#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eh0 s SER 2 N 0.00 -0.04 0.60 1.61 0.15 -1.26 -5.17 113.70 109.59 2eh0 s SER 2 Ca 0.00 -0.11 0.07 0.00 0.70 0.00 0.00 55.95 56.61 2eh0 s SER 2 Cb 0.00 0.24 0.09 0.00 -1.71 0.00 0.00 66.02 64.64 2eh0 s SER 2 CO 0.00 -0.38 0.82 -0.94 1.20 0.00 0.00 173.24 173.94 2eh0 s SER 3 N -1.33 4.96 0.00 5.45 1.04 -1.26 -5.05 113.70 117.51 2eh0 s SER 3 Ca -0.14 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 55.61 2eh0 s SER 3 Cb -0.07 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.18 2eh0 s SER 3 CO 0.02 -1.42 0.00 0.61 0.98 0.00 0.00 173.24 173.43 2eh0 n GLY 4 N -2.36 -1.11 0.00 7.32 0.00 -1.26 -5.06 105.19 102.72 2eh0 n GLY 4 Ca 0.15 0.28 0.02 0.00 0.00 0.00 0.00 46.02 46.47 2eh0 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2eh0 n SER 5 N 0.00 3.82 -1.85 1.61 2.88 -1.26 -4.59 113.62 114.23 2eh0 n SER 5 Ca 0.00 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.40 2eh0 n SER 5 Cb 0.00 1.18 0.22 0.00 -0.75 0.00 0.00 64.21 64.85 2eh0 n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2eh0 n SER 6 N -1.73 3.67 0.00 -3.46 7.64 -1.26 -5.01 113.62 113.48 2eh0 n SER 6 Ca -0.02 -3.54 0.00 0.00 1.01 0.00 0.00 58.87 56.32 2eh0 n SER 6 Cb 0.18 -0.76 0.00 0.00 -1.01 0.00 0.00 64.21 62.63 2eh0 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eh0 n GLY 7 N -0.90 3.66 3.63 0.23 0.00 -1.26 -4.67 105.19 105.87 2eh0 n GLY 7 Ca 0.47 -1.62 -0.04 0.00 0.00 0.00 0.00 46.02 44.83 2eh0 n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eh0 s THR 8 N -2.00 0.00 0.06 2.61 2.01 -1.26 -4.72 115.64 112.35 2eh0 s THR 8 Ca 0.00 0.00 -0.31 0.00 0.31 0.00 0.00 61.69 61.69 2eh0 s THR 8 Cb 0.00 -1.00 -0.07 0.00 0.01 0.00 0.00 72.50 71.44 2eh0 s THR 8 CO 0.00 0.00 1.40 -2.16 -0.69 0.00 0.00 174.62 173.17 2eh0 s PRO 9 N -0.89 4.31 0.10 4.92 0.04 -1.26 -4.54 135.00 137.67 2eh0 s PRO 9 Ca 0.06 2.03 -0.14 0.00 0.04 0.00 0.00 61.00 62.99 2eh0 s PRO 9 Cb -0.01 -3.40 0.03 0.00 0.04 0.00 0.00 34.50 31.15 2eh0 s PRO 9 CO -0.07 -0.50 0.34 -3.38 0.04 0.00 0.00 177.00 173.44 2eh0 s HIS 10 N 1.69 -0.12 -0.20 0.56 -3.43 -1.08 -0.49 115.29 112.22 2eh0 s HIS 10 Ca 0.64 -0.18 -0.06 0.00 -0.80 0.00 0.00 55.06 54.66 2eh0 s HIS 10 Cb -0.34 0.17 -0.03 0.00 -1.43 0.00 0.00 32.58 30.94 2eh0 s HIS 10 CO 0.29 -0.63 0.04 -0.51 -2.00 0.00 0.00 174.74 171.93 2eh0 s LEU 11 N -2.66 3.56 -0.13 5.38 1.43 0.88 -0.56 118.68 126.58 2eh0 s LEU 11 Ca 0.02 -0.06 -0.09 0.00 -1.03 0.00 0.00 54.13 52.97 2eh0 s LEU 11 Cb 0.02 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.29 2eh0 s LEU 11 CO -0.10 0.11 0.17 -0.69 0.23 0.00 0.00 176.35 176.07 2eh0 s VAL 12 N 0.75 5.42 -1.32 -1.59 1.01 0.05 0.22 120.40 124.95 2eh0 s VAL 12 Ca 0.02 0.29 -0.15 0.00 0.00 0.00 0.00 61.98 62.14 2eh0 s VAL 12 Cb -0.14 -3.46 0.09 0.00 0.00 0.00 0.00 36.38 32.87 2eh0 s VAL 12 CO 0.02 0.55 1.80 -3.20 0.00 0.00 0.00 175.10 174.28 2eh0 n ASN 13 N 2.48 4.77 0.00 3.32 2.85 0.14 -0.26 115.26 128.56 2eh0 n ASN 13 Ca -0.18 -2.93 0.04 0.00 -0.11 0.00 0.00 54.58 51.40 2eh0 n ASN 13 Cb 0.54 -1.67 0.26 0.00 1.24 0.00 0.00 39.78 40.14 2eh0 n ASN 13 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2eh0 n LEU 14 N 6.94 0.00 -4.01 1.20 -0.00 -1.25 -4.87 117.00 115.01 2eh0 n LEU 14 Ca 0.46 0.00 -0.18 0.00 -0.00 0.00 0.00 56.01 56.29 2eh0 n LEU 14 Cb 0.43 0.00 0.13 0.00 -0.00 0.00 0.00 43.42 43.98 2eh0 n LEU 14 CO 0.77 0.00 -0.16 0.59 -0.00 0.00 0.00 177.39 178.60 2eh0 n ASN 15 N -0.66 -2.85 -1.17 1.45 5.03 -1.25 -4.88 115.26 110.92 2eh0 n ASN 15 Ca 0.06 -0.30 0.12 0.00 0.87 0.00 0.00 54.58 55.33 2eh0 n ASN 15 Cb 0.03 -0.74 0.26 0.00 -1.02 0.00 0.00 39.78 38.32 2eh0 n ASN 15 CO 0.00 0.00 0.00 -1.84 -1.83 0.00 0.00 177.26 173.59 2eh0 n GLU 16 N -1.14 2.51 -3.55 3.52 0.28 -1.26 -4.68 120.64 116.31 2eh0 n GLU 16 Ca 0.04 -2.31 -0.39 0.00 -0.16 0.00 0.00 57.16 54.35 2eh0 n GLU 16 Cb 0.36 -1.52 -0.05 0.00 1.43 0.00 0.00 31.44 31.66 2eh0 n GLU 16 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2eh0 s ASP 17 N -1.29 6.37 0.00 -1.84 1.11 -1.26 -4.87 116.67 114.89 2eh0 s ASP 17 Ca 0.42 -3.64 0.15 0.00 0.18 0.00 0.00 52.55 49.66 2eh0 s ASP 17 Cb 0.23 -2.00 0.92 0.00 1.07 0.00 0.00 42.92 43.14 2eh0 s ASP 17 CO 0.31 -0.22 1.33 -0.81 1.18 