#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eh0 n SER 2 N 0.00 0.93 0.00 1.61 3.41 -1.26 -4.76 113.62 113.55 2eh0 n SER 2 Ca 0.00 0.88 0.00 0.00 -0.26 0.00 0.00 58.87 59.49 2eh0 n SER 2 Cb 0.00 -0.87 0.00 0.00 -0.26 0.00 0.00 64.21 63.08 2eh0 n SER 2 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2eh0 n SER 3 N 5.84 0.93 -1.40 4.04 2.88 -1.26 -5.13 113.62 119.53 2eh0 n SER 3 Ca 0.44 -0.29 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 2eh0 n SER 3 Cb -0.05 0.76 0.00 0.00 -0.75 0.00 0.00 64.21 64.18 2eh0 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2eh0 n GLY 4 N 1.04 -4.66 3.52 0.46 0.00 -1.26 -4.98 105.19 99.32 2eh0 n GLY 4 Ca 0.00 -0.49 -0.35 0.00 0.00 0.00 0.00 46.02 45.18 2eh0 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eh0 s SER 5 N -0.84 5.19 0.54 1.61 0.15 -1.26 -5.10 113.70 113.99 2eh0 s SER 5 Ca 0.00 -0.09 -0.02 0.00 0.70 0.00 0.00 55.95 56.54 2eh0 s SER 5 Cb 0.00 -1.89 0.01 0.00 -1.71 0.00 0.00 66.02 62.43 2eh0 s SER 5 CO 0.00 0.09 0.79 -0.55 1.20 0.00 0.00 173.24 174.78 2eh0 s SER 6 N 0.83 5.55 0.14 5.45 0.15 -1.26 -5.02 113.70 119.53 2eh0 s SER 6 Ca 0.02 0.37 -0.31 0.00 0.70 0.00 0.00 55.95 56.73 2eh0 s SER 6 Cb -0.14 -1.41 -0.10 0.00 -1.71 0.00 0.00 66.02 62.67 2eh0 s SER 6 CO 0.02 -0.99 1.65 -0.83 1.20 0.00 0.00 173.24 174.29 2eh0 s GLY 7 N -4.32 1.49 -0.01 9.45 0.00 -1.26 -5.00 107.32 107.67 2eh0 s GLY 7 Ca 0.53 1.36 -0.04 0.00 0.00 0.00 0.00 44.72 46.57 2eh0 s GLY 7 CO 0.41 2.80 0.09 -1.59 0.00 0.00 0.00 173.10 174.81 2eh0 s THR 8 N 1.79 0.05 0.25 0.90 2.01 -1.26 -4.57 115.64 114.81 2eh0 s THR 8 Ca 0.73 -0.43 -0.30 0.00 0.31 0.00 0.00 61.69 62.00 2eh0 s THR 8 Cb -0.44 -0.28 -0.09 0.00 0.01 0.00 0.00 72.50 71.70 2eh0 s THR 8 CO 0.32 -0.24 1.27 -2.16 -0.69 0.00 0.00 174.62 173.12 2eh0 s PRO 9 N -0.77 4.43 0.12 4.92 0.04 -1.26 -4.60 135.00 137.87 2eh0 s PRO 9 Ca -0.09 2.06 -0.24 0.00 0.04 0.00 0.00 61.00 62.77 2eh0 s PRO 9 Cb -0.05 -3.16 0.07 0.00 0.04 0.00 0.00 34.50 31.40 2eh0 s PRO 9 CO 0.00 -0.14 0.60 -3.38 0.04 0.00 0.00 177.00 174.12 2eh0 s HIS 10 N -0.51 -0.54 -0.16 0.56 -3.43 -1.22 -1.39 115.29 108.60 2eh0 s HIS 10 Ca 0.52 0.44 -0.11 0.00 -0.80 0.00 0.00 55.06 55.11 2eh0 s HIS 10 Cb -0.37 0.51 -0.05 0.00 -1.43 0.00 0.00 32.58 31.25 2eh0 s HIS 10 CO 0.43 -0.79 0.20 -0.51 -2.00 0.00 0.00 174.74 172.07 2eh0 s LEU 11 N -2.46 4.27 -0.09 5.38 1.43 0.94 -1.76 118.68 126.38 2eh0 s LEU 11 Ca -0.01 0.40 -0.01 0.00 -1.03 0.00 0.00 54.13 53.48 2eh0 s LEU 11 Cb -0.01 -2.20 -0.03 0.00 0.03 0.00 0.00 46.19 43.99 2eh0 s LEU 11 CO -0.09 0.21 -0.05 -0.69 0.23 0.00 0.00 176.35 175.96 2eh0 s VAL 12 N 0.06 3.81 -0.91 -1.59 1.01 -0.63 0.07 120.40 122.22 2eh0 s VAL 12 Ca 0.13 -0.42 -0.15 0.00 0.00 0.00 0.00 61.98 61.53 2eh0 s VAL 12 Cb -0.12 -2.59 -0.10 0.00 0.00 0.00 0.00 36.38 33.56 2eh0 s VAL 12 CO 0.02 0.57 2.05 -0.46 0.00 0.00 0.00 175.10 177.28 2eh0 n ASN 13 N 2.57 3.66 0.00 3.32 6.94 0.21 -0.39 115.26 131.56 2eh0 n ASN 13 Ca -0.18 -2.57 0.09 0.00 -0.02 0.00 0.00 54.58 51.89 2eh0 n ASN 13 Cb 0.53 -1.18 0.51 0.00 -2.36 0.00 0.00 39.78 37.28 2eh0 n ASN 13 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2eh0 n LEU 14 N 6.12 0.00 0.00 -4.53 -0.00 -1.26 -4.80 117.00 112.54 2eh0 n LEU 14 Ca 0.49 0.00 -0.09 0.00 -0.00 0.00 0.00 56.01 56.42 2eh0 n LEU 14 Cb 0.31 0.00 0.08 0.00 -0.00 0.00 0.00 43.42 43.81 2eh0 n LEU 14 CO 0.91 0.00 0.10 -0.46 -0.00 0.00 0.00 177.39 177.94 2eh0 n ASN 15 N -1.00 -2.32 -1.03 1.45 0.23 -1.25 -4.92 115.26 106.43 2eh0 n ASN 15 Ca 0.13 -0.24 0.06 0.00 -0.53 0.00 0.00 54.58 53.99 2eh0 n ASN 15 Cb 0.06 -0.32 0.26 0.00 -2.08 0.00 0.00 39.78 37.70 2eh0 n ASN 15 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2eh0 n GLU 16 N -2.35 2.90 -3.55 -3.83 1.02 -1.26 -4.82 120.64 108.75 2eh0 n GLU 16 Ca 0.04 -2.91 -0.39 0.00 -0.02 0.00 0.00 57.16 53.88 2eh0 n GLU 16 Cb 0.17 -1.88 -0.04 0.00 -0.02 0.00 0.00 31.44 29.66 2eh0 n GLU 16 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2eh0 n ASP 17 N -0.54 4.61 0.00 1.62 8.00 -1.26 -4.86 116.55 124.12 2eh0 n ASP 17 Ca 0.24 -3.11 0.08 0.00 0.71 0.00 0.00 54.79 52.71 2eh0 n ASP 17 Cb 0.95 -1.15 0.41 0.00 -0.02 0.00 0.00 41.12 41.31 2eh0 n ASP 17 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2eh0 n PRO 18 N 2.40 0.32 0.03 -0.24 -0.04 -1.26 -1.99 135.00 134.21 2eh0 n PRO 18 Ca 0.23 0.09 0.11 0.00 -0.04 0.00 0.00 63.50 63.88 2eh0 n PRO 18 Cb 0.38 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.29 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 -1.17 0.52 -3.67 1.53 4.77 -1.26 -4.97 117.00 112.75 2eh0 n LEU 19 Ca 0.09 0.03 -0.51 0.00 -0.03 0.00 0.00 56.01 55.58 2eh0 n LEU 19 Cb 0.09 -0.06 -0.07 0.00 -2.33 0.00 0.00 43.42 41.05 2eh0 n LEU 19 CO 0.10 -0.00 0.78 1.15 -1.33 0.00 0.00 177.39 178.09 2eh0 n MET 20 N -2.16 0.00 0.01 3.23 0.00 -0.84 -4.80 117.12 112.55 2eh0 n MET 20 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 57.70 57.83 2eh0 n MET 20 Cb 0.49 -1.18 0.34 0.00 0.00 0.00 0.00 33.22 32.87 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 2.62 0.40 -4.24 3.17 2.88 -1.26 -4.89 113.62 112.30 2eh0 n SER 21 Ca 0.22 -0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.47 2eh0 n SER 21 Cb -0.02 0.03 0.17 0.00 -0.75 0.00 0.00 64.21 63.64 2eh0 n SER 21 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 2eh0 s GLU 22 N -3.02 0.84 0.31 -1.46 1.03 -1.26 -4.99 118.70 110.14 2eh0 s GLU 22 Ca 0.11 -0.62 -0.29 0.00 0.03 0.00 0.00 54.97 54.20 2eh0 s GLU 22 Cb 0.17 -1.96 -0.12 0.00 -0.80 0.00 0.00 34.13 31.42 2eh0 s GLU 22 CO 0.66 -2.21 1.37 0.00 -1.33 0.00 0.00 175.26 173.75 2eh0 h LEU 24 N 3.34 0.00 -7.78 0.00 -0.00 -1.94 -3.46 115.31 105.47 2eh0 h LEU 24 Ca -0.46 0.00 -0.08 0.00 -0.00 0.00 0.00 57.88 57.34 2eh0 h LEU 24 Cb 1.27 0.00 -0.13 0.00 -0.00 0.00 0.00 40.66 41.80 2eh0 h LEU 24 CO 0.69 0.39 -0.25 -1.48 -0.00 0.00 0.00 178.44 177.78 2eh0 s LEU 25 N -6.88 0.95 -0.11 1.67 0.05 -1.26 0.66 118.68 113.75 2eh0 s LEU 25 Ca 0.01 -0.62 -0.00 0.00 0.05 0.00 0.00 54.13 53.57 2eh0 s LEU 25 Cb 0.10 1.36 0.02 0.00 -2.05 0.00 0.00 46.19 45.62 2eh0 s LEU 25 CO 0.69 -0.83 -0.08 -0.31 -0.55 0.00 0.00 176.35 175.27 2eh0 s TYR 26 N -3.88 1.49 0.19 3.48 2.02 0.11 -4.94 117.35 115.82 2eh0 s TYR 26 Ca 0.08 -0.72 -0.27 0.00 -0.37 0.00 0.00 57.07 55.80 2eh0 s TYR 26 Cb 0.03 -1.21 -0.08 0.00 -0.40 0.00 0.00 41.96 40.30 2eh0 s TYR 26 CO -0.08 -0.48 0.83 0.71 -1.57 0.00 0.00 175.55 174.96 2eh0 s TYR 27 N 1.55 3.93 0.18 2.71 2.02 -1.26 -0.04 117.35 126.43 2eh0 s TYR 27 Ca 0.02 1.72 0.08 0.00 -0.37 0.00 0.00 57.07 58.52 2eh0 s TYR 27 Cb -0.13 -2.83 -0.04 0.00 -0.40 0.00 0.00 41.96 38.56 2eh0 s TYR 27 CO -0.07 0.49 -0.01 0.42 -1.57 0.00 0.00 175.55 174.81 2eh0 s ILE 28 N -1.17 3.63 0.20 2.71 1.01 -0.48 -4.96 121.20 122.13 2eh0 s ILE 28 Ca 0.38 -1.48 0.02 0.00 0.00 0.00 0.00 60.65 59.56 2eh0 s ILE 28 Cb -0.24 -2.83 -0.01 0.00 0.01 0.00 0.00 42.46 39.40 2eh0 s ILE 28 CO 0.28 -0.12 0.07 2.29 0.00 0.00 0.00 174.94 177.46 2eh0 n LYS 29 N -0.13 0.76 -2.78 2.79 -0.00 -1.26 -4.62 118.16 112.91 2eh0 n LYS 29 Ca -0.10 -1.69 -0.41 0.00 -0.00 0.00 0.00 58.31 56.11 2eh0 n LYS 29 Cb 0.55 0.93 -0.04 0.00 -0.00 0.00 0.00 35.03 36.47 2eh0 n LYS 29 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2eh0 s ASP 30 N -2.23 7.38 0.00 -5.58 1.11 -1.26 -4.44 116.67 111.65 2eh0 s ASP 30 Ca 0.10 1.66 0.00 0.00 0.18 0.00 0.00 52.55 54.49 2eh0 s ASP 30 Cb 0.01 -2.55 0.00 0.00 1.07 0.00 0.00 42.92 41.44 2eh0 s ASP 30 CO 0.07 -0.13 0.00 0.61 1.18 0.00 0.00 175.17 176.91 2eh0 n GLY 31 N 2.55 0.26 3.03 0.21 0.00 -0.61 -4.95 105.19 105.69 2eh0 n GLY 31 Ca 0.03 -1.36 -0.31 0.00 0.00 0.00 0.00 46.02 44.38 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 -0.09 1.72 -0.57 -0.61 -1.09 -1.26 -2.09 121.20 117.20 2eh0 s ILE 32 Ca 0.00 -0.85 -0.05 0.00 -2.23 0.00 0.00 60.65 57.52 2eh0 s ILE 32 Cb 0.00 -1.66 0.15 0.00 -1.58 0.00 0.00 42.46 39.37 2eh0 s ILE 32 CO 0.00 0.37 0.40 -0.89 -1.23 0.00 0.00 174.94 173.59 2eh0 s THR 33 N 1.40 3.87 0.14 2.92 2.01 0.15 -4.89 115.64 121.25 2eh0 s THR 33 Ca 0.03 -2.51 -0.30 0.00 0.31 0.00 0.00 61.69 59.22 2eh0 s THR 33 Cb -0.14 -3.54 -0.07 0.00 0.01 0.00 0.00 72.50 68.76 2eh0 s THR 33 CO -0.10 -0.83 1.13 -0.13 -0.69 0.00 0.00 174.62 174.00 2eh0 s ARG 34 N 0.48 4.54 -0.55 4.92 0.52 -1.26 0.69 118.95 128.28 