#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 -0.61 0.51 1.61 0.01 -1.26 -5.18 113.70 108.78 2eh0 s SER 2 Ca 0.00 0.89 0.08 0.00 1.31 0.00 0.00 55.95 58.23 2eh0 s SER 2 Cb 0.00 0.84 0.05 0.00 0.21 0.00 0.00 66.02 67.12 2eh0 s SER 2 CO 0.00 -0.43 0.64 -0.55 0.41 0.00 0.00 173.24 173.31 2eh0 s SER 3 N -0.57 5.18 0.00 2.44 0.15 -1.26 -5.07 113.70 114.57 2eh0 s SER 3 Ca -0.07 -0.78 0.00 0.00 0.70 0.00 0.00 55.95 55.80 2eh0 s SER 3 Cb -0.02 -0.03 0.00 0.00 -1.71 0.00 0.00 66.02 64.26 2eh0 s SER 3 CO 0.06 -1.08 0.00 0.61 1.20 0.00 0.00 173.24 174.02 2eh0 n GLY 4 N -2.00 2.24 2.96 9.45 0.00 -1.26 -5.13 105.19 111.45 2eh0 n GLY 4 Ca 0.10 -0.43 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 2eh0 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eh0 s SER 5 N 0.00 3.78 0.05 1.61 0.01 -1.26 -5.11 113.70 112.77 2eh0 s SER 5 Ca 0.00 -1.12 0.04 0.00 1.31 0.00 0.00 55.95 56.18 2eh0 s SER 5 Cb 0.00 -1.22 -0.02 0.00 0.21 0.00 0.00 66.02 64.99 2eh0 s SER 5 CO 0.00 -0.21 -0.11 -0.94 0.41 0.00 0.00 173.24 172.39 2eh0 s SER 6 N 1.37 1.25 -0.16 2.44 1.04 -1.26 -5.15 113.70 113.24 2eh0 s SER 6 Ca -0.05 -0.50 -0.08 0.00 0.48 0.00 0.00 55.95 55.80 2eh0 s SER 6 Cb -0.18 -0.03 -0.04 0.00 0.10 0.00 0.00 66.02 65.86 2eh0 s SER 6 CO -0.07 -0.09 0.10 -0.83 0.98 0.00 0.00 173.24 173.34 2eh0 s GLY 7 N -1.38 2.03 -0.03 7.32 0.00 -1.26 -5.07 107.32 108.93 2eh0 s GLY 7 Ca -0.04 -0.70 -0.03 0.00 0.00 0.00 0.00 44.72 43.95 2eh0 s GLY 7 CO 0.01 -0.12 0.09 -1.59 0.00 0.00 0.00 173.10 171.49 2eh0 s THR 8 N -0.21 -0.00 0.08 0.90 2.01 -1.26 -4.83 115.64 112.33 2eh0 s THR 8 Ca 0.10 0.02 -0.31 0.00 0.31 0.00 0.00 61.69 61.80 2eh0 s THR 8 Cb -0.12 -0.14 -0.07 0.00 0.01 0.00 0.00 72.50 72.18 2eh0 s THR 8 CO 0.01 0.01 1.38 -2.16 -0.69 0.00 0.00 174.62 173.16 2eh0 s PRO 9 N 0.13 4.32 0.00 4.92 0.04 -1.26 -4.73 135.00 138.43 2eh0 s PRO 9 Ca -0.01 2.03 -0.15 0.00 0.04 0.00 0.00 61.00 62.91 2eh0 s PRO 9 Cb -0.02 -3.33 0.02 0.00 0.04 0.00 0.00 34.50 31.21 2eh0 s PRO 9 CO -0.00 -0.46 0.32 -3.38 0.04 0.00 0.00 177.00 173.52 2eh0 s HIS 10 N 1.41 -0.18 -0.14 0.56 -3.43 -1.23 -0.57 115.29 111.71 2eh0 s HIS 10 Ca 0.64 0.21 -0.07 0.00 -0.80 0.00 0.00 55.06 55.04 2eh0 s HIS 10 Cb -0.35 0.11 -0.04 0.00 -1.43 0.00 0.00 32.58 30.87 2eh0 s HIS 10 CO 0.29 -0.43 0.11 -0.51 -2.00 0.00 0.00 174.74 172.21 2eh0 s LEU 11 N -1.53 4.19 0.11 5.38 1.43 0.44 -2.15 118.68 126.56 2eh0 s LEU 11 Ca -0.11 0.34 0.06 0.00 -1.03 0.00 0.00 54.13 53.38 2eh0 s LEU 11 Cb -0.04 -2.03 -0.04 0.00 0.03 0.00 0.00 46.19 44.11 2eh0 s LEU 11 CO 0.02 0.33 -0.01 -0.69 0.23 0.00 0.00 176.35 176.24 2eh0 s VAL 12 N -0.55 3.92 -1.23 -1.59 1.01 -0.42 -0.02 120.40 121.52 2eh0 s VAL 12 Ca 0.12 -1.10 -0.11 0.00 0.00 0.00 0.00 61.98 60.89 2eh0 s VAL 12 Cb -0.12 -2.89 0.18 0.00 0.00 0.00 0.00 36.38 33.55 2eh0 s VAL 12 CO 0.02 0.07 1.60 0.59 0.00 0.00 0.00 175.10 177.38 2eh0 n ASN 13 N 0.42 5.23 0.00 3.32 4.13 0.29 -1.79 115.26 126.86 2eh0 n ASN 13 Ca -0.11 -3.05 0.05 0.00 1.68 0.00 0.00 54.58 53.15 2eh0 n ASN 13 Cb 0.53 -1.51 0.29 0.00 -1.54 0.00 0.00 39.78 37.54 2eh0 n ASN 13 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2eh0 n LEU 14 N 4.63 0.00 -4.00 3.41 -0.00 -1.26 -4.88 117.00 114.89 2eh0 n LEU 14 Ca 0.37 0.00 -0.18 0.00 -0.00 0.00 0.00 56.01 56.20 2eh0 n LEU 14 Cb 0.40 0.00 0.13 0.00 -0.00 0.00 0.00 43.42 43.95 2eh0 n LEU 14 CO 0.70 0.00 -0.09 0.59 -0.00 0.00 0.00 177.39 178.59 2eh0 n ASN 15 N -0.66 -2.88 -0.48 1.45 5.03 -1.26 -4.84 115.26 111.62 2eh0 n ASN 15 Ca 0.07 -0.32 0.09 0.00 0.87 0.00 0.00 54.58 55.29 2eh0 n ASN 15 Cb 0.03 -0.74 0.34 0.00 -1.02 0.00 0.00 39.78 38.39 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 -1.27 1.62 -3.55 3.52 0.28 -1.26 -4.53 120.64 115.45 2eh0 n GLU 16 Ca 0.05 -0.95 -0.39 0.00 -0.16 0.00 0.00 57.16 55.71 2eh0 n GLU 16 Cb 0.35 -1.34 -0.05 0.00 1.43 0.00 0.00 31.44 31.83 2eh0 n GLU 16 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2eh0 s ASP 17 N -1.44 6.38 0.00 -1.84 2.15 -1.26 -4.86 116.67 115.79 2eh0 s ASP 17 Ca 0.29 -3.67 0.15 0.00 0.43 0.00 0.00 52.55 49.75 2eh0 s ASP 17 Cb 0.15 -2.00 0.71 0.00 -0.30 0.00 0.00 42.92 41.49 2eh0 s