#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 6.67 -0.19 1.61 0.01 -1.26 -4.99 113.70 115.57 2eh0 s SER 2 Ca 0.00 0.54 -0.10 0.00 1.31 0.00 0.00 55.95 57.70 2eh0 s SER 2 Cb 0.00 -2.54 0.06 0.00 0.21 0.00 0.00 66.02 63.76 2eh0 s SER 2 CO 0.00 -1.17 0.44 -0.44 0.41 0.00 0.00 173.24 172.49 2eh0 s SER 3 N 2.29 -0.55 0.00 2.44 0.01 -1.26 -5.09 113.70 111.54 2eh0 s SER 3 Ca 0.46 0.98 0.00 0.00 1.31 0.00 0.00 55.95 58.70 2eh0 s SER 3 Cb -0.08 0.89 0.00 0.00 0.21 0.00 0.00 66.02 67.04 2eh0 s SER 3 CO 0.28 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.34 2eh0 n GLY 4 N 4.36 0.53 2.91 3.44 0.00 -1.26 -5.14 105.19 110.01 2eh0 n GLY 4 Ca -0.22 0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 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 0.00 3.80 -0.30 1.61 0.15 -1.26 -5.07 113.70 112.63 2eh0 s SER 5 Ca 0.00 -1.21 -0.03 0.00 0.70 0.00 0.00 55.95 55.40 2eh0 s SER 5 Cb 0.00 -1.11 0.18 0.00 -1.71 0.00 0.00 66.02 63.38 2eh0 s SER 5 CO 0.00 -0.26 0.66 -0.94 1.20 0.00 0.00 173.24 173.90 2eh0 s SER 6 N 1.44 -1.25 -0.27 5.45 1.04 -1.26 -5.03 113.70 113.82 2eh0 s SER 6 Ca -0.03 0.88 -0.09 0.00 0.48 0.00 0.00 55.95 57.19 2eh0 s SER 6 Cb -0.19 2.09 0.01 0.00 0.10 0.00 0.00 66.02 68.03 2eh0 s SER 6 CO -0.08 -0.23 0.36 0.61 0.98 0.00 0.00 173.24 174.87 2eh0 n GLY 7 N 5.43 -1.04 3.89 7.32 0.00 -1.26 -4.94 105.19 114.59 2eh0 n GLY 7 Ca -0.03 0.65 -0.33 0.00 0.00 0.00 0.00 46.02 46.32 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 -2.03 5.32 -0.04 2.61 2.01 -1.26 -4.61 115.64 117.63 2eh0 s THR 8 Ca 0.13 -0.25 -0.30 0.00 0.31 0.00 0.00 61.69 61.59 2eh0 s THR 8 Cb -0.04 -3.50 -0.05 0.00 0.01 0.00 0.00 72.50 68.92 2eh0 s THR 8 CO 0.45 0.29 1.48 -2.16 -0.69 0.00 0.00 174.62 173.99 2eh0 s PRO 9 N -2.03 4.23 0.01 4.92 0.04 -1.26 -4.86 135.00 136.06 2eh0 s PRO 9 Ca 0.28 2.02 -0.01 0.00 0.04 0.00 0.00 61.00 63.33 2eh0 s PRO 9 Cb -0.13 -3.75 -0.01 0.00 0.04 0.00 0.00 34.50 30.65 2eh0 s PRO 9 CO 0.20 -0.70 -0.01 -3.38 0.04 0.00 0.00 177.00 173.15 2eh0 s HIS 10 N 3.16 0.19 -0.21 0.56 -3.43 -1.24 -1.29 115.29 113.02 2eh0 s HIS 10 Ca 0.66 -0.38 -0.12 0.00 -0.80 0.00 0.00 55.06 54.42 2eh0 s HIS 10 Cb -0.31 -0.14 -0.05 0.00 -1.43 0.00 0.00 32.58 30.65 2eh0 s HIS 10 CO 0.26 -0.16 0.21 -0.51 -2.00 0.00 0.00 174.74 172.54 2eh0 s LEU 11 N -1.14 4.17 -0.14 5.38 1.43 0.95 -2.66 118.68 126.67 2eh0 s LEU 11 Ca -0.12 0.27 -0.09 0.00 -1.03 0.00 0.00 54.13 53.16 2eh0 s LEU 11 Cb -0.08 -2.21 -0.04 0.00 0.03 0.00 0.00 46.19 43.89 2eh0 s LEU 11 CO -0.01 0.08 0.17 -0.69 0.23 0.00 0.00 176.35 176.14 2eh0 s VAL 12 N 0.80 5.43 -1.30 -1.59 1.01 -0.42 -0.47 120.40 