#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 3.45 -0.14 1.61 1.04 -1.26 -5.10 113.70 113.30 2eh0 s SER 2 Ca 0.00 -0.72 -0.29 0.00 0.48 0.00 0.00 55.95 55.42 2eh0 s SER 2 Cb 0.00 -1.52 0.09 0.00 0.10 0.00 0.00 66.02 64.68 2eh0 s SER 2 CO 0.00 -0.03 0.78 -0.55 0.98 0.00 0.00 173.24 174.42 2eh0 s SER 3 N 1.29 -0.61 0.22 7.02 0.15 -1.26 -5.19 113.70 115.33 2eh0 s SER 3 Ca 0.03 0.84 0.04 0.00 0.70 0.00 0.00 55.95 57.56 2eh0 s SER 3 Cb -0.14 0.73 -0.02 0.00 -1.71 0.00 0.00 66.02 64.89 2eh0 s SER 3 CO -0.11 -0.44 0.15 0.61 1.20 0.00 0.00 173.24 174.66 2eh0 n GLY 4 N 1.39 3.40 2.82 9.45 0.00 -1.26 -5.16 105.19 115.82 2eh0 n GLY 4 Ca -0.16 -1.87 -0.18 0.00 0.00 0.00 0.00 46.02 43.82 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 -2.47 0.67 0.43 1.61 0.15 -1.26 -5.15 113.70 107.68 2eh0 s SER 5 Ca 0.22 -0.04 0.07 0.00 0.70 0.00 0.00 55.95 56.89 2eh0 s SER 5 Cb 0.01 -0.28 -0.04 0.00 -1.71 0.00 0.00 66.02 64.00 2eh0 s SER 5 CO 0.15 -0.11 0.20 -0.55 1.20 0.00 0.00 173.24 174.13 2eh0 s SER 6 N 1.16 4.45 0.00 5.45 0.15 -1.26 -5.13 113.70 118.51 2eh0 s SER 6 Ca -0.08 -1.13 0.00 0.00 0.70 0.00 0.00 55.95 55.45 2eh0 s SER 6 Cb -0.13 -0.31 0.00 0.00 -1.71 0.00 0.00 66.02 63.86 2eh0 s SER 6 CO -0.02 -0.63 0.00 0.61 1.20 0.00 0.00 173.24 174.40 2eh0 n GLY 7 N -1.31 0.27 1.47 9.45 0.00 -1.26 -5.06 105.19 108.75 2eh0 n GLY 7 Ca -0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.06 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 0.00 -1.91 -2.04 2.61 5.66 -1.26 -4.54 114.28 112.80 2eh0 n THR 8 Ca 0.00 1.14 -0.35 0.00 -3.05 0.00 0.00 64.05 61.79 2eh0 n THR 8 Cb 0.00 -1.84 -0.04 0.00 -1.55 0.00 0.00 70.33 66.91 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 -4.94 2.60 -0.01 1.09 0.04 -1.26 -4.62 135.00 127.91 2eh0 s PRO 9 Ca 0.00 0.35 0.07 0.00 0.04 0.00 0.00 61.00 61.46 2eh0 s PRO 9 Cb 0.00 -4.58 -0.02 0.00 0.04 0.00 0.00 34.50 29.93 2eh0 s PRO 9 CO 0.00 -2.92 -0.23 -3.38 0.04 0.00 0.00 177.00 170.51 2eh0 s HIS 10 N 9.37 2.43 -0.18 0.56 -3.43 -1.11 -1.93 115.29 121.00 2eh0 s HIS 10 Ca 0.68 -0.36 -0.12 0.00 -0.80 0.00 0.00 55.06 54.47 2eh0 s HIS 10 Cb -0.11 -1.51 -0.05 0.00 -1.43 0.00 0.00 32.58 29.49 2eh0 s HIS 10 CO 0.15 0.07 0.20 -0.51 -2.00 0.00 0.00 174.74 172.64 2eh0 s LEU 11 N -0.83 4.23 0.29 5.38 1.43 0.18 -1.70 118.68 127.66 2eh0 s LEU 11 Ca 0.11 0.35 -0.03 0.00 -1.03 0.00 0.00 54.13 53.54 2eh0 s LEU 11 Cb -0.10 -2.21 -0.04 0.00 0.03 0.00 0.00 46.19 43.86 2eh0 s LEU 11 CO 0.00 0.15 0.53 -0.69 0.23 0.00 0.00 176.35 176.57 2eh0 s VAL 12 N 0.40 5.08 -0.57 -1.59 1.01 0.44 0.52 120.40 125.68 2eh0 s VAL 12 Ca 0.12 -0.15 -0.19 0.00 0.00 0.00 0.00 61.98 61.76 2eh0 s VAL 12 Cb -0.12 -3.77 0.09 0.00 0.00 0.00 0.00 36.38 32.58 2eh0 s VAL 12 CO 0.01 -0.36 0.71 0.21 0.00 0.00 0.00 175.10 175.66 2eh0 s ASN 13 N -3.40 6.20 0.00 3.32 3.84 0.67 -1.44 114.94 124.13 2eh0 s ASN 13 Ca 0.42 -1.22 0.05 0.00 0.21 0.00 0.00 52.86 52.31 2eh0 s ASN 13 Cb -0.10 -2.31 0.13 0.00 -0.55 0.00 0.00 41.25 38.42 2eh0 s ASN 13 CO 0.32 -1.08 1.10 0.00 -2.79 0.00 0.00 177.10 174.64 2eh0 n LEU 14 N 6.42 2.37 -4.10 3.21 -0.00 -1.26 -4.97 117.00 118.68 2eh0 n LEU 14 Ca -0.08 -1.97 -0.35 0.00 -0.00 0.00 0.00 56.01 53.61 2eh0 n LEU 14 Cb 0.44 -0.10 0.09 0.00 -0.00 0.00 0.00 43.42 43.85 2eh0 n LEU 14 CO 0.58 0.59 -1.41 -0.46 -0.00 0.00 0.00 177.39 176.69 2eh0 n ASN 15 N -0.05 -2.73 0.00 1.45 0.23 -1.24 -4.76 115.26 108.16 2eh0 n ASN 15 Ca 0.05 -0.07 0.01 0.00 -0.53 0.00 0.00 54.58 54.04 2eh0 n ASN 15 Cb 0.32 -0.68 0.06 0.00 -2.08 0.00 0.00 39.78 37.39 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 0.56 0.91 -3.55 -3.83 0.28 -1.26 -4.38 120.64 109.37 2eh0 n GLU 16 Ca -0.01 0.00 -0.39 0.00 -0.16 0.00 0.00 57.16 56.60 2eh0 n GLU 16 Cb 0.67 -1.03 -0.05 0.00 1.43 0.00 0.00 31.44 32.47 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 -1.15 6.37 0.00 -1.84 1.01 -1.26 -4.87 116.67 114.93 2eh0 s ASP 17 Ca 0.03 -3.63 0.15 0.00 0.71 0.00 0.00 52.55 49.82 2eh0 s ASP 17 Cb 0.01 -2.00 0.91 0.00 1.01 0.00 0.00 42.92 42.85 2eh0 s ASP 17 CO 0.02 -0.23 1.32 -0.81 0.21 0.00 0.00 175.17 175.69 2eh0 n PRO 18 N 2.53 0.49 0.00 