#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 0.15 -0.11 1.61 0.15 -1.26 -5.16 113.70 109.08 2eh0 s SER 2 Ca 0.00 -1.07 0.00 0.00 0.70 0.00 0.00 55.95 55.58 2eh0 s SER 2 Cb 0.00 0.65 0.02 0.00 -1.71 0.00 0.00 66.02 64.98 2eh0 s SER 2 CO 0.00 -1.26 -0.09 -0.44 1.20 0.00 0.00 173.24 172.65 2eh0 s SER 3 N -3.07 2.13 0.00 5.45 0.01 -1.26 -5.11 113.70 111.86 2eh0 s SER 3 Ca 0.23 -0.31 0.00 0.00 1.31 0.00 0.00 55.95 57.18 2eh0 s SER 3 Cb -0.01 -0.86 0.00 0.00 0.21 0.00 0.00 66.02 65.36 2eh0 s SER 3 CO 0.12 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.29 2eh0 n GLY 4 N 4.74 -1.82 3.88 3.44 0.00 -1.26 -5.16 105.19 109.01 2eh0 n GLY 4 Ca -0.15 -1.13 -0.30 0.00 0.00 0.00 0.00 46.02 44.45 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 -0.87 5.12 -0.36 1.61 0.15 -1.26 -4.97 113.70 113.12 2eh0 s SER 5 Ca 0.00 1.08 0.03 0.00 0.70 0.00 0.00 55.95 57.77 2eh0 s SER 5 Cb 0.00 -1.81 0.55 0.00 -1.71 0.00 0.00 66.02 63.05 2eh0 s SER 5 CO 0.00 -1.54 1.75 -1.54 1.20 0.00 0.00 173.24 173.10 2eh0 n SER 6 N -3.13 3.64 0.00 5.45 3.41 -1.26 -4.74 113.62 117.00 2eh0 n SER 6 Ca 0.07 -3.30 0.00 0.00 -0.26 0.00 0.00 58.87 55.38 2eh0 n SER 6 Cb 0.58 -0.78 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 2eh0 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eh0 n GLY 7 N -0.82 -0.86 3.47 5.00 0.00 -1.26 -4.95 105.19 105.76 2eh0 n GLY 7 Ca 0.48 0.90 -0.33 0.00 0.00 0.00 0.00 46.02 47.08 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 0.00 3.04 0.15 2.61 2.01 -1.26 -4.66 115.64 117.53 2eh0 s THR 8 Ca 0.00 -0.73 -0.31 0.00 0.31 0.00 0.00 61.69 60.97 2eh0 s THR 8 Cb 0.00 -2.19 -0.08 0.00 0.01 0.00 0.00 72.50 70.23 2eh0 s THR 8 CO 0.00 0.59 1.34 -2.16 -0.69 0.00 0.00 174.62 173.69 2eh0 s PRO 9 N -0.65 4.36 0.04 4.92 0.04 -1.26 -4.86 135.00 137.59 2eh0 s PRO 9 Ca 0.10 2.04 -0.12 0.00 0.04 0.00 0.00 61.00 63.06 2eh0 s PRO 9 Cb -0.11 -3.23 0.01 0.00 0.04 0.00 0.00 34.50 31.21 2eh0 s PRO 9 CO 0.01 -0.34 0.25 -3.38 0.04 0.00 0.00 177.00 173.58 2eh0 s HIS 10 N 0.65 -0.03 -0.32 0.56 -3.43 -1.25 -0.61 115.29 110.85 2eh0 s HIS 10 Ca 0.60 -0.13 -0.13 0.00 -0.80 0.00 0.00 55.06 54.61 2eh0 s HIS 10 Cb -0.36 0.03 -0.03 0.00 -1.43 0.00 0.00 32.58 30.80 2eh0 s HIS 10 CO 0.34 -0.46 0.25 -0.51 -2.00 0.00 0.00 174.74 172.36 2eh0 s LEU 11 N -2.00 4.33 -0.13 5.38 1.43 0.10 -3.02 118.68 124.77 2eh0 s LEU 11 Ca -0.06 -0.23 -0.12 0.00 -1.03 0.00 0.00 54.13 52.69 2eh0 s LEU 11 Cb -0.01 -2.18 -0.05 0.00 0.03 0.00 0.00 46.19 43.98 2eh0 s LEU 11 CO -0.03 -0.19 0.27 -0.69 0.23 0.00 0.00 176.35 175.94 2eh0 s VAL 12 N 1.80 5.31 -0.09 -1.59 1.01 -0.91 -1.05 120.40 124.87 2eh0 s VAL 12 Ca 0.08 0.50 -0.30 0.00 0.00 0.00 0.00 61.98 62.26 2eh0 s VAL 12 Cb -0.17 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.61 2eh0 s VAL 12 CO 0.11 0.46 1.05 0.54 0.00 0.00 0.00 175.10 177.26 2eh0 s ASN 13 N -0.04 7.20 -0.02 3.32 6.03 0.13 -0.02 114.94 131.54 2eh0 s ASN 13 Ca 0.17 1.60 0.04 0.00 -1.03 0.00 0.00 52.86 53.63 2eh0 s ASN 13 Cb -0.13 -2.56 0.06 0.00 -3.03 0.00 0.00 41.25 35.59 2eh0 s ASN 13 CO 0.05 -0.47 0.92 0.00 -2.03 0.00 0.00 177.10 175.57 2eh0 n LEU 14 N 5.02 1.49 0.00 3.54 -0.00 -1.25 -4.96 117.00 120.84 2eh0 n LEU 14 Ca 0.09 -1.71 -0.17 0.00 -0.00 0.00 0.00 56.01 54.22 2eh0 n LEU 14 Cb 0.48 -0.08 0.16 0.00 -0.00 0.00 0.00 43.42 43.98 2eh0 n LEU 14 CO 0.53 0.42 0.19 -0.46 -0.00 0.00 0.00 177.39 178.06 2eh0 n ASN 15 N -0.54 -3.17 -1.27 1.45 0.23 -1.26 -4.90 115.26 105.81 2eh0 n ASN 15 Ca 0.03 -0.48 0.11 0.00 -0.53 0.00 0.00 54.58 53.71 2eh0 n ASN 15 Cb 0.41 -0.75 0.30 0.00 -2.08 0.00 0.00 39.78 37.67 2eh0 n ASN 15 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 2eh0 n GLU 16 N -2.05 2.74 -3.55 -3.83 0.28 -1.26 -4.72 120.64 108.25 2eh0 n GLU 16 Ca 0.08 -2.59 -0.39 0.00 -0.16 0.00 0.00 57.16 54.10 2eh0 n GLU 16 Cb 0.33 -1.54 -0.05 0.00 1.43 0.00 0.00 31.44 31.62 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 -1.02 6.35 0.00 -1.84 1.11 -1.26 -4.87 116.67 115.15 2eh0 s ASP 17 Ca 0.46 -3.60 0.15 0.00 0.18 0.00 0.00 52.55 49.74 2eh0 s ASP 17 Cb 0.24 -2.00 0.77 0.00 1.07 0.00 0.00 42.92 43.00 2eh0 s ASP 17 CO 0.31 -0.24 