123.85 2eh0 s VAL 12 Ca 0.11 0.28 -0.15 0.00 0.00 0.00 0.00 61.98 62.22 2eh0 s VAL 12 Cb -0.13 -3.46 0.11 0.00 0.00 0.00 0.00 36.38 32.89 2eh0 s VAL 12 CO 0.03 0.55 1.75 -3.20 0.00 0.00 0.00 175.10 174.22 2eh0 n ASN 13 N 2.55 4.87 0.00 3.32 2.85 0.03 -0.92 115.26 127.95 2eh0 n ASN 13 Ca -0.18 -2.95 0.04 0.00 -0.11 0.00 0.00 54.58 51.39 2eh0 n ASN 13 Cb 0.54 -1.65 0.26 0.00 1.24 0.00 0.00 39.78 40.17 2eh0 n ASN 13 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2eh0 n LEU 14 N 6.67 0.00 -4.08 1.20 -0.00 -1.26 -4.88 117.00 114.65 2eh0 n LEU 14 Ca 0.45 0.00 -0.28 0.00 -0.00 0.00 0.00 56.01 56.18 2eh0 n LEU 14 Cb 0.43 0.00 0.11 0.00 -0.00 0.00 0.00 43.42 43.95 2eh0 n LEU 14 CO 0.75 0.00 -0.88 0.59 -0.00 0.00 0.00 177.39 177.86 2eh0 n ASN 15 N -0.66 -2.68 -1.57 1.45 4.13 -1.26 -4.86 115.26 109.81 2eh0 n ASN 15 Ca 0.07 -0.14 0.07 0.00 1.68 0.00 0.00 54.58 56.26 2eh0 n ASN 15 Cb 0.03 -0.72 0.33 0.00 -1.54 0.00 0.00 39.78 37.88 2eh0 n ASN 15 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2eh0 n GLU 16 N -0.19 3.90 -3.58 3.52 1.02 -1.26 -4.69 120.64 119.36 2eh0 n GLU 16 Ca 0.01 -2.59 -0.38 0.00 -0.02 0.00 0.00 57.16 54.18 2eh0 n GLU 16 Cb 0.55 -2.00 -0.05 0.00 -0.02 0.00 0.00 31.44 29.91 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 -0.74 6.27 0.00 1.62 1.01 -1.26 -4.87 116.67 118.70 2eh0 s ASP 17 Ca 0.45 -3.71 0.15 0.00 0.71 0.00 0.00 52.55 50.15 2eh0 s ASP 17 Cb 0.32 -1.97 0.90 0.00 1.01 0.00 0.00 42.92 43.18 2eh0 s ASP 17 CO 0.17 -0.20 1.31 -0.81 0.21 0.00 0.00 175.17 175.85 2eh0 n PRO 18 N 2.38 0.49 0.00 8.23 -0.04 -1.26 -1.78 135.00 143.03 2eh0 n PRO 18 Ca 0.22 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.71 2eh0 n PRO 18 Cb 0.37 -1.48 -0.00 0.00 -0.04 0.00 0.00 33.50 32.35 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 -0.98 0.93 -4.63 1.53 4.77 -1.26 -5.03 117.00 112.33 2eh0 n LEU 19 Ca 0.11 -0.75 -0.61 0.00 -0.03 0.00 0.00 56.01 54.74 2eh0 n LEU 19 Cb 0.05 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.06 2eh0 n LEU 19 CO 0.08 0.20 0.92 1.15 -1.33 0.00 0.00 177.39 178.41 2eh0 n MET 20 N -0.39 0.34 0.00 3.23 0.00 -0.73 -4.78 117.12 114.79 2eh0 n MET 20 Ca 0.03 0.12 0.05 0.00 0.00 0.00 0.00 57.70 57.90 2eh0 n MET 20 Cb 0.14 -1.67 0.31 0.00 0.00 0.00 0.00 33.22 31.99 2eh0 n MET 20 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 2eh0 n SER 21 N 3.05 0.00 -4.98 3.17 2.88 -1.26 -4.81 113.62 111.66 2eh0 n SER 21 Ca 0.24 -1.55 -0.20 0.00 -1.33 0.00 0.00 58.87 56.03 2eh0 n SER 21 Cb 0.06 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.53 2eh0 n SER 21 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 