0.00 0.00 175.17 176.96 2eh0 n PRO 18 N 2.50 0.49 -0.00 8.23 -0.04 -1.26 -1.90 135.00 143.01 2eh0 n PRO 18 Ca 0.22 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.77 2eh0 n PRO 18 Cb 0.38 -1.49 -0.13 0.00 -0.04 0.00 0.00 33.50 32.21 2eh0 n PRO 18 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2eh0 n LEU 19 N -0.99 0.45 -3.39 1.53 4.77 -1.26 -5.00 117.00 113.11 2eh0 n LEU 19 Ca 0.12 -0.24 -0.47 0.00 -0.03 0.00 0.00 56.01 55.38 2eh0 n LEU 19 Cb 0.05 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.08 2eh0 n LEU 19 CO 0.09 0.11 0.68 1.15 -1.33 0.00 0.00 177.39 178.09 2eh0 n MET 20 N -1.84 0.00 0.01 3.23 0.00 -0.80 -4.73 117.12 112.99 2eh0 n MET 20 Ca -0.00 0.00 0.05 0.00 0.00 0.00 0.00 57.70 57.75 2eh0 n MET 20 Cb 0.42 -1.09 0.23 0.00 0.00 0.00 0.00 33.22 32.77 2eh0 n MET 20 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 2eh0 n SER 21 N 2.24 0.04 -4.25 3.17 2.88 -1.26 -4.73 113.62 111.72 2eh0 n SER 21 Ca 0.20 0.51 -0.30 0.00 -1.33 0.00 0.00 58.87 57.95 2eh0 n SER 21 Cb -0.01 -0.52 0.18 0.00 -0.75 0.00 0.00 64.21 63.11 2eh0 n SER 21 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2eh0 s GLU 22 N -3.03 0.63 0.57 -1.46 0.41 -1.26 -5.03 118.70 109.54 2eh0 s GLU 22 Ca 0.04 -0.24 -0.18 0.00 -0.41 0.00 0.00 54.97 54.19 2eh0 s GLU 22 Cb 0.06 -1.83 -0.04 0.00 -1.78 0.00 0.00 34.13 30.54 2eh0 s GLU 22 CO 0.18 -2.45 1.10 0.00 -0.49 0.00 0.00 175.26 173.60 2eh0 h LEU 24 N 0.80 0.91 -8.49 0.00 3.38 -1.96 -3.45 115.31 106.51 2eh0 h LEU 24 Ca -0.48 -0.20 -0.22 0.00 0.09 0.00 0.00 57.88 57.07 2eh0 h LEU 24 Cb 1.24 -0.24 -0.10 0.00 0.09 0.00 0.00 40.66 41.65 2eh0 h LEU 24 CO 0.57 0.91 -0.29 -1.48 0.09 0.00 0.00 178.44 178.23 2eh0 s LEU 25 N -9.37 0.91 -0.07 1.67 0.05 -1.26 0.27 118.68 110.88 2eh0 s LEU 25 Ca -0.11 -1.33 -0.01 0.00 0.05 0.00 0.00 54.13 52.74 2eh0 s LEU 25 Cb 0.15 1.23 0.03 0.00 -2.05 0.00 0.00 46.19 45.54 2eh0 s LEU 25 CO 0.83 -1.13 -0.01 -0.31 -0.55 0.00 0.00 176.35 175.18 2eh0 s TYR 26 N -3.61 0.75 -0.43 3.48 2.02 0.13 -4.96 117.35 114.73 2eh0 s TYR 26 Ca 0.31 -0.22 -0.28 0.00 -0.37 0.00 0.00 57.07 56.51 2eh0 s TYR 26 Cb 0.01 -0.82 0.02 0.00 -0.40 0.00 0.00 41.96 40.78 2eh0 s TYR 26 CO 0.16 -0.32 1.06 0.71 -1.57 0.00 0.00 175.55 175.59 2eh0 s TYR 27 N 1.78 2.94 -0.22 2.71 2.02 -1.26 -0.09 117.35 125.23 2eh0 s TYR 27 Ca 0.02 0.77 -0.28 0.00 -0.37 0.00 0.00 57.07 57.21 2eh0 s TYR 27 Cb -0.13 -4.11 0.01 0.00 -0.40 0.00 0.00 41.96 37.33 2eh0 s TYR 27 CO -0.05 -1.08 1.00 0.42 -1.57 0.00 0.00 175.55 174.27 2eh0 s ILE 28 N 4.05 4.72 0.94 2.71 1.01 0.35 -4.97 121.20 130.01 2eh0 s ILE 28 Ca 0.44 1.95 -0.15 0.00 0.00 0.00 0.00 60.65 62.89 2eh0 s ILE 28 Cb -0.09 -4.28 0.17 0.00 0.01 0.00 0.00 42.46 38.28 2eh0 s ILE 28 CO 0.26 -0.14 1.26 -1.59 0.00 0.00 0.00 174.94 174.73 2eh0 s LYS 29 N 3.03 0.85 -0.88 2.79 0.00 -1.26 -4.42 119.74 119.85 2eh0 s LYS 29 Ca 0.43 -0.22 -0.25 0.00 0.00 0.00 0.00 55.97 55.93 2eh0 s LYS 29 Cb -0.15 -1.85 0.03 0.00 0.00 0.00 0.00 37.83 35.85 2eh0 s LYS 29 CO 0.07 -2.30 1.49 -0.51 0.00 0.00 0.00 175.35 174.10 2eh0 s ASP 30 N -4.69 6.12 0.00 0.03 1.11 -1.26 -4.75 116.67 113.23 2eh0 s ASP 30 Ca 0.70 -0.88 0.00 0.00 0.18 0.00 0.00 52.55 52.56 2eh0 s ASP 30 Cb -0.07 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.36 2eh0 s ASP 30 CO 0.52 -1.84 0.00 0.61 1.18 0.00 0.00 175.17 175.64 2eh0 n GLY 31 N 6.29 -0.82 3.03 0.21 0.00 -1.25 -5.01 105.19 107.64 2eh0 n GLY 31 Ca 0.23 -0.10 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 2eh0 n GLY 31 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2eh0 s ILE 32 N -3.65 2.22 -0.75 -0.61 1.09 -1.26 -1.08 121.20 117.15 2eh0 s ILE 32 Ca 0.00 -2.12 -0.18 0.00 -1.10 0.00 0.00 60.65 57.25 2eh0 s ILE 32 Cb 0.00 -2.55 0.14 0.00 -1.06 0.00 0.00 42.46 38.99 2eh0 s ILE 32 CO 0.00 -0.43 0.84 -0.89 -0.10 0.00 0.00 174.94 174.36 2eh0 s THR 33 N 0.97 5.01 0.48 2.92 2.01 0.13 -4.90 115.64 122.27 2eh0 s THR 33 Ca 0.05 -1.57 -0.23 0.00 0.31 0.00 0.00 61.69 60.25 2eh0 s THR 33 Cb -0.19 -4.57 -0.07 0.00 0.01 0.00 0.00 72.50 67.68 2eh0 s THR 33 CO -0.07 -1.21 1.31 -0.13 -0.69 0.00 0.00 174.62 173.82 2eh0 s ARG 34 N 1.99 3.55 -0.28 4.92 0.52 -1.26 -1.04 118.95 127.36 2eh0 s ARG 34 Ca 0.19 2.13 0.02 0.00 -0.52 0.00 0.00 55.73 57.55 