1.40 -0.81 1.18 0.00 0.00 175.17 177.02 2eh0 n PRO 18 N 2.56 0.25 0.03 8.23 -0.04 -1.26 -2.01 135.00 142.75 2eh0 n PRO 18 Ca 0.21 0.13 0.11 0.00 -0.04 0.00 0.00 63.50 63.91 2eh0 n PRO 18 Cb 0.38 -1.50 -0.07 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 -1.25 0.46 -3.33 1.53 4.77 -1.26 -4.98 117.00 112.95 2eh0 n LEU 19 Ca 0.08 0.04 -0.46 0.00 -0.03 0.00 0.00 56.01 55.64 2eh0 n LEU 19 Cb 0.11 -0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.09 2eh0 n LEU 19 CO 0.11 -0.02 0.64 1.15 -1.33 0.00 0.00 177.39 177.95 2eh0 n MET 20 N -2.22 0.00 -0.40 3.23 0.00 -0.85 -4.76 117.12 112.12 2eh0 n MET 20 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 57.70 57.65 2eh0 n MET 20 Cb 0.51 -1.08 0.10 0.00 0.00 0.00 0.00 33.22 32.75 2eh0 n MET 20 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 2eh0 n SER 21 N 2.09 3.06 -4.69 3.17 7.64 -1.26 -4.87 113.62 118.77 2eh0 n SER 21 Ca 0.19 -2.49 -0.27 0.00 1.01 0.00 0.00 58.87 57.31 2eh0 n SER 21 Cb 0.00 -0.60 -0.09 0.00 -1.01 0.00 0.00 64.21 62.51 2eh0 n SER 21 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2eh0 s GLU 22 N -1.36 2.09 0.87 1.43 4.04 -1.26 -5.11 118.70 119.41 2eh0 s GLU 22 Ca 0.20 -2.02 -0.15 0.00 0.04 0.00 0.00 54.97 53.04 2eh0 s GLU 22 Cb 0.16 -1.78 -0.03 0.00 0.02 0.00 0.00 34.13 32.50 2eh0 s GLU 22 CO 0.05 -0.12 0.19 0.00 -1.84 0.00 0.00 175.26 173.53 2eh0 n LEU 24 N 0.10 0.05 -3.55 0.00 7.99 -1.26 -4.95 117.00 115.38 2eh0 n LEU 24 Ca 0.06 -0.03 -0.13 0.00 -0.01 0.00 0.00 56.01 55.90 2eh0 n LEU 24 Cb 0.53 0.00 -0.04 0.00 -0.11 0.00 0.00 43.42 43.79 2eh0 n LEU 24 CO 0.51 0.01 0.28 -1.48 -1.51 0.00 0.00 177.39 175.20 2eh0 s LEU 25 N -4.09 -0.08 -0.01 2.23 0.05 -1.26 0.22 118.68 115.74 2eh0 s LEU 25 Ca -0.05 0.00 0.02 0.00 0.05 0.00 0.00 54.13 54.15 2eh0 s LEU 25 Cb 0.11 2.18 0.00 0.00 -2.05 0.00 0.00 46.19 46.43 2eh0 s LEU 25 CO 0.70 -0.82 -0.06 -0.31 -0.55 0.00 0.00 176.35 175.32 2eh0 s TYR 26 N -3.13 0.58 0.16 3.48 2.02 -0.22 -4.96 117.35 115.28 2eh0 s TYR 26 Ca -0.02 -0.11 -0.17 0.00 -0.37 0.00 0.00 57.07 56.40 2eh0 s TYR 26 Cb -0.00 -0.40 -0.07 0.00 -0.40 0.00 0.00 41.96 41.08 2eh0 s TYR 26 CO -0.07 -0.04 0.61 0.71 -1.57 0.00 0.00 175.55 175.19 2eh0 s TYR 27 N 0.04 3.64 -0.30 2.71 2.02 -1.26 0.01 117.35 124.22 2eh0 s TYR 27 Ca -0.00 1.19 -0.01 0.00 -0.37 0.00 0.00 57.07 57.87 2eh0 s TYR 27 Cb -0.05 -2.46 0.05 0.00 -0.40 0.00 0.00 41.96 39.10 2eh0 s TYR 27 CO -0.00 0.42 -0.01 0.42 -1.57 0.00 0.00 175.55 174.80 2eh0 s ILE 28 N -1.44 2.93 0.49 2.71 1.01 0.22 -4.94 121.20 122.18 2eh0 s ILE 28 Ca 0.38 -1.39 -0.07 0.00 0.00 0.00 0.00 60.65 59.57 2eh0 s ILE 28 Cb -0.16 -2.68 0.11 0.00 0.01 0.00 0.00 42.46 39.74 2eh0 s ILE 28 CO 0.20 -0.09 0.26 2.29 0.00 0.00 0.00 174.94 177.59 2eh0 n LYS 29 N 4.61 -1.81 -3.42 2.79 0.00 -1.26 -4.41 118.16 114.66 2eh0 n LYS 29 Ca -0.13 -0.43 -0.41 0.00 -0.00 0.00 0.00 58.31 57.33 2eh0 n LYS 29 Cb 0.43 -0.67 -0.02 0.00 -0.00 0.00 0.00 35.03 34.77 2eh0 n LYS 29 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2eh0 n ASP 30 N -2.74 5.10 0.00 -5.58 9.92 -1.26 -4.75 116.55 117.24 2eh0 n ASP 30 Ca 0.04 -3.12 0.00 0.00 -0.53 0.00 0.00 54.79 51.18 2eh0 n ASP 30 Cb 0.18 -1.24 0.00 0.00 -0.64 0.00 0.00 41.12 39.42 2eh0 n ASP 30 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2eh0 n GLY 31 N 2.37 -1.14 2.99 0.44 0.00 -1.13 -4.95 105.19 103.77 2eh0 n GLY 31 Ca 0.24 0.68 -0.26 0.00 0.00 0.00 0.00 46.02 46.67 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 0.00 1.15 -0.30 -0.61 -1.09 -1.26 -0.49 121.20 118.60 2eh0 s ILE 32 Ca 0.00 -0.44 0.03 0.00 -2.23 0.00 0.00 60.65 58.01 2eh0 s ILE 32 Cb 0.00 -1.08 0.08 0.00 -1.58 0.00 0.00 42.46 39.88 2eh0 s ILE 32 CO 0.00 0.37 -0.01 -0.89 -1.23 0.00 0.00 174.94 173.18 2eh0 s THR 33 N 1.05 2.07 -0.02 2.92 2.01 0.12 -4.98 115.64 118.81 2eh0 s THR 33 Ca -0.07 -1.93 -0.30 0.00 0.31 0.00 0.00 61.69 59.70 2eh0 s THR 33 Cb -0.15 -2.39 -0.03 0.00 0.01 0.00 0.00 72.50 69.94 2eh0 s THR 33 CO -0.01 -0.36 1.05 -0.13 -0.69 0.00 0.00 174.62 174.47 2eh0 s ARG 34 N 1.07 4.48 -0.43 4.92 0.52 -1.26 0.29 118.95 128.54 2eh0 s ARG 34 Ca 0.02 1.50 -0.10 0.00 -0.52 0.00 0.00 55.73 