2eh0 s GLU 22 N -2.00 2.92 0.54 -1.46 -1.05 -1.26 -5.05 118.70 111.33 2eh0 s GLU 22 Ca 0.15 -0.90 -0.20 0.00 -0.15 0.00 0.00 54.97 53.88 2eh0 s GLU 22 Cb 0.07 -2.68 -0.08 0.00 -0.44 0.00 0.00 34.13 31.00 2eh0 s GLU 22 CO 0.12 -0.26 0.76 0.00 0.95 0.00 0.00 175.26 176.83 2eh0 h LEU 24 N 0.60 0.57 -7.96 0.00 -0.00 -1.96 -3.47 115.31 103.09 2eh0 h LEU 24 Ca -0.46 -0.77 -0.10 0.00 -0.00 0.00 0.00 57.88 56.56 2eh0 h LEU 24 Cb 1.38 -0.17 -0.14 0.00 -0.00 0.00 0.00 40.66 41.72 2eh0 h LEU 24 CO 0.50 1.26 -0.42 -1.48 -0.00 0.00 0.00 178.44 178.30 2eh0 s LEU 25 N -8.30 1.50 -0.13 1.67 0.05 -1.26 -0.79 118.68 111.42 2eh0 s LEU 25 Ca -0.13 -0.78 0.02 0.00 0.05 0.00 0.00 54.13 53.29 2eh0 s LEU 25 Cb 0.04 0.91 0.01 0.00 -2.05 0.00 0.00 46.19 45.10 2eh0 s LEU 25 CO 0.83 -0.74 -0.18 -0.31 -0.55 0.00 0.00 176.35 175.39 2eh0 s TYR 26 N -3.90 2.37 -0.86 3.48 2.02 0.37 -4.96 117.35 115.87 2eh0 s TYR 26 Ca 0.09 -1.20 -0.20 0.00 -0.37 0.00 0.00 57.07 55.38 2eh0 s TYR 26 Cb 0.05 -1.66 0.10 0.00 -0.40 0.00 0.00 41.96 40.06 2eh0 s TYR 26 CO -0.08 -0.59 1.11 0.71 -1.57 0.00 0.00 175.55 175.14 2eh0 s TYR 27 N 0.99 2.92 0.91 2.71 2.02 -1.26 -0.04 117.35 125.60 2eh0 s TYR 27 Ca -0.05 -1.08 -0.13 0.00 -0.37 0.00 0.00 57.07 55.45 2eh0 s TYR 27 Cb -0.15 -4.33 0.04 0.00 -0.40 0.00 0.00 41.96 37.12 2eh0 s TYR 27 CO -0.04 -1.59 0.51 -0.89 -1.57 0.00 0.00 175.55 171.98 2eh0 n ILE 28 N 5.77 0.33 -3.43 2.71 5.41 -0.42 -4.97 119.36 124.78 2eh0 n ILE 28 Ca 0.16 -0.21 -0.19 0.00 1.00 0.00 0.00 62.75 63.52 2eh0 n ILE 28 Cb 0.48 -0.69 0.03 0.00 -0.71 0.00 0.00 39.64 38.75 2eh0 n ILE 28 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2eh0 n LYS 29 N -1.82 0.74 -3.19 0.38 5.02 -1.26 -4.66 118.16 113.36 2eh0 n LYS 29 Ca 0.08 -2.77 -0.44 0.00 -2.02 0.00 0.00 58.31 53.15 2eh0 n LYS 29 Cb 0.53 0.05 0.00 0.00 -0.02 0.00 0.00 35.03 35.59 2eh0 n LYS 29 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2eh0 n ASP 30 N -2.15 5.58 0.00 4.39 5.75 -1.26 -4.59 116.55 124.26 2eh0 n ASP 30 Ca 0.06 -3.08 0.00 0.00 -0.01 0.00 0.00 54.79 51.76 2eh0 n ASP 30 Cb 0.52 -1.40 0.00 0.00 -1.03 0.00 0.00 41.12 39.20 2eh0 n ASP 30 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2eh0 n GLY 31 N 2.76 -1.10 2.96 6.12 0.00 -0.18 -4.92 105.19 110.83 2eh0 n GLY 31 Ca 0.27 0.66 -0.22 0.00 0.00 0.00 0.00 46.02 46.73 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 0.80 -0.27 -0.61 -1.09 -1.26 -0.91 121.20 117.86 2eh0 s ILE 32 Ca 0.00 -0.30 -0.02 0.00 -2.23 0.00 0.00 60.65 58.10 2eh0 s ILE 32 Cb 0.00 -0.76 0.09 0.00 -1.58 0.00 0.00 42.46 40.21 2eh0 s ILE 32 CO 0.00 0.28 0.09 -0.89 -1.23 0.00 0.00 