2eh0 s ARG 34 Ca 0.13 1.73 -0.04 0.00 -0.52 0.00 0.00 55.73 57.04 2eh0 s ARG 34 Cb -0.21 -3.30 0.14 0.00 0.52 0.00 0.00 34.95 32.10 2eh0 s ARG 34 CO -0.04 -0.04 0.36 0.08 0.02 0.00 0.00 175.30 175.69 2eh0 s VAL 35 N 0.18 3.67 0.00 3.52 1.01 -0.31 -1.25 120.40 127.21 2eh0 s VAL 35 Ca 0.52 -2.56 0.00 0.00 0.00 0.00 0.00 61.98 59.94 2eh0 s VAL 35 Cb -0.29 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.66 2eh0 s VAL 35 CO 0.33 -0.81 0.00 0.61 0.00 0.00 0.00 175.10 175.23 2eh0 n GLY 36 N 3.97 3.67 3.77 4.51 0.00 -0.81 -2.87 105.19 117.43 2eh0 n GLY 36 Ca 0.03 -0.21 -0.29 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 3.89 2.19 0.00 1.61 -1.52 -1.22 -1.39 119.66 123.22 2eh0 s GLN 37 Ca 0.00 -2.14 0.30 0.00 -1.95 0.00 0.00 55.36 51.57 2eh0 s GLN 37 Cb 0.00 -1.79 1.38 0.00 -0.22 0.00 0.00 33.01 32.39 2eh0 s GLN 37 CO 0.00 -0.32 1.94 0.00 -0.25 0.00 0.00 175.29 176.66 2eh0 n ALA 38 N -1.34 2.68 -0.04 6.09 0.00 -1.26 -3.48 120.51 123.16 2eh0 n ALA 38 Ca -0.09 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.05 2eh0 n ALA 38 Cb 0.66 -1.34 -0.15 0.00 0.00 0.00 0.00 19.45 18.62 2eh0 n ALA 38 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2eh0 n ASP 39 N -0.59 0.14 -4.42 0.00 5.68 -1.26 -4.90 116.55 111.21 2eh0 n ASP 39 Ca 0.19 0.06 -0.46 0.00 -0.50 0.00 0.00 54.79 54.09 2eh0 n ASP 39 Cb 0.25 1.27 -0.02 0.00 -1.14 0.00 0.00 41.12 41.48 2eh0 n ASP 39 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2eh0 n ALA 40 N -2.49 -2.38 -0.31 2.12 0.00 -1.23 -4.78 120.51 111.45 2eh0 n ALA 40 Ca -0.17 0.35 -0.02 0.00 0.00 0.00 0.00 53.44 53.59 2eh0 n ALA 40 Cb 0.86 -1.66 0.01 0.00 0.00 0.00 0.00 19.45 18.66 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 0.98 -0.22 -3.82 0.00 -0.58 -1.26 -3.88 120.64 111.86 2eh0 n GLU 41 Ca 0.15 1.21 -0.36 0.00 -0.42 0.00 0.00 57.16 57.74 2eh0 n GLU 41 Cb 0.30 -1.79 -0.12 0.00 -0.57 0.00 0.00 31.44 29.26 2eh0 n GLU 41 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2eh0 s ARG 42 N -5.67 3.72 0.05 3.49 3.00 -1.26 -5.04 118.95 117.23 2eh0 s ARG 42 Ca -0.11 -0.45 -0.31 0.00 0.00 0.00 0.00 55.73 54.87 2eh0 s ARG 42 Cb 0.15 -3.31 -0.16 0.00 0.00 0.00 0.00 34.95 31.62 2eh0 s ARG 42 CO 0.55 -0.10 0.76 -2.13 0.00 0.00 0.00 175.30 174.38 2eh0 n ARG 43 N 4.66 0.00 -3.80 3.54 3.00 -1.25 -4.91 116.66 117.90 2eh0 n ARG 43 Ca -0.16 0.00 -0.35 0.00 -0.00 0.00 0.00 57.85 57.34 2eh0 n ARG 43 Cb 0.52 -1.14 -0.08 0.00 0.00 0.00 0.00 32.46 31.76 2eh0 n ARG 43 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 2eh0 s GLN 44 N -0.24 4.09 0.17 -0.14 -1.52 -1.25 -4.84 119.66 115.92 2eh0 s GLN 44 Ca 0.70 -0.24 -0.19 0.00 -1.95 0.00 0.00 55.36 53.68 2eh0 s GLN 44 Cb -0.98 -3.36 0.09 0.00 -0.22 0.00 0.00 33.01 28.54 2eh0 s GLN 44 CO 0.48 0.33 1.65 0.22 -0.25 0.00 0.00 175.29 177.71 2eh0 h ASP 45 N 6.55 -0.57 -3.55 5.90 1.82 -1.51 -3.37 116.42 121.68 2eh0 h ASP 45 Ca -0.41 0.14 -0.67 0.00 -0.39 0.00 0.00 57.03 55.70 2eh0 h ASP 45 Cb 1.16 0.32 -0.27 0.00 0.68 0.00 0.00 39.33 41.22 2eh0 h ASP 45 CO 0.74 -0.20 -0.66 -0.63 -1.61 0.00 0.00 179.24 176.87 2eh0 s ILE 46 N -6.16 3.72 -0.47 2.25 1.01 -0.95 -5.03 121.20 115.57 2eh0 s ILE 46 Ca -0.14 -0.63 -0.16 0.00 0.00 0.00 0.00 60.65 59.71 2eh0 s ILE 46 Cb 0.14 -2.84 0.06 0.00 0.01 0.00 0.00 42.46 39.83 2eh0 s ILE 46 CO 0.70 0.20 0.43 -0.69 0.00 0.00 0.00 174.94 175.58 2eh0 s VAL 47 N 1.48 5.17 0.92 2.92 1.01 -1.26 -1.92 120.40 128.73 2eh0 s VAL 47 Ca 0.03 -0.90 -0.12 0.00 0.00 0.00 0.00 61.98 61.00 2eh0 s VAL 47 Cb -0.16 -4.13 0.14 0.00 0.00 0.00 0.00 36.38 32.23 2eh0 s VAL 47 CO 0.00 -0.58 1.13 -0.76 0.00 0.00 0.00 175.10 174.89 2eh0 s LEU 48 N 1.83 1.97 0.46 3.92 2.01 -0.48 -4.99 118.68 123.39 2eh0 s LEU 48 Ca 0.06 1.02 0.08 0.00 0.01 0.00 0.00 54.13 55.30 2eh0 s LEU 48 Cb -0.23 -3.34 0.03 0.00 0.01 0.00 0.00 46.19 42.66 2eh0 s LEU 48 CO 0.08 -2.62 0.63 -0.44 1.01 0.00 0.00 176.35 175.01 2eh0 s SER 49 N -3.92 5.53 0.29 2.29 0.01 -1.26 -4.86 113.70 111.78 2eh0 s SER 49 Ca 0.64 -0.46 0.00 0.00 1.31 0.00 0.00 55.95 57.44 2eh0 s SER 49 Cb -0.15 -0.51 0.00 0.00 0.21 0.00 0.00 66.02 65.56 2eh0 s SER 49 CO 0.54 -0.89 0.00 0.61 0.41 0.00 0.00 173.24 