56.63 2eh0 s ARG 34 Cb -0.19 -3.47 0.08 0.00 0.52 0.00 0.00 34.95 31.89 2eh0 s ARG 34 CO -0.08 -0.19 0.29 0.08 0.02 0.00 0.00 175.30 175.42 2eh0 s VAL 35 N 1.38 4.43 0.00 3.52 1.01 0.59 -2.31 120.40 129.02 2eh0 s VAL 35 Ca 0.53 -1.33 0.00 0.00 0.00 0.00 0.00 61.98 61.18 2eh0 s VAL 35 Cb -0.22 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.46 2eh0 s VAL 35 CO 0.25 -0.52 0.00 0.61 0.00 0.00 0.00 175.10 175.44 2eh0 n GLY 36 N 4.97 3.05 3.91 4.51 0.00 -1.13 -1.99 105.19 118.52 2eh0 n GLY 36 Ca -0.10 -0.39 -0.27 0.00 0.00 0.00 0.00 46.02 45.26 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 2.37 3.21 0.09 1.61 -1.52 -1.21 -3.26 119.66 120.94 2eh0 s GLN 37 Ca 0.00 0.05 -0.09 0.00 -1.95 0.00 0.00 55.36 53.38 2eh0 s GLN 37 Cb 0.00 -2.34 -0.22 0.00 -0.22 0.00 0.00 33.01 30.23 2eh0 s GLN 37 CO 0.00 -0.45 1.18 0.00 -0.25 0.00 0.00 175.29 175.77 2eh0 h ALA 38 N 0.04 0.15 0.00 6.09 0.00 -1.92 -3.18 119.26 120.44 2eh0 h ALA 38 Ca -0.46 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 53.67 2eh0 h ALA 38 Cb 1.23 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2eh0 h ALA 38 CO 0.61 0.80 0.00 -0.25 0.00 0.00 0.00 179.25 180.41 2eh0 n ASP 39 N -3.71 0.69 -4.38 0.00 8.00 -1.26 -4.58 116.55 111.31 2eh0 n ASP 39 Ca -0.10 0.62 -0.46 0.00 0.71 0.00 0.00 54.79 55.55 2eh0 n ASP 39 Cb 0.94 -0.78 -0.02 0.00 -0.02 0.00 0.00 41.12 41.24 2eh0 n ASP 39 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2eh0 n ALA 40 N -1.76 -2.83 -0.36 2.24 0.00 -1.20 -4.78 120.51 111.81 2eh0 n ALA 40 Ca 0.04 0.36 -0.06 0.00 0.00 0.00 0.00 53.44 53.77 2eh0 n ALA 40 Cb 0.32 -1.59 -0.04 0.00 0.00 0.00 0.00 19.45 18.15 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 1.07 -0.31 -3.37 0.00 -0.58 -1.26 -3.69 120.64 112.49 2eh0 n GLU 41 Ca 0.16 1.35 -0.42 0.00 -0.42 0.00 0.00 57.16 57.83 2eh0 n GLU 41 Cb 0.29 -2.00 -0.09 0.00 -0.57 0.00 0.00 31.44 29.07 2eh0 n GLU 41 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 2eh0 s ARG 42 N -5.62 3.18 0.03 3.49 6.06 -1.26 -5.02 118.95 119.82 2eh0 s ARG 42 Ca -0.11 -0.73 -0.27 0.00 -2.50 0.00 0.00 55.73 52.11 2eh0 s ARG 42 Cb 0.13 -3.93 -0.14 0.00 0.06 0.00 0.00 34.95 31.07 2eh0 s ARG 42 CO 0.59 -0.75 0.70 -2.13 -2.50 0.00 0.00 175.30 171.21 2eh0 n ARG 43 N 5.45 0.00 -3.88 5.12 3.00 -1.24 -4.94 116.66 120.17 2eh0 n ARG 43 Ca -0.09 0.00 -0.21 0.00 -0.00 0.00 0.00 57.85 57.55 2eh0 n ARG 43 Cb 0.48 -1.02 -0.04 0.00 0.00 0.00 0.00 32.46 31.88 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 -0.15 2.71 -0.07 -0.14 -1.52 -1.26 -4.95 119.66 114.28 2eh0 s GLN 44 Ca 0.62 -1.29 -0.03 0.00 -1.95 0.00 0.00 55.36 52.71 2eh0 s GLN 44 Cb -0.87 -2.45 -0.01 0.00 -0.22 0.00 0.00 33.01 29.45 2eh0 s GLN 44 CO 0.41 0.13 -0.05 0.22 -0.25 0.00 0.00 175.29 175.76 2eh0 h ASP 45 N 1.31 0.00 -3.70 5.90 3.58 -1.82 -3.46 116.42 118.23 2eh0 h ASP 45 Ca -0.45 0.00 -0.65 0.00 0.42 0.00 0.00 57.03 56.35 2eh0 h ASP 45 Cb 1.25 0.00 -0.16 0.00 1.72 0.00 0.00 39.33 42.14 2eh0 h ASP 45 CO 0.59 0.36 -0.29 -0.63 -2.88 0.00 0.00 179.24 176.40 2eh0 s ILE 46 N -1.52 5.18 -0.39 2.25 1.01 -1.24 -5.05 121.20 121.45 2eh0 s ILE 46 Ca -0.04 0.23 -0.14 0.00 0.00 0.00 0.00 60.65 60.69 2eh0 s ILE 46 Cb 0.01 -3.76 0.01 0.00 0.01 0.00 0.00 42.46 38.72 2eh0 s ILE 46 CO 0.06 0.01 0.29 -0.69 0.00 0.00 0.00 174.94 174.61 2eh0 s VAL 47 N 2.02 5.26 0.60 2.92 1.01 -1.26 -2.84 120.40 128.13 2eh0 s VAL 47 Ca 0.13 -0.52 -0.14 0.00 0.00 0.00 0.00 61.98 61.44 2eh0 s VAL 47 Cb -0.16 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 2eh0 s VAL 47 CO 0.11 -0.22 1.04 -0.76 0.00 0.00 0.00 175.10 175.27 2eh0 s LEU 48 N 1.70 3.43 1.00 3.92 2.01 -1.20 -4.99 118.68 124.54 2eh0 s LEU 48 Ca 0.05 1.69 -0.18 0.00 0.01 0.00 0.00 54.13 55.71 2eh0 s LEU 48 Cb -0.18 -4.52 -0.10 0.00 0.01 0.00 0.00 46.19 41.40 2eh0 s LEU 48 CO 0.10 -1.08 -0.60 -0.24 1.01 0.00 0.00 176.35 175.54 2eh0 n SER 49 N -2.22 -4.36 0.00 2.29 2.88 -1.26 -4.73 113.62 106.21 2eh0 n SER 49 Ca 0.08 0.16 0.05 0.00 -1.33 0.00 0.00 58.87 57.83 2eh0 n SER 49 Cb 0.53 -0.83 0.27 0.00 -0.75 0.00 0.00 64.21 63.44 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 2.94 -0.45 1.90 0.46 