ASP 17 CO 0.23 -0.22 1.42 -0.81 -0.17 0.00 0.00 175.17 175.62 2eh0 n PRO 18 N 2.47 0.16 0.00 4.34 -0.04 -1.26 -1.99 135.00 138.67 2eh0 n PRO 18 Ca 0.22 0.17 0.06 0.00 -0.04 0.00 0.00 63.50 63.91 2eh0 n PRO 18 Cb 0.38 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.27 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 -1.34 0.62 -3.41 1.53 4.77 -1.26 -5.02 117.00 112.89 2eh0 n LEU 19 Ca 0.06 -0.52 -0.48 0.00 -0.03 0.00 0.00 56.01 55.05 2eh0 n LEU 19 Cb 0.13 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.15 2eh0 n LEU 19 CO 0.12 0.15 0.73 1.15 -1.33 0.00 0.00 177.39 178.21 2eh0 n MET 20 N -1.22 0.00 0.00 3.23 0.00 -0.84 -4.73 117.12 113.56 2eh0 n MET 20 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 57.70 57.82 2eh0 n MET 20 Cb 0.19 -1.09 0.52 0.00 0.00 0.00 0.00 33.22 32.84 2eh0 n MET 20 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 2eh0 n SER 21 N 2.44 0.00 -4.93 3.17 3.41 -1.26 -4.77 113.62 111.68 2eh0 n SER 21 Ca 0.20 -0.39 -0.26 0.00 -0.26 0.00 0.00 58.87 58.17 2eh0 n SER 21 Cb -0.02 -0.09 0.07 0.00 -0.26 0.00 0.00 64.21 63.91 2eh0 n SER 21 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2eh0 s GLU 22 N -2.18 2.23 0.54 4.33 0.41 -1.26 -5.02 118.70 117.74 2eh0 s GLU 22 Ca 0.25 -0.27 -0.20 0.00 -0.41 0.00 0.00 54.97 54.34 2eh0 s GLU 22 Cb 0.13 -2.18 -0.08 0.00 -1.78 0.00 0.00 34.13 30.21 2eh0 s GLU 22 CO 0.24 -1.21 0.71 0.00 -0.49 0.00 0.00 175.26 174.51 2eh0 h LEU 24 N 0.56 0.42 -7.96 0.00 -0.00 -1.95 -3.46 115.31 102.93 2eh0 h LEU 24 Ca -0.46 -0.88 -0.10 0.00 -0.00 0.00 0.00 57.88 56.45 2eh0 h LEU 24 Cb 1.38 -0.14 -0.14 0.00 -0.00 0.00 0.00 40.66 41.77 2eh0 h LEU 24 CO 0.50 1.72 -0.38 -1.48 -0.00 0.00 0.00 178.44 178.80 2eh0 s LEU 25 N -7.37 1.33 -0.07 1.67 0.05 -1.26 0.10 118.68 113.13 2eh0 s LEU 25 Ca -0.20 -0.78 0.00 0.00 0.05 0.00 0.00 54.13 53.20 2eh0 s LEU 25 Cb 0.05 1.01 0.02 0.00 -2.05 0.00 0.00 46.19 45.22 2eh0 s LEU 25 CO 0.78 -0.78 -0.06 -0.31 -0.55 0.00 0.00 176.35 175.43 2eh0 s TYR 26 N -3.91 1.08 -0.55 3.48 1.51 0.98 -4.95 117.35 114.98 2eh0 s TYR 26 Ca 0.10 -0.41 -0.27 0.00 -1.01 0.00 0.00 57.07 55.48 2eh0 s TYR 26 Cb 0.05 -0.94 0.03 0.00 -0.11 0.00 0.00 41.96 40.99 2eh0 s TYR 26 CO -0.06 -0.33 1.07 0.71 -1.11 0.00 0.00 175.55 175.82 2eh0 s TYR 27 N 1.33 2.73 -0.03 2.71 2.02 -1.26 -0.42 117.35 124.43 2eh0 s TYR 27 Ca -0.04 0.29 -0.30 0.00 -0.37 0.00 0.00 57.07 56.66 2eh0 s TYR 27 Cb -0.14 -4.29 -0.05 0.00 -0.40 0.00 0.00 41.96 37.08 2eh0 s TYR 27 CO -0.03 -1.42 1.50 0.42 -1.57 0.00 0.00 175.55 174.46 2eh0 s ILE 28 N 4.42 3.63 0.49 2.71 1.01 0.26 -4.97 121.20 128.75 2eh0 s ILE 28 Ca 0.38 0.93 -0.07 0.00 0.00 0.00 0.00 60.65 61.90 2eh0 s ILE 28 Cb -0.09 -3.60 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 2eh0 s ILE 28 CO 0.24 -0.04 0.81 -1.59 0.00 0.00 0.00 174.94 174.37 2eh0 s LYS 29 N 3.10 3.58 -0.81 2.79 0.00 -1.26 -4.50 119.74 122.63 2eh0 s LYS 29 Ca 0.67 0.30 -0.26 0.00 0.00 0.00 0.00 55.97 56.68 2eh0 s LYS 29 Cb -0.32 -2.34 -0.23 0.00 0.00 0.00 0.00 37.83 34.94 2eh0 s LYS 29 CO 0.27 -0.23 1.93 -0.40 0.00 0.00 0.00 175.35 176.92 2eh0 n ASP 30 N -2.20 1.77 0.00 0.03 5.75 -1.26 -4.44 116.55 116.20 2eh0 n ASP 30 Ca 0.01 -2.56 0.00 0.00 -0.01 0.00 0.00 54.79 52.23 2eh0 n ASP 30 Cb 0.55 -1.37 0.00 0.00 -1.03 0.00 0.00 41.12 39.27 2eh0 n ASP 30 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2eh0 n GLY 31 N 5.60 1.06 2.81 6.12 0.00 -1.20 -4.96 105.19 114.62 2eh0 n GLY 31 Ca 0.44 0.34 -0.28 0.00 0.00 0.00 0.00 46.02 46.53 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 2.10 0.81 -0.74 -0.61 -1.09 -1.26 -1.76 121.20 118.65 2eh0 s ILE 32 Ca 0.00 -0.60 -0.16 0.00 -2.23 0.00 0.00 60.65 57.66 2eh0 s ILE 32 Cb 0.00 -1.16 0.16 0.00 -1.58 0.00 0.00 42.46 39.88 2eh0 s ILE 32 CO 0.00 -0.05 0.76 -0.89 -1.23 0.00 0.00 174.94 173.53 2eh0 s THR 33 N 1.74 5.20 0.08 2.92 2.01 0.62 -4.83 115.64 123.38 2eh0 s THR 33 Ca -0.01 -1.79 -0.31 0.00 0.31 0.00 0.00 61.69 59.90 2eh0 s THR 33 Cb -0.16 -4.50 -0.08 0.00 0.01 0.00 0.00 72.50 67.76 2eh0 s THR 33 CO -0.07 -1.11 1.60 -0.13 -0.69 0.00 0.00 174.62 174.22 2eh0 s ARG 34 N 1.45 4.22 -0.57 4.92 0.52 -1.26 -0.94 