8.23 -0.04 -1.26 -1.80 135.00 143.14 2eh0 n PRO 18 Ca 0.21 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.73 2eh0 n PRO 18 Cb 0.38 -1.49 -0.06 0.00 -0.04 0.00 0.00 33.50 32.28 2eh0 n PRO 18 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2eh0 n LEU 19 N -0.99 0.72 -4.21 1.53 4.77 -1.26 -5.01 117.00 112.55 2eh0 n LEU 19 Ca 0.11 -0.54 -0.60 0.00 -0.03 0.00 0.00 56.01 54.96 2eh0 n LEU 19 Cb 0.05 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.05 2eh0 n LEU 19 CO 0.09 0.17 1.03 1.15 -1.33 0.00 0.00 177.39 178.50 2eh0 n MET 20 N -1.15 0.00 -0.36 3.23 0.00 -0.74 -4.78 117.12 113.31 2eh0 n MET 20 Ca 0.03 0.00 0.05 0.00 0.00 0.00 0.00 57.70 57.78 2eh0 n MET 20 Cb 0.21 -1.33 0.20 0.00 0.00 0.00 0.00 33.22 32.30 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 3.63 2.91 -1.22 3.17 7.64 -1.26 -4.88 113.62 123.60 2eh0 n SER 21 Ca 0.28 -2.29 0.00 0.00 1.01 0.00 0.00 58.87 57.87 2eh0 n SER 21 Cb -0.05 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 62.69 2eh0 n SER 21 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2eh0 n GLU 22 N 0.46 1.86 -1.99 1.43 4.71 -1.26 -5.05 120.64 120.80 2eh0 n GLU 22 Ca 0.14 0.00 -0.39 0.00 -0.01 0.00 0.00 57.16 56.90 2eh0 n GLU 22 Cb 0.57 0.00 0.01 0.00 -1.01 0.00 0.00 31.44 31.01 2eh0 n GLU 22 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2eh0 h LEU 24 N 2.36 0.76 0.00 0.00 -0.00 -1.96 -3.46 115.31 113.02 2eh0 h LEU 24 Ca -0.50 -0.57 -0.34 0.00 -0.00 0.00 0.00 57.88 56.47 2eh0 h LEU 24 Cb 1.26 -0.23 -0.08 0.00 -0.00 0.00 0.00 40.66 41.60 2eh0 h LEU 24 CO 0.61 1.36 -0.23 0.00 -0.00 0.00 0.00 178.44 180.18 2eh0 n LEU 25 N -3.84 0.00 -3.70 1.67 -0.00 -1.26 -0.24 117.00 109.64 2eh0 n LEU 25 Ca -0.08 -2.98 -0.16 0.00 -0.00 0.00 0.00 56.01 52.78 2eh0 n LEU 25 Cb 0.82 2.35 -0.15 0.00 -0.00 0.00 0.00 43.42 46.44 2eh0 n LEU 25 CO 0.53 -0.63 -0.24 -0.31 -0.00 0.00 0.00 177.39 176.73 2eh0 s TYR 26 N -3.00 -0.15 -0.00 1.47 1.51 0.18 -4.95 117.35 112.40 2eh0 s TYR 26 Ca 0.32 0.54 -0.16 0.00 -1.01 0.00 0.00 57.07 56.76 2eh0 s TYR 26 Cb -0.00 -0.22 -0.06 0.00 -0.11 0.00 0.00 41.96 41.57 2eh0 s TYR 26 CO 0.23 -0.23 0.45 0.71 -1.11 0.00 0.00 175.55 175.60 2eh0 s TYR 27 N 1.90 3.71 -0.20 2.71 1.51 -1.26 0.49 117.35 126.22 2eh0 s TYR 27 Ca -0.01 1.03 -0.07 0.00 -1.01 0.00 0.00 57.07 57.01 2eh0 s TYR 27 Cb -0.12 -2.37 -0.04 0.00 -0.11 0.00 0.00 41.96 39.33 2eh0 s TYR 27 CO -0.06 0.57 0.06 0.42 -1.11 0.00 0.00 175.55 175.42 2eh0 s ILE 28 N -0.84 4.58 0.41 2.71 1.01 -0.81 -4.97 121.20 123.28 2eh0 s ILE 28 Ca 0.25 -0.10 -0.07 0.00 0.00 0.00 0.00 60.65 60.73 2eh0 s ILE 28 Cb -0.17 -3.08 0.11 0.00 0.01 0.00 0.00 42.46 39.33 2eh0 s ILE 28 CO 0.14 0.43 0.25 0.29 0.00 0.00 0.00 174.94 176.05 2eh0 n LYS 29 N 3.90 -2.70 -3.40 2.79 4.01 -1.26 -4.41 118.16 117.09 2eh0 n LYS 29 Ca -0.16 -0.42 -0.43 0.00 -0.51 0.00 0.00 58.31 56.79 2eh0 n LYS 29 Cb 0.52 -0.52 -0.01 0.00 -0.51 0.00 0.00 35.03 34.50 2eh0 n LYS 29 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89 2eh0 n ASP 30 N -3.77 5.27 0.00 4.39 5.68 -1.26 -4.70 116.55 122.16 2eh0 n ASP 30 Ca 0.04 -3.06 0.00 0.00 -0.50 0.00 0.00 54.79 51.27 2eh0 n ASP 30 Cb 0.17 -1.31 0.00 0.00 -1.14 0.00 0.00 41.12 38.83 2eh0 n ASP 30 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2eh0 n GLY 31 N 2.59 -0.36 3.40 6.12 0.00 0.42 -4.89 105.19 112.46 2eh0 n GLY 31 Ca 0.24 0.33 -0.33 0.00 0.00 0.00 0.00 46.02 46.26 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 2.94 -0.28 -0.61 1.09 -1.26 0.55 121.20 123.64 2eh0 s ILE 32 Ca 0.00 -0.73 0.00 0.00 -1.10 0.00 0.00 60.65 58.82 2eh0 s ILE 32 Cb 0.00 -2.19 0.08 0.00 -1.06 0.00 0.00 42.46 39.29 2eh0 s ILE 32 CO 0.00 0.55 0.03 -0.89 -0.10 0.00 0.00 174.94 174.54 2eh0 s THR 33 N -0.11 1.30 -0.46 2.92 2.01 0.39 -4.95 115.64 116.73 2eh0 s THR 33 Ca -0.02 -1.41 -0.29 0.00 0.31 0.00 0.00 61.69 60.28 2eh0 s THR 33 Cb -0.14 -1.82 0.03 0.00 0.01 0.00 0.00 72.50 70.59 2eh0 s THR 33 CO 0.04 -0.42 1.12 -0.13 -0.69 0.00 0.00 174.62 174.54 2eh0 s ARG 34 N 1.45 3.74 0.10 4.92 0.52 -1.26 -0.02 118.95 128.39 2eh0 s ARG 34 Ca 0.04 0.58 -0.16 0.00 -0.52 0.00 0.00 55.73 55.66 2eh0 s ARG 34 Cb -0.18 -3.90 -0.07 0.00 0.52 0.00 0.00 34.95 31.33 2eh0 s ARG 34 CO -0.14 -1.34 0.54 0.08 0.02 0.00 0.00 175.30 174.46 2eh0 s VAL 35 N 4.35 4.83 0.00 3.52 1.01 0.11 -2.62 120.40 131.62 2eh0 s VAL 35 Ca 0.47 0.99 0.00 0.00 0.00 0.00 0.00 61.98 63.44 2eh0 s VAL 35 Cb -0.08 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.51 2eh0 s VAL 35 CO 0.30 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.43 2eh0 n GLY 36 N 1.31 -0.56 3.99 4.51 0.00 -1.08 -2.27 105.19 111.09 2eh0 n GLY 36 Ca -0.09 -0.12 -0.18 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.44 2.79 0.14 1.61 -1.52 -1.07 -1.71 119.66 119.47 2eh0 s GLN 37 Ca 0.00 -1.28 0.18 0.00 -1.95 0.00 0.00 55.36 52.30 2eh0 s GLN 37 Cb 0.00 -2.70 -0.05 0.00 -0.22 0.00 0.00 33.01 30.04 2eh0 s GLN 37 CO 0.00 -0.25 1.01 0.00 -0.25 0.00 0.00 175.29 175.80 2eh0 h ALA 38 N 0.71 0.64 0.00 6.09 0.00 -1.90 -3.32 119.26 121.47 2eh0 h ALA 38 Ca -0.40 -0.57 -0.05 0.00 0.00 0.00 0.00 54.91 53.88 2eh0 h ALA 38 Cb 1.28 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 2eh0 h ALA 38 CO 0.47 0.64 -0.25 0.22 0.00 0.00 0.00 179.25 180.34 2eh0 h ASP 39 N 0.00 0.00 -0.89 0.00 1.82 -1.96 -3.43 116.42 111.96 2eh0 h ASP 39 Ca -0.09 0.00 -0.65 0.00 -0.39 0.00 0.00 57.03 55.89 2eh0 h ASP 39 Cb 1.41 0.00 0.07 0.00 0.68 0.00 0.00 39.33 41.49 2eh0 h ASP 39 CO 0.04 0.25 -0.21 0.00 -1.61 0.00 0.00 179.24 177.70 2eh0 n ALA 40 N -2.19 -3.00 -0.40 -0.78 0.00 -1.25 -4.68 120.51 108.21 2eh0 n ALA 40 Ca 0.02 0.46 0.35 0.00 0.00 0.00 0.00 53.44 54.27 2eh0 n ALA 40 Cb 0.54 -1.50 0.60 0.00 0.00 0.00 0.00 19.45 19.08 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 1.11 -0.04 -3.90 0.00 1.02 -1.26 -3.44 120.64 114.14 2eh0 n GLU 41 Ca 0.17 1.14 -0.35 0.00 -0.02 0.00 0.00 57.16 58.10 2eh0 n GLU 41 Cb 0.15 -2.21 -0.14 0.00 -0.02 0.00 0.00 31.44 29.22 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 -5.11 2.44 -0.41 3.49 0.52 -1.26 -5.05 118.95 113.56 2eh0 s ARG 42 Ca -0.07 -1.26 -0.38 0.00 -0.52 0.00 0.00 55.73 53.50 2eh0 s ARG 42 Cb 0.28 -3.19 -0.16 0.00 0.52 0.00 0.00 34.95 32.39 2eh0 s ARG 42 CO 0.73 -0.62 1.39 -2.13 0.02 0.00 0.00 175.30 174.69 2eh0 n ARG 43 N 4.63 0.00 -3.17 3.54 0.63 -1.22 -4.87 116.66 116.20 2eh0 n ARG 43 Ca -0.13 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.41 2eh0 n ARG 43 Cb 0.43 -1.23 -0.05 0.00 0.45 0.00 0.00 32.46 32.06 2eh0 n ARG 43 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 2eh0 s GLN 44 N 2.89 4.36 0.04 -0.14 -1.52 -1.25 -4.96 119.66 119.08 2eh0 s GLN 44 Ca 0.88 0.75 -0.12 0.00 -1.95 0.00 0.00 55.36 54.92 2eh0 s GLN 44 Cb -1.23 -3.38 -0.04 0.00 -0.22 0.00 0.00 33.01 28.14 2eh0 s GLN 44 CO 0.65 0.26 1.19 0.22 -0.25 0.00 0.00 175.29 177.36 2eh0 h ASP 45 N 6.06 -0.62 -3.79 5.90 3.58 -1.84 -3.38 116.42 122.34 2eh0 h ASP 45 Ca -0.44 0.08 -0.65 0.00 0.42 0.00 0.00 57.03 56.44 2eh0 h ASP 45 Cb 1.20 0.24 -0.19 0.00 1.72 0.00 0.00 39.33 42.30 2eh0 h ASP 45 CO 0.72 -0.16 -0.55 -0.63 -2.88 0.00 0.00 179.24 175.75 2eh0 s ILE 46 N -3.93 4.99 -0.28 2.25 1.01 -1.26 -5.07 121.20 118.91 2eh0 s ILE 46 Ca -0.05 -0.01 -0.11 0.00 0.00 0.00 0.00 60.65 60.48 2eh0 s ILE 46 Cb 0.03 -3.40 -0.05 0.00 0.01 0.00 0.00 42.46 39.04 2eh0 s ILE 46 CO 0.21 0.23 0.19 -0.69 0.00 0.00 0.00 174.94 174.88 2eh0 s VAL 47 N 1.71 5.31 0.45 2.92 1.01 -1.26 -2.63 120.40 127.90 2eh0 s VAL 47 Ca 0.07 0.17 -0.03 0.00 0.00 0.00 0.00 61.98 62.19 2eh0 s VAL 47 Cb -0.16 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.66 2eh0 s VAL 47 CO 0.09 0.25 0.71 -0.76 0.00 0.00 0.00 175.10 175.38 2eh0 s LEU 48 N 1.77 3.70 0.00 3.92 2.01 -0.69 -5.01 118.68 124.38 2eh0 s LEU 48 Ca 0.07 0.68 -0.01 0.00 0.01 0.00 0.00 54.13 54.88 2eh0 s LEU 48 Cb -0.16 -3.58 0.08 0.00 0.01 0.00 0.00 46.19 42.54 2eh0 s LEU 48 CO 0.11 -0.56 0.54 -1.20 1.01 0.00 0.00 176.35 176.24 2eh0 n SER 49 N -2.13 0.67 -0.34 2.29 7.64 -1.26 -4.83 113.62 115.66 2eh0 n SER 49 Ca -0.00 -1.58 0.04 0.00 1.01 0.00 0.00 58.87 58.33 2eh0 n SER 49 Cb 0.56 -0.35 -0.02 0.00 -1.01 0.00 0.00 64.21 63.39 2eh0 n SER 49 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eh0 n GLY 50 N 0.92 -2.83 1.30 0.23 0.00 -1.26 -4.69 