0.00 -1.26 -4.72 105.19 104.05 2eh0 n GLY 50 Ca 0.00 -0.06 -0.18 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.14 -3.10 -1.52 4.61 0.00 -1.26 -4.63 120.51 113.47 2eh0 n ALA 51 Ca 0.06 -0.92 -0.25 0.00 0.00 0.00 0.00 53.44 52.33 2eh0 n ALA 51 Cb 0.06 -0.08 -0.14 0.00 0.00 0.00 0.00 19.45 19.28 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 -4.67 0.63 -3.99 0.00 8.25 -1.26 -4.84 115.22 109.34 2eh0 n HIS 52 Ca 0.08 0.08 -0.09 0.00 -0.26 0.00 0.00 57.72 57.54 2eh0 n HIS 52 Cb 0.36 -1.75 -0.10 0.00 1.12 0.00 0.00 29.99 29.62 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 7.62 0.14 0.12 1.59 -1.09 -1.26 -4.28 121.20 124.05 2eh0 s ILE 53 Ca 1.17 -1.19 0.07 0.00 -2.23 0.00 0.00 60.65 58.47 2eh0 s ILE 53 Cb -0.62 -0.77 -0.04 0.00 -1.58 0.00 0.00 42.46 39.45 2eh0 s ILE 53 CO 0.37 -0.65 -0.07 -0.54 -1.23 0.00 0.00 174.94 172.81 2eh0 s LYS 54 N -2.41 2.21 0.53 2.79 -0.14 -1.26 -4.99 119.74 116.46 2eh0 s LYS 54 Ca -0.07 -1.03 0.22 0.00 -1.36 0.00 0.00 55.97 53.73 2eh0 s LYS 54 Cb -0.03 -2.33 1.35 0.00 -1.68 0.00 0.00 37.83 35.14 2eh0 s LYS 54 CO -0.04 0.50 2.05 0.93 -0.76 0.00 0.00 175.35 178.03 2eh0 h GLU 55 N 3.41 0.00 -0.70 1.68 3.07 -1.92 -2.47 114.58 117.64 2eh0 h GLU 55 Ca -0.48 -0.00 -0.41 0.00 -0.50 0.00 0.00 59.36 57.96 2eh0 h GLU 55 Cb 1.17 -0.00 -0.41 0.00 -0.84 0.00 0.00 28.75 28.67 2eh0 h GLU 55 CO 0.54 0.00 -0.96 0.39 -1.40 0.00 0.00 179.01 177.58 2eh0 n GLU 56 N -4.44 2.66 0.00 2.33 1.02 -1.26 -3.32 120.64 117.63 2eh0 n GLU 56 Ca 0.05 -3.86 0.00 0.00 -0.02 0.00 0.00 57.16 53.33 2eh0 n GLU 56 Cb 0.42 -1.93 0.00 0.00 -0.02 0.00 0.00 31.44 29.91 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 -0.60 0.00 -3.90 -0.32 -0.00 -0.93 -4.64 115.22 104.83 2eh0 n HIS 57 Ca 0.26 0.00 -0.08 0.00 0.46 0.00 0.00 57.72 58.36 2eh0 n HIS 57 Cb 0.86 -0.39 -0.02 0.00 -0.12 0.00 0.00 29.99 30.32 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 -2.65 0.18 -0.18 0.00 1.01 -0.97 -0.30 121.20 118.29 2eh0 s ILE 59 Ca 0.17 -1.44 -0.02 0.00 0.00 0.00 0.00 60.65 59.36 2eh0 s ILE 59 Cb -0.00 -1.40 0.05 0.00 0.01 0.00 0.00 42.46 41.12 2eh0 s ILE 59 CO 0.12 -0.80 0.00 -0.36 0.00 0.00 0.00 174.94 173.90 2eh0 s PHE 60 N -3.84 1.29 -0.20 3.97 0.08 0.15 -1.68 117.98 117.74 2eh0 s PHE 60 Ca 0.05 -0.92 -0.09 0.00 0.12 0.00 0.00 56.93 56.10 2eh0 s PHE 60 Cb 0.06 -1.12 -0.05 0.00 -0.57 0.00 0.00 43.02 41.34 2eh0 s PHE 60 CO -0.10 -0.59 0.11 0.50 -0.10 0.00 0.00 175.22 175.04 2eh0 s ARG 61 N 1.77 4.08 -0.41 0.44 3.52 -0.86 0.12 118.95 127.61 2eh0 s ARG 61 Ca -0.00 -0.28 0.02 0.00 -0.13 0.00 0.00 55.73 55.34 2eh0 s ARG 61 Cb -0.16 -3.37 0.11 0.00 -1.56 0.00 0.00 34.95 29.97 2eh0 s ARG 61 CO -0.07 0.23 0.16 -1.54 -0.81 0.00 0.00 175.30 173.26 2eh0 s SER 62 N 0.53 4.87 0.00 -2.12 1.04 0.36 -1.84 113.70 116.55 2eh0 s SER 62 Ca 0.06 -2.31 0.06 0.00 0.48 0.00 0.00 55.95 54.23 2eh0 s SER 62 Cb -0.12 -1.70 -0.02 0.00 0.10 0.00 0.00 66.02 64.28 2eh0 s SER 62 CO 0.00 -0.40 -0.17 -0.70 0.98 0.00 0.00 173.24 172.95 2eh0 s GLU 63 N 0.70 1.32 -0.39 4.02 -6.30 -0.81 -2.84 118.70 114.41 2eh0 s GLU 63 Ca 0.12 -0.68 -0.29 0.00 -2.50 0.00 0.00 54.97 51.62 2eh0 s GLU 63 Cb -0.21 -1.31 0.02 0.00 0.00 0.00 0.00 34.13 32.63 2eh0 s GLU 63 CO -0.05 0.35 1.09 0.50 0.02 0.00 0.00 175.26 177.16 2eh0 s ARG 64 N -0.63 3.91 1.06 4.30 3.52 -1.26 -1.20 118.95 128.65 2eh0 s ARG 64 Ca 0.06 0.82 -0.17 0.00 -0.13 0.00 0.00 55.73 56.32 2eh0 s ARG 64 Cb -0.07 -3.81 0.07 0.00 -1.56 0.00 0.00 34.95 29.57 2eh0 s ARG 64 CO 0.00 -1.10 0.07 0.45 -0.81 0.00 0.00 175.30 173.91 2eh0 n SER 65 N 7.25 -2.39 0.29 -2.12 2.88 0.23 -4.69 113.62 115.07 2eh0 n SER 65 Ca 0.12 0.04 0.18 0.00 -1.33 0.00 0.00 58.87 57.88 2eh0 n SER 65 Cb 0.48 -1.02 0.98 0.00 -0.75 0.00 0.00 64.21 63.90 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 -1.84 0.00 1.41 -3.46 7.08 -1.95 0.11 115.58 116.93 2eh0 h ASN 66 Ca -0.50 0.00 -0.12 0.00 -3.08 0.00 0.00 56.30 52.61 2eh0 h ASN 66 Cb 1.33 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 37.56 2eh0 h ASN 66 CO 0.36 0.00 -0.60 0.28 -2.08 0.00 0.00 177.43 175.39 2eh0 h SER 67 N 0.00 0.00 0.00 6.14 0.02 -2.02 -3.47 113.55 