06 0.00 -0.41 0.00 0.00 54.97 53.86 2ed9 s GLU 93 Cb -0.04 -2.70 -0.02 0.00 -1.78 0.00 0.00 34.13 29.59 2ed9 s GLU 93 CO 0.41 -0.54 0.44 -1.59 -0.49 0.00 0.00 175.26 173.49 2ed9 s LYS 94 N -4.50 3.24 -0.99 1.61 -2.85 -1.26 -4.48 119.74 110.52 2ed9 s LYS 94 Ca 0.58 -0.91 -0.23 0.00 -1.00 0.00 0.00 55.97 54.41 2ed9 s LYS 94 Cb -0.08 -2.84 0.03 0.00 -2.06 0.00 0.00 37.83 32.88 2ed9 s LYS 94 CO 0.36 0.19 0.44 0.41 0.10 0.00 0.00 175.35 176.84 2ed9 n GLY 95 N -1.57 -0.55 3.24 0.59 0.00 -1.24 -4.92 105.19 100.74 2ed9 n GLY 95 Ca -0.03 0.24 -0.15 0.00 0.00 0.00 0.00 46.02 46.07 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 -3.90 0.76 -0.09 1.61 0.01 -1.26 -4.99 113.70 105.86 2ed9 s SER 96 Ca 0.32 -1.53 0.03 0.00 1.31 0.00 0.00 55.95 56.08 2ed9 s SER 96 Cb -0.18 0.44 -0.02 0.00 0.21 0.00 0.00 66.02 66.47 2ed9 s SER 96 CO 0.76 -0.92 -0.16 -1.58 0.41 0.00 0.00 173.24 171.75 2ed9 s GLN 97 N -3.89 2.92 0.23 12.44 0.74 -1.26 -2.03 119.66 128.81 2ed9 s GLN 97 Ca 0.40 -0.74 0.04 0.00 0.05 0.00 0.00 55.36 55.10 2ed9 s GLN 97 Cb 0.05 -2.44 -0.05 0.00 1.10 0.00 0.00 33.01 31.67 2ed9 s GLN 97 CO 0.18 0.38 -0.02 0.71 -0.55 0.00 0.00 175.29 175.99 2ed9 s TYR 98 N -0.10 1.58 0.06 1.67 1.51 0.07 -3.99 117.35 118.15 2ed9 s TYR 98 Ca -0.03 -0.88 0.00 0.00 -1.01 0.00 0.00 57.07 55.16 2ed9 s TYR 98 Cb -0.14 -0.91 -0.04 0.00 -0.11 0.00 0.00 41.96 40.77 2ed9 s TYR 98 CO 0.04 0.02 -0.04 -1.12 -1.11 0.00 0.00 175.55 173.33 2ed9 s SER 99 N -3.31 0.64 0.33 2.29 0.01 0.41 0.03 113.70 114.10 2ed9 s SER 99 Ca 0.27 -0.90 -0.09 0.00 1.31 0.00 0.00 55.95 56.54 2ed9 s SER 99 Cb 0.05 0.15 0.02 0.00 0.21 0.00 0.00 66.02 66.45 2ed9 s SER 99 CO 0.08 -0.50 0.57 -0.36 0.41 0.00 0.00 173.24 173.45 2ed9 s PHE 100 N -3.35 0.62 -0.26 2.43 0.40 0.22 -1.71 117.98 116.34 2ed9 s PHE 100 Ca 0.04 -1.01 -0.26 0.00 -0.60 0.00 0.00 56.93 55.10 2ed9 s PHE 100 Cb 0.04 0.26 0.10 0.00 0.51 0.00 0.00 43.02 43.93 2ed9 s PHE 100 CO -0.07 -1.23 0.92 -1.14 0.70 0.00 0.00 175.22 174.39 2ed9 s GLN 101 N -3.06 0.64 -0.08 0.44 0.74 -0.73 -2.14 119.66 115.46 2ed9 s GLN 101 Ca 0.24 0.68 0.05 0.00 0.05 0.00 0.00 55.36 56.38 2ed9 s GLN 101 Cb -0.02 0.31 -0.01 0.00 1.10 0.00 0.00 33.01 34.39 2ed9 s GLN 101 CO 0.15 -0.09 -0.23 0.08 -0.55 0.00 0.00 175.29 174.65 2ed9 s VAL 102 N 0.13 2.17 -0.04 1.34 1.01 -1.26 -2.13 120.40 121.62 2ed9 s VAL 102 Ca 0.01 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 61.00 2ed9 s VAL 102 Cb -0.04 -1.81 0.02 0.00 0.00 0.00 0.00 36.38 34.54 2ed9 s VAL 102 CO -0.03 0.56 -0.05 -0.44 0.00 0.00 0.00 175.10 175.15 2ed9 s SER 103 N 0.07 0.90 -0.22 3.32 0.01 -0.93 -3.49 113.70 113.36 2ed9 s SER 103 Ca -0.10 -0.13 -0.29 0.00 1.31 0.00 0.00 55.95 56.74 2ed9 