2eh0 s ARG 34 Cb -0.15 -2.46 0.06 0.00 0.52 0.00 0.00 34.95 32.92 2eh0 s ARG 34 CO -0.02 -0.83 -0.06 0.08 0.02 0.00 0.00 175.30 174.49 2eh0 s VAL 35 N -1.34 2.42 0.00 3.52 1.01 0.63 -2.98 120.40 123.66 2eh0 s VAL 35 Ca 0.65 -1.65 0.00 0.00 0.00 0.00 0.00 61.98 60.98 2eh0 s VAL 35 Cb -0.37 -2.46 0.00 0.00 0.00 0.00 0.00 36.38 33.55 2eh0 s VAL 35 CO 0.46 -0.12 0.00 0.61 0.00 0.00 0.00 175.10 176.05 2eh0 n GLY 36 N 4.47 1.82 3.97 4.51 0.00 -1.16 -2.54 105.19 116.26 2eh0 n GLY 36 Ca -0.12 -0.14 -0.21 0.00 0.00 0.00 0.00 46.02 45.55 2eh0 n GLY 36 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2eh0 s GLN 37 N 3.65 3.37 0.15 1.61 -0.21 -1.18 -2.05 119.66 125.01 2eh0 s GLN 37 Ca 0.00 -0.71 -0.09 0.00 0.02 0.00 0.00 55.36 54.58 2eh0 s GLN 37 Cb 0.00 -2.82 -0.00 0.00 1.00 0.00 0.00 33.01 31.19 2eh0 s GLN 37 CO 0.00 0.28 1.47 0.00 -2.12 0.00 0.00 175.29 174.92 2eh0 h ALA 38 N 1.01 0.59 0.00 6.09 0.00 -1.89 -2.81 119.26 122.25 2eh0 h ALA 38 Ca -0.50 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 53.93 2eh0 h ALA 38 Cb 1.23 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2eh0 h ALA 38 CO 0.59 0.68 0.00 -0.44 0.00 0.00 0.00 179.25 180.08 2eh0 h ASP 39 N 0.66 0.00 -1.95 0.00 3.32 -1.95 -3.44 116.42 113.05 2eh0 h ASP 39 Ca 0.04 0.00 -0.62 0.00 0.02 0.00 0.00 57.03 56.46 2eh0 h ASP 39 Cb 1.04 0.00 0.13 0.00 0.22 0.00 0.00 39.33 40.72 2eh0 h ASP 39 CO 0.10 0.00 -0.35 0.00 -1.72 0.00 0.00 179.24 177.27 2eh0 n ALA 40 N -2.02 -1.68 -0.32 3.45 0.00 -1.06 -4.80 120.51 114.07 2eh0 n ALA 40 Ca -0.01 0.29 -0.07 0.00 0.00 0.00 0.00 53.44 53.65 2eh0 n ALA 40 Cb 0.14 -1.77 -0.06 0.00 0.00 0.00 0.00 19.45 17.77 2eh0 n ALA 40 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2eh0 n GLU 41 N 0.80 -0.31 -2.22 0.00 1.02 -1.26 -4.46 120.64 114.20 2eh0 n GLU 41 Ca 0.13 1.18 -0.26 0.00 -0.02 0.00 0.00 57.16 58.19 2eh0 n GLU 41 Cb 0.34 -1.74 0.16 0.00 -0.02 0.00 0.00 31.44 30.18 2eh0 n GLU 41 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2eh0 n ARG 42 N -5.01 -0.71 -3.22 3.49 3.00 -1.26 -5.03 116.66 107.92 2eh0 n ARG 42 Ca 0.03 -2.38 -0.45 0.00 -0.01 0.00 0.00 57.85 55.04 2eh0 n ARG 42 Cb 0.22 -1.02 -0.05 0.00 0.00 0.00 0.00 32.46 31.61 2eh0 n ARG 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 2eh0 s ARG 43 N -5.51 3.02 -0.10 5.56 3.52 -1.26 -4.86 118.95 119.32 2eh0 s ARG 43 Ca 0.71 -1.47 -0.30 0.00 -0.13 0.00 0.00 55.73 54.54 2eh0 s ARG 43 Cb -0.03 -4.26 -0.02 0.00 -1.56 0.00 0.00 34.95 29.08 2eh0 s ARG 43 CO 0.48 -1.40 1.17 -0.65 -0.81 0.00 0.00 175.30 174.10 2eh0 s GLN 44 N 2.14 4.33 0.15 5.12 -1.52 -1.26 -4.82 119.66 123.79 2eh0 s GLN 44 Ca 0.07 1.60 -0.18 0.00 -1.95 0.00 0.00 55.36 54.90 2eh0 s GLN 44 Cb -0.26 -3.60 0.03 0.00 -0.22 0.00 0.00 33.01 28.95 2eh0 s GLN 44 CO 0.05 -0.50 1.69 0.22 -0.25 0.00 0.00 175.29 176.51 2eh0 h ASP 45 N 7.55 -0.23 -3.64 5.90 1.82 -1.87 -3.39 116.42 122.56 2eh0 h ASP 45 Ca -0.31 0.08 -0.64 0.00 -0.39 0.00 0.00 57.03 55.77 2eh0 h ASP 45 Cb 1.14 0.17 -0.20 0.00 0.68 0.00 0.00 39.33 41.11 2eh0 h ASP 45 CO 0.90 -0.08 -0.59 -0.63 -1.61 0.00 0.00 179.24 177.23 2eh0 s ILE 46 N -6.20 4.61 -0.24 2.25 1.01 -1.22 -5.08 121.20 116.32 2eh0 s ILE 46 Ca -0.14 -0.08 -0.10 0.00 0.00 0.00 0.00 60.65 60.34 2eh0 s ILE 46 Cb 0.12 -3.15 -0.05 0.00 0.01 0.00 0.00 42.46 39.39 2eh0 s ILE 46 CO 0.70 0.34 0.15 -0.69 0.00 0.00 0.00 174.94 175.43 2eh0 s VAL 47 N 1.44 5.22 0.49 2.92 1.01 -1.26 -2.97 120.40 127.26 2eh0 s VAL 47 Ca 0.06 0.13 0.08 0.00 0.00 0.00 0.00 61.98 62.25 2eh0 s VAL 47 Cb -0.15 -3.43 0.03 0.00 0.00 0.00 0.00 36.38 32.83 2eh0 s VAL 47 CO 0.05 0.35 0.56 -0.76 0.00 0.00 0.00 175.10 175.30 2eh0 s LEU 48 N 1.09 3.27 1.20 3.92 2.01 -0.87 -5.02 118.68 124.27 2eh0 s LEU 48 Ca 0.07 -0.77 -0.17 0.00 0.01 0.00 0.00 54.13 53.27 2eh0 s LEU 48 Cb -0.14 -1.95 0.23 0.00 0.01 0.00 0.00 46.19 44.35 2eh0 s LEU 48 CO 0.05 -0.97 0.54 -0.24 1.01 0.00 0.00 176.35 176.74 2eh0 n SER 49 N -1.88 -2.61 -2.37 2.29 2.88 -1.26 -4.80 113.62 105.87 2eh0 n SER 49 Ca 0.08 -0.32 -0.28 0.00 -1.33 0.00 0.00 58.87 57.02 2eh0 n SER 49 Cb 0.61 -1.04 0.01 0.00 -0.75 0.00 0.00 64.21 63.05 2eh0 n SER 49 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2eh0 n GLY 50 N 1.72 6.08 0.44 0.46 0.00 -1.26 -4.48 105.19 