118.95 127.29 2eh0 s ARG 34 Ca 0.16 2.29 -0.04 0.00 -0.52 0.00 0.00 55.73 57.62 2eh0 s ARG 34 Cb -0.16 -3.49 0.15 0.00 0.52 0.00 0.00 34.95 31.97 2eh0 s ARG 34 CO -0.03 -0.68 0.39 0.08 0.02 0.00 0.00 175.30 175.08 2eh0 s VAL 35 N 2.23 3.73 0.00 3.52 1.01 0.52 -0.70 120.40 130.70 2eh0 s VAL 35 Ca 0.72 -2.63 0.00 0.00 0.00 0.00 0.00 61.98 60.06 2eh0 s VAL 35 Cb -0.40 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.53 2eh0 s VAL 35 CO 0.31 -0.83 0.00 0.61 0.00 0.00 0.00 175.10 175.19 2eh0 n GLY 36 N 3.88 2.77 3.94 4.51 0.00 -0.86 -1.43 105.19 118.00 2eh0 n GLY 36 Ca 0.04 -0.05 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 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 4.86 3.17 0.11 1.61 -1.52 -1.11 -1.03 119.66 125.75 2eh0 s GLN 37 Ca 0.00 -0.27 0.17 0.00 -1.95 0.00 0.00 55.36 53.31 2eh0 s GLN 37 Cb 0.00 -2.49 -0.09 0.00 -0.22 0.00 0.00 33.01 30.20 2eh0 s GLN 37 CO 0.00 -0.28 0.93 0.00 -0.25 0.00 0.00 175.29 175.69 2eh0 h ALA 38 N 0.32 0.64 0.00 6.09 0.00 -1.89 -3.32 119.26 121.09 2eh0 h ALA 38 Ca -0.47 -0.70 -0.00 0.00 0.00 0.00 0.00 54.91 53.74 2eh0 h ALA 38 Cb 1.24 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 2eh0 h ALA 38 CO 0.59 0.77 -0.01 -0.44 0.00 0.00 0.00 179.25 180.16 2eh0 h ASP 39 N 0.00 0.00 -1.53 0.00 5.19 -1.95 -3.43 116.42 114.70 2eh0 h ASP 39 Ca -0.12 0.00 -0.45 0.00 -0.62 0.00 0.00 57.03 55.84 2eh0 h ASP 39 Cb 1.49 0.00 0.15 0.00 0.18 0.00 0.00 39.33 41.15 2eh0 h ASP 39 CO 0.04 0.01 -1.01 0.00 -3.12 0.00 0.00 179.24 175.16 2eh0 n ALA 40 N -2.10 -3.20 -0.23 3.45 0.00 -1.25 -4.61 120.51 112.57 2eh0 n ALA 40 Ca 0.02 -0.15 0.21 0.00 0.00 0.00 0.00 53.44 53.53 2eh0 n ALA 40 Cb 0.43 -1.03 0.40 0.00 0.00 0.00 0.00 19.45 19.25 2eh0 n ALA 40 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2eh0 n GLU 41 N 1.33 -0.05 -4.73 0.00 0.28 -1.26 -4.42 120.64 111.80 2eh0 n GLU 41 Ca 0.04 1.01 -0.32 0.00 -0.16 0.00 0.00 57.16 57.73 2eh0 n GLU 41 Cb 0.38 -1.78 -0.08 0.00 1.43 0.00 0.00 31.44 31.39 2eh0 n GLU 41 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 2eh0 s ARG 42 N -5.17 2.16 -0.32 3.44 1.81 -1.26 -5.11 118.95 114.49 2eh0 s ARG 42 Ca -0.07 -2.37 -0.22 0.00 -1.72 0.00 0.00 55.73 51.34 2eh0 s ARG 42 Cb 0.24 -1.39 0.00 0.00 -0.45 0.00 0.00 34.95 33.35 2eh0 s ARG 42 CO 0.56 -0.38 0.73 0.50 -0.68 0.00 0.00 175.30 176.03 2eh0 s ARG 43 N -3.85 3.88 0.46 3.54 3.52 -1.26 -4.73 118.95 120.51 2eh0 s ARG 43 Ca 0.08 0.41 -0.07 0.00 -0.13 0.00 0.00 55.73 56.02 2eh0 s ARG 43 Cb 0.02 -3.75 -0.05 0.00 -1.56 0.00 0.00 34.95 29.61 2eh0 s ARG 43 CO 0.05 -0.69 0.79 -0.65 -0.81 0.00 0.00 175.30 173.99 2eh0 s GLN 44 N 2.88 3.63 -0.02 5.12 -1.52 -1.26 -4.96 119.66 123.52 2eh0 s GLN 44 Ca 0.30 0.33 -0.12 0.00 -1.95 0.00 0.00 55.36 53.91 2eh0 s GLN 44 Cb -0.14 -2.37 -0.07 0.00 -0.22 0.00 0.00 33.01 30.22 2eh0 s GLN 44 CO 0.13 -0.17 0.65 -0.44 -0.25 0.00 0.00 175.29 175.22 2eh0 h ASP 45 N 0.56 -0.37 -3.45 5.90 5.19 -1.66 -3.42 116.42 119.17 2eh0 h ASP 45 Ca -0.47 0.01 -0.72 0.00 -0.62 0.00 0.00 57.03 55.23 2eh0 h ASP 45 Cb 1.20 0.10 -0.21 0.00 0.18 0.00 0.00 39.33 40.59 2eh0 h ASP 45 CO 0.62 -0.08 -0.40 -0.63 -3.12 0.00 0.00 179.24 175.63 2eh0 s ILE 46 N -3.09 5.25 -0.22 0.35 1.01 0.12 -4.97 121.20 119.65 2eh0 s ILE 46 Ca -0.06 -0.76 -0.18 0.00 0.00 0.00 0.00 60.65 59.65 2eh0 s ILE 46 Cb 0.01 -3.98 -0.03 0.00 0.01 0.00 0.00 42.46 38.47 2eh0 s ILE 46 CO 0.19 -0.38 0.49 -0.69 0.00 0.00 0.00 174.94 174.55 2eh0 s VAL 47 N 1.67 5.11 0.60 2.92 1.01 -1.26 -2.02 120.40 128.43 2eh0 s VAL 47 Ca 0.05 0.87 0.08 0.00 0.00 0.00 0.00 61.98 62.98 2eh0 s VAL 47 Cb -0.20 -3.81 0.09 0.00 0.00 0.00 0.00 36.38 32.46 2eh0 s VAL 47 CO 0.09 0.16 0.82 -0.76 0.00 0.00 0.00 175.10 175.41 2eh0 s LEU 48 N 1.82 3.08 0.51 3.92 2.01 -0.20 -4.99 118.68 124.83 2eh0 s LEU 48 Ca 0.22 -0.78 0.01 0.00 0.01 0.00 0.00 54.13 53.58 2eh0 s LEU 48 Cb -0.15 -1.67 -0.01 0.00 0.01 0.00 0.00 46.19 44.37 2eh0 s LEU 48 CO 0.09 -1.42 0.01 -0.55 1.01 0.00 0.00 176.35 175.49 2eh0 s SER 49 N -4.68 4.04 0.00 2.29 0.15 -1.26 -4.80 113.70 109.44 2eh0 s SER 49 Ca 0.63 -1.68 0.00 0.00 0.70 0.00 0.00 55.95 55.59 2eh0 s SER 49 Cb -0.06 0.60 0.00 