s SER 103 Cb -0.16 -0.38 0.00 0.00 0.21 0.00 0.00 66.02 65.70 2ed9 s SER 103 CO 0.06 -0.02 1.16 0.00 0.41 0.00 0.00 173.24 174.84 2ed9 s ALA 104 N 0.68 3.62 -0.11 1.44 0.00 -1.26 -1.14 121.76 124.99 2ed9 s ALA 104 Ca -0.09 0.25 -0.15 0.00 0.00 0.00 0.00 51.96 51.97 2ed9 s ALA 104 Cb -0.12 -3.62 -0.05 0.00 0.00 0.00 0.00 23.12 19.33 2ed9 s ALA 104 CO 0.00 -1.23 0.35 -1.64 0.00 0.00 0.00 175.76 173.25 2ed9 s MET 105 N 3.47 4.16 0.34 0.00 -1.94 -0.26 -1.85 119.30 123.22 2ed9 s MET 105 Ca 0.49 0.23 0.04 0.00 -1.71 0.00 0.00 55.69 54.74 2ed9 s MET 105 Cb -0.17 -3.37 0.04 0.00 2.01 0.00 0.00 34.83 33.33 2ed9 s MET 105 CO 0.12 0.35 0.31 0.25 -0.01 0.00 0.00 175.02 176.04 2ed9 n THR 106 N 3.14 0.00 0.10 2.05 -2.24 0.14 -1.69 114.28 115.78 2ed9 n THR 106 Ca -0.12 -1.30 0.02 0.00 -2.27 0.00 0.00 64.05 60.39 2ed9 n THR 106 Cb 0.52 -0.33 0.10 0.00 -2.10 0.00 0.00 70.33 68.52 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 -1.41 1.75 -0.03 2.28 3.14 0.13 -3.32 118.33 120.87 2ed9 n VAL 107 Ca 0.01 0.47 -0.03 0.00 -2.96 0.00 0.00 64.34 61.84 2ed9 n VAL 107 Cb 0.38 -1.43 -0.01 0.00 -1.06 0.00 0.00 33.84 31.72 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 -1.56 0.55 0.00 6.55 2.85 -1.26 -5.04 115.26 117.35 2ed9 n ASN 108 Ca 0.01 0.11 0.00 0.00 -0.11 0.00 0.00 54.58 54.58 2ed9 n ASN 108 Cb 0.03 -0.57 0.00 0.00 1.24 0.00 0.00 39.78 40.48 2ed9 n ASN 108 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2ed9 n GLY 109 N 1.50 2.85 3.70 8.20 0.00 -1.21 -5.11 105.19 115.11 2ed9 n GLY 109 Ca -0.04 -0.63 -0.40 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.23 5.03 0.00 2.61 2.01 -1.26 -0.69 115.64 121.11 2ed9 s THR 110 Ca 0.00 1.36 0.00 0.00 0.31 0.00 0.00 61.69 63.36 2ed9 s THR 110 Cb 0.00 -4.01 0.00 0.00 0.01 0.00 0.00 72.50 68.50 2ed9 s THR 110 CO 0.00 0.20 0.00 0.61 -0.69 0.00 0.00 174.62 174.74 2ed9 n GLY 111 N 3.33 -2.16 3.73 4.40 0.00 -0.77 -4.95 105.19 108.76 2ed9 n GLY 111 Ca -0.01 -1.40 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 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 -0.18 4.38 -0.06 1.61 0.04 -1.26 -4.87 135.00 134.66 2ed9 s PRO 112 Ca 0.00 2.04 -0.30 0.00 0.04 0.00 0.00 61.00 62.78 2ed9 s PRO 112 Cb 0.00 -3.21 -0.05 0.00 0.04 0.00 0.00 34.50 31.28 2ed9 s PRO 112 CO 0.00 -0.28 1.50 -1.25 0.04 0.00 0.00 177.00 177.01 2ed9 s PRO 113 N 0.12 4.22 1.33 0.56 0.04 -1.26 -4.70 135.00 135.30 2ed9 s PRO 113 Ca 0.58 2.01 -0.22 0.00 0.04 0.00 0.00 61.00 63.41 2ed9 s PRO 113 Cb -0.36 -3.81 0.33 0.00 0.04 0.00 0.00 34.50 30.71 2ed9 s PRO 113 CO 0.37 -0.74 1.03 -1.54 0.04 0.00 0.00 177.00 176.16 2ed9 s SER 114 N 2.59 -0.19 0.29 6.66 1.04 -1.23 -4.92 113.70 117.94 2ed9 s SER 114 Ca 0.67 0.67 -0.30 