#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 4.37 -0.07 1.61 0.01 -1.26 -4.99 113.70 113.36 2eh0 s SER 2 Ca 0.00 -1.71 -0.06 0.00 1.31 0.00 0.00 55.95 55.49 2eh0 s SER 2 Cb 0.00 -1.37 -0.02 0.00 0.21 0.00 0.00 66.02 64.84 2eh0 s SER 2 CO 0.00 -0.32 -0.12 -0.24 0.41 0.00 0.00 173.24 172.97 2eh0 n SER 3 N 4.49 0.90 -3.19 2.44 2.88 -1.26 -5.01 113.62 114.86 2eh0 n SER 3 Ca -0.04 0.33 0.01 0.00 -1.33 0.00 0.00 58.87 57.85 2eh0 n SER 3 Cb 0.42 -0.66 -0.02 0.00 -0.75 0.00 0.00 64.21 63.21 2eh0 n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2eh0 s GLY 4 N -3.56 -0.91 0.27 0.46 0.00 -1.26 -5.03 107.32 97.29 2eh0 s GLY 4 Ca -0.10 1.51 -0.01 0.00 0.00 0.00 0.00 44.72 46.13 2eh0 s GLY 4 CO 0.14 3.28 1.41 -1.26 0.00 0.00 0.00 173.10 176.68 2eh0 n SER 5 N 5.41 -0.17 -4.52 1.64 2.88 -1.26 -4.47 113.62 113.13 2eh0 n SER 5 Ca -0.01 1.54 -0.37 0.00 -1.33 0.00 0.00 58.87 58.71 2eh0 n SER 5 Cb 0.51 -0.53 0.06 0.00 -0.75 0.00 0.00 64.21 63.50 2eh0 n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2eh0 n SER 6 N -5.37 -0.47 0.00 -3.46 2.88 -1.26 -5.00 113.62 100.95 2eh0 n SER 6 Ca 0.19 0.68 0.00 0.00 -1.33 0.00 0.00 58.87 58.42 2eh0 n SER 6 Cb 0.63 -1.27 0.00 0.00 -0.75 0.00 0.00 64.21 62.81 2eh0 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2eh0 n GLY 7 N 1.51 -0.02 1.47 0.46 0.00 -1.26 -5.09 105.19 102.26 2eh0 n GLY 7 Ca 0.12 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.21 2eh0 n GLY 7 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2eh0 n THR 8 N -1.36 -1.87 -2.13 2.61 5.66 -1.26 -4.70 114.28 111.22 2eh0 n THR 8 Ca 0.00 1.13 -0.43 0.00 -3.05 0.00 0.00 64.05 61.70 2eh0 n THR 8 Cb 0.00 -1.82 -0.03 0.00 -1.55 0.00 0.00 70.33 66.94 2eh0 n THR 8 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2eh0 s PRO 9 N -4.92 3.99 0.04 1.09 0.04 -1.26 -4.65 135.00 129.32 2eh0 s PRO 9 Ca 0.00 1.82 0.01 0.00 0.04 0.00 0.00 61.00 62.88 2eh0 s PRO 9 Cb 0.00 -3.97 -0.02 0.00 0.04 0.00 0.00 34.50 30.54 2eh0 s PRO 9 CO 0.00 -1.05 -0.06 -3.38 0.04 0.00 0.00 177.00 172.54 2eh0 s HIS 10 N 4.54 0.56 -0.14 0.56 -3.43 -1.13 -0.02 115.29 116.23 2eh0 s HIS 10 Ca 0.69 -0.54 -0.10 0.00 -0.80 0.00 0.00 55.06 54.31 2eh0 s HIS 10 Cb -0.27 -0.34 -0.05 0.00 -1.43 0.00 0.00 32.58 30.49 2eh0 s HIS 10 CO 0.27 -0.12 0.20 -0.51 -2.00 0.00 0.00 174.74 172.57 2eh0 s LEU 11 N -1.63 4.32 -0.02 5.38 1.43 0.10 -1.26 118.68 127.01 2eh0 s LEU 11 Ca -0.11 0.47 0.01 0.00 -1.03 0.00 0.00 54.13 53.47 2eh0 s LEU 11 Cb -0.09 -2.19 -0.03 0.00 0.03 0.00 0.00 46.19 43.91 2eh0 s LEU 11 CO -0.00 0.28 -0.02 -0.69 0.23 0.00 0.00 176.35 176.15 2eh0 s VAL 12 N -0.39 4.03 -0.54 -1.59 1.01 -0.04 0.12 120.40 123.00 2eh0 s VAL 12 Ca 0.14 -0.56 -0.26 0.00 0.00 0.00 0.00 61.98 61.30 2eh0 s VAL 12 Cb -0.12 -2.76 0.04 0.00 0.00 0.00 0.00 36.38 33.53 2eh0 s VAL 12 CO 0.03 0.44 1.02 0.21 0.00 0.00 0.00 175.10 176.81 2eh0 s ASN 13 N -1.34 6.41 0.00 3.32 3.84 0.17 -0.90 114.94 126.44 2eh0 s ASN 13 Ca 0.17 -0.11 0.07 0.00 0.21 0.00 0.00 52.86 53.21 2eh0 s ASN 13 Cb -0.11 -2.48 0.16 0.00 -0.55 0.00 0.00 41.25 38.27 2eh0 s ASN 13 CO 0.07 -1.28 1.04 0.00 -2.79 0.00 0.00 177.10 174.15 2eh0 n LEU 14 N 7.73 2.33 -4.11 3.21 -0.00 -1.26 -4.98 117.00 119.93 2eh0 n LEU 14 Ca 0.05 -1.71 -0.27 0.00 -0.00 0.00 0.00 56.01 54.07 2eh0 n LEU 14 Cb 0.48 -0.11 0.13 0.00 -0.00 0.00 0.00 43.42 43.92 2eh0 n LEU 14 CO 0.66 0.56 -0.66 0.59 -0.00 0.00 0.00 177.39 178.54 2eh0 n ASN 15 N 0.24 -2.69 -0.77 1.45 3.02 -1.26 -4.82 115.26 110.43 2eh0 n ASN 15 Ca 0.07 -0.19 0.04 0.00 -0.03 0.00 0.00 54.58 54.47 2eh0 n ASN 15 Cb 0.31 -0.78 0.14 0.00 -0.61 0.00 0.00 39.78 38.85 2eh0 n ASN 15 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2eh0 n GLU 16 N -0.86 2.07 -3.62 3.52 1.02 -1.26 -4.56 120.64 116.95 2eh0 n GLU 16 Ca 0.02 -1.15 -0.37 0.00 -0.02 0.00 0.00 57.16 55.64 2eh0 n GLU 16 Cb 0.53 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.40 2eh0 n GLU 16 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2eh0 s ASP 17 N -0.69 6.06 0.00 1.62 1.01 -1.26 -4.87 116.67 118.54 2eh0 s ASP 17 Ca 0.21 -3.68 0.14 0.00 0.71 0.00 0.00 52.55 49.93 2eh0 s ASP 17 Cb 0.13 -1.93 0.65 0.00 1.01 0.00 0.00 