0.00 -1.71 0.00 0.00 66.02 64.85 2eh0 s SER 49 CO 0.40 -0.89 0.00 0.61 1.20 0.00 0.00 173.24 174.55 2eh0 n GLY 50 N -1.26 -2.44 0.01 9.45 0.00 -1.26 -4.74 105.19 104.96 2eh0 n GLY 50 Ca -0.19 -1.83 0.01 0.00 0.00 0.00 0.00 46.02 44.01 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 0.06 2.28 -0.83 4.61 0.00 -1.26 -4.67 120.51 120.70 2eh0 n ALA 51 Ca 0.00 -0.13 -0.16 0.00 0.00 0.00 0.00 53.44 53.14 2eh0 n ALA 51 Cb 0.00 -0.07 0.04 0.00 0.00 0.00 0.00 19.45 19.43 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 -0.84 1.55 -4.22 0.00 8.25 -1.26 -4.88 115.22 113.82 2eh0 n HIS 52 Ca 0.00 -1.92 -0.13 0.00 -0.26 0.00 0.00 57.72 55.42 2eh0 n HIS 52 Cb 0.03 -0.93 -0.10 0.00 1.12 0.00 0.00 29.99 30.11 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 -2.27 0.77 0.14 1.59 -1.09 -1.26 -4.56 121.20 114.53 2eh0 s ILE 53 Ca 0.31 -1.98 0.10 0.00 -2.23 0.00 0.00 60.65 56.85 2eh0 s ILE 53 Cb 0.24 -1.92 -0.04 0.00 -1.58 0.00 0.00 42.46 39.17 2eh0 s ILE 53 CO -0.00 -0.67 -0.23 -0.54 -1.23 0.00 0.00 174.94 172.27 2eh0 s LYS 54 N -3.86 1.33 0.31 2.79 -0.14 -1.26 -4.98 119.74 113.93 2eh0 s LYS 54 Ca 0.18 -1.34 0.06 0.00 -1.36 0.00 0.00 55.97 53.51 2eh0 s LYS 54 Cb 0.05 -1.66 0.86 0.00 -1.68 0.00 0.00 37.83 35.40 2eh0 s LYS 54 CO 0.00 0.38 1.50 0.39 -0.76 0.00 0.00 175.35 176.86 2eh0 n GLU 55 N 0.73 -0.07 -2.07 1.68 4.71 -1.26 -0.08 120.64 124.28 2eh0 n GLU 55 Ca -0.17 1.41 -0.20 0.00 -0.01 0.00 0.00 57.16 58.19 2eh0 n GLU 55 Cb 0.54 -2.30 0.03 0.00 -1.01 0.00 0.00 31.44 28.70 2eh0 n GLU 55 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2eh0 n GLU 56 N -5.36 3.35 -0.36 3.49 -0.58 -1.26 -2.74 120.64 117.17 2eh0 n GLU 56 Ca 0.26 -4.07 0.30 0.00 -0.42 0.00 0.00 57.16 53.23 2eh0 n GLU 56 Cb 0.85 -2.18 0.50 0.00 -0.57 0.00 0.00 31.44 30.05 2eh0 n GLU 56 CO 0.00 0.00 0.00 1.58 -0.48 0.00 0.00 177.13 178.23 2eh0 n HIS 57 N -0.71 0.49 -3.94 -0.32 -0.00 0.88 -3.48 115.22 108.14 2eh0 n HIS 57 Ca 0.39 0.49 -0.00 0.00 0.46 0.00 0.00 57.72 59.06 2eh0 n HIS 57 Cb 0.94 -0.89 0.02 0.00 -0.12 0.00 0.00 29.99 29.94 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 -2.04 0.00 -0.21 0.00 1.01 -1.12 -0.36 121.20 118.48 2eh0 s ILE 59 Ca 0.26 -1.07 -0.04 0.00 0.00 0.00 0.00 60.65 59.79 2eh0 s ILE 59 Cb -0.02 -1.97 0.07 0.00 0.01 0.00 0.00 42.46 40.56 2eh0 s ILE 59 CO 0.03 -0.02 0.10 -0.36 0.00 0.00 0.00 174.94 174.68 2eh0 s PHE 60 N -3.94 0.33 -0.14 3.97 0.40 -0.12 -2.79 117.98 115.68 2eh0 s PHE 60 Ca 0.14 -0.56 -0.09 0.00 -0.60 0.00 0.00 56.93 55.83 2eh0 s PHE 60 Cb -0.03 -0.80 -0.04 0.00 0.51 0.00 0.00 43.02 42.65 2eh0 s PHE 60 CO 0.05 -0.62 0.15 0.50 0.70 0.00 0.00 175.22 176.00 2eh0 s ARG 61 N 2.10 3.76 -0.08 0.44 3.52 0.07 -0.28 118.95 128.47 2eh0 s ARG 61 Ca 0.04 -0.13 0.01 0.00 -0.13 0.00 0.00 55.73 55.52 2eh0 s ARG 61 Cb -0.16 -3.28 0.02 0.00 -1.56 0.00 0.00 34.95 29.96 2eh0 s ARG 61 CO -0.18 0.59 -0.11 -1.12 -0.81 0.00 0.00 175.30 173.67 2eh0 s SER 62 N -0.48 1.91 -0.17 -2.12 0.01 -0.72 -0.54 113.70 111.59 2eh0 s SER 62 Ca 0.13 -0.30 -0.24 0.00 1.31 0.00 0.00 55.95 56.85 2eh0 s SER 62 Cb -0.12 -0.83 0.06 0.00 0.21 0.00 0.00 66.02 65.34 2eh0 s SER 62 CO 0.02 -0.02 0.63 -0.70 0.41 0.00 0.00 173.24 173.58 2eh0 s GLU 63 N 1.03 0.83 0.02 12.44 2.56 -0.23 -3.24 118.70 132.11 2eh0 s GLU 63 Ca -0.08 0.65 -0.30 0.00 0.00 0.00 0.00 54.97 55.25 2eh0 s GLU 63 Cb -0.15 0.40 -0.04 0.00 2.00 0.00 0.00 34.13 36.35 2eh0 s GLU 63 CO -0.01 -0.16 0.96 0.50 -0.56 0.00 0.00 175.26 175.99 2eh0 s ARG 64 N -0.19 4.58 1.19 4.30 3.52 -1.26 -0.86 118.95 130.23 2eh0 s ARG 64 Ca -0.04 1.39 -0.19 0.00 -0.13 0.00 0.00 55.73 56.76 2eh0 s ARG 64 Cb -0.03 -3.44 0.28 0.00 -1.56 0.00 0.00 34.95 30.20 2eh0 s ARG 64 CO 0.04 0.01 1.12 0.45 -0.81 0.00 0.00 175.30 176.10 2eh0 s SER 65 N 0.80 1.01 0.00 -2.12 0.15 0.15 -4.82 113.70 108.87 2eh0 s SER 65 Ca 0.50 0.62 0.11 0.00 0.70 0.00 0.00 55.95 57.88 2eh0 s SER 65 Cb -0.21 -0.86 0.49 0.00 -1.71 0.00 0.00 66.02 63.72 2eh0 s SER 65 CO 0.28 -4.07 1.33 -3.20 1.20 0.00 0.00 173.24 168.78 2eh0 n ASN 66 N -4.72 0.00 -0.95 5.45 5.15 -1.26 -1.25 115.26 117.68 2eh0 n ASN 66 Ca 0.13 0.41 0.12 0.00 -0.60 0.00 0.00 54.58 