114.22 2eh0 h SER 67 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2eh0 h SER 67 Cb 0.11 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.65 2eh0 h SER 67 CO 0.00 0.55 0.00 0.61 -1.14 0.00 0.00 176.83 176.85 2eh0 n GLY 68 N 1.25 1.42 3.43 -3.77 0.00 0.38 -5.11 105.19 102.79 2eh0 n GLY 68 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.04 3.57 -0.62 1.61 -1.05 -1.25 -4.85 118.70 116.07 2eh0 s GLU 69 Ca 0.00 -0.56 -0.26 0.00 -0.15 0.00 0.00 54.97 54.00 2eh0 s GLU 69 Cb 0.00 -2.95 -0.04 0.00 -0.44 0.00 0.00 34.13 30.70 2eh0 s GLU 69 CO 0.00 0.09 2.02 0.08 0.95 0.00 0.00 175.26 178.40 2eh0 s VAL 70 N 0.76 3.27 0.18 1.83 1.01 -1.26 -0.60 120.40 125.58 2eh0 s VAL 70 Ca -0.02 0.09 -0.03 0.00 0.00 0.00 0.00 61.98 62.03 2eh0 s VAL 70 Cb -0.15 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.49 2eh0 s VAL 70 CO 0.02 -0.67 0.39 -0.63 0.00 0.00 0.00 175.10 174.21 2eh0 s ILE 71 N 10.13 5.17 -0.06 2.22 -1.09 -0.34 -4.75 121.20 132.48 2eh0 s ILE 71 Ca 0.76 -0.13 0.03 0.00 -2.23 0.00 0.00 60.65 59.08 2eh0 s ILE 71 Cb -0.13 -3.68 0.00 0.00 -1.58 0.00 0.00 42.46 37.08 2eh0 s ILE 71 CO 0.19 -0.08 -0.17 -0.69 -1.23 0.00 0.00 174.94 172.97 2eh0 s VAL 72 N -1.78 1.45 -0.03 2.92 1.01 -1.26 -1.93 120.40 120.79 2eh0 s VAL 72 Ca 0.40 -0.69 0.06 0.00 0.00 0.00 0.00 61.98 61.76 2eh0 s VAL 72 Cb -0.12 -1.27 -0.01 0.00 0.00 0.00 0.00 36.38 34.98 2eh0 s VAL 72 CO 0.27 0.42 -0.22 -0.89 0.00 0.00 0.00 175.10 174.68 2eh0 s THR 73 N 0.36 1.76 -0.20 3.92 2.01 -0.77 -1.75 115.64 120.97 2eh0 s THR 73 Ca -0.12 -0.94 -0.14 0.00 0.31 0.00 0.00 61.69 60.80 2eh0 s THR 73 Cb -0.15 -1.48 -0.04 0.00 0.01 0.00 0.00 72.50 70.84 2eh0 s THR 73 CO 0.04 0.50 0.32 -0.22 -0.69 0.00 0.00 174.62 174.57 2eh0 s LEU 74 N -0.38 4.17 -0.81 4.42 2.96 0.05 -2.02 118.68 127.06 2eh0 s LEU 74 Ca 0.05 0.43 0.01 0.00 -0.22 0.00 0.00 54.13 54.39 2eh0 s LEU 74 Cb -0.10 -2.39 0.20 0.00 0.50 0.00 0.00 46.19 44.40 2eh0 s LEU 74 CO 0.00 -0.01 0.65 -1.61 -1.32 0.00 0.00 176.35 174.07 2eh0 s GLU 75 N 1.06 2.93 1.07 1.98 8.01 -0.67 -3.13 118.70 129.94 2eh0 s GLU 75 Ca 0.16 -3.28 -0.14 0.00 0.01 0.00 0.00 54.97 51.72 2eh0 s GLU 75 Cb -0.14 -3.74 0.22 0.00 -4.31 0.00 0.00 34.13 26.16 2eh0 s GLU 75 CO 0.06 -1.27 1.10 -1.25 0.01 0.00 0.00 175.26 173.91 2eh0 s PRO 76 N -1.34 -0.12 0.50 0.39 0.04 -1.26 -2.28 135.00 130.93 2eh0 s PRO 76 Ca 0.26 0.34 0.01 0.00 0.04 0.00 0.00 61.00 61.65 2eh0 s PRO 76 Cb -0.07 -1.69 0.01 0.00 0.04 0.00 0.00 34.50 32.80 2eh0 s PRO 76 CO -0.14 -3.06 0.12 0.00 0.04 0.00 0.00 177.00 173.96 2eh0 h GLU 78 N 0.00 0.23 -0.69 0.00 4.57 -1.94 -3.32 114.58 113.43 2eh0 h GLU 78 Ca -0.39 -0.39 0.00 0.00 -1.18 0.00 0.00 59.36 57.40 2eh0 h GLU 78 Cb 1.23 0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.97 2eh0 h GLU 78 CO 0.63 1.07 0.00 0.54 -1.18 0.00 0.00 179.01 180.07 2eh0 n ARG 79 N -3.41 3.07 -5.02 1.92 5.12 -1.26 -4.87 116.66 112.21 2eh0 n ARG 79 Ca -0.22 -1.83 -0.31 0.00 -1.93 0.00 0.00 57.85 53.57 2eh0 n ARG 79 Cb 1.05 -1.83 -0.15 0.00 -1.16 0.00 0.00 32.46 30.37 2eh0 n ARG 79 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2eh0 s SER 80 N -0.58 3.20 -0.58 0.55 1.04 -1.25 -4.89 113.70 111.19 2eh0 s SER 80 Ca 0.32 -0.53 -0.14 0.00 0.48 0.00 0.00 55.95 56.08 2eh0 s SER 80 Cb 0.23 -0.34 0.14 0.00 0.10 0.00 0.00 66.02 66.15 2eh0 s SER 80 CO 0.12 0.28 0.51 -1.61 0.98 0.00 0.00 173.24 173.52 2eh0 s GLU 81 N -1.04 2.97 0.02 4.02 8.01 -1.26 -4.71 118.70 126.70 2eh0 s GLU 81 Ca 0.11 -1.88 0.08 0.00 0.01 0.00 0.00 54.97 53.30 2eh0 s GLU 81 Cb -0.10 -4.23 -0.02 0.00 -4.31 0.00 0.00 34.13 25.47 2eh0 s GLU 81 CO 0.01 -1.29 -0.25 0.99 0.01 0.00 0.00 175.26 174.74 2eh0 s THR 82 N 1.25 1.97 -0.16 3.63 2.01 -1.26 -2.91 115.64 120.17 2eh0 s THR 82 Ca 0.07 -1.20 -0.04 0.00 0.31 0.00 0.00 61.69 60.83 2eh0 s THR 82 Cb -0.25 -1.66 0.05 0.00 0.01 0.00 0.00 72.50 70.65 2eh0 s THR 82 CO -0.00 0.43 0.06 -0.31 -0.69 0.00 0.00 174.62 174.11 2eh0 s TYR 83 N -0.69 0.52 -0.13 4.92 2.02 -0.82 -2.47 117.35 120.69 2eh0 s TYR 83 Ca 0.10 -0.45 -0.04 0.00 -0.37 0.00 0.00 57.07 56.31 2eh0 s TYR 83 Cb -0.10 -0.80 -0.03 0.00 -0.40 0.00 0.00 41.96 40.63 2eh0 s TYR 