42.92 42.78 2eh0 s ASP 17 CO 0.10 -0.20 1.44 -0.81 0.21 0.00 0.00 175.17 175.91 2eh0 n PRO 18 N 2.41 0.06 0.00 8.23 -0.04 -1.26 -1.94 135.00 142.47 2eh0 n PRO 18 Ca 0.21 0.22 0.11 0.00 -0.04 0.00 0.00 63.50 64.00 2eh0 n PRO 18 Cb 0.37 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.39 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 -1.44 0.72 -4.36 1.53 4.77 -1.26 -4.97 117.00 112.00 2eh0 n LEU 19 Ca 0.04 -0.21 -0.61 0.00 -0.03 0.00 0.00 56.01 55.21 2eh0 n LEU 19 Cb 0.15 -0.12 -0.09 0.00 -2.33 0.00 0.00 43.42 41.03 2eh0 n LEU 19 CO 0.13 0.16 0.94 1.15 -1.33 0.00 0.00 177.39 178.44 2eh0 n MET 20 N -1.59 0.00 0.00 3.23 0.00 -0.82 -4.79 117.12 113.16 2eh0 n MET 20 Ca 0.04 0.00 0.15 0.00 0.00 0.00 0.00 57.70 57.89 2eh0 n MET 20 Cb 0.35 -1.39 0.68 0.00 0.00 0.00 0.00 33.22 32.86 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 3.16 0.27 -4.44 3.17 3.41 -1.26 -4.86 113.62 113.07 2eh0 n SER 21 Ca 0.26 -0.44 -0.29 0.00 -0.26 0.00 0.00 58.87 58.13 2eh0 n SER 21 Cb -0.02 -0.14 0.15 0.00 -0.26 0.00 0.00 64.21 63.93 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 -2.48 1.15 0.83 4.33 0.41 -1.26 -5.02 118.70 116.67 2eh0 s GLU 22 Ca 0.30 -0.19 -0.14 0.00 -0.41 0.00 0.00 54.97 54.53 2eh0 s GLU 22 Cb 0.20 -1.88 0.04 0.00 -1.78 0.00 0.00 34.13 30.71 2eh0 s GLU 22 CO 0.46 -2.10 0.77 0.00 -0.49 0.00 0.00 175.26 173.90 2eh0 h LEU 24 N -1.01 0.60 -8.56 0.00 -0.00 -1.95 -3.46 115.31 100.94 2eh0 h LEU 24 Ca -0.45 -0.79 -0.26 0.00 -0.00 0.00 0.00 57.88 56.38 2eh0 h LEU 24 Cb 1.31 -0.19 -0.11 0.00 -0.00 0.00 0.00 40.66 41.66 2eh0 h LEU 24 CO 0.41 1.65 -0.35 -1.48 -0.00 0.00 0.00 178.44 178.67 2eh0 s LEU 25 N -7.27 1.05 -0.10 1.67 0.05 -1.26 0.44 118.68 113.27 2eh0 s LEU 25 Ca -0.12 -1.40 -0.04 0.00 0.05 0.00 0.00 54.13 52.63 2eh0 s LEU 25 Cb 0.06 1.05 0.05 0.00 -2.05 0.00 0.00 46.19 45.30 2eh0 s LEU 25 CO 0.88 -1.09 0.19 -0.31 -0.55 0.00 0.00 176.35 175.46 2eh0 s TYR 26 N -3.63 -0.25 0.02 3.48 2.02 0.12 -4.97 117.35 114.13 2eh0 s TYR 26 Ca 0.33 0.71 -0.29 0.00 -0.37 0.00 0.00 57.07 57.45 2eh0 s TYR 26 Cb 0.02 -0.16 -0.04 0.00 -0.40 0.00 0.00 41.96 41.38 2eh0 s TYR 26 CO 0.17 -0.28 0.93 0.71 -1.57 0.00 0.00 175.55 175.51 2eh0 s TYR 27 N 2.15 3.69 -0.17 2.71 1.51 -1.26 0.02 117.35 126.00 2eh0 s TYR 27 Ca 0.01 1.65 -0.17 0.00 -1.01 0.00 0.00 57.07 57.54 2eh0 s TYR 27 Cb -0.12 -3.05 -0.04 0.00 -0.11 0.00 0.00 41.96 38.65 2eh0 s TYR 27 CO -0.07 0.07 0.46 0.42 -1.11 0.00 0.00 175.55 175.33 2eh0 s ILE 28 N 0.69 5.17 0.40 2.71 1.01 0.97 -4.96 121.20 127.19 2eh0 s ILE 28 Ca 0.48 0.87 -0.04 0.00 0.00 0.00 0.00 60.65 61.96 2eh0 s ILE 28 Cb -0.21 -3.79 0.09 0.00 0.01 0.00 0.00 42.46 38.55 2eh0 s ILE 28 CO 0.27 0.26 0.55 2.29 0.00 0.00 0.00 174.94 178.31 2eh0 n LYS 29 N 4.25 -0.23 -3.08 2.79 -0.00 -1.26 -4.45 118.16 116.18 2eh0 n LYS 29 Ca -0.07 -1.08 -0.40 0.00 -0.00 0.00 0.00 58.31 56.76 2eh0 n LYS 29 Cb 0.51 -0.49 -0.06 0.00 -0.00 0.00 0.00 35.03 34.99 2eh0 n LYS 29 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 2eh0 s ASP 30 N -3.09 6.73 0.00 -5.58 2.15 -1.26 -4.65 116.67 110.97 2eh0 s ASP 30 Ca 0.33 0.89 0.00 0.00 0.43 0.00 0.00 52.55 54.20 2eh0 s ASP 30 Cb -0.01 -2.37 0.00 0.00 -0.30 0.00 0.00 42.92 40.24 2eh0 s ASP 30 CO 0.23 -0.30 0.00 0.61 -0.17 0.00 0.00 175.17 175.54 2eh0 n GLY 31 N 3.75 0.40 3.21 2.66 0.00 -1.11 -5.01 105.19 109.09 2eh0 n GLY 31 Ca -0.00 -1.31 -0.34 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.73 2.71 -0.54 -0.61 1.09 -1.26 -1.85 121.20 119.01 2eh0 s ILE 32 Ca 0.00 -0.72 -0.08 0.00 -1.10 0.00 0.00 60.65 58.75 2eh0 s ILE 32 Cb 0.00 -2.19 0.14 0.00 -1.06 0.00 0.00 42.46 39.35 2eh0 s ILE 32 CO 0.00 0.48 0.40 -0.89 -0.10 0.00 0.00 174.94 174.83 2eh0 s THR 33 N 1.38 4.17 0.00 2.92 2.01 0.10 -4.94 115.64 121.30 2eh0 s THR 33 Ca 0.05 -2.14 -0.30 0.00 0.31 0.00 0.00 61.69 59.62 2eh0 s THR 33 Cb -0.14 -3.73 -0.05 0.00 0.01 0.00 0.00 72.50 68.60 2eh0 s THR 33 CO -0.08 -0.82 1.25 -0.13 -0.69 0.00 0.00 174.62 174.15 2eh0 s ARG 34 N 0.91 4.36 -0.45 4.92 0.52 -1.26 0.52 118.95 128.47 2eh0 s ARG 34 Ca 0.10 1.79 -0.09 0.00 -0.52 0.00 0.00 55.73 57.00 2eh0 s ARG 34 Cb -0.23 -3.48 0.10 0.00 0.52 0.00 0.00 