54.64 2eh0 n ASN 66 Cb 0.59 -0.45 0.11 0.00 -0.53 0.00 0.00 39.78 39.50 2eh0 n ASN 66 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2eh0 n SER 67 N -1.45 2.98 0.00 1.20 3.41 -1.26 -4.94 113.62 113.56 2eh0 n SER 67 Ca 0.03 -1.97 0.00 0.00 -0.26 0.00 0.00 58.87 56.67 2eh0 n SER 67 Cb 0.12 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 2eh0 n SER 67 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eh0 n GLY 68 N 1.33 0.78 3.63 5.00 0.00 -0.38 -5.02 105.19 110.53 2eh0 n GLY 68 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.31 4.14 -0.35 1.61 -1.05 -1.26 -4.74 118.70 116.74 2eh0 s GLU 69 Ca 0.00 0.77 -0.28 0.00 -0.15 0.00 0.00 54.97 55.31 2eh0 s GLU 69 Cb 0.00 -3.65 -0.03 0.00 -0.44 0.00 0.00 34.13 30.01 2eh0 s GLU 69 CO 0.00 -0.48 1.93 0.08 0.95 0.00 0.00 175.26 177.73 2eh0 s VAL 70 N 2.71 3.34 0.01 1.83 1.01 -1.26 -0.68 120.40 127.37 2eh0 s VAL 70 Ca 0.31 0.33 0.03 0.00 0.00 0.00 0.00 61.98 62.65 2eh0 s VAL 70 Cb -0.15 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 2eh0 s VAL 70 CO 0.08 -0.36 -0.03 -0.63 0.00 0.00 0.00 175.10 174.16 2eh0 s ILE 71 N 7.73 3.91 0.06 2.22 -1.09 -0.04 -4.94 121.20 129.05 2eh0 s ILE 71 Ca 0.84 -0.72 0.08 0.00 -2.23 0.00 0.00 60.65 58.61 2eh0 s ILE 71 Cb -0.23 -2.74 -0.03 0.00 -1.58 0.00 0.00 42.46 37.88 2eh0 s ILE 71 CO 0.32 0.36 -0.22 -0.69 -1.23 0.00 0.00 174.94 173.48 2eh0 s VAL 72 N -1.07 1.75 -0.03 2.92 1.01 -1.26 -1.06 120.40 122.65 2eh0 s VAL 72 Ca 0.19 -1.29 0.01 0.00 0.00 0.00 0.00 61.98 60.89 2eh0 s VAL 72 Cb -0.11 -1.53 0.01 0.00 0.00 0.00 0.00 36.38 34.75 2eh0 s VAL 72 CO 0.10 0.18 -0.06 -0.89 0.00 0.00 0.00 175.10 174.43 2eh0 s THR 73 N -0.86 0.56 -0.05 3.92 2.01 0.30 -0.01 115.64 121.51 2eh0 s THR 73 Ca 0.08 -0.19 -0.10 0.00 0.31 0.00 0.00 61.69 61.79 2eh0 s THR 73 Cb -0.09 -0.54 -0.05 0.00 0.01 0.00 0.00 72.50 71.83 2eh0 s THR 73 CO 0.02 0.21 0.27 -0.22 -0.69 0.00 0.00 174.62 174.21 2eh0 s LEU 74 N 0.56 4.42 -0.60 4.42 2.96 0.22 -0.75 118.68 129.89 2eh0 s LEU 74 Ca -0.07 0.68 0.04 0.00 -0.22 0.00 0.00 54.13 54.56 2eh0 s LEU 74 Cb -0.11 -2.39 0.16 0.00 0.50 0.00 0.00 46.19 44.35 2eh0 s LEU 74 CO 0.00 0.35 0.42 -1.61 -1.32 0.00 0.00 176.35 174.19 2eh0 s GLU 75 N -1.20 1.99 0.47 1.98 2.02 -1.12 -2.91 118.70 119.94 2eh0 s GLU 75 Ca 0.21 -2.90 -0.22 0.00 0.02 0.00 0.00 54.97 52.07 2eh0 s GLU 75 Cb -0.14 -2.90 -0.07 0.00 0.10 0.00 0.00 34.13 31.12 2eh0 s GLU 75 CO 0.10 -1.28 1.16 -1.25 0.02 0.00 0.00 175.26 174.01 2eh0 s PRO 76 N -0.87 3.69 1.22 0.39 0.04 -1.26 -2.80 135.00 135.41 2eh0 s PRO 76 Ca 0.25 1.74 -0.20 0.00 0.04 0.00 0.00 61.00 62.83 2eh0 s PRO 76 Cb -0.07 -2.34 0.31 0.00 0.04 0.00 0.00 34.50 32.44 2eh0 s PRO 76 CO -0.14 -0.60 0.98 0.00 0.04 0.00 0.00 177.00 177.28 2eh0 s GLU 78 N -5.25 4.21 -1.36 0.00 2.12 -1.26 -3.94 118.70 113.21 2eh0 s GLU 78 Ca 0.66 0.43 0.00 0.00 0.36 0.00 0.00 54.97 56.42 2eh0 s GLU 78 Cb -0.08 -3.55 0.00 0.00 0.26 0.00 0.00 34.13 30.77 2eh0 s GLU 78 CO 0.52 -0.11 0.00 0.54 -0.54 0.00 0.00 175.26 175.66 2eh0 n ARG 79 N 4.65 -1.15 -1.37 4.30 5.12 -1.26 -5.00 116.66 121.96 2eh0 n ARG 79 Ca -0.05 0.81 -0.11 0.00 -1.93 0.00 0.00 57.85 56.57 2eh0 n ARG 79 Cb 0.51 -5.08 0.06 0.00 -1.16 0.00 0.00 32.46 26.79 2eh0 n ARG 79 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2eh0 n SER 80 N -0.73 0.49 -3.92 0.55 3.41 -1.25 -5.05 113.62 107.12 2eh0 n SER 80 Ca -0.17 -1.45 -0.32 0.00 -0.26 0.00 0.00 58.87 56.67 2eh0 n SER 80 Cb 0.59 -0.34 -0.09 0.00 -0.26 0.00 0.00 64.21 64.12 2eh0 n SER 80 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2eh0 n GLU 81 N -1.96 2.36 -3.99 4.33 4.07 -1.26 -5.03 120.64 119.17 2eh0 n GLU 81 Ca 0.08 -4.52 -0.24 0.00 -0.06 0.00 0.00 57.16 52.42 2eh0 n GLU 81 Cb 0.27 -2.34 -0.17 0.00 -0.06 0.00 0.00 31.44 29.14 2eh0 n GLU 81 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 2eh0 s THR 82 N -1.64 0.75 -0.08 6.31 2.01 -1.25 -0.61 115.64 121.12 2eh0 s THR 82 Ca 0.28 -0.15 0.04 0.00 0.31 0.00 0.00 61.69 62.17 2eh0 s THR 82 Cb -0.02 -0.80 0.00 0.00 0.01 0.00 0.00 72.50 71.69 2eh0 s THR 82 CO -0.12 0.31 -0.20 -0.31 -0.69 0.00 0.00 174.62 173.61 2eh0 s TYR 83 N 1.52 2.14 -0.13 4.92 1.51 0.11 -0.85 117.35 126.57 2eh0 s TYR 83 Ca -0.00 -0.82 0.01 0.00 -1.01 0.00 0.00 57.07 55.25 2eh0 s TYR 83 Cb -0.13 -1.46 -0.01 0.00 -0.11 0.00 0.00 41.96 40.25 2eh0 s TYR 83 CO -0.04 -0.34 -0.17 0.08 -1.11 0.00 0.00 175.55 173.97 2eh0 s VAL 84 N 0.36 2.60 -1.68 0.71 1.01 0.44 -0.14 120.40 123.71 2eh0 s VAL 84 Ca -0.15 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.02 2eh0 s VAL 84 Cb -0.16 -2.07 0.00 0.00 0.00 0.00 0.00 36.38 34.15 2eh0 s VAL 84 CO 0.06 0.53 0.00 0.59 0.00 0.00 0.00 175.10 176.29 2eh0 n ASN 85 N 3.67 -5.11 0.00 3.32 3.02 0.12 -1.79 115.26 118.48 2eh0 n ASN 85 Ca -0.19 0.21 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 2eh0 n ASN 85 Cb 0.53 -4.18 0.00 0.00 -0.61 0.00 0.00 39.78 35.52 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 -0.92 3.00 3.97 7.41 0.00 -1.26 -4.95 105.19 112.45 2eh0 n GLY 86 Ca -0.19 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.14 2.38 0.29 1.61 -2.85 -0.74 -5.00 119.74 115.30 2eh0 s LYS 87 Ca 0.00 -0.82 -0.19 0.00 -1.00 0.00 0.00 55.97 53.97 2eh0 s LYS 87 Cb 0.00 -2.45 -0.09 0.00 -2.06 0.00 0.00 37.83 33.23 2eh0 s LYS 87 CO 0.00 -0.86 0.77 0.50 0.10 0.00 0.00 175.35 175.86 2eh0 s ARG 88 N -4.85 4.18 -0.27 1.78 6.06 -1.26 0.17 118.95 124.76 2eh0 s ARG 88 Ca 0.59 0.86 0.01 0.00 -2.50 0.00 0.00 55.73 54.69 2eh0 s ARG 88 Cb -0.10 -2.62 0.07 0.00 0.06 0.00 0.00 34.95 32.37 2eh0 s ARG 88 CO 0.40 0.25 -0.02 0.54 -2.50 0.00 0.00 175.30 173.97 2eh0 s VAL 89 N -1.78 1.64 -0.08 7.11 0.11 -0.03 -4.67 120.40 122.70 2eh0 s VAL 89 Ca 0.50 -1.50 0.12 0.00 -2.93 0.00 0.00 61.98 58.17 2eh0 s VAL 89 Cb -0.13 -2.00 0.19 0.00 -1.53 0.00 0.00 36.38 32.90 2eh0 s VAL 89 CO 0.19 -0.27 1.09 -0.24 -3.33 0.00 0.00 175.10 172.54 2eh0 n SER 90 N 4.59 2.20 -3.97 3.54 2.88 -1.26 -4.61 113.62 116.99 2eh0 n SER 90 Ca -0.08 -2.69 -0.09 0.00 -1.33 0.00 0.00 58.87 54.68 2eh0 n SER 90 Cb 0.43 -0.28 -0.10 0.00 -0.75 0.00 0.00 64.21 63.52 2eh0 n SER 90 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2eh0 s GLN 91 N -2.19 0.56 -0.78 -1.46 -2.07 -1.26 -4.92 119.66 107.54 2eh0 s GLN 91 Ca 0.20 -0.84 -0.25 0.00 -1.82 0.00 0.00 55.36 52.65 2eh0 s GLN 91 Cb 0.18 0.21 -0.04 0.00 -1.09 0.00 0.00 33.01 32.28 2eh0 s GLN 91 CO 0.02 -0.13 1.91 -1.25 -1.32 0.00 0.00 175.29 174.52 2eh0 s PRO 92 N -2.76 2.59 0.38 9.60 0.04 -1.26 -4.65 135.00 138.94 2eh0 s PRO 92 Ca -0.04 0.10 0.08 0.00 0.04 0.00 0.00 61.00 61.18 2eh0 s PRO 92 Cb -0.00 -4.77 -0.07 0.00 0.04 0.00 0.00 34.50 29.70 2eh0 s PRO 92 CO -0.05 -3.10 0.01 0.14 0.04 0.00 0.00 177.00 174.03 2eh0 s VAL 93 N 9.64 2.20 0.14 -0.36 -7.23 -1.15 -4.92 120.40 118.72 2eh0 s VAL 93 Ca 0.69 -2.01 -0.21 0.00 -1.81 0.00 0.00 61.98 58.64 2eh0 s VAL 93 Cb -0.09 -2.88 -0.08 0.00 0.56 0.00 0.00 36.38 33.89 2eh0 s VAL 93 CO 0.09 -0.08 0.68 -1.10 -0.31 0.00 0.00 175.10 174.37 2eh0 s GLN 94 N -3.71 4.34 0.51 4.82 -0.21 -1.26 -0.61 119.66 123.53 2eh0 s GLN 94 Ca 0.35 0.91 -0.05 0.00 0.02 0.00 0.00 55.36 56.59 2eh0 s GLN 94 Cb 0.06 -3.15 -0.02 0.00 1.00 0.00 0.00 33.01 30.89 2eh0 s GLN 94 CO 0.18 0.55 0.81 -0.51 -2.12 0.00 0.00 175.29 174.20 2eh0 s LEU 95 N -1.36 3.53 0.33 2.90 2.01 0.99 -4.89 118.68 122.20 2eh0 s LEU 95 Ca 0.35 0.82 0.10 0.00 0.01 0.00 0.00 54.13 55.41 2eh0 s LEU 95 Cb -0.20 -3.73 -0.06 0.00 0.01 0.00 0.00 46.19 42.21 2eh0 s LEU 95 CO 0.22 -0.71 -0.09 -0.13 1.01 0.00 0.00 176.35 176.64 2eh0 s ARG 96 N -4.79 1.85 -0.39 1.70 1.81 -1.26 -4.64 118.95 113.23 2eh0 s ARG 96 Ca 0.49 -1.86 -0.29 0.00 -1.72 0.00 0.00 55.73 52.35 2eh0 s ARG 96 Cb -0.10 -1.77 -0.00 0.00 -0.45 0.00 0.00 34.95 32.63 2eh0 s ARG 96 CO 0.44 0.18 1.57 0.45 -0.68 0.00 0.00 175.30 177.26 2eh0 s SER 97 N -3.61 6.14 0.00 0.23 0.15 -1.26 -2.26 113.70 113.08 2eh0 s SER 97 Ca 0.32 0.98 0.00 0.00 0.70 0.00 0.00 55.95 57.96 2eh0 s SER 97 Cb 0.00 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 2eh0 s SER 97 CO 0.17 -1.57 0.00 0.61 1.20 0.00 0.00 173.24 173.65 2eh0 n GLY 98 N 5.23 0.87 3.72 9.45 0.00 -0.36 -4.89 105.19 119.21 2eh0 n GLY 98 Ca 0.19 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.01 6.74 -0.29 1.61 2.20 -0.96 -4.73 114.94 117.49 2eh0 s ASN 99 Ca 0.00 2.45 -0.27 