173.91 2eh0 n GLY 50 N -1.96 -2.92 0.68 3.44 0.00 -1.26 -4.48 105.19 98.69 2eh0 n GLY 50 Ca 0.09 -1.26 0.09 0.00 0.00 0.00 0.00 46.02 44.94 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 -3.10 2.48 1.45 4.61 0.00 -1.26 -3.83 120.51 120.86 2eh0 n ALA 51 Ca -0.04 -0.64 0.11 0.00 0.00 0.00 0.00 53.44 52.87 2eh0 n ALA 51 Cb 0.33 -1.02 0.45 0.00 0.00 0.00 0.00 19.45 19.21 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 0.57 0.13 -3.55 0.00 8.25 -1.26 -4.70 115.22 114.65 2eh0 n HIS 52 Ca 0.15 -0.07 -0.41 0.00 -0.26 0.00 0.00 57.72 57.14 2eh0 n HIS 52 Cb 0.36 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.38 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 -1.87 4.45 0.30 1.59 -1.09 -1.25 -4.45 121.20 118.88 2eh0 s ILE 53 Ca 0.33 -1.39 -0.29 0.00 -2.23 0.00 0.00 60.65 57.07 2eh0 s ILE 53 Cb 0.17 -3.74 -0.13 0.00 -1.58 0.00 0.00 42.46 37.18 2eh0 s ILE 53 CO 0.27 -0.57 1.26 0.29 -1.23 0.00 0.00 174.94 174.96 2eh0 n LYS 54 N 4.98 1.92 -0.27 2.79 4.76 -1.26 -4.63 118.16 126.44 2eh0 n LYS 54 Ca -0.10 0.67 0.33 0.00 -2.87 0.00 0.00 58.31 56.35 2eh0 n LYS 54 Cb 0.43 -2.23 0.72 0.00 -1.84 0.00 0.00 35.03 32.11 2eh0 n LYS 54 CO 0.00 0.00 0.00 1.05 -1.37 0.00 0.00 177.40 177.08 2eh0 h GLU 55 N 2.86 0.00 -0.91 1.97 9.09 -1.92 0.47 114.58 126.13 2eh0 h GLU 55 Ca -0.44 0.00 -0.43 0.00 0.05 0.00 0.00 59.36 58.53 2eh0 h GLU 55 Cb 1.29 0.00 -0.41 0.00 -1.65 0.00 0.00 28.75 27.98 2eh0 h GLU 55 CO 0.65 0.00 -0.97 0.39 0.05 0.00 0.00 179.01 179.14 2eh0 n GLU 56 N -3.95 2.48 0.00 1.06 1.02 -1.26 -3.46 120.64 116.53 2eh0 n GLU 56 Ca 0.24 -3.86 0.00 0.00 -0.02 0.00 0.00 57.16 53.52 2eh0 n GLU 56 Cb 1.24 -1.85 0.00 0.00 -0.02 0.00 0.00 31.44 30.82 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 -0.47 0.00 -4.10 -0.32 -0.00 0.16 -4.57 115.22 105.92 2eh0 n HIS 57 Ca 0.25 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.31 2eh0 n HIS 57 Cb 0.81 -0.46 -0.04 0.00 -0.12 0.00 0.00 29.99 30.18 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 -2.80 0.15 -0.22 0.00 1.01 -1.10 -1.17 121.20 117.07 2eh0 s ILE 59 Ca 0.23 -1.27 -0.01 0.00 0.00 0.00 0.00 60.65 59.60 2eh0 s ILE 59 Cb 0.01 -1.27 0.07 0.00 0.01 0.00 0.00 42.46 41.27 2eh0 s ILE 59 CO 0.16 -0.70 0.02 -0.36 0.00 0.00 0.00 174.94 174.06 2eh0 s PHE 60 N -3.57 1.53 -0.15 3.97 0.08 0.22 -2.07 117.98 117.98 2eh0 s PHE 60 Ca 0.03 -1.26 -0.08 0.00 0.12 0.00 0.00 56.93 55.75 2eh0 s PHE 60 Cb 0.04 -1.30 -0.04 0.00 -0.57 0.00 0.00 43.02 41.15 2eh0 s PHE 60 CO -0.09 -0.70 0.13 0.50 -0.10 0.00 0.00 175.22 174.95 2eh0 s ARG 61 N 1.69 3.70 -0.22 0.44 3.52 -0.74 0.32 118.95 127.65 2eh0 s ARG 61 Ca -0.01 -0.19 -0.01 0.00 -0.13 0.00 0.00 55.73 55.39 2eh0 s ARG 61 Cb -0.18 -3.25 0.06 0.00 -1.56 0.00 0.00 34.95 30.03 2eh0 s ARG 61 CO -0.10 0.59 0.01 0.45 -0.81 0.00 0.00 175.30 175.44 2eh0 s SER 62 N -0.48 3.34 0.02 -2.12 0.15 -0.89 -1.53 113.70 112.19 2eh0 s SER 62 Ca 0.12 -1.03 0.00 0.00 0.70 0.00 0.00 55.95 55.75 2eh0 s SER 62 Cb -0.12 -0.81 -0.02 0.00 -1.71 0.00 0.00 66.02 63.36 2eh0 s SER 62 CO 0.02 -0.30 -0.03 -0.70 1.20 0.00 0.00 173.24 173.43 2eh0 s GLU 63 N 1.68 0.29 -0.59 5.44 2.56 -0.93 -1.57 118.70 125.57 2eh0 s GLU 63 Ca -0.01 -0.50 -0.28 0.00 0.00 0.00 0.00 54.97 54.18 2eh0 s GLU 63 Cb -0.18 0.01 0.03 0.00 2.00 0.00 0.00 34.13 36.00 2eh0 s GLU 63 CO -0.09 -0.02 1.18 0.50 -0.56 0.00 0.00 175.26 176.27 2eh0 s ARG 64 N -1.14 3.47 1.00 4.30 3.52 -1.26 -1.49 118.95 127.34 2eh0 s ARG 64 Ca -0.11 0.16 -0.18 0.00 -0.13 0.00 0.00 55.73 55.47 2eh0 s ARG 64 Cb -0.08 -4.03 -0.14 0.00 -1.56 0.00 0.00 34.95 29.13 2eh0 s ARG 64 CO -0.01 -1.72 -0.80 0.45 -0.81 0.00 0.00 175.30 172.41 2eh0 n SER 65 N 8.46 -5.66 0.33 -2.12 2.88 0.26 -4.58 113.62 113.20 2eh0 n SER 65 Ca 0.07 0.17 0.19 0.00 -1.33 0.00 0.00 58.87 57.98 2eh0 n SER 65 Cb 0.49 -0.76 1.04 0.00 -0.75 0.00 0.00 64.21 64.23 2eh0 n SER 65 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2eh0 h ASN 66 N -1.03 0.00 1.58 -3.46 7.08 -1.94 0.24 115.58 118.05 2eh0 h ASN 66 Ca -0.44 0.00 -0.06 0.00 -3.08 0.00 0.00 56.30 52.72 2eh0 h ASN 66 Cb 1.31 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 37.54 2eh0 h ASN 66 CO 