34.95 31.86 2eh0 s ARG 34 CO -0.03 -0.41 0.31 0.08 0.02 0.00 0.00 175.30 175.27 2eh0 s VAL 35 N 1.83 4.26 0.00 3.52 1.01 0.12 -2.43 120.40 128.72 2eh0 s VAL 35 Ca 0.59 -1.59 0.00 0.00 0.00 0.00 0.00 61.98 60.98 2eh0 s VAL 35 Cb -0.28 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.39 2eh0 s VAL 35 CO 0.26 -0.65 0.00 0.61 0.00 0.00 0.00 175.10 175.31 2eh0 n GLY 36 N 4.93 4.49 3.90 4.51 0.00 -1.17 -2.07 105.19 119.78 2eh0 n GLY 36 Ca -0.09 -0.45 -0.20 0.00 0.00 0.00 0.00 46.02 45.28 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 4.82 2.81 0.00 1.61 -1.52 -1.24 -3.27 119.66 122.88 2eh0 s GLN 37 Ca 0.00 -1.25 0.26 0.00 -1.95 0.00 0.00 55.36 52.43 2eh0 s GLN 37 Cb 0.00 -2.58 1.52 0.00 -0.22 0.00 0.00 33.01 31.73 2eh0 s GLN 37 CO 0.00 0.02 1.91 0.00 -0.25 0.00 0.00 175.29 176.98 2eh0 n ALA 38 N -1.50 2.44 -0.01 6.09 0.00 -1.26 -2.71 120.51 123.55 2eh0 n ALA 38 Ca 0.00 -0.16 0.08 0.00 0.00 0.00 0.00 53.44 53.36 2eh0 n ALA 38 Cb 0.59 -1.43 -0.14 0.00 0.00 0.00 0.00 19.45 18.48 2eh0 n ALA 38 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2eh0 n ASP 39 N -1.06 0.97 -4.05 0.00 9.92 -1.26 -4.95 116.55 116.11 2eh0 n ASP 39 Ca 0.18 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 54.03 2eh0 n ASP 39 Cb 0.11 1.75 -0.01 0.00 -0.64 0.00 0.00 41.12 42.33 2eh0 n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2eh0 n ALA 40 N -2.14 -2.83 -0.31 2.24 0.00 -1.10 -4.71 120.51 111.65 2eh0 n ALA 40 Ca -0.05 0.25 0.22 0.00 0.00 0.00 0.00 53.44 53.86 2eh0 n ALA 40 Cb 0.49 -1.43 0.41 0.00 0.00 0.00 0.00 19.45 18.92 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 1.10 -0.07 -4.04 0.00 1.02 -1.26 -4.39 120.64 113.01 2eh0 n GLU 41 Ca 0.13 1.34 -0.22 0.00 -0.02 0.00 0.00 57.16 58.40 2eh0 n GLU 41 Cb 0.31 -2.27 -0.05 0.00 -0.02 0.00 0.00 31.44 29.41 2eh0 n GLU 41 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2eh0 s ARG 42 N -5.67 2.63 -0.47 3.49 1.81 -1.26 -5.07 118.95 114.42 2eh0 s ARG 42 Ca -0.10 -1.30 -0.29 0.00 -1.72 0.00 0.00 55.73 52.32 2eh0 s ARG 42 Cb 0.30 -2.38 0.02 0.00 -0.45 0.00 0.00 34.95 32.43 2eh0 s ARG 42 CO 0.73 0.23 1.29 0.50 -0.68 0.00 0.00 175.30 177.36 2eh0 s ARG 43 N -3.87 3.60 0.04 3.54 3.52 -1.26 -4.86 118.95 119.66 2eh0 s ARG 43 Ca 0.36 0.68 -0.30 0.00 -0.13 0.00 0.00 55.73 56.34 2eh0 s ARG 43 Cb -0.06 -3.99 -0.04 0.00 -1.56 0.00 0.00 34.95 29.30 2eh0 s ARG 43 CO 0.24 -1.54 1.05 -0.65 -0.81 0.00 0.00 175.30 173.59 2eh0 s GLN 44 N 4.81 4.54 0.28 5.12 -1.52 -1.26 -4.89 119.66 126.73 2eh0 s GLN 44 Ca 0.54 1.55 0.00 0.00 -1.95 0.00 0.00 55.36 55.50 2eh0 s GLN 44 Cb -0.10 -3.40 0.52 0.00 -0.22 0.00 0.00 33.01 29.81 2eh0 s GLN 44 CO 0.31 -0.07 1.84 0.22 -0.25 0.00 0.00 175.29 177.34 2eh0 h ASP 45 N 6.54 0.92 -4.09 5.90 1.82 -1.82 -3.41 116.42 122.28 2eh0 h ASP 45 Ca -0.42 0.04 -0.60 0.00 -0.39 0.00 0.00 57.03 55.67 2eh0 h ASP 45 Cb 1.22 -0.14 -0.31 0.00 0.68 0.00 0.00 39.33 40.78 2eh0 h ASP 45 CO 0.76 0.51 -0.85 -0.63 -1.61 0.00 0.00 179.24 177.42 2eh0 s ILE 46 N -5.98 1.60 -0.05 2.25 1.01 -1.24 -5.08 121.20 113.72 2eh0 s ILE 46 Ca -0.12 -0.83 0.06 0.00 0.00 0.00 0.00 60.65 59.76 2eh0 s ILE 46 Cb 0.22 -1.35 -0.02 0.00 0.01 0.00 0.00 42.46 41.32 2eh0 s ILE 46 CO 0.81 0.45 -0.24 -0.69 0.00 0.00 0.00 174.94 175.27 2eh0 s VAL 47 N -0.17 2.19 0.29 2.92 1.01 -1.26 -3.03 120.40 122.35 2eh0 s VAL 47 Ca 0.00 -1.03 0.08 0.00 0.00 0.00 0.00 61.98 61.03 2eh0 s VAL 47 Cb -0.11 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 2eh0 s VAL 47 CO 0.01 0.57 0.11 -0.76 0.00 0.00 0.00 175.10 175.04 2eh0 s LEU 48 N -0.35 3.40 0.58 3.92 2.01 -1.20 -5.05 118.68 121.98 2eh0 s LEU 48 Ca 0.02 -0.57 0.07 0.00 0.01 0.00 0.00 54.13 53.66 2eh0 s LEU 48 Cb -0.12 -1.92 0.08 0.00 0.01 0.00 0.00 46.19 44.24 2eh0 s LEU 48 CO 0.02 -0.12 0.79 -0.44 1.01 0.00 0.00 176.35 177.61 2eh0 s SER 49 N -3.79 5.05 0.00 2.29 0.01 -1.26 -4.91 113.70 111.09 2eh0 s SER 49 Ca 0.34 -0.63 0.00 0.00 1.31 0.00 0.00 55.95 56.98 2eh0 s SER 49 Cb -0.06 0.00 0.00 0.00 0.21 0.00 0.00 66.02 66.18 2eh0 s SER 49 CO 0.22 -1.34 0.00 0.61 0.41 0.00 0.00 173.24 173.15 2eh0 n GLY 50 N -2.30 -2.21 0.02 3.44 0.00 -1.26 -4.70 105.19 98.19 2eh0 n GLY 50 Ca 0.14 -1.72 0.01 0.00 0.00 0.00 0.00 46.02 44.45 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 -0.03 2.33 1.93 4.61 0.00 -1.26 -4.57 120.51 123.51 2eh0 n ALA 51 Ca 0.00 -0.17 0.01 0.00 0.00 0.00 0.00 53.44 53.27 2eh0 n ALA 51 Cb 0.00 -0.08 0.04 0.00 0.00 0.00 0.00 19.45 19.42 2eh0 n ALA 51 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2eh0 n HIS 52 N -0.75 0.00 -4.01 0.00 -0.00 -1.26 -4.81 115.22 104.39 2eh0 n HIS 52 Ca 0.01 0.00 -0.24 0.00 -0.00 0.00 0.00 57.72 57.49 2eh0 n HIS 52 Cb 0.04 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 29.99 2eh0 n HIS 52 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 2eh0 s ILE 53 N -2.00 4.99 0.16 3.57 -1.09 -1.26 -4.22 121.20 121.34 2eh0 s ILE 53 Ca 0.02 -0.97 0.09 0.00 -2.23 0.00 0.00 60.65 57.56 2eh0 s ILE 53 Cb 0.01 -3.63 -0.04 0.00 -1.58 0.00 0.00 42.46 37.22 2eh0 s ILE 53 CO 0.02 -0.21 -0.20 -0.54 -1.23 0.00 0.00 174.94 172.78 2eh0 s LYS 54 N -3.52 1.30 0.34 2.79 -0.14 -1.26 -5.01 119.74 114.24 2eh0 s LYS 54 Ca 0.33 -1.38 0.08 0.00 -1.36 0.00 0.00 55.97 53.64 2eh0 s LYS 54 Cb -0.10 -1.48 0.79 0.00 -1.68 0.00 0.00 37.83 35.36 2eh0 s LYS 54 CO 0.27 0.32 1.85 0.93 -0.76 0.00 0.00 175.35 177.96 2eh0 h GLU 55 N 3.43 0.70 -0.65 1.68 3.07 -1.91 -1.87 114.58 119.03 2eh0 h GLU 55 Ca -0.44 -0.04 -0.48 0.00 -0.50 0.00 0.00 59.36 57.90 2eh0 h GLU 55 Cb 1.20 -0.16 -0.37 0.00 -0.84 0.00 0.00 28.75 28.59 2eh0 h GLU 55 CO 0.47 0.46 -0.74 0.39 -1.40 0.00 0.00 179.01 178.20 2eh0 n GLU 56 N -4.59 3.31 0.00 2.33 1.02 -1.26 -3.77 120.64 117.67 2eh0 n GLU 56 Ca 0.19 -4.03 0.00 0.00 -0.02 0.00 0.00 57.16 53.30 2eh0 n GLU 56 Cb 0.49 -2.19 0.00 0.00 -0.02 0.00 0.00 31.44 29.72 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 -0.77 0.00 -3.86 -0.32 -0.00 -0.70 -4.52 115.22 105.05 2eh0 n HIS 57 Ca 0.41 0.00 -0.09 0.00 0.46 0.00 0.00 57.72 58.50 2eh0 n HIS 57 Cb 0.93 -0.41 -0.02 0.00 -0.12 0.00 0.00 29.99 30.37 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 -2.66 0.16 -0.23 0.00 1.01 -0.58 0.12 121.20 119.02 2eh0 s ILE 59 Ca 0.18 -1.30 -0.00 0.00 0.00 0.00 0.00 60.65 59.53 2eh0 s ILE 59 Cb -0.01 -1.27 0.06 0.00 0.01 0.00 0.00 42.46 41.25 2eh0 s ILE 59 CO 0.13 -0.72 -0.02 -0.36 0.00 0.00 0.00 174.94 173.97 2eh0 s PHE 60 N -3.55 2.04 -0.24 3.97 0.08 0.18 -1.01 117.98 119.45 2eh0 s PHE 60 Ca 0.03 -1.55 -0.10 0.00 0.12 0.00 0.00 56.93 55.43 2eh0 s PHE 60 Cb 0.04 -1.47 -0.05 0.00 -0.57 0.00 0.00 43.02 40.98 2eh0 s PHE 60 CO -0.09 -0.74 0.15 0.50 -0.10 0.00 0.00 175.22 174.94 2eh0 s ARG 61 N 1.51 4.03 -0.28 0.44 3.52 -0.73 0.03 118.95 127.47 2eh0 s ARG 61 Ca -0.04 -0.29 0.03 0.00 -0.13 0.00 0.00 55.73 55.30 2eh0 s ARG 61 Cb -0.18 -3.52 0.07 0.00 -1.56 0.00 0.00 34.95 29.76 2eh0 s ARG 61 CO -0.07 0.03 -0.05 -1.12 -0.81 0.00 0.00 175.30 173.28 2eh0 s SER 62 N 1.12 4.41 0.02 -2.12 0.01 -0.77 -1.31 113.70 115.06 2eh0 s SER 62 Ca 0.07 -1.57 0.01 0.00 1.31 0.00 0.00 55.95 55.77 2eh0 s SER 62 Cb -0.14 -1.48 -0.01 0.00 0.21 0.00 0.00 66.02 64.60 2eh0 s SER 62 CO 0.05 -0.26 -0.04 -0.70 0.41 0.00 0.00 173.24 172.70 2eh0 s GLU 63 N 1.12 0.33 -0.63 12.44 2.56 -0.81 -2.75 118.70 130.97 2eh0 s GLU 63 Ca -0.03 -0.42 -0.28 0.00 0.00 0.00 0.00 54.97 54.25 2eh0 s GLU 63 Cb -0.19 -0.16 0.03 0.00 2.00 0.00 0.00 34.13 35.81 2eh0 s GLU 63 CO -0.07 0.03 1.21 0.50 -0.56 0.00 0.00 175.26 176.37 2eh0 s ARG 64 N -0.85 3.40 0.93 4.30 3.52 -1.26 -1.46 118.95 127.54 2eh0 s ARG 64 Ca -0.06 0.07 -0.17 0.00 -0.13 0.00 0.00 55.73 55.44 2eh0 s ARG 64 Cb -0.06 -4.07 -0.14 0.00 -1.56 0.00 0.00 34.95 29.13 2eh0 s ARG 64 CO -0.00 -1.82 -0.62 0.45 -0.81 0.00 0.00 175.30 172.49 2eh0 n SER 65 N 8.70 -5.41 -0.09 -2.12 2.88 0.19 -4.56 113.62 113.21 2eh0 n SER 65 Ca 0.06 0.26 0.25 0.00 -1.33 0.00 0.00 58.87 58.11 2eh0 n SER 65 Cb 0.49 -0.81 0.72 0.00 -0.75 0.00 0.00 64.21 63.86 2eh0 n SER 65 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 2eh0 h ASN 66 N -0.91 0.00 0.40 -3.46 -0.73 -1.94 0.49 115.58 109.44 2eh0 h ASN 66 Ca -0.44 0.00 -0.07 0.00 1.87 0.00 0.00 56.30 57.66 2eh0 h ASN 66 Cb 1.32 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.90 2eh0 h ASN 66 CO 0.26 0.00 -0.33 -1.28 -0.37 0.00 0.00 177.43 175.71 