83 CO 0.01 -0.50 0.02 0.08 -1.57 0.00 0.00 175.55 173.58 2eh0 s VAL 84 N 2.03 4.40 -1.97 0.71 1.01 0.52 -1.08 120.40 126.02 2eh0 s VAL 84 Ca 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.80 2eh0 s VAL 84 Cb -0.16 -2.91 0.00 0.00 0.00 0.00 0.00 36.38 33.31 2eh0 s VAL 84 CO -0.08 0.54 0.00 0.59 0.00 0.00 0.00 175.10 176.15 2eh0 n ASN 85 N 2.89 -5.34 0.00 3.32 5.03 -0.33 -0.84 115.26 120.00 2eh0 n ASN 85 Ca -0.18 0.40 0.00 0.00 0.87 0.00 0.00 54.58 55.67 2eh0 n ASN 85 Cb 0.53 -4.51 0.00 0.00 -1.02 0.00 0.00 39.78 34.78 2eh0 n ASN 85 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2eh0 n GLY 86 N -0.68 0.76 3.35 7.41 0.00 -1.25 -4.94 105.19 109.82 2eh0 n GLY 86 Ca -0.20 0.00 -0.21 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 -0.43 1.32 0.13 1.61 -2.85 -0.02 -5.07 119.74 114.44 2eh0 s LYS 87 Ca 0.00 -1.48 -0.30 0.00 -1.00 0.00 0.00 55.97 53.18 2eh0 s LYS 87 Cb 0.00 -1.30 -0.07 0.00 -2.06 0.00 0.00 37.83 34.40 2eh0 s LYS 87 CO 0.00 0.25 1.20 0.50 0.10 0.00 0.00 175.35 177.40 2eh0 s ARG 88 N -3.09 4.47 -0.29 1.78 3.52 -1.26 0.19 118.95 124.28 2eh0 s ARG 88 Ca 0.19 1.83 -0.05 0.00 -0.13 0.00 0.00 55.73 57.56 2eh0 s ARG 88 Cb -0.04 -3.29 0.02 0.00 -1.56 0.00 0.00 34.95 30.08 2eh0 s ARG 88 CO 0.07 -0.15 0.05 0.54 -0.81 0.00 0.00 175.30 175.00 2eh0 s VAL 89 N 0.41 3.68 -0.13 7.11 0.11 -1.03 -4.81 120.40 125.74 2eh0 s VAL 89 Ca 0.55 -0.83 0.16 0.00 -2.93 0.00 0.00 61.98 58.93 2eh0 s VAL 89 Cb -0.31 -2.92 0.29 0.00 -1.53 0.00 0.00 36.38 31.91 2eh0 s VAL 89 CO 0.33 0.07 1.15 -1.20 -3.33 0.00 0.00 175.10 172.12 2eh0 n SER 90 N 4.81 2.01 -3.79 3.54 7.64 -1.26 -4.70 113.62 121.87 2eh0 n SER 90 Ca -0.15 -3.12 -0.11 0.00 1.01 0.00 0.00 58.87 56.51 2eh0 n SER 90 Cb 0.47 -0.42 -0.08 0.00 -1.01 0.00 0.00 64.21 63.17 2eh0 n SER 90 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2eh0 s GLN 91 N -2.64 0.74 -0.75 1.43 -2.07 -1.26 -4.97 119.66 110.14 2eh0 s GLN 91 Ca 0.30 -0.52 -0.26 0.00 -1.82 0.00 0.00 55.36 53.07 2eh0 s GLN 91 Cb 0.27 0.31 -0.03 0.00 -1.09 0.00 0.00 33.01 32.47 2eh0 s GLN 91 CO 0.01 -0.22 1.90 -1.25 -1.32 0.00 0.00 175.29 174.41 2eh0 s PRO 92 N -2.38 2.59 0.26 9.60 0.04 -1.25 -4.70 135.00 139.16 2eh0 s PRO 92 Ca -0.06 0.18 0.10 0.00 0.04 0.00 0.00 61.00 61.26 2eh0 s PRO 92 Cb -0.02 -4.71 -0.05 0.00 0.04 0.00 0.00 34.50 29.77 2eh0 s PRO 92 CO -0.03 -3.04 -0.08 0.14 0.04 0.00 0.00 177.00 174.03 2eh0 s VAL 93 N 9.57 3.07 -0.67 -0.36 -7.23 -1.18 -4.90 120.40 118.69 2eh0 s VAL 93 Ca 0.69 -2.08 -0.23 0.00 -1.81 0.00 0.00 61.98 58.55 2eh0 s VAL 93 Cb -0.10 -2.62 0.07 0.00 0.56 0.00 0.00 36.38 34.29 2eh0 s VAL 93 CO 0.10 -0.36 0.98 -1.10 -0.31 0.00 0.00 175.10 174.41 2eh0 s GLN 94 N -3.54 3.12 0.41 4.82 -0.21 -1.26 -0.77 119.66 122.23 2eh0 s GLN 94 Ca 0.30 -0.83 -0.18 0.00 0.02 0.00 0.00 55.36 54.67 2eh0 s GLN 94 Cb -0.06 -4.25 -0.14 0.00 1.00 0.00 0.00 33.01 29.56 2eh0 s GLN 94 CO 0.18 -1.83 -0.01 1.28 -2.12 0.00 0.00 175.29 172.78 2eh0 n LEU 95 N 7.75 -2.99 -4.41 2.90 7.99 -0.72 -4.92 117.00 122.60 2eh0 n LEU 95 Ca -0.03 0.67 -0.36 0.00 -0.01 0.00 0.00 56.01 56.29 2eh0 n LEU 95 Cb 0.46 -0.79 -0.13 0.00 -0.11 0.00 0.00 43.42 42.84 2eh0 n LEU 95 CO 0.64 -4.11 -0.32 -0.60 -1.51 0.00 0.00 177.39 171.49 2eh0 s ARG 96 N -0.92 3.57 -0.41 3.23 3.00 -1.26 -4.84 118.95 121.32 2eh0 s ARG 96 Ca 0.53 -0.53 -0.37 0.00 -1.00 0.00 0.00 55.73 54.36 2eh0 s ARG 96 Cb -0.52 -3.19 -0.16 0.00 0.00 0.00 0.00 34.95 31.08 2eh0 s ARG 96 CO 0.59 -0.15 1.53 -1.13 0.00 0.00 0.00 175.30 176.14 2eh0 n SER 97 N 4.76 0.80 0.00 -2.12 3.41 -1.26 0.12 113.62 119.32 2eh0 n SER 97 Ca -0.17 0.76 0.00 0.00 -0.26 0.00 0.00 58.87 59.20 2eh0 n SER 97 Cb 0.51 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 2eh0 n SER 97 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eh0 n GLY 98 N 4.72 0.88 3.71 5.00 0.00 -0.46 -5.01 105.19 114.04 2eh0 n GLY 98 Ca 0.35 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.02 7.32 -0.44 1.61 4.22 0.31 -4.83 114.94 121.11 2eh0 s ASN 99 Ca 0.00 1.78 -0.27 0.00 -2.14 0.00 0.00 52.86 52.22 2eh0 s ASN 99 Cb 0.00 -2.58 0.03 0.00 1.28 0.00 0.00 41.25 39.98 2eh0 s ASN 99 CO 0.00 -0.28 1.03 -0.13 -2.04 0.00 0.00 177.10 175.69 2eh0 s ARG 100 N 0.81 3.71 -0.23 3.55 0.52 -1.26 -3.65 118.95 122.40 2eh0 s ARG 100 Ca 0.53 0.48 -0.06 0.00 -0.52 0.00 0.00 55.73 56.15 2eh0 s ARG 100 Cb -0.24 -3.88 -0.02 0.00 0.52 0.00 0.00 34.95 31.33 2eh0 s ARG 100 CO 0.29 -1.23 0.03 0.42 0.02 0.00 0.00 175.30 174.83 2eh0 s ILE 101 N 4.02 4.02 -0.24 1.52 1.01 -1.11 -1.18 121.20 129.23 2eh0 s ILE 101 Ca 0.43 -0.28 -0.06 0.00 0.00 0.00 0.00 60.65 60.74 2eh0 s ILE 101 Cb -0.09 -2.85 -0.01 0.00 0.01 0.00 0.00 42.46 39.51 2eh0 s ILE 101 CO 0.27 0.38 0.02 -0.63 0.00 0.00 0.00 174.94 174.98 2eh0 s ILE 102 N 1.39 3.84 -0.35 2.92 1.01 -0.24 -1.87 121.20 127.90 2eh0 s ILE 102 Ca 0.05 -0.38 0.04 0.00 0.00 0.00 0.00 60.65 60.36 2eh0 s ILE 102 Cb -0.15 -2.80 0.10 0.00 0.01 0.00 0.00 42.46 39.63 2eh0 s ILE 102 CO 0.02 0.35 0.06 -0.04 0.00 0.00 0.00 174.94 175.32 2eh0 s MET 103 N 1.54 1.50 0.00 2.79 -1.94 0.10 -1.95 119.30 121.35 2eh0 s MET 103 Ca 0.06 -1.92 0.00 0.00 -1.71 0.00 0.00 55.69 52.12 2eh0 s MET 103 Cb -0.15 -3.21 0.00 0.00 2.01 0.00 0.00 34.83 33.48 2eh0 s MET 103 CO 0.00 -0.95 0.00 0.41 -0.01 0.00 0.00 175.02 174.47 2eh0 n GLY 104 N 4.19 1.38 0.84 -0.03 0.00 -1.15 -4.32 105.19 106.10 2eh0 n GLY 104 Ca 0.04 -0.99 -0.00 0.00 0.00 0.00 0.00 46.02 45.07 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 0.00 0.03 0.00 1.61 3.00 -1.26 -4.90 118.16 116.63 2eh0 n LYS 105 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.32 2eh0 n LYS 105 Cb 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 35.03 34.77 2eh0 n LYS 105 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2eh0 n ASN 106 N -2.84 1.42 -4.56 3.14 4.13 -1.26 -4.97 115.26 110.32 2eh0 n ASN 106 Ca -0.01 -1.65 -0.32 0.00 1.68 0.00 0.00 54.58 54.29 2eh0 n ASN 106 Cb 0.03 0.00 -0.04 0.00 -1.54 0.00 0.00 39.78 38.22 2eh0 n ASN 106 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 2eh0 s HIS 107 N -0.65 1.95 0.04 3.10 3.76 -1.26 -4.87 115.29 117.36 2eh0 s HIS 107 Ca 0.00 0.33 0.05 0.00 -0.15 0.00 0.00 55.06 55.30 2eh0 s HIS 107 Cb 0.00 -4.21 -0.03 0.00 1.11 0.00 0.00 32.58 29.45 2eh0 s HIS 107 CO 0.00 -1.88 -0.11 0.08 -0.85 0.00 0.00 174.74 171.98 2eh0 s VAL 108 N 8.74 3.30 0.04 -0.90 1.01 -1.26 -0.72 120.40 130.61 2eh0 s VAL 108 Ca 0.63 -1.04 -0.00 0.00 0.00 0.00 0.00 61.98 61.57 2eh0 s VAL 108 Cb -0.06 -2.45 -0.03 0.00 0.00 0.00 0.00 36.38 33.83 2eh0 s VAL 108 CO 0.01 0.30 -0.04 -0.36 0.00 0.00 0.00 175.10 175.02 2eh0 s PHE 109 N -1.03 0.46 -0.20 5.22 0.08 -0.78 -3.88 117.98 117.84 2eh0 s PHE 109 Ca 0.17 -0.81 -0.06 0.00 0.12 0.00 0.00 56.93 56.35 2eh0 s PHE 109 Cb -0.11 -0.33 -0.03 0.00 -0.57 0.00 0.00 43.02 41.98 2eh0 s PHE 109 CO 0.09 -0.27 0.04 0.50 -0.10 0.00 0.00 175.22 175.48 2eh0 s ARG 110 N -2.82 3.78 -0.55 0.44 3.00 0.97 -2.75 118.95 121.01 2eh0 s ARG 110 Ca -0.02 -0.44 -0.28 0.00 -1.00 0.00 0.00 55.73 53.98 2eh0 s ARG 110 Cb -0.00 -3.17 0.03 0.00 0.00 0.00 0.00 34.95 31.80 2eh0 s ARG 110 CO -0.05 0.10 1.21 0.12 0.00 0.00 0.00 175.30 176.67 2eh0 s PHE 111 N 0.82 2.61 -0.40 5.12 5.36 -1.24 -2.14 117.98 128.11 2eh0 s PHE 111 Ca 0.02 0.50 -0.19 0.00 -0.96 0.00 0.00 56.93 56.30 2eh0 s PHE 111 Cb -0.14 -4.48 0.01 0.00 -0.34 0.00 0.00 43.02 38.07 2eh0 s PHE 111 CO 0.02 -1.58 0.56 1.21 -1.46 0.00 0.00 175.22 173.97 2eh0 s ASN 112 N 3.04 6.30 -0.83 6.13 3.84 -1.17 -1.35 114.94 130.91 2eh0 s ASN 112 Ca 0.46 -0.30 0.01 0.00 0.21 0.00 0.00 52.86 53.24 2eh0 s ASN 112 Cb -0.08 -2.28 0.22 0.00 -0.55 0.00 0.00 41.25 38.56 2eh0 s ASN 112 CO 0.27 -0.64 0.77 1.57 -2.79 0.00 0.00 177.10 176.29 2eh0 n HIS 113 N 5.95 3.75 0.18 0.43 -0.00 -1.26 -3.93 115.22 120.34 2eh0 n HIS 113 Ca -0.04 -4.05 0.04 0.00 -0.00 0.00 0.00 57.72 53.67 2eh0 n HIS 113 Cb 0.48 -0.93 0.35 0.00 -0.00 0.00 0.00 29.99 29.89 2eh0 n HIS 113 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 2eh0 h PRO 114 N 5.47 0.00 0.71 1.57 0.13 -1.92 -0.02 132.00 137.94 2eh0 h PRO 114 Ca 0.17 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.27 2eh0 h PRO 114 Cb 0.75 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.89 2eh0 h PRO 114 CO 0.86 0.40 -0.34 0.93 -0.23 0.00 0.00 178.00 179.62 2eh0 