0.23 0.00 -0.31 -1.28 -2.08 0.00 0.00 177.43 174.00 2eh0 h SER 67 N 0.00 0.00 0.00 6.14 0.87 -2.02 -3.47 113.55 115.07 2eh0 h SER 67 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2eh0 h SER 67 Cb 0.27 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.23 2eh0 h SER 67 CO 0.00 0.31 0.00 0.61 -0.53 0.00 0.00 176.83 177.22 2eh0 n GLY 68 N 1.04 1.65 3.33 5.77 0.00 0.86 -5.12 105.19 112.72 2eh0 n GLY 68 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.28 2.50 -0.24 1.61 -1.05 -1.24 -4.87 118.70 115.12 2eh0 s GLU 69 Ca 0.00 -0.85 -0.29 0.00 -0.15 0.00 0.00 54.97 53.68 2eh0 s GLU 69 Cb 0.00 -2.21 -0.01 0.00 -0.44 0.00 0.00 34.13 31.47 2eh0 s GLU 69 CO 0.00 0.46 1.33 0.08 0.95 0.00 0.00 175.26 178.08 2eh0 s VAL 70 N -0.35 4.13 0.20 1.83 1.01 -1.26 0.92 120.40 126.89 2eh0 s VAL 70 Ca 0.02 1.32 0.11 0.00 0.00 0.00 0.00 61.98 63.43 2eh0 s VAL 70 Cb -0.12 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 2eh0 s VAL 70 CO 0.02 -0.34 -0.20 -0.63 0.00 0.00 0.00 175.10 173.95 2eh0 s ILE 71 N 4.16 2.56 -0.08 2.22 -1.09 -0.55 -4.88 121.20 123.54 2eh0 s ILE 71 Ca 0.57 -1.98 0.03 0.00 -2.23 0.00 0.00 60.65 57.04 2eh0 s ILE 71 Cb -0.19 -2.25 0.01 0.00 -1.58 0.00 0.00 42.46 38.45 2eh0 s ILE 71 CO 0.21 -0.14 -0.15 -0.69 -1.23 0.00 0.00 174.94 172.94 2eh0 s VAL 72 N -1.75 1.38 -0.08 2.92 1.01 -1.26 -2.20 120.40 120.43 2eh0 s VAL 72 Ca 0.22 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.62 2eh0 s VAL 72 Cb -0.08 -1.24 0.00 0.00 0.00 0.00 0.00 36.38 35.06 2eh0 s VAL 72 CO 0.11 0.41 -0.18 -0.89 0.00 0.00 0.00 175.10 174.55 2eh0 s THR 73 N 0.64 1.59 -0.23 3.92 2.01 -0.58 -1.44 115.64 121.56 2eh0 s THR 73 Ca -0.14 -0.75 -0.19 0.00 0.31 0.00 0.00 61.69 60.91 2eh0 s THR 73 Cb -0.16 -1.39 -0.03 0.00 0.01 0.00 0.00 72.50 70.93 2eh0 s THR 73 CO 0.04 0.45 0.57 -0.22 -0.69 0.00 0.00 174.62 174.78 2eh0 s LEU 74 N 0.41 4.10 -0.92 4.42 2.96 0.49 -1.80 118.68 128.34 2eh0 s LEU 74 Ca -0.14 0.68 -0.02 0.00 -0.22 0.00 0.00 54.13 54.42 2eh0 s LEU 74 Cb -0.16 -2.77 0.23 0.00 0.50 0.00 0.00 46.19 43.98 2eh0 s LEU 74 CO 0.06 -0.27 0.83 -1.61 -1.32 0.00 0.00 176.35 174.03 2eh0 s GLU 75 N 2.06 3.40 1.14 1.98 2.02 -0.88 -2.53 118.70 125.88 2eh0 s GLU 75 Ca 0.25 -3.29 -0.17 0.00 0.02 0.00 0.00 54.97 51.78 2eh0 s GLU 75 Cb -0.16 -4.03 0.26 0.00 0.10 0.00 0.00 34.13 30.30 2eh0 s GLU 75 CO 0.09 -1.26 1.10 -1.25 0.02 0.00 0.00 175.26 173.97 2eh0 s PRO 76 N -1.37 -0.69 0.13 0.39 0.04 -1.26 -2.72 135.00 129.52 2eh0 s PRO 76 Ca 0.28 0.12 0.10 0.00 0.04 0.00 0.00 61.00 61.54 2eh0 s PRO 76 Cb -0.07 -1.64 -0.04 0.00 0.04 0.00 0.00 34.50 32.79 2eh0 s PRO 76 CO -0.12 -3.39 -0.25 0.00 0.04 0.00 0.00 177.00 173.28 2eh0 n GLU 78 N 0.83 0.90 -0.07 0.00 0.28 -1.26 -2.68 120.64 118.63 2eh0 n GLU 78 Ca -0.17 0.00 0.07 0.00 -0.16 0.00 0.00 57.16 56.90 2eh0 n GLU 78 Cb 0.54 -1.22 0.10 0.00 1.43 0.00 0.00 31.44 32.28 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 -0.72 1.63 -4.51 3.44 5.12 -1.26 -5.05 116.66 115.31 2eh0 n ARG 79 Ca 0.10 -2.22 -0.26 0.00 -1.93 0.00 0.00 57.85 53.54 2eh0 n ARG 79 Cb 0.04 -1.32 -0.08 0.00 -1.16 0.00 0.00 32.46 29.94 2eh0 n ARG 79 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 2eh0 s SER 80 N -2.31 2.79 -0.78 0.55 0.01 -1.09 -4.96 113.70 107.91 2eh0 s SER 80 Ca 0.22 -1.68 0.03 0.00 1.31 0.00 0.00 55.95 55.84 2eh0 s SER 80 Cb 0.20 0.51 0.19 0.00 0.21 0.00 0.00 66.02 67.12 2eh0 s SER 80 CO 0.02 -0.93 0.60 1.21 0.41 0.00 0.00 173.24 174.55 2eh0 n GLU 81 N -0.91 2.13 -4.01 12.44 2.13 -1.26 -4.91 120.64 126.25 2eh0 n GLU 81 Ca -0.06 -4.49 -0.31 0.00 0.66 0.00 0.00 57.16 52.95 2eh0 n GLU 81 Cb 0.65 -2.33 -0.06 0.00 0.27 0.00 0.00 31.44 29.97 2eh0 n GLU 81 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 2eh0 s THR 82 N -1.47 4.92 -0.13 6.31 2.01 -1.26 -2.77 115.64 123.26 2eh0 s THR 82 Ca 0.26 -0.51 -0.05 0.00 0.31 0.00 0.00 61.69 61.70 2eh0 s THR 82 Cb -0.05 -3.35 0.06 0.00 0.01 0.00 0.00 72.50 69.18 2eh0 s THR 82 CO -0.15 0.20 0.26 -0.31 -0.69 0.00 0.00 174.62 173.93 2eh0 s TYR 83 N -1.37 -0.41 -0.04 4.92 2.02 -0.96 -3.03 117.35 118.47 2eh0 s TYR 83 Ca 0.29 0.96 0.06 0.00 -0.37 0.00 0.00 57.07 58.01 2eh0 s TYR 