174.94 173.18 2eh0 s THR 33 N 0.68 0.61 0.28 2.92 2.01 0.96 -4.98 115.64 118.12 2eh0 s THR 33 Ca -0.11 -1.05 -0.29 0.00 0.31 0.00 0.00 61.69 60.54 2eh0 s THR 33 Cb -0.14 -1.37 -0.09 0.00 0.01 0.00 0.00 72.50 70.91 2eh0 s THR 33 CO 0.02 -0.55 1.04 -0.13 -0.69 0.00 0.00 174.62 174.30 2eh0 s ARG 34 N 1.77 4.67 -0.28 4.92 1.81 -1.26 0.20 118.95 130.78 2eh0 s ARG 34 Ca 0.07 1.66 0.01 0.00 -1.72 0.00 0.00 55.73 55.75 2eh0 s ARG 34 Cb -0.17 -3.15 0.06 0.00 -0.45 0.00 0.00 34.95 31.24 2eh0 s ARG 34 CO -0.23 0.29 -0.06 0.08 -0.68 0.00 0.00 175.30 174.70 2eh0 s VAL 35 N -1.23 2.46 0.00 3.52 1.01 0.70 -2.42 120.40 124.45 2eh0 s VAL 35 Ca 0.45 -1.60 0.00 0.00 0.00 0.00 0.00 61.98 60.83 2eh0 s VAL 35 Cb -0.29 -2.46 0.00 0.00 0.00 0.00 0.00 36.38 33.63 2eh0 s VAL 35 CO 0.36 -0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.98 2eh0 n GLY 36 N 4.49 0.49 3.28 4.51 0.00 -0.65 -1.78 105.19 115.53 2eh0 n GLY 36 Ca -0.13 0.49 -0.26 0.00 0.00 0.00 0.00 46.02 46.12 2eh0 n GLY 36 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2eh0 n GLN 37 N 0.00 0.85 -0.07 1.61 1.13 -1.15 -0.48 117.38 119.28 2eh0 n GLN 37 Ca 0.00 -3.16 -0.08 0.00 -1.94 0.00 0.00 57.00 51.82 2eh0 n GLN 37 Cb 0.00 0.62 -0.15 0.00 0.11 0.00 0.00 30.24 30.81 2eh0 n GLN 37 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2eh0 n ALA 38 N -1.77 1.59 0.21 -1.58 0.00 -1.26 -3.88 120.51 113.83 2eh0 n ALA 38 Ca -0.17 -1.12 0.11 0.00 0.00 0.00 0.00 53.44 52.26 2eh0 n ALA 38 Cb 0.56 -0.40 0.16 0.00 0.00 0.00 0.00 19.45 19.77 2eh0 n ALA 38 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2eh0 h ASP 39 N 0.00 0.00 -1.16 0.00 3.32 -1.96 -3.44 116.42 113.18 2eh0 h ASP 39 Ca -0.44 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.01 2eh0 h ASP 39 Cb 2.09 0.00 0.12 0.00 0.22 0.00 0.00 39.33 41.76 2eh0 h ASP 39 CO 0.04 0.04 -0.64 0.00 -1.72 0.00 0.00 179.24 176.96 2eh0 n ALA 40 N -2.11 -2.79 -0.45 3.45 0.00 -1.26 -4.68 120.51 112.67 2eh0 n ALA 40 Ca 0.04 0.29 0.38 0.00 0.00 0.00 0.00 53.44 54.15 2eh0 n ALA 40 Cb 0.54 -1.44 0.65 0.00 0.00 0.00 0.00 19.45 19.20 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 1.04 -0.03 -4.83 0.00 1.02 -1.26 -4.14 120.64 112.44 2eh0 n GLU 41 Ca 0.14 1.20 -0.33 0.00 -0.02 0.00 0.00 57.16 58.15 2eh0 n GLU 41 Cb 0.28 -2.37 -0.13 0.00 -0.02 0.00 0.00 31.44 29.21 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 -5.18 2.56 -0.28 3.49 1.81 -1.26 -5.07 118.95 115.03 2eh0 s ARG 42 Ca -0.07 -0.66 -0.28 0.00 -1.72 0.00 0.00 55.73 52.99 2eh0 s ARG 42 Cb 0.30 -2.42 -0.03 0.00 -0.45 0.00 0.00 34.95 32.34 2eh0 s ARG 42 CO 0.78 0.63 1.91 0.50 -0.68 0.00 0.00 175.30 