105.19 98.85 2eh0 n GLY 50 Ca 0.09 -1.34 0.09 0.00 0.00 0.00 0.00 46.02 44.86 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 -2.48 2.72 -0.45 4.61 0.00 -1.26 -4.26 120.51 119.40 2eh0 n ALA 51 Ca -0.02 -1.50 0.10 0.00 0.00 0.00 0.00 53.44 52.02 2eh0 n ALA 51 Cb 0.16 -0.86 0.34 0.00 0.00 0.00 0.00 19.45 19.09 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 1.02 1.25 -3.50 0.00 8.25 -1.26 -4.95 115.22 116.03 2eh0 n HIS 52 Ca 0.23 -0.54 -0.19 0.00 -0.26 0.00 0.00 57.72 56.95 2eh0 n HIS 52 Cb 0.74 -0.13 -0.01 0.00 1.12 0.00 0.00 29.99 31.70 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 -1.48 3.98 -0.07 1.59 -1.09 -1.26 -4.59 121.20 118.28 2eh0 s ILE 53 Ca 0.50 -1.04 0.03 0.00 -2.23 0.00 0.00 60.65 57.90 2eh0 s ILE 53 Cb 0.29 -3.37 -0.02 0.00 -1.58 0.00 0.00 42.46 37.78 2eh0 s ILE 53 CO 0.28 -0.15 -0.15 -0.54 -1.23 0.00 0.00 174.94 173.15 2eh0 s LYS 54 N -4.16 2.70 0.23 2.79 -0.14 -1.26 -5.00 119.74 114.89 2eh0 s LYS 54 Ca 0.45 -0.71 0.02 0.00 -1.36 0.00 0.00 55.97 54.36 2eh0 s LYS 54 Cb -0.09 -2.41 0.57 0.00 -1.68 0.00 0.00 37.83 34.21 2eh0 s LYS 54 CO 0.31 0.51 1.14 0.39 -0.76 0.00 0.00 175.35 176.94 2eh0 n GLU 55 N 2.63 -0.06 -2.47 1.68 4.71 -1.26 0.58 120.64 126.45 2eh0 n GLU 55 Ca -0.17 1.09 -0.27 0.00 -0.01 0.00 0.00 57.16 57.79 2eh0 n GLU 55 Cb 0.52 -1.74 0.00 0.00 -1.01 0.00 0.00 31.44 29.22 2eh0 n GLU 55 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2eh0 n GLU 56 N -4.99 3.42 -0.00 3.49 1.02 -1.26 -2.58 120.64 119.73 2eh0 n GLU 56 Ca 0.17 -4.50 -0.00 0.00 -0.02 0.00 0.00 57.16 52.82 2eh0 n GLU 56 Cb 0.57 -2.25 -0.00 0.00 -0.02 0.00 0.00 31.44 29.74 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 -0.48 -0.00 -3.91 -0.32 -0.00 0.20 -4.36 115.22 106.34 2eh0 n HIS 57 Ca 0.39 0.01 -0.10 0.00 0.46 0.00 0.00 57.72 58.48 2eh0 n HIS 57 Cb 0.65 -0.37 -0.02 0.00 -0.12 0.00 0.00 29.99 30.14 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 -2.70 0.16 -0.24 0.00 1.01 -0.79 0.10 121.20 118.73 2eh0 s ILE 59 Ca 0.20 -1.28 0.01 0.00 0.00 0.00 0.00 60.65 59.59 2eh0 s ILE 59 Cb -0.01 -0.82 0.06 0.00 0.01 0.00 0.00 42.46 41.71 2eh0 s ILE 59 CO 0.15 -0.71 -0.07 -0.36 0.00 0.00 0.00 174.94 173.95 2eh0 s PHE 60 N -2.53 2.67 -0.48 3.97 0.08 0.97 -0.13 117.98 122.52 2eh0 s PHE 60 Ca -0.06 -1.92 -0.16 0.00 0.12 0.00 0.00 56.93 54.91 2eh0 s PHE 60 Cb -0.02 -1.69 0.08 0.00 -0.57 0.00 0.00 43.02 40.81 2eh0 s PHE 60 CO -0.05 -0.81 0.41 0.50 -0.10 0.00 0.00 175.22 175.17 2eh0 s ARG 61 N 1.30 2.98 -0.39 0.44 3.52 -0.10 -0.46 118.95 126.25 2eh0 s ARG 61 Ca -0.06 -1.36 -0.04 0.00 -0.13 0.00 0.00 55.73 54.14 2eh0 s ARG 61 Cb -0.19 -4.14 0.09 0.00 -1.56 0.00 0.00 34.95 29.15 2eh0 s ARG 61 CO -0.06 -1.05 0.17 -1.12 -0.81 0.00 0.00 175.30 172.43 2eh0 s SER 62 N 2.65 5.24 0.26 -2.12 0.01 0.19 -1.40 113.70 118.53 2eh0 s SER 62 Ca 0.04 -1.77 0.02 0.00 1.31 0.00 0.00 55.95 55.56 2eh0 s SER 62 Cb -0.24 -1.83 -0.04 0.00 0.21 0.00 0.00 66.02 64.12 2eh0 s SER 62 CO 0.07 -0.48 0.19 -1.61 0.41 0.00 0.00 173.24 171.81 2eh0 s GLU 63 N 1.22 1.44 -0.52 12.44 2.02 -0.76 -0.44 118.70 134.10 2eh0 s GLU 63 Ca 0.04 -1.80 -0.28 0.00 0.02 0.00 0.00 54.97 52.95 2eh0 s GLU 63 Cb -0.22 0.25 0.03 0.00 0.10 0.00 0.00 34.13 34.28 2eh0 s GLU 63 CO -0.02 -0.49 1.14 0.50 0.02 0.00 0.00 175.26 176.41 2eh0 s ARG 64 N -3.87 3.63 1.00 1.61 3.52 -1.26 -0.20 118.95 123.37 2eh0 s ARG 64 Ca 0.39 0.41 -0.13 0.00 -0.13 0.00 0.00 55.73 56.27 2eh0 s ARG 64 Cb 0.05 -3.95 0.17 0.00 -1.56 0.00 0.00 34.95 29.66 2eh0 s ARG 64 CO 0.18 -1.48 0.33 0.45 -0.81 0.00 0.00 175.30 173.97 2eh0 n SER 65 N 8.01 -3.01 0.28 -2.12 2.88 0.11 -4.67 113.62 115.11 2eh0 n SER 65 Ca 0.10 -0.39 0.17 0.00 -1.33 0.00 0.00 58.87 57.42 2eh0 n SER 65 Cb 0.49 -0.76 0.75 0.00 -0.75 0.00 0.00 64.21 63.94 2eh0 n SER 65 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 2eh0 h ASN 66 N -2.69 0.00 0.08 -3.46 2.35 -1.95 -1.72 115.58 108.18 2eh0 h ASN 66 Ca -0.23 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.52 2eh0 h ASN 66 Cb 0.74 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.11 2eh0 h ASN 66 CO 0.14 0.05 -0.10 -1.20 -1.65 0.00 0.00 177.43 174.67 