83 Cb -0.12 -0.04 -0.01 0.00 -0.40 0.00 0.00 41.96 41.38 2eh0 s TYR 83 CO 0.22 -0.35 -0.23 0.08 -1.57 0.00 0.00 175.55 173.70 2eh0 s VAL 84 N 2.39 1.83 -1.56 0.71 1.01 0.25 -1.24 120.40 123.79 2eh0 s VAL 84 Ca 0.01 -0.96 -0.02 0.00 0.00 0.00 0.00 61.98 61.00 2eh0 s VAL 84 Cb -0.12 -1.53 0.00 0.00 0.00 0.00 0.00 36.38 34.73 2eh0 s VAL 84 CO -0.08 0.51 0.31 0.59 0.00 0.00 0.00 175.10 176.43 2eh0 n ASN 85 N 2.77 -5.75 0.00 3.32 3.02 -0.89 -1.07 115.26 116.67 2eh0 n ASN 85 Ca -0.17 -0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.23 2eh0 n ASN 85 Cb 0.52 -4.67 0.00 0.00 -0.61 0.00 0.00 39.78 35.02 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 -1.27 0.70 3.72 7.41 0.00 -1.26 -4.98 105.19 109.51 2eh0 n GLY 86 Ca -0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.27 2.13 0.11 1.61 -2.85 -0.23 -5.11 119.74 115.13 2eh0 s LYS 87 Ca 0.00 -2.32 -0.22 0.00 -1.00 0.00 0.00 55.97 52.42 2eh0 s LYS 87 Cb 0.00 -1.52 -0.07 0.00 -2.06 0.00 0.00 37.83 34.18 2eh0 s LYS 87 CO 0.00 -0.29 0.67 0.50 0.10 0.00 0.00 175.35 176.33 2eh0 s ARG 88 N -3.83 4.38 -0.27 1.78 6.06 -1.26 0.88 118.95 126.69 2eh0 s ARG 88 Ca 0.13 0.93 0.02 0.00 -2.50 0.00 0.00 55.73 54.32 2eh0 s ARG 88 Cb 0.04 -3.26 0.07 0.00 0.06 0.00 0.00 34.95 31.86 2eh0 s ARG 88 CO 0.07 0.58 -0.05 0.54 -2.50 0.00 0.00 175.30 173.95 2eh0 s VAL 89 N -1.04 1.84 -0.01 7.11 0.11 -1.17 -4.74 120.40 122.50 2eh0 s VAL 89 Ca 0.32 -1.57 0.10 0.00 -2.93 0.00 0.00 61.98 57.91 2eh0 s VAL 89 Cb -0.21 -2.11 -0.15 0.00 -1.53 0.00 0.00 36.38 32.38 2eh0 s VAL 89 CO 0.22 -0.19 0.21 -0.24 -3.33 0.00 0.00 175.10 171.78 2eh0 n SER 90 N 4.53 2.74 -4.73 3.54 2.88 -1.26 -4.65 113.62 116.68 2eh0 n SER 90 Ca -0.09 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.21 2eh0 n SER 90 Cb 0.43 1.44 -0.06 0.00 -0.75 0.00 0.00 64.21 65.27 2eh0 n SER 90 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2eh0 s GLN 91 N -2.68 2.60 -0.40 -1.46 1.11 -1.26 -4.60 119.66 112.97 2eh0 s GLN 91 Ca -0.04 -1.15 -0.28 0.00 0.01 0.00 0.00 55.36 53.90 2eh0 s GLN 91 Cb 0.06 -2.40 -0.01 0.00 -1.01 0.00 0.00 33.01 29.65 2eh0 s GLN 91 CO 0.41 0.41 1.73 -1.25 0.01 0.00 0.00 175.29 176.60 2eh0 s PRO 92 N -3.47 3.26 0.15 2.91 0.04 -1.26 -4.60 135.00 132.03 2eh0 s PRO 92 Ca 0.31 1.18 0.05 0.00 0.04 0.00 0.00 61.00 62.58 2eh0 s PRO 92 Cb -0.08 -4.19 -0.04 0.00 0.04 0.00 0.00 34.50 30.22 2eh0 s PRO 92 CO 0.22 -1.95 -0.10 0.14 0.04 0.00 0.00 177.00 175.35 2eh0 s VAL 93 N 6.96 1.19 0.33 -0.36 -7.23 -1.05 -4.94 120.40 115.29 2eh0 s VAL 93 Ca 0.74 -2.07 -0.27 0.00 -1.81 0.00 0.00 61.98 58.58 2eh0 s VAL 93 Cb -0.19 -1.85 -0.09 0.00 0.56 0.00 0.00 36.38 34.80 2eh0 s VAL 93 CO 0.31 -0.74 1.00 -1.10 -0.31 0.00 0.00 175.10 174.26 2eh0 s GLN 94 N -3.74 4.51 0.41 4.82 -0.21 -1.26 -0.38 119.66 123.80 2eh0 s GLN 94 Ca 0.17 1.49 -0.11 0.00 0.02 0.00 0.00 55.36 56.93 2eh0 s GLN 94 Cb 0.02 -2.86 -0.07 0.00 1.00 0.00 0.00 33.01 31.11 2eh0 s GLN 94 CO 0.01 0.18 0.78 -0.51 -2.12 0.00 0.00 175.29 173.62 2eh0 s LEU 95 N -2.00 3.83 -0.19 2.90 2.01 -0.52 -4.87 118.68 119.85 2eh0 s LEU 95 Ca 0.50 1.16 -0.07 0.00 0.01 0.00 0.00 54.13 55.73 2eh0 s LEU 95 Cb -0.23 -4.04 -0.04 0.00 0.01 0.00 0.00 46.19 41.89 2eh0 s LEU 95 CO 0.29 -0.40 0.06 -0.60 1.01 0.00 0.00 176.35 176.71 2eh0 s ARG 96 N -3.81 3.95 -0.94 1.70 6.06 -1.26 -4.87 118.95 119.78 2eh0 s ARG 96 Ca 0.52 -0.35 -0.14 0.00 -2.50 0.00 0.00 55.73 53.25 2eh0 s ARG 96 Cb -0.10 -3.22 -0.28 0.00 0.06 0.00 0.00 34.95 31.41 2eh0 s ARG 96 CO 0.31 0.24 2.24 0.45 -2.50 0.00 0.00 175.30 176.04 2eh0 n SER 97 N 3.63 -0.51 0.00 -2.12 2.88 -1.26 0.09 113.62 116.33 2eh0 n SER 97 Ca -0.16 -0.77 0.00 0.00 -1.33 0.00 0.00 58.87 56.61 2eh0 n SER 97 Cb 0.52 -0.85 0.00 0.00 -0.75 0.00 0.00 64.21 63.13 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 5.88 1.14 3.89 0.46 0.00 0.28 -4.90 105.19 111.95 2eh0 n GLY 98 Ca 0.62 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.31 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 -2.00 6.45 -0.22 1.61 2.20 0.11 -4.85 114.94 118.24 2eh0 s ASN 99 Ca 0.00 0.48 -0.27 0.00 -0.94 0.00 0.00 52.86 52.13 2eh0 s ASN 99 Cb 0.00 -2.05 0.00 0.00 -2.00 0.00 0.00 