108.15 2eh0 n GLY 50 Ca 0.04 -2.69 -0.02 0.00 0.00 0.00 0.00 46.02 43.35 2eh0 n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2eh0 n ALA 51 N -0.58 1.44 -1.99 4.61 0.00 -1.26 -4.86 120.51 117.88 2eh0 n ALA 51 Ca 0.43 -0.28 -0.02 0.00 0.00 0.00 0.00 53.44 53.58 2eh0 n ALA 51 Cb 0.71 0.05 0.11 0.00 0.00 0.00 0.00 19.45 20.33 2eh0 n ALA 51 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2eh0 n HIS 52 N -3.11 0.75 -4.05 0.00 8.25 -1.26 -5.06 115.22 110.74 2eh0 n HIS 52 Ca -0.03 -1.53 -0.26 0.00 -0.26 0.00 0.00 57.72 55.64 2eh0 n HIS 52 Cb 0.12 -0.25 -0.05 0.00 1.12 0.00 0.00 29.99 30.93 2eh0 n HIS 52 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2eh0 s ILE 53 N -2.97 4.70 -0.01 1.59 -1.09 -1.26 -4.32 121.20 117.84 2eh0 s ILE 53 Ca 0.39 -1.00 0.02 0.00 -2.23 0.00 0.00 60.65 57.83 2eh0 s ILE 53 Cb 0.38 -3.42 -0.03 0.00 -1.58 0.00 0.00 42.46 37.81 2eh0 s ILE 53 CO -0.06 -0.12 -0.05 -0.54 -1.23 0.00 0.00 174.94 172.93 2eh0 s LYS 54 N -3.20 2.63 0.35 2.79 3.01 -1.26 -4.99 119.74 119.07 2eh0 s LYS 54 Ca 0.32 -0.67 0.12 0.00 -1.01 0.00 0.00 55.97 54.73 2eh0 s LYS 54 Cb -0.10 -2.55 0.93 0.00 -1.01 0.00 0.00 37.83 35.10 2eh0 s LYS 54 CO 0.25 0.62 1.77 0.93 0.51 0.00 0.00 175.35 179.43 2eh0 h GLU 55 N 4.58 0.54 -0.61 1.68 3.07 -1.92 -2.04 114.58 119.89 2eh0 h GLU 55 Ca -0.49 -0.03 -0.42 0.00 -0.50 0.00 0.00 59.36 57.93 2eh0 h GLU 55 Cb 1.17 -0.12 -0.41 0.00 -0.84 0.00 0.00 28.75 28.55 2eh0 h GLU 55 CO 0.54 0.36 -0.94 0.39 -1.40 0.00 0.00 179.01 177.97 2eh0 n GLU 56 N -4.72 2.80 0.00 2.33 1.02 -1.26 -3.11 120.64 117.70 2eh0 n GLU 56 Ca 0.24 -3.87 0.00 0.00 -0.02 0.00 0.00 57.16 53.51 2eh0 n GLU 56 Cb 0.73 -1.98 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 2eh0 n GLU 56 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 2eh0 n HIS 57 N -0.66 0.00 -4.22 -0.32 -0.00 -0.77 -4.41 115.22 104.84 2eh0 n HIS 57 Ca 0.29 0.00 -0.18 0.00 0.46 0.00 0.00 57.72 58.28 2eh0 n HIS 57 Cb 0.90 -0.35 -0.07 0.00 -0.12 0.00 0.00 29.99 30.35 2eh0 n HIS 57 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2eh0 s ILE 59 N -3.25 0.12 -0.26 0.00 1.01 -0.92 -0.27 121.20 117.63 2eh0 s ILE 59 Ca 0.38 -1.01 -0.00 0.00 0.00 0.00 0.00 60.65 60.02 2eh0 s ILE 59 Cb 0.01 -0.60 0.04 0.00 0.01 0.00 0.00 42.46 41.92 2eh0 s ILE 59 CO 0.26 -0.55 -0.07 -0.36 0.00 0.00 0.00 174.94 174.22 2eh0 s PHE 60 N -2.01 3.15 -0.23 3.97 0.08 -0.20 -1.19 117.98 121.56 2eh0 s PHE 60 Ca -0.10 -1.86 -0.07 0.00 0.12 0.00 0.00 56.93 55.02 2eh0 s PHE 60 Cb -0.05 -2.02 -0.03 0.00 -0.57 0.00 0.00 43.02 40.34 2eh0 s PHE 60 CO -0.02 -0.80 0.05 0.50 -0.10 0.00 0.00 175.22 174.85 2eh0 s ARG 61 N 1.24 3.69 -0.39 0.44 3.52 -0.92 0.22 118.95 126.76 2eh0 s ARG 61 Ca -0.03 -0.47 -0.08 0.00 -0.13 0.00 0.00 55.73 55.02 2eh0 s ARG 61 Cb -0.18 -3.24 0.06 0.00 -1.56 0.00 0.00 34.95 30.04 2eh0 s ARG 61 CO -0.04 -0.07 0.20 -1.54 -0.81 0.00 0.00 175.30 173.03 2eh0 s SER 62 N 1.27 5.49 -0.04 -2.12 1.04 -0.24 -1.70 113.70 117.39 2eh0 s SER 62 Ca 0.04 -1.40 0.02 0.00 0.48 0.00 0.00 55.95 55.10 2eh0 s SER 62 Cb -0.15 -1.93 0.01 0.00 0.10 0.00 0.00 66.02 64.05 2eh0 s SER 62 CO 0.03 -0.45 -0.10 -0.70 0.98 0.00 0.00 173.24 173.00 2eh0 s GLU 63 N 1.40 1.12 -0.60 4.02 2.12 -0.73 -3.88 118.70 122.15 2eh0 s GLU 63 Ca 0.02 -0.32 -0.28 0.00 0.36 0.00 0.00 54.97 54.75 2eh0 s GLU 63 Cb -0.22 -1.02 0.03 0.00 0.26 0.00 0.00 34.13 33.19 2eh0 s GLU 63 CO 0.02 0.09 1.19 0.50 -0.54 0.00 0.00 175.26 176.52 2eh0 s ARG 64 N 0.33 3.46 0.66 4.30 3.52 -1.26 -1.14 118.95 128.82 2eh0 s ARG 64 Ca -0.06 0.15 -0.18 0.00 -0.13 0.00 0.00 55.73 55.51 2eh0 s ARG 64 Cb -0.11 -4.04 -0.14 0.00 -1.56 0.00 0.00 34.95 29.10 2eh0 s ARG 64 CO 0.01 -1.74 -0.29 0.45 -0.81 0.00 0.00 175.30 172.92 2eh0 n SER 65 N 8.53 -4.23 0.01 -2.12 2.88 0.14 -4.55 113.62 114.27 2eh0 n SER 65 Ca 0.07 0.51 0.22 0.00 -1.33 0.00 0.00 58.87 58.35 2eh0 n SER 65 Cb 0.49 -0.84 0.63 0.00 -0.75 0.00 0.00 64.21 63.74 2eh0 n SER 65 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 2eh0 h ASN 66 N -0.32 0.00 0.15 -3.46 -0.26 -1.94 0.78 115.58 110.53 2eh0 h ASN 66 Ca -0.42 0.00 -0.15 0.00 -0.56 0.00 0.00 56.30 55.17 2eh0 h ASN 66 Cb 1.40 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.65 2eh0 h ASN 66 CO 0.36 0.00 -0.55 