0.00 -0.94 0.00 0.00 52.86 54.10 2eh0 s ASN 99 Cb 0.00 -2.59 0.01 0.00 -2.00 0.00 0.00 41.25 36.67 2eh0 s ASN 99 CO 0.00 -0.70 0.98 -0.60 -2.94 0.00 0.00 177.10 173.83 2eh0 s ARG 100 N 0.93 4.08 -0.27 3.55 6.06 -1.26 -3.19 118.95 128.86 2eh0 s ARG 100 Ca 0.65 0.99 -0.02 0.00 -2.50 0.00 0.00 55.73 54.86 2eh0 s ARG 100 Cb -0.39 -3.71 0.03 0.00 0.06 0.00 0.00 34.95 30.94 2eh0 s ARG 100 CO 0.32 -0.76 -0.03 0.42 -2.50 0.00 0.00 175.30 172.74 2eh0 s ILE 101 N 3.32 2.95 -0.25 4.11 1.01 -0.87 0.12 121.20 131.60 2eh0 s ILE 101 Ca 0.41 -1.15 -0.09 0.00 0.00 0.00 0.00 60.65 59.82 2eh0 s ILE 101 Cb -0.13 -2.57 -0.04 0.00 0.01 0.00 0.00 42.46 39.72 2eh0 s ILE 101 CO 0.12 0.08 0.12 -0.63 0.00 0.00 0.00 174.94 174.63 2eh0 s ILE 102 N 1.30 4.86 0.05 2.92 1.01 0.80 -1.12 121.20 131.02 2eh0 s ILE 102 Ca -0.02 0.01 0.07 0.00 0.00 0.00 0.00 60.65 60.71 2eh0 s ILE 102 Cb -0.18 -3.27 -0.03 0.00 0.01 0.00 0.00 42.46 38.99 2eh0 s ILE 102 CO -0.03 0.33 -0.16 -0.04 0.00 0.00 0.00 174.94 175.04 2eh0 s MET 103 N 1.36 2.11 3.97 2.79 -1.94 -0.90 -0.72 119.30 125.97 2eh0 s MET 103 Ca 0.06 -0.97 0.00 0.00 -1.71 0.00 0.00 55.69 53.07 2eh0 s MET 103 Cb -0.15 -2.23 0.00 0.00 2.01 0.00 0.00 34.83 34.47 2eh0 s MET 103 CO 0.06 0.54 0.00 0.41 -0.01 0.00 0.00 175.02 176.02 2eh0 n GLY 104 N 1.43 2.79 0.73 -0.03 0.00 0.22 -2.65 105.19 107.67 2eh0 n GLY 104 Ca -0.16 0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2eh0 n GLY 104 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2eh0 n LYS 105 N 9.65 0.00 -1.86 1.61 3.00 -1.26 -4.86 118.16 124.44 2eh0 n LYS 105 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 58.31 57.98 2eh0 n LYS 105 Cb 0.00 -0.06 0.04 0.00 0.00 0.00 0.00 35.03 35.01 2eh0 n LYS 105 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 2eh0 n ASN 106 N -2.30 6.61 -2.94 3.14 5.15 -1.26 -4.72 115.26 118.95 2eh0 n ASN 106 Ca 0.00 -3.79 -0.24 0.00 -0.60 0.00 0.00 54.58 49.95 2eh0 n ASN 106 Cb 0.00 -0.80 -0.03 0.00 -0.53 0.00 0.00 39.78 38.42 2eh0 n ASN 106 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 2eh0 n HIS 107 N -0.67 3.01 -2.29 1.20 8.25 -1.09 -4.98 115.22 118.65 2eh0 n HIS 107 Ca 0.52 -3.82 -0.29 0.00 -0.26 0.00 0.00 57.72 53.87 2eh0 n HIS 107 Cb 0.57 -0.43 0.00 0.00 1.12 0.00 0.00 29.99 31.25 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 -4.07 4.80 -0.12 1.59 1.01 -1.26 -2.11 120.40 120.23 2eh0 s VAL 108 Ca 0.46 0.56 -0.21 0.00 0.00 0.00 0.00 61.98 62.79 2eh0 s VAL 108 Cb 0.31 -3.86 0.05 0.00 0.00 0.00 0.00 36.38 32.89 2eh0 s VAL 108 CO -0.12 -0.97 0.52 -0.36 0.00 0.00 0.00 175.10 174.17 2eh0 s PHE 109 N -2.92 -0.51 -0.15 5.22 0.08 -0.27 -4.46 117.98 114.96 2eh0 s PHE 109 Ca 0.51 1.09 -0.02 0.00 0.12 0.00 0.00 56.93 58.63 2eh0 s PHE 109 Cb -0.11 0.23 -0.02 0.00 -0.57 0.00 0.00 43.02 42.56 2eh0 s PHE 109 CO 0.48 -0.39 -0.09 0.50 -0.10 0.00 0.00 175.22 175.62 2eh0 s ARG 110 N -0.46 3.45 0.14 0.44 3.52 -0.74 -2.05 118.95 123.26 2eh0 s ARG 110 Ca -0.06 -0.63 -0.26 0.00 -0.13 0.00 0.00 55.73 54.64 2eh0 s ARG 110 Cb -0.03 -2.77 -0.07 0.00 -1.56 0.00 0.00 34.95 30.51 2eh0 s ARG 110 CO 0.04 0.14 0.82 0.12 -0.81 0.00 0.00 175.30 175.61 2eh0 s PHE 111 N 0.57 3.87 -0.29 5.12 5.36 -1.19 -1.31 117.98 130.11 2eh0 s PHE 111 Ca -0.06 1.66 0.02 0.00 -0.96 0.00 0.00 56.93 57.59 2eh0 s PHE 111 Cb -0.15 -2.84 0.08 0.00 -0.34 0.00 0.00 43.02 39.77 2eh0 s PHE 111 CO 0.03 0.42 0.01 -0.80 -1.46 0.00 0.00 175.22 173.42 2eh0 s ASN 112 N -0.77 4.32 -0.84 6.13 -0.87 -0.91 -1.22 114.94 120.77 2eh0 s ASN 112 Ca 0.38 -1.68 0.01 0.00 -1.57 0.00 0.00 52.86 50.00 2eh0 s ASN 112 Cb -0.23 -1.34 0.21 0.00 -0.02 0.00 0.00 41.25 39.88 2eh0 s ASN 112 CO 0.27 -0.32 0.72 1.57 -2.57 0.00 0.00 177.10 176.77 2eh0 n HIS 113 N 4.51 3.89 0.97 2.20 -0.00 -1.26 -3.53 115.22 122.00 2eh0 n HIS 113 Ca -0.04 -4.15 0.07 0.00 0.46 0.00 0.00 57.72 54.06 2eh0 n HIS 113 Cb 0.43 -0.97 0.40 0.00 -0.12 0.00 0.00 29.99 29.73 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 2.10 0.48 -0.08 1.57 -0.04 -1.26 -3.11 135.00 134.67 2eh0 n PRO 114 Ca 0.22 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.54 2eh0 n PRO 114 Cb 0.36 -1.44 -0.10 0.00 -0.04 0.00 