2eh0 h SER 67 N 0.00 0.00 0.00 1.15 0.87 -2.02 -3.46 113.55 110.09 2eh0 h SER 67 Ca 0.35 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.91 2eh0 h SER 67 Cb 1.49 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.45 2eh0 h SER 67 CO -0.00 0.33 0.00 0.61 -0.53 0.00 0.00 176.83 177.24 2eh0 n GLY 68 N -0.46 1.54 3.56 5.77 0.00 0.17 -5.12 105.19 110.66 2eh0 n GLY 68 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.08 2.76 -0.27 1.61 -1.05 -1.24 -4.86 118.70 115.57 2eh0 s GLU 69 Ca 0.00 -0.57 -0.29 0.00 -0.15 0.00 0.00 54.97 53.96 2eh0 s GLU 69 Cb 0.00 -2.58 -0.00 0.00 -0.44 0.00 0.00 34.13 31.11 2eh0 s GLU 69 CO 0.00 0.64 1.30 0.08 0.95 0.00 0.00 175.26 178.22 2eh0 s VAL 70 N -0.73 4.17 0.14 1.83 1.01 -1.26 0.54 120.40 126.09 2eh0 s VAL 70 Ca 0.11 1.34 0.10 0.00 0.00 0.00 0.00 61.98 63.53 2eh0 s VAL 70 Cb -0.11 -4.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 2eh0 s VAL 70 CO 0.01 -0.39 -0.21 -0.63 0.00 0.00 0.00 175.10 173.88 2eh0 s ILE 71 N 4.19 2.62 -0.06 2.22 -1.09 -0.54 -4.94 121.20 123.60 2eh0 s ILE 71 Ca 0.56 -1.68 0.03 0.00 -2.23 0.00 0.00 60.65 57.34 2eh0 s ILE 71 Cb -0.18 -2.21 0.00 0.00 -1.58 0.00 0.00 42.46 38.50 2eh0 s ILE 71 CO 0.21 0.04 -0.16 -0.69 -1.23 0.00 0.00 174.94 173.12 2eh0 s VAL 72 N -1.25 1.39 -0.07 2.92 1.01 -1.26 -1.92 120.40 121.22 2eh0 s VAL 72 Ca 0.18 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.54 2eh0 s VAL 72 Cb -0.10 -1.22 0.00 0.00 0.00 0.00 0.00 36.38 35.06 2eh0 s VAL 72 CO 0.09 0.41 -0.17 -0.89 0.00 0.00 0.00 175.10 174.54 2eh0 s THR 73 N 0.36 1.51 -0.18 3.92 2.01 -0.43 -0.54 115.64 122.30 2eh0 s THR 73 Ca -0.11 -0.72 -0.21 0.00 0.31 0.00 0.00 61.69 60.97 2eh0 s THR 73 Cb -0.14 -1.33 -0.03 0.00 0.01 0.00 0.00 72.50 71.01 2eh0 s THR 73 CO 0.04 0.44 0.62 -0.22 -0.69 0.00 0.00 174.62 174.80 2eh0 s LEU 74 N 0.38 4.16 -0.87 4.42 2.96 -0.01 -1.78 118.68 127.95 2eh0 s LEU 74 Ca -0.13 0.84 -0.01 0.00 -0.22 0.00 0.00 54.13 54.62 2eh0 s LEU 74 Cb -0.15 -2.88 0.21 0.00 0.50 0.00 0.00 46.19 43.87 2eh0 s LEU 74 CO 0.05 -0.24 0.74 -1.61 -1.32 0.00 0.00 176.35 173.97 2eh0 s GLU 75 N 1.74 3.17 1.03 1.98 2.02 -0.18 -3.07 118.70 125.39 2eh0 s GLU 75 Ca 0.29 -3.27 -0.17 0.00 0.02 0.00 0.00 54.97 51.83 2eh0 s GLU 75 Cb -0.16 -3.89 0.26 0.00 0.10 0.00 0.00 34.13 30.44 2eh0 s GLU 75 CO 0.11 -1.26 0.91 -0.35 0.02 0.00 0.00 175.26 174.69 2eh0 n PRO 76 N 2.31 -2.79 -4.48 0.39 -0.04 -1.26 -1.52 135.00 127.60 2eh0 n PRO 76 Ca 0.21 -1.46 -0.31 0.00 -0.04 0.00 0.00 63.50 61.90 2eh0 n PRO 76 Cb 0.37 -1.37 -0.05 0.00 -0.04 0.00 0.00 33.50 32.41 2eh0 n PRO 76 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2eh0 n GLU 78 N -1.38 0.27 -0.81 0.00 2.13 -1.26 -4.20 120.64 115.38 2eh0 n GLU 78 Ca -0.17 -0.03 0.01 0.00 0.66 0.00 0.00 57.16 57.63 2eh0 n GLU 78 Cb 0.64 -1.56 0.18 0.00 0.27 0.00 0.00 31.44 30.97 2eh0 n GLU 78 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2eh0 n ARG 79 N -1.88 1.89 -4.12 5.31 5.12 -1.26 -5.02 116.66 116.70 2eh0 n ARG 79 Ca 0.02 -3.43 -0.16 0.00 -1.93 0.00 0.00 57.85 52.35 2eh0 n ARG 79 Cb 0.43 -1.72 -0.12 0.00 -1.16 0.00 0.00 32.46 29.89 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 -3.27 1.22 -0.62 0.55 1.04 -1.26 -4.93 113.70 106.43 2eh0 s SER 80 Ca 0.40 -0.56 -0.19 0.00 0.48 0.00 0.00 55.95 56.08 2eh0 s SER 80 Cb 0.38 -0.01 0.11 0.00 0.10 0.00 0.00 66.02 66.60 2eh0 s SER 80 CO -0.05 -0.13 0.73 -0.70 0.98 0.00 0.00 173.24 174.07 2eh0 s GLU 81 N -1.58 3.09 -0.04 4.02 2.56 -1.26 -4.79 118.70 120.71 2eh0 s GLU 81 Ca -0.06 -1.38 0.04 0.00 0.00 0.00 0.00 54.97 53.57 2eh0 s GLU 81 Cb -0.10 -4.30 -0.00 0.00 2.00 0.00 0.00 34.13 31.73 2eh0 s GLU 81 CO 0.01 -1.55 -0.14 0.99 -0.56 0.00 0.00 175.26 174.01 2eh0 s THR 82 N 2.62 1.15 -0.04 -1.70 2.01 -1.26 -1.12 115.64 117.31 2eh0 s THR 82 Ca 0.13 -0.56 0.02 0.00 0.31 0.00 0.00 61.69 61.59 2eh0 s THR 82 Cb -0.23 -1.00 0.01 0.00 0.01 0.00 0.00 72.50 71.29 2eh0 s THR 82 CO 0.05 0.34 -0.09 -0.31 -0.69 0.00 0.00 174.62 173.92 2eh0 s TYR 83 N 0.11 1.00 0.14 4.92 2.02 -0.98 -2.26 117.35 122.30 2eh0 s TYR 83 Ca -0.03 -0.28 0.11 0.00 -0.37 0.00 0.00 57.07 56.50 2eh0 s TYR 83 Cb -0.10 -0.74 -0.04 0.00 -0.40 0.00 