2eh0 n SER 67 N -3.20 1.36 0.00 5.81 7.64 -1.26 -4.91 113.62 119.07 2eh0 n SER 67 Ca -0.00 -1.28 0.00 0.00 1.01 0.00 0.00 58.87 58.59 2eh0 n SER 67 Cb 0.28 0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 2eh0 n SER 67 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eh0 n GLY 68 N 1.24 0.69 3.66 0.23 0.00 -0.65 -5.04 105.19 105.33 2eh0 n GLY 68 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.62 4.17 -0.16 1.61 -1.05 -1.26 -4.67 118.70 116.71 2eh0 s GLU 69 Ca 0.00 0.25 -0.29 0.00 -0.15 0.00 0.00 54.97 54.78 2eh0 s GLU 69 Cb 0.00 -3.55 -0.05 0.00 -0.44 0.00 0.00 34.13 30.09 2eh0 s GLU 69 CO 0.00 -0.09 1.99 0.08 0.95 0.00 0.00 175.26 178.19 2eh0 s VAL 70 N 1.45 3.20 0.18 1.83 1.01 -1.26 0.09 120.40 126.90 2eh0 s VAL 70 Ca 0.20 0.22 0.09 0.00 0.00 0.00 0.00 61.98 62.49 2eh0 s VAL 70 Cb -0.15 -3.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.97 2eh0 s VAL 70 CO 0.09 -0.10 -0.10 -0.63 0.00 0.00 0.00 175.10 174.35 2eh0 s ILE 71 N 6.55 3.14 -0.06 2.22 -1.09 0.71 -4.63 121.20 128.04 2eh0 s ILE 71 Ca 0.89 -1.69 0.04 0.00 -2.23 0.00 0.00 60.65 57.67 2eh0 s ILE 71 Cb -0.33 -2.56 -0.00 0.00 -1.58 0.00 0.00 42.46 37.99 2eh0 s ILE 71 CO 0.35 -0.12 -0.19 -0.69 -1.23 0.00 0.00 174.94 173.07 2eh0 s VAL 72 N -1.72 1.57 -0.04 2.92 1.01 -1.26 -1.83 120.40 121.06 2eh0 s VAL 72 Ca 0.25 -0.77 0.03 0.00 0.00 0.00 0.00 61.98 61.49 2eh0 s VAL 72 Cb -0.09 -1.36 0.00 0.00 0.00 0.00 0.00 36.38 34.93 2eh0 s VAL 72 CO 0.15 0.45 -0.14 -0.89 0.00 0.00 0.00 175.10 174.67 2eh0 s THR 73 N 0.18 1.16 -0.25 3.92 2.01 -0.50 -0.39 115.64 121.76 2eh0 s THR 73 Ca -0.08 -0.56 -0.16 0.00 0.31 0.00 0.00 61.69 61.19 2eh0 s THR 73 Cb -0.14 -1.01 -0.03 0.00 0.01 0.00 0.00 72.50 71.33 2eh0 s THR 73 CO 0.04 0.34 0.44 -0.22 -0.69 0.00 0.00 174.62 174.53 2eh0 s LEU 74 N 0.13 4.06 -0.93 4.42 2.96 -0.09 -0.92 118.68 128.31 2eh0 s LEU 74 Ca -0.04 0.43 -0.04 0.00 -0.22 0.00 0.00 54.13 54.27 2eh0 s LEU 74 Cb -0.10 -2.55 0.23 0.00 0.50 0.00 0.00 46.19 44.26 2eh0 s LEU 74 CO 0.02 -0.22 0.84 -1.61 -1.32 0.00 0.00 176.35 174.06 2eh0 s GLU 75 N 2.07 3.45 0.67 1.98 2.02 0.81 -2.88 118.70 126.81 2eh0 s GLU 75 Ca 0.18 -3.22 -0.15 0.00 0.02 0.00 0.00 54.97 51.81 2eh0 s GLU 75 Cb -0.16 -4.09 0.00 0.00 0.10 0.00 0.00 34.13 29.99 2eh0 s GLU 75 CO 0.09 -1.26 1.11 -1.25 0.02 0.00 0.00 175.26 173.98 2eh0 s PRO 76 N -1.25 2.77 0.39 0.39 0.04 -1.26 -1.89 135.00 134.19 2eh0 s PRO 76 Ca 0.27 1.38 -0.03 0.00 0.04 0.00 0.00 61.00 62.66 2eh0 s PRO 76 Cb -0.08 -1.95 0.08 0.00 0.04 0.00 0.00 34.50 32.59 2eh0 s PRO 76 CO -0.11 -1.27 0.54 0.00 0.04 0.00 0.00 177.00 176.19 2eh0 s GLU 78 N -3.97 4.36 -1.12 0.00 2.56 -1.26 -3.79 118.70 115.48 2eh0 s GLU 78 Ca 0.33 0.99 -0.06 0.00 0.00 0.00 0.00 54.97 56.22 2eh0 s GLU 78 Cb -0.01 -3.53 0.01 0.00 2.00 0.00 0.00 34.13 32.60 2eh0 s GLU 78 CO 0.22 -0.18 0.86 0.54 -0.56 0.00 0.00 175.26 176.14 2eh0 n ARG 79 N 4.67 -5.91 -3.70 4.30 5.12 -1.26 -4.99 116.66 114.90 2eh0 n ARG 79 Ca 0.03 0.68 -0.36 0.00 -1.93 0.00 0.00 57.85 56.26 2eh0 n ARG 79 Cb 0.50 -5.21 -0.09 0.00 -1.16 0.00 0.00 32.46 26.49 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 -3.16 6.10 -0.66 0.55 1.04 -1.25 -4.98 113.70 111.34 2eh0 s SER 80 Ca 0.43 0.13 -0.27 0.00 0.48 0.00 0.00 55.95 56.71 2eh0 s SER 80 Cb -0.19 -2.09 -0.26 0.00 0.10 0.00 0.00 66.02 63.58 2eh0 s SER 80 CO 0.53 0.10 1.87 1.21 0.98 0.00 0.00 173.24 177.93 2eh0 n GLU 81 N 4.08 0.43 -4.56 4.02 4.07 -1.26 -4.83 120.64 122.59 2eh0 n GLU 81 Ca -0.15 -1.56 -0.22 0.00 -0.06 0.00 0.00 57.16 55.17 2eh0 n GLU 81 Cb 0.52 -3.26 -0.15 0.00 -0.06 0.00 0.00 31.44 28.50 2eh0 n GLU 81 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 2eh0 s THR 82 N 11.24 1.13 -0.10 6.31 2.01 -1.26 -2.51 115.64 132.45 2eh0 s THR 82 Ca 0.72 -0.73 -0.05 0.00 0.31 0.00 0.00 61.69 61.95 2eh0 s THR 82 Cb 0.05 -0.96 0.05 0.00 0.01 0.00 0.00 72.50 71.65 2eh0 s THR 82 CO 0.23 0.22 0.23 -0.31 -0.69 0.00 0.00 174.62 174.31 2eh0 s TYR 83 N -0.49 -0.32 -0.12 4.92 1.51 -0.68 -2.92 117.35 119.26 2eh0 s TYR 83 Ca 0.04 0.78 0.02 0.00 -1.01 0.00 0.00 57.07 56.90 2eh0 s TYR 83 Cb -0.06 -0.02 -0.01 0.00 -0.11 0.00 0.00 