0.77 -1.06 0.00 0.00 177.43 176.95 2eh0 h SER 67 N 0.00 0.48 0.00 5.81 4.64 -2.02 -3.47 113.55 118.99 2eh0 h SER 67 Ca 0.28 -0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2eh0 h SER 67 Cb 1.71 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.66 2eh0 h SER 67 CO -0.00 0.93 0.00 0.61 -0.87 0.00 0.00 176.83 177.50 2eh0 n GLY 68 N 0.21 1.82 3.54 -0.77 0.00 0.27 -5.13 105.19 105.13 2eh0 n GLY 68 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 2eh0 n GLY 68 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2eh0 s GLU 69 N -0.01 3.28 -0.20 1.61 -1.05 -1.24 -4.85 118.70 116.25 2eh0 s GLU 69 Ca 0.00 -0.53 -0.29 0.00 -0.15 0.00 0.00 54.97 54.00 2eh0 s GLU 69 Cb 0.00 -2.78 -0.02 0.00 -0.44 0.00 0.00 34.13 30.89 2eh0 s GLU 69 CO 0.00 0.43 1.48 0.08 0.95 0.00 0.00 175.26 178.20 2eh0 s VAL 70 N -0.16 3.90 -0.07 1.83 1.01 -1.26 0.28 120.40 125.92 2eh0 s VAL 70 Ca 0.03 1.04 0.05 0.00 0.00 0.00 0.00 61.98 63.10 2eh0 s VAL 70 Cb -0.13 -3.82 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 2eh0 s VAL 70 CO 0.03 -0.26 -0.24 -0.63 0.00 0.00 0.00 175.10 173.99 2eh0 s ILE 71 N 4.47 2.04 -0.10 2.22 -1.09 -0.30 -4.92 121.20 123.52 2eh0 s ILE 71 Ca 0.65 -1.04 -0.02 0.00 -2.23 0.00 0.00 60.65 58.00 2eh0 s ILE 71 Cb -0.24 -1.73 -0.03 0.00 -1.58 0.00 0.00 42.46 38.87 2eh0 s ILE 71 CO 0.25 0.56 -0.00 -0.69 -1.23 0.00 0.00 174.94 173.83 2eh0 s VAL 72 N 0.00 4.28 -0.04 2.92 1.01 -1.26 -1.78 120.40 125.54 2eh0 s VAL 72 Ca -0.08 -0.25 0.05 0.00 0.00 0.00 0.00 61.98 61.69 2eh0 s VAL 72 Cb -0.15 -2.82 -0.01 0.00 0.00 0.00 0.00 36.38 33.41 2eh0 s VAL 72 CO 0.05 0.58 -0.18 -0.89 0.00 0.00 0.00 175.10 174.66 2eh0 s THR 73 N -0.63 1.49 -0.22 3.92 2.01 -0.69 -0.74 115.64 120.78 2eh0 s THR 73 Ca 0.10 -0.76 -0.16 0.00 0.31 0.00 0.00 61.69 61.18 2eh0 s THR 73 Cb -0.12 -1.28 -0.04 0.00 0.01 0.00 0.00 72.50 71.08 2eh0 s THR 73 CO 0.02 0.43 0.40 -0.22 -0.69 0.00 0.00 174.62 174.56 2eh0 s LEU 74 N -0.06 4.12 -0.90 4.42 2.96 0.01 -2.15 118.68 127.08 2eh0 s LEU 74 Ca -0.02 0.45 -0.02 0.00 -0.22 0.00 0.00 54.13 54.32 2eh0 s LEU 74 Cb -0.11 -2.50 0.22 0.00 0.50 0.00 0.00 46.19 44.30 2eh0 s LEU 74 CO 0.02 -0.12 0.79 -1.61 -1.32 0.00 0.00 176.35 174.10 2eh0 s GLU 75 N 1.59 3.30 0.68 1.98 2.02 -0.33 -2.93 118.70 125.01 2eh0 s GLU 75 Ca 0.18 -3.25 -0.14 0.00 0.02 0.00 0.00 54.97 51.77 2eh0 s GLU 75 Cb -0.15 -3.98 0.01 0.00 0.10 0.00 0.00 34.13 30.11 2eh0 s GLU 75 CO 0.08 -1.26 1.11 -1.25 0.02 0.00 0.00 175.26 173.96 2eh0 s PRO 76 N -1.31 2.70 0.67 0.39 0.04 -1.26 -2.16 135.00 134.08 2eh0 s PRO 76 Ca 0.27 1.35 -0.08 0.00 0.04 0.00 0.00 61.00 62.59 2eh0 s PRO 76 Cb -0.08 -1.94 0.03 0.00 0.04 0.00 0.00 34.50 32.56 2eh0 s PRO 76 CO -0.12 -1.32 1.01 0.00 0.04 0.00 0.00 177.00 176.61 2eh0 n GLU 78 N -2.86 0.76 -0.43 0.00 0.28 -1.26 -3.83 120.64 113.30 2eh0 n GLU 78 Ca 0.06 -0.44 0.06 0.00 -0.16 0.00 0.00 57.16 56.69 2eh0 n GLU 78 Cb 0.59 -1.49 0.12 0.00 1.43 0.00 0.00 31.44 32.08 2eh0 n GLU 78 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2eh0 n ARG 79 N -0.74 0.98 -4.51 3.44 1.74 -1.26 -5.06 116.66 111.25 2eh0 n ARG 79 Ca 0.12 -2.39 -0.24 0.00 -0.77 0.00 0.00 57.85 54.57 2eh0 n ARG 79 Cb 0.34 -1.18 -0.11 0.00 -1.02 0.00 0.00 32.46 30.49 2eh0 n ARG 79 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2eh0 s SER 80 N -2.51 3.01 -0.38 0.55 1.04 -1.25 -5.05 113.70 109.11 2eh0 s SER 80 Ca 0.27 -1.33 -0.04 0.00 0.48 0.00 0.00 55.95 55.33 2eh0 s SER 80 Cb 0.26 -0.22 0.09 0.00 0.10 0.00 0.00 66.02 66.25 2eh0 s SER 80 CO -0.02 -0.48 0.17 -1.61 0.98 0.00 0.00 173.24 172.28 2eh0 s GLU 81 N -3.79 2.28 -0.05 4.02 8.01 -1.26 -4.86 118.70 123.06 2eh0 s GLU 81 Ca 0.34 -1.57 0.04 0.00 0.01 0.00 0.00 54.97 53.80 2eh0 s GLU 81 Cb 0.08 -3.54 -0.00 0.00 -4.31 0.00 0.00 34.13 26.35 2eh0 s GLU 81 CO 0.16 -0.92 -0.18 0.99 0.01 0.00 0.00 175.26 175.31 2eh0 s THR 82 N 1.25 1.51 -0.10 3.63 2.01 -1.26 0.62 115.64 123.30 2eh0 s THR 82 Ca 0.03 -0.76 0.00 0.00 0.31 0.00 0.00 61.69 61.28 2eh0 s THR 82 Cb -0.22 -1.30 0.02 0.00 0.01 0.00 0.00 72.50 71.02 2eh0 s THR 82 CO -0.02 0.43 -0.09 -0.31 -0.69 0.00 0.00 174.62 173.95 2eh0 s TYR 83 N 0.03 1.47 -0.12 4.92 2.02 -0.18 -1.13 117.35 124.37 2eh0 s TYR 83 Ca -0.04 -0.69 0.02 0.00 -0.37 0.00 0.00 57.07 55.98 