0.00 41.96 40.68 2eh0 s TYR 83 CO 0.01 -0.14 -0.26 0.08 -1.57 0.00 0.00 175.55 173.67 2eh0 s VAL 84 N 0.40 2.28 -0.00 0.71 1.01 0.43 -1.09 120.40 124.14 2eh0 s VAL 84 Ca -0.07 -1.81 0.00 0.00 0.00 0.00 0.00 61.98 60.11 2eh0 s VAL 84 Cb -0.11 -2.02 0.00 0.00 0.00 0.00 0.00 36.38 34.25 2eh0 s VAL 84 CO 0.01 0.05 0.00 0.59 0.00 0.00 0.00 175.10 175.75 2eh0 n ASN 85 N 0.80 -0.55 0.00 3.32 5.03 -0.88 0.14 115.26 123.11 2eh0 n ASN 85 Ca -0.17 0.27 0.00 0.00 0.87 0.00 0.00 54.58 55.55 2eh0 n ASN 85 Cb 0.54 -0.77 0.00 0.00 -1.02 0.00 0.00 39.78 38.52 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 -0.27 3.11 1.85 7.41 0.00 -1.25 -4.88 105.19 111.15 2eh0 n GLY 86 Ca -0.00 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 44.99 2eh0 n GLY 86 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2eh0 n LYS 87 N 0.00 -0.44 -2.37 1.61 2.85 0.36 -4.97 118.16 115.20 2eh0 n LYS 87 Ca 0.00 -1.05 -0.26 0.00 -1.05 0.00 0.00 58.31 55.95 2eh0 n LYS 87 Cb 0.00 -0.59 0.04 0.00 -0.65 0.00 0.00 35.03 33.84 2eh0 n LYS 87 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 177.40 177.85 2eh0 s ARG 88 N -4.25 2.62 -0.22 -1.58 3.52 -1.26 0.16 118.95 117.94 2eh0 s ARG 88 Ca 0.35 -0.20 -0.03 0.00 -0.13 0.00 0.00 55.73 55.72 2eh0 s ARG 88 Cb -0.01 -2.27 0.11 0.00 -1.56 0.00 0.00 34.95 31.22 2eh0 s ARG 88 CO 0.24 -0.88 0.26 0.54 -0.81 0.00 0.00 175.30 174.65 2eh0 s VAL 89 N -3.04 -0.38 -0.01 7.11 0.11 -0.96 -4.35 120.40 118.88 2eh0 s VAL 89 Ca 0.56 -0.17 0.01 0.00 -2.93 0.00 0.00 61.98 59.46 2eh0 s VAL 89 Cb -0.11 -0.75 -0.02 0.00 -1.53 0.00 0.00 36.38 33.98 2eh0 s VAL 89 CO 0.44 -0.23 0.03 -0.24 -3.33 0.00 0.00 175.10 171.77 2eh0 n SER 90 N 5.32 3.81 -4.73 3.54 2.88 -1.26 -4.63 113.62 118.56 2eh0 n SER 90 Ca -0.05 -0.10 -0.25 0.00 -1.33 0.00 0.00 58.87 57.14 2eh0 n SER 90 Cb 0.49 1.04 -0.06 0.00 -0.75 0.00 0.00 64.21 64.93 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 -1.89 2.63 -0.80 -1.46 -0.21 -1.26 -4.62 119.66 112.05 2eh0 s GLN 91 Ca -0.00 -1.07 -0.25 0.00 0.02 0.00 0.00 55.36 54.06 2eh0 s GLN 91 Cb 0.01 -2.45 -0.04 0.00 1.00 0.00 0.00 33.01 31.53 2eh0 s GLN 91 CO 0.05 0.44 1.91 -1.25 -2.12 0.00 0.00 175.29 174.32 2eh0 s PRO 92 N -3.26 2.59 0.22 2.91 0.04 -1.26 -4.67 135.00 131.57 2eh0 s PRO 92 Ca 0.30 0.03 0.10 0.00 0.04 0.00 0.00 61.00 61.47 2eh0 s PRO 92 Cb -0.09 -4.82 -0.04 0.00 0.04 0.00 0.00 34.50 29.59 2eh0 s PRO 92 CO 0.21 -3.14 -0.14 0.14 0.04 0.00 0.00 177.00 174.12 2eh0 s VAL 93 N 9.70 2.88 0.28 -0.36 -7.23 -1.17 -4.90 120.40 119.59 2eh0 s VAL 93 Ca 0.69 -1.96 -0.29 0.00 -1.81 0.00 0.00 61.98 58.62 2eh0 s VAL 93 Cb -0.09 -2.46 -0.09 0.00 0.56 0.00 0.00 36.38 34.30 2eh0 s VAL 93 CO 0.07 -0.22 0.99 -1.10 -0.31 0.00 0.00 175.10 174.53 2eh0 s GLN 94 N -3.09 4.69 0.34 4.82 -0.21 -1.26 -0.83 119.66 124.12 2eh0 s GLN 94 Ca 0.26 1.55 -0.09 0.00 0.02 0.00 0.00 55.36 57.10 2eh0 s GLN 94 Cb -0.07 -3.11 -0.06 0.00 1.00 0.00 0.00 33.01 30.77 2eh0 s GLN 94 CO 0.15 0.34 0.67 -0.51 -2.12 0.00 0.00 175.29 173.82 2eh0 s LEU 95 N -1.54 3.97 0.44 2.90 2.01 0.30 -4.90 118.68 121.87 2eh0 s LEU 95 Ca 0.45 1.00 0.07 0.00 0.01 0.00 0.00 54.13 55.66 2eh0 s LEU 95 Cb -0.26 -3.84 -0.02 0.00 0.01 0.00 0.00 46.19 42.09 2eh0 s LEU 95 CO 0.33 -0.28 0.33 -0.13 1.01 0.00 0.00 176.35 177.61 2eh0 s ARG 96 N -3.53 2.40 -0.59 1.70 3.00 -1.26 -4.76 118.95 115.90 2eh0 s ARG 96 Ca 0.49 -1.71 -0.26 0.00 0.00 0.00 0.00 55.73 54.25 2eh0 s ARG 96 Cb -0.11 -2.22 0.04 0.00 0.00 0.00 0.00 34.95 32.66 2eh0 s ARG 96 CO 0.28 -0.26 1.10 0.45 0.00 0.00 0.00 175.30 176.88 2eh0 s SER 97 N -4.10 6.37 0.00 0.23 0.15 -1.26 -3.18 113.70 111.91 2eh0 s SER 97 Ca 0.44 -0.17 0.00 0.00 0.70 0.00 0.00 55.95 56.92 2eh0 s SER 97 Cb -0.01 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 2eh0 s SER 97 CO 0.25 -1.43 0.00 0.61 1.20 0.00 0.00 173.24 173.88 2eh0 n GLY 98 N 5.13 0.89 3.77 9.45 0.00 -1.09 -5.03 105.19 118.30 2eh0 n GLY 98 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 2eh0 n GLY 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eh0 s ASN 99 N -1.78 6.29 -0.41 1.61 2.20 -1.19 -4.86 114.94 116.79 2eh0 s ASN 99 Ca 0.00 2.35 -0.17 0.00 -0.94 0.00 0.00 52.86 54.10 