41.96 41.76 2eh0 s TYR 83 CO 0.00 -0.26 -0.18 0.08 -1.11 0.00 0.00 175.55 174.09 2eh0 s VAL 84 N 1.61 2.63 -1.64 0.71 1.01 0.37 -0.28 120.40 124.80 2eh0 s VAL 84 Ca -0.06 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.11 2eh0 s VAL 84 Cb -0.11 -2.07 0.00 0.00 0.00 0.00 0.00 36.38 34.20 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 3.55 -5.15 0.00 3.32 5.03 -1.02 -1.81 115.26 119.18 2eh0 n ASN 85 Ca -0.19 0.15 0.00 0.00 0.87 0.00 0.00 54.58 55.41 2eh0 n ASN 85 Cb 0.53 -4.23 0.00 0.00 -1.02 0.00 0.00 39.78 35.06 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 -0.94 2.92 3.95 7.41 0.00 -1.26 -4.97 105.19 112.30 2eh0 n GLY 86 Ca -0.20 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 2eh0 n GLY 86 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eh0 s LYS 87 N -0.13 3.33 0.86 1.61 3.01 -0.75 -5.01 119.74 122.67 2eh0 s LYS 87 Ca 0.00 -0.41 -0.12 0.00 -1.01 0.00 0.00 55.97 54.43 2eh0 s LYS 87 Cb 0.00 -2.63 0.11 0.00 -1.01 0.00 0.00 37.83 34.30 2eh0 s LYS 87 CO 0.00 0.00 1.10 0.50 0.51 0.00 0.00 175.35 177.46 2eh0 s ARG 88 N -4.40 1.52 -0.22 1.68 3.52 -1.26 0.14 118.95 119.94 2eh0 s ARG 88 Ca 0.43 0.73 -0.04 0.00 -0.13 0.00 0.00 55.73 56.72 2eh0 s ARG 88 Cb -0.10 -1.85 0.10 0.00 -1.56 0.00 0.00 34.95 31.55 2eh0 s ARG 88 CO 0.37 -2.03 0.24 0.54 -0.81 0.00 0.00 175.30 173.60 2eh0 s VAL 89 N -3.03 -0.34 0.00 7.11 0.11 -1.15 -4.50 120.40 118.60 2eh0 s VAL 89 Ca 0.63 -0.17 0.00 0.00 -2.93 0.00 0.00 61.98 59.51 2eh0 s VAL 89 Cb -0.17 -0.72 0.00 0.00 -1.53 0.00 0.00 36.38 33.96 2eh0 s VAL 89 CO 0.56 -0.24 0.10 -0.24 -3.33 0.00 0.00 175.10 171.95 2eh0 n SER 90 N 5.32 0.21 -4.49 3.54 2.88 -1.26 -4.68 113.62 115.14 2eh0 n SER 90 Ca -0.05 -0.60 -0.26 0.00 -1.33 0.00 0.00 58.87 56.63 2eh0 n SER 90 Cb 0.49 0.78 -0.11 0.00 -0.75 0.00 0.00 64.21 64.63 2eh0 n SER 90 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2eh0 s GLN 91 N -0.78 1.75 -0.71 -1.46 -2.07 -1.26 -4.70 119.66 110.42 2eh0 s GLN 91 Ca 0.00 -1.46 -0.26 0.00 -1.82 0.00 0.00 55.36 51.82 2eh0 s GLN 91 Cb 0.00 -1.96 -0.03 0.00 -1.09 0.00 0.00 33.01 29.93 2eh0 s GLN 91 CO 0.00 0.40 1.89 -1.25 -1.32 0.00 0.00 175.29 175.01 2eh0 s PRO 92 N -2.86 2.60 0.17 9.60 0.04 -1.26 -4.62 135.00 138.68 2eh0 s PRO 92 Ca 0.24 0.31 0.11 0.00 0.04 0.00 0.00 61.00 61.69 2eh0 s PRO 92 Cb -0.08 -4.61 -0.04 0.00 0.04 0.00 0.00 34.50 29.81 2eh0 s PRO 92 CO 0.13 -2.95 -0.23 0.14 0.04 0.00 0.00 177.00 174.12 2eh0 s VAL 93 N 9.43 2.19 0.20 -0.36 -7.23 -1.14 -4.91 120.40 118.59 2eh0 s VAL 93 Ca 0.68 -1.95 -0.30 0.00 -1.81 0.00 0.00 61.98 58.61 2eh0 s VAL 93 Cb -0.11 -2.01 -0.09 0.00 0.56 0.00 0.00 36.38 34.73 2eh0 s VAL 93 CO 0.14 -0.13 1.27 -1.10 -0.31 0.00 0.00 175.10 174.96 2eh0 s GLN 94 N -2.58 4.42 0.46 4.82 -0.21 -1.26 -0.92 119.66 124.40 2eh0 s GLN 94 Ca 0.18 2.00 -0.21 0.00 0.02 0.00 0.00 55.36 57.35 2eh0 s GLN 94 Cb -0.08 -3.20 -0.09 0.00 1.00 0.00 0.00 33.01 30.64 2eh0 s GLN 94 CO 0.08 -0.19 1.05 -0.51 -2.12 0.00 0.00 175.29 173.60 2eh0 s LEU 95 N -0.26 3.93 -0.27 2.90 2.01 0.48 -4.88 118.68 122.59 2eh0 s LEU 95 Ca 0.55 1.97 -0.12 0.00 0.01 0.00 0.00 54.13 56.54 2eh0 s LEU 95 Cb -0.35 -4.45 -0.05 0.00 0.01 0.00 0.00 46.19 41.35 2eh0 s LEU 95 CO 0.38 -0.71 0.21 -0.60 1.01 0.00 0.00 176.35 176.65 2eh0 s ARG 96 N -3.02 3.99 -0.88 1.70 6.06 -1.26 -4.83 118.95 120.71 2eh0 s ARG 96 Ca 0.65 -0.24 -0.24 0.00 -2.50 0.00 0.00 55.73 53.39 2eh0 s ARG 96 Cb -0.18 -3.63 -0.18 0.00 0.06 0.00 0.00 34.95 31.02 2eh0 s ARG 96 CO 0.22 -0.13 2.23 0.43 -2.50 0.00 0.00 175.30 175.55 2eh0 n SER 97 N 4.90 1.27 0.00 -2.12 7.64 -1.26 -0.31 113.62 123.74 2eh0 n SER 97 Ca -0.13 -1.81 0.00 0.00 1.01 0.00 0.00 58.87 57.94 2eh0 n SER 97 Cb 0.52 -1.58 0.00 0.00 -1.01 0.00 0.00 64.21 62.14 2eh0 n SER 97 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eh0 n GLY 98 N 6.39 -0.39 1.61 0.23 0.00 0.44 -4.80 105.19 108.67 2eh0 n GLY 98 Ca 0.44 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.34 2eh0 n GLY 98 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2eh0 n ASN 99 N 0.00 0.06 -3.68 1.61 0.23 0.57 -4.75 115.26 109.30 2eh0 n ASN 99 Ca 0.00 -1.21 -0.27 0.00 -0.53 