41.25 37.20 2eh0 s ASN 99 CO 0.00 0.22 0.94 -0.13 -2.94 0.00 0.00 177.10 175.19 2eh0 s ARG 100 N -2.01 4.24 -0.16 3.55 0.52 -1.26 -2.82 118.95 121.02 2eh0 s ARG 100 Ca 0.30 1.17 0.02 0.00 -0.52 0.00 0.00 55.73 56.70 2eh0 s ARG 100 Cb -0.13 -3.63 0.02 0.00 0.52 0.00 0.00 34.95 31.73 2eh0 s ARG 100 CO 0.19 -0.55 -0.20 0.42 0.02 0.00 0.00 175.30 175.18 2eh0 s ILE 101 N 2.92 1.99 -0.10 1.52 1.01 -1.01 -2.09 121.20 125.44 2eh0 s ILE 101 Ca 0.40 -0.91 -0.00 0.00 0.00 0.00 0.00 60.65 60.14 2eh0 s ILE 101 Cb -0.15 -1.79 -0.02 0.00 0.01 0.00 0.00 42.46 40.51 2eh0 s ILE 101 CO 0.08 0.53 -0.09 -0.63 0.00 0.00 0.00 174.94 174.83 2eh0 s ILE 102 N 1.11 3.48 -0.33 2.92 1.01 -0.37 -1.28 121.20 127.73 2eh0 s ILE 102 Ca -0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 60.65 60.11 2eh0 s ILE 102 Cb -0.14 -2.45 0.11 0.00 0.01 0.00 0.00 42.46 39.99 2eh0 s ILE 102 CO -0.08 0.55 0.12 -0.04 0.00 0.00 0.00 174.94 175.49 2eh0 s MET 103 N -0.18 0.72 2.63 2.79 -1.94 -0.99 -2.28 119.30 120.05 2eh0 s MET 103 Ca 0.02 -1.15 0.00 0.00 -1.71 0.00 0.00 55.69 52.85 2eh0 s MET 103 Cb -0.13 -1.91 0.00 0.00 2.01 0.00 0.00 34.83 34.80 2eh0 s MET 103 CO 0.03 -1.02 0.00 0.41 -0.01 0.00 0.00 175.02 174.42 2eh0 n GLY 104 N 4.69 1.31 2.96 -0.03 0.00 -1.11 -4.45 105.19 108.55 2eh0 n GLY 104 Ca -0.00 -0.81 -0.21 0.00 0.00 0.00 0.00 46.02 44.99 2eh0 n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eh0 s LYS 105 N 0.00 1.11 -1.63 1.61 -0.14 -1.26 -4.81 119.74 114.62 2eh0 s LYS 105 Ca 0.00 -0.26 -0.15 0.00 -1.36 0.00 0.00 55.97 54.20 2eh0 s LYS 105 Cb 0.00 -1.01 0.12 0.00 -1.68 0.00 0.00 37.83 35.27 2eh0 s LYS 105 CO 0.00 0.02 0.79 0.09 -0.76 0.00 0.00 175.35 175.48 2eh0 n ASN 106 N 3.72 -3.25 -2.70 2.83 4.13 -1.26 -4.87 115.26 113.85 2eh0 n ASN 106 Ca -0.22 -0.96 -0.21 0.00 1.68 0.00 0.00 54.58 54.86 2eh0 n ASN 106 Cb 0.52 -3.05 -0.00 0.00 -1.54 0.00 0.00 39.78 35.71 2eh0 n ASN 106 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2eh0 n HIS 107 N -4.45 2.59 -3.44 3.10 8.25 -1.26 -5.05 115.22 114.95 2eh0 n HIS 107 Ca 0.02 -3.30 -0.38 0.00 -0.26 0.00 0.00 57.72 53.81 2eh0 n HIS 107 Cb 0.52 -0.28 -0.07 0.00 1.12 0.00 0.00 29.99 31.28 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 -4.34 5.23 0.30 1.59 1.01 -1.26 -2.35 120.40 120.58 2eh0 s VAL 108 Ca 0.42 0.65 0.07 0.00 0.00 0.00 0.00 61.98 63.12 2eh0 s VAL 108 Cb 0.39 -3.70 -0.06 0.00 0.00 0.00 0.00 36.38 33.01 2eh0 s VAL 108 CO -0.11 0.29 -0.06 -0.36 0.00 0.00 0.00 175.10 174.87 2eh0 s PHE 109 N 1.06 2.07 -0.30 5.22 0.40 -0.41 -3.76 117.98 122.25 2eh0 s PHE 109 Ca 0.18 -0.67 -0.07 0.00 -0.60 0.00 0.00 56.93 55.77 2eh0 s PHE 109 Cb -0.14 -1.20 0.02 0.00 0.51 0.00 0.00 43.02 42.20 2eh0 s PHE 109 CO 0.07 0.33 0.08 0.50 0.70 0.00 0.00 175.22 176.91 2eh0 s ARG 110 N -3.71 2.99 -0.70 0.44 6.06 0.47 -2.39 118.95 122.11 2eh0 s ARG 110 Ca 0.31 -0.92 -0.27 0.00 -2.50 0.00 0.00 55.73 52.34 2eh0 s ARG 110 Cb 0.04 -3.39 0.03 0.00 0.06 0.00 0.00 34.95 31.69 2eh0 s ARG 110 CO 0.13 -0.49 1.26 0.12 -2.50 0.00 0.00 175.30 173.83 2eh0 s PHE 111 N 1.48 2.36 0.43 5.12 5.36 -1.13 -1.60 117.98 130.00 2eh0 s PHE 111 Ca 0.02 0.08 -0.00 0.00 -0.96 0.00 0.00 56.93 56.06 2eh0 s PHE 111 Cb -0.18 -4.60 -0.01 0.00 -0.34 0.00 0.00 43.02 37.89 2eh0 s PHE 111 CO 0.02 -1.96 0.66 0.54 -1.46 0.00 0.00 175.22 173.02 2eh0 s ASN 112 N 3.59 5.97 -0.50 6.13 2.20 -0.72 0.10 114.94 131.71 2eh0 s ASN 112 Ca 0.37 0.39 0.06 0.00 -0.94 0.00 0.00 52.86 52.75 2eh0 s ASN 112 Cb -0.08 -1.72 0.22 0.00 -2.00 0.00 0.00 41.25 37.68 2eh0 s ASN 112 CO 0.18 -0.60 0.81 1.57 -2.94 0.00 0.00 177.10 176.11 2eh0 n HIS 113 N -2.04 -3.42 0.98 1.54 -0.00 -1.26 -3.45 115.22 107.57 2eh0 n HIS 113 Ca -0.00 -1.68 0.06 0.00 0.46 0.00 0.00 57.72 56.56 2eh0 n HIS 113 Cb 0.57 1.46 0.36 0.00 -0.12 0.00 0.00 29.99 32.26 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 2.15 0.49 -0.04 1.57 -0.04 -1.26 -2.20 135.00 135.67 2eh0 n PRO 114 Ca 0.13 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.38 2eh0 n PRO 114 Cb 0.60 -1.38 -0.13 0.00 -0.04 0.00 0.00 33.50 32.55 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 0.17 0.54 4.39 -1.91 -3.35 114.58 114.56 