2eh0 s ASN 99 Cb 0.00 -2.61 0.02 0.00 -2.00 0.00 0.00 41.25 36.66 2eh0 s ASN 99 CO 0.00 -0.84 0.46 -0.60 -2.94 0.00 0.00 177.10 173.18 2eh0 s ARG 100 N -2.53 3.19 -0.30 3.55 3.52 -1.26 -3.73 118.95 121.39 2eh0 s ARG 100 Ca 0.61 -0.65 -0.06 0.00 -0.13 0.00 0.00 55.73 55.50 2eh0 s ARG 100 Cb -0.30 -3.94 0.02 0.00 -1.56 0.00 0.00 34.95 29.16 2eh0 s ARG 100 CO 0.37 -0.83 0.07 0.42 -0.81 0.00 0.00 175.30 174.53 2eh0 s ILE 101 N 2.21 3.82 -0.08 4.11 1.01 -1.07 -2.08 121.20 129.13 2eh0 s ILE 101 Ca 0.14 -0.80 -0.03 0.00 0.00 0.00 0.00 60.65 59.96 2eh0 s ILE 101 Cb -0.17 -3.00 -0.04 0.00 0.01 0.00 0.00 42.46 39.27 2eh0 s ILE 101 CO 0.14 0.05 0.04 -0.63 0.00 0.00 0.00 174.94 174.54 2eh0 s ILE 102 N 1.47 4.59 -0.32 2.92 1.09 -0.25 -1.48 121.20 129.22 2eh0 s ILE 102 Ca 0.02 -0.18 -0.00 0.00 -1.10 0.00 0.00 60.65 59.38 2eh0 s ILE 102 Cb -0.17 -2.97 0.10 0.00 -1.06 0.00 0.00 42.46 38.36 2eh0 s ILE 102 CO 0.02 0.58 0.10 -0.04 -0.10 0.00 0.00 174.94 175.49 2eh0 s MET 103 N -1.02 0.83 0.00 2.79 -1.94 -0.55 -2.31 119.30 117.10 2eh0 s MET 103 Ca 0.15 -1.22 0.00 0.00 -1.71 0.00 0.00 55.69 52.91 2eh0 s MET 103 Cb -0.12 -2.14 0.00 0.00 2.01 0.00 0.00 34.83 34.58 2eh0 s MET 103 CO 0.04 -0.99 0.00 0.41 -0.01 0.00 0.00 175.02 174.47 2eh0 n GLY 104 N 4.70 1.22 1.08 -0.03 0.00 -0.27 -4.35 105.19 107.53 2eh0 n GLY 104 Ca -0.01 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.09 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 0.00 -2.81 1.61 0.00 -1.26 -4.78 118.16 110.92 2eh0 n LYS 105 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 58.31 58.05 2eh0 n LYS 105 Cb 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 35.03 34.99 2eh0 n LYS 105 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 2eh0 n ASN 106 N -2.53 4.33 -3.62 3.14 6.94 -1.26 -4.92 115.26 117.33 2eh0 n ASN 106 Ca 0.00 -3.65 -0.27 0.00 -0.02 0.00 0.00 54.58 50.64 2eh0 n ASN 106 Cb 0.00 -0.53 -0.10 0.00 -2.36 0.00 0.00 39.78 36.79 2eh0 n ASN 106 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 2eh0 n HIS 107 N -0.29 2.30 -2.27 -2.53 8.25 -1.26 -4.81 115.22 114.61 2eh0 n HIS 107 Ca 0.33 -4.03 -0.29 0.00 -0.26 0.00 0.00 57.72 53.47 2eh0 n HIS 107 Cb 0.49 -0.43 0.01 0.00 1.12 0.00 0.00 29.99 31.19 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 -1.44 4.51 -0.21 1.59 1.01 -1.26 -1.48 120.40 123.11 2eh0 s VAL 108 Ca 0.31 0.42 -0.14 0.00 0.00 0.00 0.00 61.98 62.57 2eh0 s VAL 108 Cb 0.04 -3.76 0.06 0.00 0.00 0.00 0.00 36.38 32.72 2eh0 s VAL 108 CO -0.13 -0.87 0.54 -0.36 0.00 0.00 0.00 175.10 174.28 2eh0 s PHE 109 N -2.99 -0.76 -0.28 5.22 0.08 -0.55 -4.21 117.98 114.50 2eh0 s PHE 109 Ca 0.52 1.61 -0.14 0.00 0.12 0.00 0.00 56.93 59.04 2eh0 s PHE 109 Cb -0.11 0.37 -0.04 0.00 -0.57 0.00 0.00 43.02 42.68 2eh0 s PHE 109 CO 0.49 -0.39 0.34 0.50 -0.10 0.00 0.00 175.22 176.05 2eh0 s ARG 110 N 1.21 3.97 -0.54 0.44 3.52 -0.08 -2.59 118.95 124.88 2eh0 s ARG 110 Ca -0.07 -0.06 -0.28 0.00 -0.13 0.00 0.00 55.73 55.18 2eh0 s ARG 110 Cb -0.06 -3.67 0.03 0.00 -1.56 0.00 0.00 34.95 29.69 2eh0 s ARG 110 CO -0.12 -0.27 1.13 0.12 -0.81 0.00 0.00 175.30 175.35 2eh0 s PHE 111 N 2.00 2.70 -0.34 5.12 5.36 -1.24 -0.86 117.98 130.72 2eh0 s PHE 111 Ca 0.13 0.44 -0.17 0.00 -0.96 0.00 0.00 56.93 56.37 2eh0 s PHE 111 Cb -0.16 -4.42 -0.01 0.00 -0.34 0.00 0.00 43.02 38.10 2eh0 s PHE 111 CO 0.10 -1.45 0.46 -0.80 -1.46 0.00 0.00 175.22 172.07 2eh0 s ASN 112 N 2.78 6.27 -0.66 6.13 -0.87 -0.39 -2.68 114.94 125.52 2eh0 s ASN 112 Ca 0.43 -0.07 0.05 0.00 -1.57 0.00 0.00 52.86 51.70 2eh0 s ASN 112 Cb -0.08 -2.24 0.26 0.00 -0.02 0.00 0.00 41.25 39.17 2eh0 s ASN 112 CO 0.27 -0.42 0.82 1.57 -2.57 0.00 0.00 177.10 176.77 2eh0 n HIS 113 N 5.60 3.63 0.01 2.20 -0.00 -1.26 -2.83 115.22 122.57 2eh0 n HIS 113 Ca -0.06 -4.05 -0.07 0.00 0.46 0.00 0.00 57.72 54.00 2eh0 n HIS 113 Cb 0.49 -0.59 0.11 0.00 -0.12 0.00 0.00 29.99 29.88 2eh0 n HIS 113 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2eh0 h PRO 114 N 4.11 0.50 -0.69 1.57 0.13 -1.92 0.22 132.00 135.93 2eh0 h PRO 114 Ca 0.19 -0.27 0.13 0.00 -0.87 0.00 0.00 66.00 65.19 2eh0 h PRO 114 Cb 0.64 0.01 -0.09 0.00 0.13 0.00 0.00 31.00 31.69 2eh0 h PRO 114 CO 