0.00 0.00 54.58 52.57 2eh0 n ASN 99 Cb 0.00 -0.42 -0.16 0.00 -2.08 0.00 0.00 39.78 37.12 2eh0 n ASN 99 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 2eh0 s ARG 100 N -4.19 0.45 -0.26 -3.83 0.52 -1.26 -2.74 118.95 107.64 2eh0 s ARG 100 Ca 0.31 -0.39 -0.17 0.00 -0.52 0.00 0.00 55.73 54.97 2eh0 s ARG 100 Cb -0.01 -1.94 -0.03 0.00 0.52 0.00 0.00 34.95 33.49 2eh0 s ARG 100 CO 0.22 -0.71 0.45 0.42 0.02 0.00 0.00 175.30 175.70 2eh0 s ILE 101 N 1.94 5.12 -0.26 1.52 1.09 -0.70 -2.43 121.20 127.49 2eh0 s ILE 101 Ca 0.02 0.75 -0.07 0.00 -1.10 0.00 0.00 60.65 60.24 2eh0 s ILE 101 Cb -0.17 -3.77 -0.02 0.00 -1.06 0.00 0.00 42.46 37.45 2eh0 s ILE 101 CO -0.12 0.13 0.07 -0.63 -0.10 0.00 0.00 174.94 174.29 2eh0 s ILE 102 N 2.08 4.21 -0.30 2.92 1.01 0.61 -1.91 121.20 129.82 2eh0 s ILE 102 Ca 0.19 -0.30 0.02 0.00 0.00 0.00 0.00 60.65 60.56 2eh0 s ILE 102 Cb -0.16 -3.01 0.09 0.00 0.01 0.00 0.00 42.46 39.39 2eh0 s ILE 102 CO 0.09 0.28 0.02 -0.04 0.00 0.00 0.00 174.94 175.30 2eh0 s MET 103 N 1.59 1.40 0.00 2.79 -1.94 -0.70 -1.68 119.30 120.76 2eh0 s MET 103 Ca 0.06 -1.41 0.00 0.00 -1.71 0.00 0.00 55.69 52.63 2eh0 s MET 103 Cb -0.15 -2.73 0.00 0.00 2.01 0.00 0.00 34.83 33.96 2eh0 s MET 103 CO 0.03 -0.83 0.00 0.41 -0.01 0.00 0.00 175.02 174.62 2eh0 n GLY 104 N 4.52 1.44 1.03 -0.03 0.00 -1.05 -4.33 105.19 106.77 2eh0 n GLY 104 Ca -0.03 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.17 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 -0.34 1.61 3.00 -1.26 -4.92 118.16 116.24 2eh0 n LYS 105 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 58.31 58.39 2eh0 n LYS 105 Cb 0.00 0.00 0.21 0.00 0.00 0.00 0.00 35.03 35.24 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 -2.01 3.11 -4.41 3.14 3.02 -1.26 -4.89 115.26 111.96 2eh0 n ASN 106 Ca 0.00 -3.14 -0.43 0.00 -0.03 0.00 0.00 54.58 50.97 2eh0 n ASN 106 Cb 0.00 -0.51 0.00 0.00 -0.61 0.00 0.00 39.78 38.66 2eh0 n ASN 106 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2eh0 n HIS 107 N -0.94 4.62 -4.06 3.10 8.25 -1.26 -4.56 115.22 120.37 2eh0 n HIS 107 Ca 0.20 -3.13 -0.36 0.00 -0.26 0.00 0.00 57.72 54.17 2eh0 n HIS 107 Cb 0.80 -2.32 -0.07 0.00 1.12 0.00 0.00 29.99 29.52 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 2.33 5.07 0.01 1.59 1.01 -1.26 -1.72 120.40 127.42 2eh0 s VAL 108 Ca 0.46 0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.48 2eh0 s VAL 108 Cb 0.01 -3.19 -0.01 0.00 0.00 0.00 0.00 36.38 33.19 2eh0 s VAL 108 CO 0.02 0.60 -0.06 -0.36 0.00 0.00 0.00 175.10 175.30 2eh0 s PHE 109 N -0.99 0.54 -0.18 5.22 0.08 -0.81 -3.64 117.98 118.21 2eh0 s PHE 109 Ca 0.15 -0.19 -0.13 0.00 0.12 0.00 0.00 56.93 56.87 2eh0 s PHE 109 Cb -0.12 -0.34 -0.05 0.00 -0.57 0.00 0.00 43.02 41.95 2eh0 s PHE 109 CO 0.04 -0.03 0.28 0.50 -0.10 0.00 0.00 175.22 175.91 2eh0 s ARG 110 N -0.49 4.23 -0.02 0.44 3.52 -0.52 -1.72 118.95 124.39 2eh0 s ARG 110 Ca -0.01 0.05 -0.29 0.00 -0.13 0.00 0.00 55.73 55.35 2eh0 s ARG 110 Cb -0.04 -3.45 -0.03 0.00 -1.56 0.00 0.00 34.95 29.87 2eh0 s ARG 110 CO -0.00 0.19 0.94 0.12 -0.81 0.00 0.00 175.30 175.74 2eh0 s PHE 111 N 0.62 3.63 -0.30 5.12 5.36 -1.11 -0.42 117.98 130.88 2eh0 s PHE 111 Ca 0.15 1.62 0.02 0.00 -0.96 0.00 0.00 56.93 57.76 2eh0 s PHE 111 Cb -0.13 -3.08 0.09 0.00 -0.34 0.00 0.00 43.02 39.56 2eh0 s PHE 111 CO 0.04 -0.01 0.03 -0.80 -1.46 0.00 0.00 175.22 173.01 2eh0 s ASN 112 N 0.99 4.33 -0.85 6.13 -0.87 -0.69 -0.42 114.94 123.57 2eh0 s ASN 112 Ca 0.50 -1.73 0.01 0.00 -1.57 0.00 0.00 52.86 50.06 2eh0 s ASN 112 Cb -0.20 -1.31 0.25 0.00 -0.02 0.00 0.00 41.25 39.96 2eh0 s ASN 112 CO 0.26 -0.34 0.93 1.57 -2.57 0.00 0.00 177.10 176.94 2eh0 n HIS 113 N 4.52 3.51 0.05 2.20 -0.00 -1.26 -2.76 115.22 121.49 2eh0 n HIS 113 Ca -0.03 -3.78 -0.05 0.00 0.46 0.00 0.00 57.72 54.33 2eh0 n HIS 113 Cb 0.42 -0.94 0.15 0.00 -0.12 0.00 0.00 29.99 29.50 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 5.20 0.37 0.38 1.57 0.13 -1.91 -2.04 132.00 135.70 2eh0 h PRO 114 Ca 0.18 -0.20 -0.00 0.00 -0.87 0.00 0.00 66.00 65.11 2eh0 h PRO 114 Cb 0.71 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.82 2eh0 h PRO 114 CO 0.96 0.75 -0.36 1.49 -0.23 0.00 0.00 178.00 180.61 2eh0 h GLU 115 N 0.30 -0.73 -0.10 0.86 4.22 -1.89 -2.58 114.58 114.66 2eh0 h GLU 115 Ca 0.02 0.05 -0.11 0.00 0.08 0.00 0.00 59.36 59.40 2eh0 h GLU 115 Cb 0.91 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 2eh0 h GLU 115 CO 0.08 -0.49 -0.43 0.37 -2.18 0.00 0.00 179.01 176.36 2eh0 h GLN 116 N -0.76 0.23 0.00 1.92 4.15 -1.82 -2.57 115.11 116.26 2eh0 h GLN 116 Ca -0.03 -0.11 0.00 0.00 0.77 0.00 0.00 58.65 59.28 2eh0 h GLN 116 Cb 0.68 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.37 2eh0 h GLN 116 CO -0.05 0.62 0.00 0.00 -1.93 0.00 0.00 178.83 177.46 2eh0 n ALA 117 N -2.47 1.07 0.02 3.38 0.00 -0.77 -0.97 120.51 120.77 2eh0 n ALA 117 Ca -0.02 -0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.33 2eh0 n ALA 117 Cb 0.49 -1.02 -0.13 0.00 0.00 0.00 0.00 19.45 18.79 2eh0 n ALA 117 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2eh0 h ARG 118 N 0.00 0.03 0.00 0.00 0.11 -1.14 -3.27 114.38 110.11 2eh0 h ARG 118 Ca 0.00 -0.05 0.00 0.00 0.10 0.00 0.00 59.98 60.03 2eh0 h ARG 118 Cb 0.02 0.02 0.00 0.00 1.11 0.00 0.00 29.97 31.12 2eh0 h ARG 118 CO 0.00 0.78 0.00 0.00 0.10 0.00 0.00 179.97 180.85 2eh0 n ALA 119 N -2.48 1.98 0.18 0.08 0.00 -0.15 -2.54 120.51 117.58 2eh0 n ALA 119 Ca -0.10 -0.09 0.06 0.00 0.00 0.00 0.00 53.44 53.32 2eh0 n ALA 119 Cb 1.00 -1.31 0.18 0.00 0.00 0.00 0.00 19.45 19.32 2eh0 n ALA 119 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2eh0 h GLU 120 N 0.00 0.00 0.00 0.00 4.39 -1.62 -3.29 114.58 114.06 2eh0 h GLU 120 Ca 0.00 0.00 -0.32 0.00 0.34 0.00 0.00 59.36 59.38 2eh0 h GLU 120 Cb 0.21 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.80 2eh0 h GLU 120 CO 0.00 0.35 -2.26 0.54 -1.16 0.00 0.00 179.01 176.48 2eh0 n ARG 121 N -3.26 0.95 0.26 2.33 1.74 -1.05 -4.28 116.66 113.34 2eh0 n ARG 121 Ca 0.02 -0.02 0.18 0.00 -0.77 0.00 0.00 57.85 57.26 2eh0 n ARG 121 Cb 0.61 -1.48 0.94 0.00 -1.02 0.00 0.00 32.46 31.51 2eh0 n ARG 121 CO 0.00 0.00 0.00 1.05 -1.52 0.00 0.00 177.63 177.16 2eh0 h GLU 122 N 0.00 0.00 -4.20 5.56 4.11 -1.59 -3.45 114.58 115.01 2eh0 h GLU 122 Ca -0.48 0.00 -0.42 0.00 0.07 0.00 0.00 59.36 58.53 2eh0 h GLU 122 Cb 2.09 0.00 0.13 0.00 0.50 0.00 0.00 28.75 31.47 2eh0 h GLU 122 CO 0.03 0.00 -0.83 0.36 0.07 0.00 0.00 179.01 178.64 2eh0 n LYS 123 N -2.73 0.00 -1.58 1.06 0.00 -1.24 -4.59 118.16 109.08 2eh0 n LYS 123 Ca -0.02 0.00 -0.58 0.00 -0.00 0.00 0.00 58.31 57.71 2eh0 n LYS 123 Cb 0.07 -0.70 -0.07 0.00 -0.00 0.00 0.00 35.03 34.32 2eh0 n LYS 123 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 2eh0 n THR 124 N -1.08 0.03 -1.56 0.58 -1.04 -1.26 -4.82 114.28 105.12 2eh0 n THR 124 Ca 0.05 -0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.76 2eh0 n THR 124 Cb 0.33 -0.43 -0.03 0.00 -1.82 0.00 0.00 70.33 68.38 2eh0 n THR 124 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2eh0 n SER 125 N 2.45 6.74 0.00 8.00 7.64 -1.26 -4.81 113.62 132.38 2eh0 n SER 125 Ca 0.21 -3.36 0.00 0.00 1.01 0.00 0.00 58.87 56.73 2eh0 n SER 125 Cb 0.10 -1.18 0.00 0.00 -1.01 0.00 0.00 64.21 62.12 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 0.49 -2.18 3.67 0.23 0.00 -1.26 -4.65 105.19 101.49 2eh0 n GLY 126 Ca 0.50 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.23 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 0.20 -1.37 1.61 0.04 -1.26 -4.08 135.00 130.13 2eh0 s PRO 127 Ca 0.00 0.44 -0.00 0.00 0.04 0.00 0.00 61.00 61.48 2eh0 s PRO 127 Cb 0.00 -1.72 0.00 0.00 0.04 0.00 0.00 34.50 32.82 2eh0 s PRO 127 CO 0.00 -2.87 0.52 0.45 0.04 0.00 0.00 177.00 175.14 2eh0 n SER 128 N -4.26 -0.62 -4.60 6.66 2.88 -1.26 -4.94 113.62 107.49 2eh0 n SER 128 Ca 0.06 -0.94 -0.38 0.00 -1.33 0.00 0.00 58.87 56.28 2eh0 n SER 128 Cb 0.58 -3.42 -0.11 0.00 -0.75 0.00 0.00 64.21 60.51 2eh0 n SER 128 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2eh0 s SER 129 N -4.37 6.03 0.00 -3.46 1.04 -1.26 -5.12 113.70 106.57 2eh0 s SER 129 Ca 0.00 0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.44 2eh0 s SER 129 Cb -0.00 -2.12 0.00 0.00 0.10 0.00 0.00 66.02 64.00 2eh0 s SER 129 CO 0.86 -0.05 0.49 0.61 0.98 0.00 0.00 173.24 176.13