2eh0 h GLU 115 Ca 0.00 -0.24 -0.35 0.00 0.34 0.00 0.00 59.36 59.11 2eh0 h GLU 115 Cb 0.00 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 2eh0 h GLU 115 CO 0.00 1.11 -1.76 0.37 -1.16 0.00 0.00 179.01 177.57 2eh0 h GLN 116 N -0.58 0.37 -0.39 2.33 5.75 -1.87 -3.32 115.11 117.40 2eh0 h GLN 116 Ca -0.29 -0.63 0.11 0.00 -0.15 0.00 0.00 58.65 57.70 2eh0 h GLN 116 Cb 1.55 0.23 -0.02 0.00 1.07 0.00 0.00 27.48 30.31 2eh0 h GLN 116 CO -0.03 1.28 0.50 0.00 -2.65 0.00 0.00 178.83 177.93 2eh0 h ALA 117 N 0.15 2.05 -0.87 3.38 0.00 -1.65 0.15 119.26 122.47 2eh0 h ALA 117 Ca -0.35 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 2eh0 h ALA 117 Cb 2.09 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 19.86 2eh0 h ALA 117 CO 0.17 -0.70 0.50 0.07 0.00 0.00 0.00 179.25 179.29 2eh0 h ARG 118 N 0.00 1.20 0.00 0.00 0.11 -1.70 -2.87 114.38 111.12 2eh0 h ARG 118 Ca 0.18 -0.12 -0.28 0.00 0.10 0.00 0.00 59.98 59.86 2eh0 h ARG 118 Cb 1.18 -0.24 -0.05 0.00 1.11 0.00 0.00 29.97 31.97 2eh0 h ARG 118 CO -0.00 0.86 -1.64 0.00 0.10 0.00 0.00 179.97 179.29 2eh0 h ALA 119 N 1.34 0.72 -0.92 0.08 0.00 -0.97 -3.35 119.26 116.17 2eh0 h ALA 119 Ca 0.31 -1.41 0.25 0.00 0.00 0.00 0.00 54.91 54.06 2eh0 h ALA 119 Cb -0.01 0.43 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 2eh0 h ALA 119 CO -0.05 1.55 0.64 0.93 0.00 0.00 0.00 179.25 182.31 2eh0 h GLU 120 N 0.00 0.11 -0.06 0.00 5.08 -1.08 0.50 114.58 119.14 2eh0 h GLU 120 Ca -0.26 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 57.99 2eh0 h GLU 120 Cb 1.99 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 31.20 2eh0 h GLU 120 CO 0.09 0.08 -0.44 0.00 -1.00 0.00 0.00 179.01 177.73 2eh0 h ARG 121 N 0.12 0.13 0.00 2.33 2.47 -1.67 -2.46 114.38 115.30 2eh0 h ARG 121 Ca 0.45 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 59.11 2eh0 h ARG 121 Cb 1.60 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.92 2eh0 h ARG 121 CO -0.06 0.55 0.00 0.93 0.56 0.00 0.00 179.97 181.94 2eh0 h GLU 122 N 0.11 0.00 -6.62 0.04 4.39 -0.20 -3.44 114.58 108.87 2eh0 h GLU 122 Ca 0.01 0.00 -0.51 0.00 0.34 0.00 0.00 59.36 59.19 2eh0 h GLU 122 Cb 0.83 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.46 2eh0 h GLU 122 CO 0.06 0.00 -0.00 0.21 -1.16 0.00 0.00 179.01 178.12 2eh0 s LYS 123 N -3.40 3.85 0.07 2.33 2.20 -0.93 -5.08 119.74 118.78 2eh0 s LYS 123 Ca 0.04 0.42 -0.04 0.00 -0.36 0.00 0.00 55.97 56.03 2eh0 s LYS 123 Cb 0.09 -2.52 -0.05 0.00 -1.51 0.00 0.00 37.83 33.84 2eh0 s LYS 123 CO 0.47 0.19 0.30 -0.08 -0.36 0.00 0.00 175.35 175.86 2eh0 s THR 124 N -2.00 5.27 0.56 3.43 -1.32 -1.26 -5.01 115.64 115.30 2eh0 s THR 124 Ca 0.50 -0.02 0.09 0.00 -1.21 0.00 0.00 61.69 61.05 2eh0 s THR 124 Cb -0.11 -3.61 0.07 0.00 -1.51 0.00 0.00 72.50 67.35 2eh0 s THR 124 CO 0.23 0.18 0.71 -0.55 -2.21 0.00 0.00 174.62 172.97 2eh0 s SER 125 N -2.19 5.05 -0.44 8.08 0.15 -1.26 -5.11 113.70 117.98 2eh0 s SER 125 Ca 0.35 -0.89 0.02 0.00 0.70 0.00 0.00 55.95 56.13 2eh0 s SER 125 Cb -0.13 0.25 0.22 0.00 -1.71 0.00 0.00 66.02 64.66 2eh0 s SER 125 CO 0.22 -1.26 0.94 0.61 1.20 0.00 0.00 173.24 174.96 2eh0 n GLY 126 N -2.13 -0.85 0.12 9.45 0.00 -1.26 -5.03 105.19 105.49 2eh0 n GLY 126 Ca 0.12 0.65 -0.13 0.00 0.00 0.00 0.00 46.02 46.66 2eh0 n GLY 126 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eh0 h PRO 127 N 4.25 0.31 -6.29 1.61 0.13 -1.99 -3.32 132.00 126.69 2eh0 h PRO 127 Ca -0.06 -0.16 -0.55 0.00 -0.87 0.00 0.00 66.00 64.36 2eh0 h PRO 127 Cb 1.12 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.21 2eh0 h PRO 127 CO 0.04 0.70 0.08 0.45 -0.23 0.00 0.00 178.00 179.04 2eh0 s SER 128 N -6.06 7.17 -1.49 1.44 0.15 -1.26 -3.93 113.70 109.72 2eh0 s SER 128 Ca -0.14 1.39 -0.13 0.00 0.70 0.00 0.00 55.95 57.76 2eh0 s SER 128 Cb 0.05 -2.43 0.10 0.00 -1.71 0.00 0.00 66.02 62.03 2eh0 s SER 128 CO 0.74 0.15 0.73 -0.24 1.20 0.00 0.00 173.24 175.82 2eh0 n SER 129 N 2.21 -4.03 -0.51 5.45 2.88 -1.26 -5.23 113.62 113.12 2eh0 n SER 129 Ca -0.06 -0.69 0.06 0.00 -1.33 0.00 0.00 58.87 56.86 2eh0 n SER 129 Cb 0.50 -3.28 0.05 0.00 -0.75 0.00 0.00 64.21 60.73 2eh0 n SER 129 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42