0.87 0.84 0.22 1.49 -0.23 0.00 0.00 178.00 181.19 2eh0 h GLU 115 N 0.41 0.35 0.09 0.86 4.81 -1.89 -0.90 114.58 118.30 2eh0 h GLU 115 Ca 0.03 -0.02 -0.30 0.00 -0.13 0.00 0.00 59.36 58.94 2eh0 h GLU 115 Cb 0.93 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.21 2eh0 h GLU 115 CO 0.08 0.23 -1.60 0.37 -0.73 0.00 0.00 179.01 177.36 2eh0 h GLN 116 N 0.36 0.20 0.00 1.92 5.75 -1.92 -3.34 115.11 118.08 2eh0 h GLN 116 Ca 0.37 -0.34 0.00 0.00 -0.15 0.00 0.00 58.65 58.54 2eh0 h GLN 116 Cb 0.56 0.13 0.00 0.00 1.07 0.00 0.00 27.48 29.24 2eh0 h GLN 116 CO -0.41 1.16 0.31 0.00 -2.65 0.00 0.00 178.83 177.24 2eh0 h ALA 117 N -0.11 1.24 0.04 3.38 0.00 -0.74 0.49 119.26 123.56 2eh0 h ALA 117 Ca -0.36 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.32 2eh0 h ALA 117 Cb 1.76 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.53 2eh0 h ALA 117 CO 0.01 -0.24 -1.06 0.07 0.00 0.00 0.00 179.25 178.03 2eh0 h ARG 118 N 0.00 0.11 0.00 0.00 0.11 -1.28 -3.23 114.38 110.09 2eh0 h ARG 118 Ca 0.00 -0.18 0.00 0.00 0.10 0.00 0.00 59.98 59.90 2eh0 h ARG 118 Cb 0.61 0.06 0.00 0.00 1.11 0.00 0.00 29.97 31.76 2eh0 h ARG 118 CO 0.00 1.06 -0.55 0.00 0.10 0.00 0.00 179.97 180.58 2eh0 n ALA 119 N -2.42 3.25 -0.43 0.08 0.00 0.17 -4.20 120.51 116.94 2eh0 n ALA 119 Ca -0.03 -0.30 0.37 0.00 0.00 0.00 0.00 53.44 53.48 2eh0 n ALA 119 Cb 0.95 -1.15 0.64 0.00 0.00 0.00 0.00 19.45 19.89 2eh0 n ALA 119 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2eh0 n GLU 120 N -1.75 -0.04 0.14 0.00 0.28 -0.84 0.10 120.64 118.54 2eh0 n GLU 120 Ca 0.05 1.23 -0.11 0.00 -0.16 0.00 0.00 57.16 58.16 2eh0 n GLU 120 Cb 0.38 -2.39 -0.07 0.00 1.43 0.00 0.00 31.44 30.80 2eh0 n GLU 120 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2eh0 h ARG 121 N 0.00 -0.41 -0.95 3.44 2.47 -1.82 -3.23 114.38 113.88 2eh0 h ARG 121 Ca 0.84 0.03 0.29 0.00 -1.26 0.00 0.00 59.98 59.88 2eh0 h ARG 121 Cb 2.64 0.09 -0.17 0.00 -1.65 0.00 0.00 29.97 30.89 2eh0 h ARG 121 CO -0.50 -0.08 0.23 0.93 0.56 0.00 0.00 179.97 181.11 2eh0 h GLU 122 N -0.93 0.08 -6.06 0.04 5.08 -0.61 -3.42 114.58 108.77 2eh0 h GLU 122 Ca -0.04 -0.01 -0.53 0.00 -1.00 0.00 0.00 59.36 57.78 2eh0 h GLU 122 Cb 0.51 -0.02 0.24 0.00 0.50 0.00 0.00 28.75 29.99 2eh0 h GLU 122 CO 0.07 0.06 -2.00 1.17 -1.00 0.00 0.00 179.01 177.30 2eh0 n LYS 123 N -5.33 -0.05 -1.46 2.33 4.81 -0.89 -4.71 118.16 112.85 2eh0 n LYS 123 Ca 0.26 -0.01 -0.47 0.00 -0.87 0.00 0.00 58.31 57.22 2eh0 n LYS 123 Cb 0.86 -1.06 -0.03 0.00 0.02 0.00 0.00 35.03 34.82 2eh0 n LYS 123 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2eh0 n THR 124 N -2.86 1.95 0.00 3.15 -2.24 -1.26 -4.91 114.28 108.11 2eh0 n THR 124 Ca -0.01 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.28 2eh0 n THR 124 Cb 0.61 -0.33 0.00 0.00 -2.10 0.00 0.00 70.33 68.51 2eh0 n THR 124 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2eh0 n SER 125 N 1.75 1.77 -0.25 3.42 7.64 -1.26 -4.84 113.62 121.84 2eh0 n SER 125 Ca 0.15 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.97 2eh0 n SER 125 Cb 0.27 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.41 2eh0 n SER 125 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eh0 n GLY 126 N 2.99 -2.58 3.72 0.23 0.00 -1.26 -4.53 105.19 103.76 2eh0 n GLY 126 Ca 0.00 0.90 -0.30 0.00 0.00 0.00 0.00 46.02 46.62 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 -4.57 1.32 0.02 1.61 0.04 -1.26 -5.07 135.00 127.09 2eh0 s PRO 127 Ca -0.07 0.84 0.08 0.00 0.04 0.00 0.00 61.00 61.89 2eh0 s PRO 127 Cb 0.06 -1.82 -0.02 0.00 0.04 0.00 0.00 34.50 32.77 2eh0 s PRO 127 CO 0.36 -2.20 -0.24 -1.54 0.04 0.00 0.00 177.00 173.42 2eh0 s SER 128 N -3.43 2.90 0.50 6.66 1.04 -1.26 -5.07 113.70 115.04 2eh0 s SER 128 Ca 0.63 -0.51 0.02 0.00 0.48 0.00 0.00 55.95 56.57 2eh0 s SER 128 Cb -0.18 -0.29 -0.02 0.00 0.10 0.00 0.00 66.02 65.64 2eh0 s SER 128 CO 0.57 0.26 0.01 -0.44 0.98 0.00 0.00 173.24 174.61 2eh0 s SER 129 N -0.92 4.11 0.00 7.02 0.01 -1.26 -5.21 113.70 117.45 2eh0 s SER 129 Ca 0.10 -1.63 0.00 0.00 1.31 0.00 0.00 55.95 55.73 2eh0 s SER 129 Cb -0.09 0.44 0.00 0.00 0.21 0.00 0.00 66.02 66.58 2eh0 s SER 129 CO 0.01 -0.82 0.00 0.61 0.41 0.00 0.00 173.24 173.45