0.00 0.48 0.00 0.00 55.95 57.47 2ed9 s SER 114 Cb -0.30 -0.91 -0.11 0.00 0.10 0.00 0.00 66.02 64.80 2ed9 s SER 114 CO 0.25 -4.81 1.52 0.20 0.98 0.00 0.00 173.24 171.38 2ed9 s ASN 115 N -3.61 6.47 -0.79 7.02 0.01 -1.26 -4.84 114.94 117.94 2ed9 s ASN 115 Ca 0.70 2.87 -0.25 0.00 -0.71 0.00 0.00 52.86 55.47 2ed9 s ASN 115 Cb -0.10 -2.64 -0.01 0.00 0.41 0.00 0.00 41.25 38.91 2ed9 s ASN 115 CO 0.57 -0.83 1.71 0.26 -1.51 0.00 0.00 177.10 177.30 2ed9 s TRP 116 N -0.20 1.96 0.38 2.20 0.52 -1.26 -4.76 118.94 117.78 2ed9 s TRP 116 Ca 0.60 0.32 -0.25 0.00 0.02 0.00 0.00 56.10 56.79 2ed9 s TRP 116 Cb -0.46 -4.28 -0.09 0.00 -1.15 0.00 0.00 33.47 27.50 2ed9 s TRP 116 CO 0.49 -2.04 1.04 0.71 0.02 0.00 0.00 176.95 177.17 2ed9 s TYR 117 N 8.09 3.35 -0.06 -1.98 1.51 -0.91 -4.83 117.35 122.52 2ed9 s TYR 117 Ca 0.59 1.67 0.06 0.00 -1.01 0.00 0.00 57.07 58.37 2ed9 s TYR 117 Cb -0.08 -3.10 -0.01 0.00 -0.11 0.00 0.00 41.96 38.66 2ed9 s TYR 117 CO 0.08 -0.49 -0.25 0.99 -1.11 0.00 0.00 175.55 174.78 2ed9 s THR 118 N -1.63 2.09 -0.07 -0.71 2.01 -1.26 -0.61 115.64 115.47 2ed9 s THR 118 Ca 0.56 -1.06 0.03 0.00 0.31 0.00 0.00 61.69 61.54 2ed9 s THR 118 Cb -0.22 -1.75 0.00 0.00 0.01 0.00 0.00 72.50 70.54 2ed9 s THR 118 CO 0.28 0.57 -0.17 0.00 -0.69 0.00 0.00 174.62 174.60 2ed9 s ALA 119 N -0.18 1.61 -0.26 7.40 0.00 0.10 -4.96 121.76 125.48 2ed9 s ALA 119 Ca -0.03 -0.66 -0.08 0.00 0.00 0.00 0.00 51.96 51.18 2ed9 s ALA 119 Cb -0.14 -0.62 -0.03 0.00 0.00 0.00 0.00 23.12 22.33 2ed9 s ALA 119 CO 0.04 0.22 0.10 -1.21 0.00 0.00 0.00 175.76 174.91 2ed9 s GLU 120 N 0.36 3.75 0.40 0.00 2.02 -1.26 -0.75 118.70 123.21 2ed9 s GLU 120 Ca -0.12 -0.43 -0.25 0.00 0.02 0.00 0.00 54.97 54.19 2ed9 s GLU 120 Cb -0.15 -3.41 -0.08 0.00 0.10 0.00 0.00 34.13 30.58 2ed9 s GLU 120 CO 0.05 -0.17 1.18 0.95 0.02 0.00 0.00 175.26 177.28 2ed9 s THR 121 N 1.61 3.12 -0.07 3.63 -4.23 -0.86 -4.96 115.64 113.88 2ed9 s THR 121 Ca 0.06 0.94 -0.30 0.00 -1.18 0.00 0.00 61.69 61.22 2ed9 s THR 121 Cb -0.15 -3.53 -0.05 0.00 1.34 0.00 0.00 72.50 70.11 2ed9 s THR 121 CO 0.06 0.09 1.50 -2.16 -0.54 0.00 0.00 174.62 173.57 2ed9 s PRO 122 N -2.28 4.22 0.54 3.99 0.04 -1.26 -3.66 135.00 136.59 2ed9 s PRO 122 Ca 0.57 2.01 0.35 0.00 0.04 0.00 0.00 61.00 63.97 2ed9 s PRO 122 Cb -0.31 -3.83 1.52 0.00 0.04 0.00 0.00 34.50 31.92 2ed9 s PRO 122 CO 0.39 -0.75 1.83 0.93 0.04 0.00 0.00 177.00 179.45 2ed9 h GLU 123 N 8.79 0.00 -0.01 4.56 3.07 -1.93 -3.37 114.58 125.69 2ed9 h GLU 123 Ca -0.36 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.50 2ed9 h GLU 123 Cb 1.16 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.07 2ed9 h GLU 123 CO 0.95 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 178.65