2eh0 s TYR 83 Cb -0.12 -1.19 -0.01 0.00 -0.40 0.00 0.00 41.96 40.24 2eh0 s TYR 83 CO 0.03 -0.46 -0.18 0.08 -1.57 0.00 0.00 175.55 173.45 2eh0 s VAL 84 N 1.47 2.62 -1.60 0.71 1.01 0.20 -0.46 120.40 124.35 2eh0 s VAL 84 Ca 0.01 -0.82 -0.00 0.00 0.00 0.00 0.00 61.98 61.16 2eh0 s VAL 84 Cb -0.13 -2.06 0.00 0.00 0.00 0.00 0.00 36.38 34.19 2eh0 s VAL 84 CO -0.06 0.54 0.05 0.59 0.00 0.00 0.00 175.10 176.22 2eh0 n ASN 85 N 3.54 -5.46 0.00 3.32 3.02 0.41 -1.30 115.26 118.80 2eh0 n ASN 85 Ca -0.19 0.01 0.00 0.00 -0.03 0.00 0.00 54.58 54.37 2eh0 n ASN 85 Cb 0.53 -4.55 0.00 0.00 -0.61 0.00 0.00 39.78 35.15 2eh0 n ASN 85 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2eh0 n GLY 86 N -1.01 2.68 3.94 7.41 0.00 -1.26 -5.00 105.19 111.95 2eh0 n GLY 86 Ca -0.21 -0.14 -0.27 0.00 0.00 0.00 0.00 46.02 45.39 2eh0 n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eh0 s LYS 87 N 0.00 1.32 -0.13 1.61 -2.85 -0.42 -5.00 119.74 114.27 2eh0 s LYS 87 Ca 0.00 -0.53 -0.14 0.00 -1.00 0.00 0.00 55.97 54.31 2eh0 s LYS 87 Cb 0.00 -2.05 -0.05 0.00 -2.06 0.00 0.00 37.83 33.68 2eh0 s LYS 87 CO 0.00 -1.87 0.32 0.50 0.10 0.00 0.00 175.35 174.40 2eh0 s ARG 88 N -5.54 4.15 -0.25 1.78 6.06 -1.26 0.60 118.95 124.49 2eh0 s ARG 88 Ca 0.68 0.16 -0.05 0.00 -2.50 0.00 0.00 55.73 54.02 2eh0 s ARG 88 Cb -0.06 -3.38 -0.00 0.00 0.06 0.00 0.00 34.95 31.57 2eh0 s ARG 88 CO 0.49 0.34 0.01 0.54 -2.50 0.00 0.00 175.30 174.18 2eh0 s VAL 89 N 0.14 3.63 0.00 7.11 0.11 -0.28 -4.79 120.40 126.31 2eh0 s VAL 89 Ca 0.18 -0.57 0.00 0.00 -2.93 0.00 0.00 61.98 58.67 2eh0 s VAL 89 Cb -0.14 -2.75 0.00 0.00 -1.53 0.00 0.00 36.38 31.96 2eh0 s VAL 89 CO 0.06 0.28 0.00 -1.54 -3.33 0.00 0.00 175.10 170.57 2eh0 n SER 90 N 4.82 2.05 -4.61 3.54 3.41 -1.26 -4.45 113.62 117.12 2eh0 n SER 90 Ca -0.17 -0.22 -0.23 0.00 -0.26 0.00 0.00 58.87 57.99 2eh0 n SER 90 Cb 0.50 0.84 -0.08 0.00 -0.26 0.00 0.00 64.21 65.21 2eh0 n SER 90 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2eh0 s GLN 91 N -1.25 2.15 -0.74 4.33 -0.21 -1.26 -4.66 119.66 118.02 2eh0 s GLN 91 Ca 0.00 -1.53 -0.26 0.00 0.02 0.00 0.00 55.36 53.60 2eh0 s GLN 91 Cb 0.00 -2.06 -0.03 0.00 1.00 0.00 0.00 33.01 31.92 2eh0 s GLN 91 CO 0.00 0.33 1.90 -1.25 -2.12 0.00 0.00 175.29 174.14 2eh0 s PRO 92 N -3.65 2.60 0.26 2.91 0.04 -1.26 -4.62 135.00 131.28 2eh0 s PRO 92 Ca 0.32 0.21 0.11 0.00 0.04 0.00 0.00 61.00 61.67 2eh0 s PRO 92 Cb -0.05 -4.68 -0.05 0.00 0.04 0.00 0.00 34.50 29.76 2eh0 s PRO 92 CO 0.19 -3.01 -0.13 0.14 0.04 0.00 0.00 177.00 174.23 2eh0 s VAL 93 N 9.50 2.88 0.11 -0.36 -7.23 -1.15 -4.91 120.40 119.24 2eh0 s VAL 93 Ca 0.68 -2.12 -0.28 0.00 -1.81 0.00 0.00 61.98 58.45 2eh0 s VAL 93 Cb -0.10 -2.50 -0.06 0.00 0.56 0.00 0.00 36.38 34.28 2eh0 s VAL 93 CO 0.11 -0.33 0.89 -1.10 -0.31 0.00 0.00 175.10 174.36 2eh0 s GLN 94 N -3.40 4.65 0.34 4.82 -0.21 -1.26 -0.81 119.66 123.79 2eh0 s GLN 94 Ca 0.29 1.33 -0.22 0.00 0.02 0.00 0.00 55.36 56.78 2eh0 s GLN 94 Cb -0.06 -3.36 -0.10 0.00 1.00 0.00 0.00 33.01 30.49 2eh0 s GLN 94 CO 0.16 0.28 0.89 -0.51 -2.12 0.00 0.00 175.29 173.99 2eh0 s LEU 95 N -0.18 4.17 -0.23 2.90 2.01 0.08 -4.92 118.68 122.51 2eh0 s LEU 95 Ca 0.43 1.66 -0.11 0.00 0.01 0.00 0.00 54.13 56.12 2eh0 s LEU 95 Cb -0.23 -4.14 -0.05 0.00 0.01 0.00 0.00 46.19 41.78 2eh0 s LEU 95 CO 0.28 -0.17 0.19 -0.60 1.01 0.00 0.00 176.35 177.06 2eh0 s ARG 96 N -2.54 4.09 -0.81 1.70 6.06 -1.26 -4.73 118.95 121.47 2eh0 s ARG 96 Ca 0.54 -0.21 -0.24 0.00 -2.50 0.00 0.00 55.73 53.32 2eh0 s ARG 96 Cb -0.14 -3.53 -0.19 0.00 0.06 0.00 0.00 34.95 31.15 2eh0 s ARG 96 CO 0.19 0.06 2.15 0.45 -2.50 0.00 0.00 175.30 175.65 2eh0 n SER 97 N 4.26 0.12 -0.11 -2.12 2.88 -1.26 -0.14 113.62 117.25 2eh0 n SER 97 Ca -0.14 0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.50 2eh0 n SER 97 Cb 0.52 -0.72 0.00 0.00 -0.75 0.00 0.00 64.21 63.26 2eh0 n SER 97 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2eh0 n GLY 98 N 5.19 0.84 3.84 0.46 0.00 0.56 -4.92 105.19 111.15 2eh0 n GLY 98 Ca 0.53 -0.11 -0.37 0.00 0.00 0.00 0.00 46.02 46.08 2eh0 n GLY 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eh0 s ASN 99 N -1.93 6.44 -0.43 1.61 4.22 0.80 -4.80 114.94 120.85 2eh0 s ASN 99 Ca 0.00 0.52 -0.27 0.00 -2.14 0.00 0.00 52.86 50.97 2eh0 s