0.00 33.50 32.29 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 0.00 -0.22 0.54 3.07 -1.90 -3.29 114.58 112.78 2eh0 h GLU 115 Ca 0.00 0.00 -0.06 0.00 -0.50 0.00 0.00 59.36 58.80 2eh0 h GLU 115 Cb 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 2eh0 h GLU 115 CO 0.00 0.78 -0.09 0.37 -1.40 0.00 0.00 179.01 178.67 2eh0 h GLN 116 N -1.00 0.45 0.00 2.33 -0.00 -1.91 -2.62 115.11 112.37 2eh0 h GLN 116 Ca -0.10 -0.19 0.00 0.00 -0.00 0.00 0.00 58.65 58.36 2eh0 h GLN 116 Cb 0.90 -0.02 0.00 0.00 0.00 0.00 0.00 27.48 28.37 2eh0 h GLN 116 CO -0.06 0.72 0.05 0.00 0.00 0.00 0.00 178.83 179.54 2eh0 n ALA 117 N -2.40 0.93 0.10 3.38 0.00 -1.20 -0.90 120.51 120.42 2eh0 n ALA 117 Ca -0.05 0.05 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 2eh0 n ALA 117 Cb 0.32 -0.99 0.10 0.00 0.00 0.00 0.00 19.45 18.88 2eh0 n ALA 117 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2eh0 h ARG 118 N 0.00 0.11 0.00 0.00 0.11 -1.53 -2.96 114.38 110.11 2eh0 h ARG 118 Ca 0.00 -0.09 0.00 0.00 0.10 0.00 0.00 59.98 59.99 2eh0 h ARG 118 Cb 0.10 0.02 0.00 0.00 1.11 0.00 0.00 29.97 31.20 2eh0 h ARG 118 CO 0.00 0.76 -0.30 0.00 0.10 0.00 0.00 179.97 180.53 2eh0 n ALA 119 N -2.44 3.00 -0.32 0.08 0.00 -0.08 -4.10 120.51 116.65 2eh0 n ALA 119 Ca -0.02 -0.24 0.18 0.00 0.00 0.00 0.00 53.44 53.36 2eh0 n ALA 119 Cb 0.68 -1.27 0.37 0.00 0.00 0.00 0.00 19.45 19.22 2eh0 n ALA 119 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2eh0 h GLU 120 N 0.00 0.15 0.00 0.00 4.11 -1.53 1.40 114.58 118.72 2eh0 h GLU 120 Ca 0.00 -0.01 -0.09 0.00 0.07 0.00 0.00 59.36 59.33 2eh0 h GLU 120 Cb 0.52 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2eh0 h GLU 120 CO 0.00 0.10 -0.43 0.00 0.07 0.00 0.00 179.01 178.75 2eh0 h ARG 121 N 0.16 0.00 0.00 1.06 2.47 -1.79 -2.97 114.38 113.30 2eh0 h ARG 121 Ca 0.64 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.36 2eh0 h ARG 121 Cb 1.40 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.72 2eh0 h ARG 121 CO -0.72 0.43 0.00 0.39 0.56 0.00 0.00 179.97 180.63 2eh0 n GLU 122 N -3.32 0.82 -0.81 0.04 -0.58 0.47 -4.90 120.64 112.37 2eh0 n GLU 122 Ca 0.01 0.00 -0.34 0.00 -0.42 0.00 0.00 57.16 56.42 2eh0 n GLU 122 Cb 0.64 -1.50 0.11 0.00 -0.57 0.00 0.00 31.44 30.11 2eh0 n GLU 122 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 2eh0 n LYS 123 N -1.09 -0.93 -1.77 3.49 2.85 -0.36 -4.75 118.16 115.60 2eh0 n LYS 123 Ca 0.21 -0.27 -0.42 0.00 -1.05 0.00 0.00 58.31 56.78 2eh0 n LYS 123 Cb 0.15 -1.37 -0.03 0.00 -0.65 0.00 0.00 35.03 33.13 2eh0 n LYS 123 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 2eh0 s THR 124 N -2.12 3.19 -0.73 0.58 2.01 -1.26 -4.94 115.64 112.37 2eh0 s THR 124 Ca 0.45 0.22 -0.05 0.00 0.31 0.00 0.00 61.69 62.62 2eh0 s THR 124 Cb -0.01 -3.15 0.19 0.00 0.01 0.00 0.00 72.50 69.53 2eh0 s THR 124 CO 0.63 -0.03 0.58 -0.94 -0.69 0.00 0.00 174.62 174.17 2eh0 s SER 125 N 4.41 5.70 -0.90 3.53 1.04 -1.26 -4.99 113.70 121.24 2eh0 s SER 125 Ca 0.85 -3.03 -0.01 0.00 0.48 0.00 0.00 55.95 54.23 2eh0 s SER 125 Cb -0.39 -1.94 0.23 0.00 0.10 0.00 0.00 66.02 64.02 2eh0 s SER 125 CO 0.38 -0.36 0.83 0.61 0.98 0.00 0.00 173.24 175.68 2eh0 n GLY 126 N 3.30 4.23 3.77 7.32 0.00 -1.26 -5.07 105.19 117.48 2eh0 n GLY 126 Ca 0.12 -2.61 -0.31 0.00 0.00 0.00 0.00 46.02 43.22 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 -1.55 2.38 -0.17 1.61 0.04 -1.26 -5.00 135.00 131.04 2eh0 s PRO 127 Ca 0.29 1.22 0.04 0.00 0.04 0.00 0.00 61.00 62.59 2eh0 s PRO 127 Cb -0.05 -1.91 -0.13 0.00 0.04 0.00 0.00 34.50 32.45 2eh0 s PRO 127 CO -0.11 -1.55 -0.11 0.45 0.04 0.00 0.00 177.00 175.72 2eh0 n SER 128 N -3.26 2.34 -4.17 6.66 2.88 -1.26 -4.86 113.62 111.94 2eh0 n SER 128 Ca 0.09 -0.07 -0.39 0.00 -1.33 0.00 0.00 58.87 57.17 2eh0 n SER 128 Cb 0.53 -0.02 -0.09 0.00 -0.75 0.00 0.00 64.21 63.87 2eh0 n SER 128 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2eh0 s SER 129 N -5.52 5.54 0.00 -3.46 0.15 -1.26 -5.38 113.70 103.78 2eh0 s SER 129 Ca -0.20 -2.05 0.00 0.00 0.70 0.00 0.00 55.95 54.39 2eh0 s SER 129 Cb 0.06 -1.94 0.00 0.00 -1.71 0.00 0.00 66.02 62.43 2eh0 s SER 129 CO 0.46 -0.61 0.00 0.61 1.20 0.00 0.00 173.24 174.89