h GLU 115 N 0.00 -0.92 -0.38 0.86 4.39 -1.90 -2.85 114.58 113.79 2eh0 h GLU 115 Ca -0.00 0.06 -0.16 0.00 0.34 0.00 0.00 59.36 59.60 2eh0 h GLU 115 Cb 0.79 0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 29.65 2eh0 h GLU 115 CO 0.05 -0.61 -0.40 0.37 -1.16 0.00 0.00 179.01 177.26 2eh0 h GLN 116 N -1.23 0.94 0.00 2.33 4.15 -1.86 -2.82 115.11 116.63 2eh0 h GLN 116 Ca -0.10 -0.50 0.00 0.00 0.77 0.00 0.00 58.65 58.82 2eh0 h GLN 116 Cb 0.73 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.44 2eh0 h GLN 116 CO 0.16 1.16 0.26 0.00 -1.93 0.00 0.00 178.83 178.48 2eh0 h ALA 117 N 0.76 1.25 0.05 3.38 0.00 -1.07 0.13 119.26 123.77 2eh0 h ALA 117 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.71 2eh0 h ALA 117 Cb 1.00 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.80 2eh0 h ALA 117 CO 0.10 -0.25 -1.07 0.07 0.00 0.00 0.00 179.25 178.09 2eh0 h ARG 118 N 0.00 0.46 -0.00 0.00 0.11 -1.24 -3.22 114.38 110.48 2eh0 h ARG 118 Ca 0.00 -0.56 -0.07 0.00 0.10 0.00 0.00 59.98 59.45 2eh0 h ARG 118 Cb 0.52 0.17 -0.01 0.00 1.11 0.00 0.00 29.97 31.76 2eh0 h ARG 118 CO 0.00 1.20 -0.34 0.00 0.10 0.00 0.00 179.97 180.93 2eh0 h ALA 119 N 0.59 1.43 -1.08 0.08 0.00 -0.83 -2.80 119.26 116.64 2eh0 h ALA 119 Ca -0.12 -0.31 0.31 0.00 0.00 0.00 0.00 54.91 54.80 2eh0 h ALA 119 Cb 1.73 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.42 2eh0 h ALA 119 CO 0.19 0.43 0.81 0.93 0.00 0.00 0.00 179.25 181.61 2eh0 h GLU 120 N 0.00 0.00 -0.13 0.00 4.39 -1.53 0.82 114.58 118.13 2eh0 h GLU 120 Ca -0.00 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.56 2eh0 h GLU 120 Cb 0.61 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.25 2eh0 h GLU 120 CO 0.04 0.00 -0.50 0.00 -1.16 0.00 0.00 179.01 177.40 2eh0 h ARG 121 N 0.00 0.33 0.00 2.33 2.47 -1.68 -2.93 114.38 114.91 2eh0 h ARG 121 Ca 0.51 -0.19 0.00 0.00 -1.26 0.00 0.00 59.98 59.04 2eh0 h ARG 121 Cb 2.13 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 30.47 2eh0 h ARG 121 CO -0.01 0.76 -0.63 0.39 0.56 0.00 0.00 179.97 181.04 2eh0 n GLU 122 N -3.96 0.28 -0.55 0.04 -0.58 0.26 -4.14 120.64 111.98 2eh0 n GLU 122 Ca -0.02 0.08 0.45 0.00 -0.42 0.00 0.00 57.16 57.24 2eh0 n GLU 122 Cb 0.55 -1.67 0.73 0.00 -0.57 0.00 0.00 31.44 30.48 2eh0 n GLU 122 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 2eh0 h LYS 123 N 0.00 0.00 -6.21 3.49 2.10 -0.75 -3.41 116.57 111.80 2eh0 h LYS 123 Ca 0.00 -0.00 -0.50 0.00 -2.00 0.00 0.00 60.65 58.15 2eh0 h LYS 123 Cb 0.73 -0.00 0.25 0.00 -0.90 0.00 0.00 32.23 32.31 2eh0 h LYS 123 CO 0.00 0.00 -2.05 -2.37 -2.00 0.00 0.00 179.45 173.04 2eh0 n THR 124 N -4.48 0.00 -0.55 0.07 5.66 -1.26 -4.89 114.28 108.84 2eh0 n THR 124 Ca 0.42 -0.18 -0.30 0.00 -3.05 0.00 0.00 64.05 60.94 2eh0 n THR 124 Cb 1.72 -0.18 0.23 0.00 -1.55 0.00 0.00 70.33 70.54 2eh0 n THR 124 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 2eh0 n SER 125 N 1.98 -1.83 0.00 1.09 3.41 -1.26 -4.99 113.62 112.02 2eh0 n SER 125 Ca -0.01 -0.11 0.00 0.00 -0.26 0.00 0.00 58.87 58.49 2eh0 n SER 125 Cb 0.67 -1.19 0.00 0.00 -0.26 0.00 0.00 64.21 63.44 2eh0 n SER 125 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eh0 n GLY 126 N 1.27 -1.35 3.58 5.00 0.00 -1.26 -5.08 105.19 107.36 2eh0 n GLY 126 Ca 0.03 0.45 -0.28 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 2.51 -0.11 1.61 0.04 -1.26 -4.59 135.00 133.19 2eh0 s PRO 127 Ca 0.00 -0.99 0.20 0.00 0.04 0.00 0.00 61.00 60.25 2eh0 s PRO 127 Cb 0.00 -5.21 -0.29 0.00 0.04 0.00 0.00 34.50 29.04 2eh0 s PRO 127 CO 0.00 -3.86 0.28 -1.13 0.04 0.00 0.00 177.00 172.33 2eh0 n SER 128 N 14.31 0.01 -0.80 6.66 3.41 -1.26 -4.30 113.62 131.64 2eh0 n SER 128 Ca 0.44 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 59.12 2eh0 n SER 128 Cb 0.47 1.49 0.19 0.00 -0.26 0.00 0.00 64.21 66.10 2eh0 n SER 128 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2eh0 n SER 129 N -2.51 3.20 0.00 4.04 3.41 -1.26 -5.38 113.62 115.12 2eh0 n SER 129 Ca -0.18 -2.05 0.00 0.00 -0.26 0.00 0.00 58.87 56.38 2eh0 n SER 129 Cb 0.87 -0.30 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 2eh0 n SER 129 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49