ASN 99 Cb 0.00 -2.11 0.02 0.00 1.28 0.00 0.00 41.25 40.44 2eh0 s ASN 99 CO 0.00 0.34 1.02 -0.60 -2.04 0.00 0.00 177.10 175.82 2eh0 s ARG 100 N -0.73 3.74 -0.16 3.55 3.52 -1.26 -3.63 118.95 123.99 2eh0 s ARG 100 Ca 0.16 0.52 0.00 0.00 -0.13 0.00 0.00 55.73 56.28 2eh0 s ARG 100 Cb -0.13 -3.87 -0.00 0.00 -1.56 0.00 0.00 34.95 29.40 2eh0 s ARG 100 CO 0.05 -1.17 -0.15 0.42 -0.81 0.00 0.00 175.30 173.64 2eh0 s ILE 101 N 3.92 2.68 -0.14 4.11 1.01 -1.23 -0.44 121.20 131.11 2eh0 s ILE 101 Ca 0.42 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 60.32 2eh0 s ILE 101 Cb -0.10 -2.14 0.00 0.00 0.01 0.00 0.00 42.46 40.24 2eh0 s ILE 101 CO 0.25 0.51 -0.18 -0.63 0.00 0.00 0.00 174.94 174.89 2eh0 s ILE 102 N 0.88 2.42 -0.53 2.92 1.01 0.39 -2.59 121.20 125.70 2eh0 s ILE 102 Ca -0.04 -0.86 -0.09 0.00 0.00 0.00 0.00 60.65 59.66 2eh0 s ILE 102 Cb -0.15 -2.00 0.14 0.00 0.01 0.00 0.00 42.46 40.46 2eh0 s ILE 102 CO -0.01 0.53 0.41 -0.04 0.00 0.00 0.00 174.94 175.83 2eh0 s MET 103 N 0.76 2.63 0.00 2.79 -1.94 -1.25 -1.01 119.30 121.28 2eh0 s MET 103 Ca -0.07 -1.94 0.00 0.00 -1.71 0.00 0.00 55.69 51.97 2eh0 s MET 103 Cb -0.16 -3.97 0.00 0.00 2.01 0.00 0.00 34.83 32.71 2eh0 s MET 103 CO 0.00 -1.21 0.00 0.41 -0.01 0.00 0.00 175.02 174.21 2eh0 n GLY 104 N 4.64 0.23 1.19 -0.03 0.00 0.20 -4.64 105.19 106.78 2eh0 n GLY 104 Ca -0.04 0.33 -0.09 0.00 0.00 0.00 0.00 46.02 46.23 2eh0 n GLY 104 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2eh0 n LYS 105 N 0.00 -0.36 0.00 1.61 4.76 -1.26 -4.91 118.16 117.99 2eh0 n LYS 105 Ca 0.00 -0.64 0.01 0.00 -2.87 0.00 0.00 58.31 54.81 2eh0 n LYS 105 Cb 0.00 -0.41 0.04 0.00 -1.84 0.00 0.00 35.03 32.82 2eh0 n LYS 105 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 2eh0 n ASN 106 N -3.25 0.00 -3.98 4.39 6.94 -1.26 -4.66 115.26 113.43 2eh0 n ASN 106 Ca 0.05 -1.77 -0.34 0.00 -0.02 0.00 0.00 54.58 52.50 2eh0 n ASN 106 Cb 0.18 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 37.50 2eh0 n ASN 106 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 2eh0 n HIS 107 N -0.52 1.07 -3.32 -2.53 8.25 -1.26 -4.88 115.22 112.02 2eh0 n HIS 107 Ca 0.01 -0.84 -0.38 0.00 -0.26 0.00 0.00 57.72 56.24 2eh0 n HIS 107 Cb 0.00 -1.74 -0.06 0.00 1.12 0.00 0.00 29.99 29.31 2eh0 n HIS 107 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2eh0 s VAL 108 N 10.00 5.01 0.15 1.59 1.01 -1.26 -3.88 120.40 133.02 2eh0 s VAL 108 Ca 0.70 1.04 0.10 0.00 0.00 0.00 0.00 61.98 63.82 2eh0 s VAL 108 Cb 0.07 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 2eh0 s VAL 108 CO 0.22 0.44 -0.24 -0.36 0.00 0.00 0.00 175.10 175.17 2eh0 s PHE 109 N -0.24 2.13 -0.26 5.22 0.08 -1.07 -3.89 117.98 119.95 2eh0 s PHE 109 Ca 0.27 -0.39 -0.10 0.00 0.12 0.00 0.00 56.93 56.83 2eh0 s PHE 109 Cb -0.17 -1.11 -0.05 0.00 -0.57 0.00 0.00 43.02 41.12 2eh0 s PHE 109 CO 0.14 0.36 0.16 0.50 -0.10 0.00 0.00 175.22 176.28 2eh0 s ARG 110 N -2.30 3.97 -0.80 0.44 3.52 0.64 -3.47 118.95 120.94 2eh0 s ARG 110 Ca 0.14 -0.32 -0.26 0.00 -0.13 0.00 0.00 55.73 55.17 2eh0 s ARG 110 Cb -0.09 -3.56 0.03 0.00 -1.56 0.00 0.00 34.95 29.77 2eh0 s ARG 110 CO 0.07 -0.07 1.34 0.12 -0.81 0.00 0.00 175.30 175.96 2eh0 s PHE 111 N 1.41 2.31 0.08 5.12 5.36 -1.24 -0.77 117.98 130.24 2eh0 s PHE 111 Ca 0.07 -0.18 -0.25 0.00 -0.96 0.00 0.00 56.93 55.61 2eh0 s PHE 111 Cb -0.15 -4.62 -0.06 0.00 -0.34 0.00 0.00 43.02 37.85 2eh0 s PHE 111 CO 0.07 -2.06 0.76 -0.80 -1.46 0.00 0.00 175.22 171.74 2eh0 s ASN 112 N 4.20 7.25 -0.45 6.13 -0.87 0.28 0.21 114.94 131.69 2eh0 s ASN 112 Ca 0.39 1.49 0.07 0.00 -1.57 0.00 0.00 52.86 53.23 2eh0 s ASN 112 Cb -0.06 -2.47 0.23 0.00 -0.02 0.00 0.00 41.25 38.92 2eh0 s ASN 112 CO 0.10 0.08 0.66 1.57 -2.57 0.00 0.00 177.10 176.94 2eh0 n HIS 113 N 2.45 -2.00 0.98 2.20 -0.00 -1.26 -2.64 115.22 114.94 2eh0 n HIS 113 Ca -0.04 -2.57 0.08 0.00 0.46 0.00 0.00 57.72 55.65 2eh0 n HIS 113 Cb 0.50 0.68 0.45 0.00 -0.12 0.00 0.00 29.99 31.50 2eh0 n HIS 113 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 2eh0 n PRO 114 N 1.88 0.49 -0.02 1.57 -0.04 -1.26 -2.45 135.00 135.16 2eh0 n PRO 114 Ca 0.17 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.45 2eh0 n PRO 114 Cb 0.56 -1.48 -0.13 0.00 -0.04 0.00 0.00 33.50 32.41 2eh0 n PRO 114 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2eh0 h GLU 115 N 0.00 0.14 0.09 0.54 5.08 -1.90 -3.29 114.58 115.24 2eh0 h GLU 115 Ca 0.00 -0.23 -0.20 0.00 -1.00 0.00 0.00 59.36 57.92 2eh0 h GLU 115 Cb 0.00 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2eh0 h GLU 115 CO 0.00 1.11 -1.02 0.37 -1.00 0.00 0.00 179.01 178.48 2eh0 h GLN 116 N -0.68 0.19 -1.04 2.33 5.75 -1.89 -3.33 115.11 116.45 2eh0 h GLN 116 Ca -0.15 -0.33 0.30 0.00 -0.15 0.00 0.00 58.65 58.32 2eh0 h GLN 116 Cb 1.38 0.12 -0.04 0.00 1.07 0.00 0.00 27.48 30.01 2eh0 h GLN 116 CO 0.03 1.16 0.75 0.00 -2.65 0.00 0.00 178.83 178.12 2eh0 h ALA 117 N -0.06 2.99 -0.67 3.38 0.00 -1.69 0.31 119.26 123.53 2eh0 h ALA 117 Ca -0.22 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 54.74 2eh0 h ALA 117 Cb 1.56 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 19.39 2eh0 h ALA 117 CO 0.04 -1.29 0.44 0.07 0.00 0.00 0.00 179.25 178.51 2eh0 h ARG 118 N 0.00 0.57 -0.17 0.00 0.11 -1.66 -0.06 114.38 113.17 2eh0 h ARG 118 Ca 0.50 -0.03 0.05 0.00 0.10 0.00 0.00 59.98 60.59 2eh0 h ARG 118 Cb 2.00 -0.13 -0.01 0.00 1.11 0.00 0.00 29.97 32.94 2eh0 h ARG 118 CO -0.01 0.38 0.33 0.00 0.10 0.00 0.00 179.97 180.78 2eh0 h ALA 119 N 1.65 1.65 -0.73 0.08 0.00 -0.58 -0.21 119.26 121.12 2eh0 h ALA 119 Ca 0.30 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.28 2eh0 h ALA 119 Cb 0.40 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 2eh0 h ALA 119 CO -0.10 -0.42 0.48 1.05 0.00 0.00 0.00 179.25 180.27 2eh0 h GLU 120 N 0.00 0.69 -0.02 0.00 4.11 -1.15 -2.17 114.58 116.03 2eh0 h GLU 120 Ca 0.08 -0.04 -0.01 0.00 0.07 0.00 0.00 59.36 59.46 2eh0 h GLU 120 Cb 0.75 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 2eh0 h GLU 120 CO -0.00 0.46 -0.02 0.00 0.07 0.00 0.00 179.01 179.52 2eh0 h ARG 121 N 0.71 0.05 -0.99 1.06 2.47 -1.22 -3.17 114.38 113.30 2eh0 h ARG 121 Ca 0.33 -0.02 0.18 0.00 -1.26 0.00 0.00 59.98 59.20 2eh0 h ARG 121 Cb 0.35 0.00 -0.10 0.00 -1.65 0.00 0.00 29.97 28.57 2eh0 h ARG 121 CO -0.11 0.52 0.59 0.93 0.56 0.00 0.00 179.97 182.46 2eh0 h GLU 122 N -0.42 0.76 -7.07 0.04 5.08 -1.52 -3.41 114.58 108.03 2eh0 h GLU 122 Ca 0.00 -0.05 -0.53 0.00 -1.00 0.00 0.00 59.36 57.79 2eh0 h GLU 122 Cb 0.51 -0.17 0.11 0.00 0.50 0.00 0.00 28.75 29.69 2eh0 h GLU 122 CO 0.00 0.50 0.50 0.21 -1.00 0.00 0.00 179.01 179.23 2eh0 s LYS 123 N -5.88 3.14 0.83 2.33 2.20 -0.86 -5.00 119.74 116.50 2eh0 s LYS 123 Ca -0.11 1.89 -0.12 0.00 -0.36 0.00 0.00 55.97 57.27 2eh0 s LYS 123 Cb 0.24 -2.07 0.18 0.00 -1.51 0.00 0.00 37.83 34.67 2eh0 s LYS 123 CO 0.80 -1.09 0.41 -2.37 -0.36 0.00 0.00 175.35 172.75 2eh0 n THR 124 N -1.29 0.00 -3.60 3.43 5.66 -1.26 -4.98 114.28 112.25 2eh0 n THR 124 Ca 0.12 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 61.08 2eh0 n THR 124 Cb 0.48 -0.47 -0.02 0.00 -1.55 0.00 0.00 70.33 68.78 2eh0 n THR 124 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 2eh0 s SER 125 N -2.16 -0.19 0.00 1.09 0.15 -1.26 -4.98 113.70 106.35 2eh0 s SER 125 Ca 0.32 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.89 2eh0 s SER 125 Cb -0.06 0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.51 2eh0 s SER 125 CO 0.27 -0.43 0.00 0.61 1.20 0.00 0.00 173.24 174.89 2eh0 n GLY 126 N -0.26 -0.40 3.77 9.45 0.00 -1.26 -5.14 105.19 111.36 2eh0 n GLY 126 Ca -0.05 0.31 -0.38 0.00 0.00 0.00 0.00 46.02 45.91 2eh0 n GLY 126 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eh0 s PRO 127 N 0.00 3.95 -0.14 1.61 0.04 -1.26 -4.95 135.00 134.26 2eh0 s PRO 127 Ca 0.00 1.85 -0.29 0.00 0.04 0.00 0.00 61.00 62.60 2eh0 s PRO 127 Cb 0.00 -2.60 -0.04 0.00 0.04 0.00 0.00 34.50 31.89 2eh0 s PRO 127 CO 0.00 -0.41 1.70 -1.54 0.04 0.00 0.00 177.00 176.79 2eh0 s SER 128 N -1.16 6.43 -0.06 6.66 1.04 -1.26 -4.99 113.70 120.36 2eh0 s SER 128 Ca 0.59 1.95 0.05 0.00 0.48 0.00 0.00 55.95 59.03 2eh0 s SER 128 Cb -0.31 -2.53 -0.01 0.00 0.10 0.00 0.00 66.02 63.27 2eh0 s SER 128 CO 0.39 -1.17 -0.23 -0.94 0.98 0.00 0.00 173.24 172.27 2eh0 s SER 129 N 4.21 2.81 0.00 7.02 1.04 -1.26 -5.31 113.70 122.21 2eh0 s SER 129 Ca 0.76 -0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.71 2eh0 s SER 129 Cb -0.30 -0.85 0.00 0.00 0.10 0.00 0.00 66.02 64.97 2eh0 s SER 129 CO 0.30 0.21 0.00 0.61 0.98 0.00 0.00 173.24 175.34