178.44 2eh0 s ARG 43 N -0.74 3.35 0.02 3.54 3.52 -1.26 -4.89 118.95 122.49 2eh0 s ARG 43 Ca 0.11 1.66 -0.16 0.00 -0.13 0.00 0.00 55.73 57.21 2eh0 s ARG 43 Cb -0.11 -4.23 -0.06 0.00 -1.56 0.00 0.00 34.95 28.99 2eh0 s ARG 43 CO 0.01 -1.84 0.46 -0.65 -0.81 0.00 0.00 175.30 172.47 2eh0 s GLN 44 N 5.72 4.02 0.03 5.12 -1.52 -1.25 -4.87 119.66 126.91 2eh0 s GLN 44 Ca 0.85 0.52 -0.29 0.00 -1.95 0.00 0.00 55.36 54.50 2eh0 s GLN 44 Cb -0.26 -3.23 -0.16 0.00 -0.22 0.00 0.00 33.01 29.13 2eh0 s GLN 44 CO 0.34 0.66 1.25 0.22 -0.25 0.00 0.00 175.29 177.51 2eh0 h ASP 45 N 4.71 -0.77 -3.70 5.90 3.58 -1.81 -3.41 116.42 120.91 2eh0 h ASP 45 Ca -0.51 -0.00 -0.65 0.00 0.42 0.00 0.00 57.03 56.29 2eh0 h ASP 45 Cb 1.22 0.20 -0.16 0.00 1.72 0.00 0.00 39.33 42.30 2eh0 h ASP 45 CO 0.62 -0.42 -0.28 -0.63 -2.88 0.00 0.00 179.24 175.65 2eh0 s ILE 46 N -5.01 5.17 -0.32 2.25 1.01 -1.05 -5.05 121.20 118.20 2eh0 s ILE 46 Ca -0.15 0.21 -0.09 0.00 0.00 0.00 0.00 60.65 60.62 2eh0 s ILE 46 Cb 0.02 -3.77 0.00 0.00 0.01 0.00 0.00 42.46 38.72 2eh0 s ILE 46 CO 0.49 -0.01 0.14 -0.69 0.00 0.00 0.00 174.94 174.87 2eh0 s VAL 47 N 2.03 4.42 0.45 2.92 1.01 -1.26 -1.63 120.40 128.34 2eh0 s VAL 47 Ca 0.13 -0.57 -0.13 0.00 0.00 0.00 0.00 61.98 61.40 2eh0 s VAL 47 Cb -0.16 -3.30 -0.07 0.00 0.00 0.00 0.00 36.38 32.85 2eh0 s VAL 47 CO 0.11 0.02 0.86 -0.76 0.00 0.00 0.00 175.10 175.33 2eh0 s LEU 48 N 1.57 3.75 1.01 3.92 2.01 0.37 -4.98 118.68 126.34 2eh0 s LEU 48 Ca 0.04 1.32 -0.12 0.00 0.01 0.00 0.00 54.13 55.38 2eh0 s LEU 48 Cb -0.17 -4.22 0.18 0.00 0.01 0.00 0.00 46.19 41.98 2eh0 s LEU 48 CO 0.05 -0.47 0.97 -0.24 1.01 0.00 0.00 176.35 177.67 2eh0 n SER 49 N -1.40 -0.70 -3.45 2.29 2.88 -1.26 -4.80 113.62 107.18 2eh0 n SER 49 Ca 0.04 0.20 -0.36 0.00 -1.33 0.00 0.00 58.87 57.42 2eh0 n SER 49 Cb 0.54 -1.36 -0.03 0.00 -0.75 0.00 0.00 64.21 62.62 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 0.72 3.48 2.73 0.46 0.00 -1.26 -4.62 105.19 106.71 2eh0 n GLY 50 Ca 0.08 -1.26 -0.28 0.00 0.00 0.00 0.00 46.02 44.56 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 5.39 3.66 -3.85 4.61 0.00 -1.26 -4.83 120.51 124.23 2eh0 n ALA 51 Ca 0.54 -4.62 -0.28 0.00 0.00 0.00 0.00 53.44 49.08 2eh0 n ALA 51 Cb 0.28 -0.99 0.03 0.00 0.00 0.00 0.00 19.45 18.78 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 1.56 -2.27 -4.06 0.00 8.25 -1.26 -3.04 115.22 114.40 2eh0 n HIS 52 Ca 0.23 0.90 -0.23 0.00 -0.26 0.00 0.00 57.72 58.37 2eh0 n HIS 52 Cb 0.37 -4.14 -0.04 0.00 1.12 0.00 0.00 29.99 27.30 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 -3.38 4.75 0.11 1.59 -1.09 -1.26 -4.38 121.20 117.54 2eh0 s ILE 53 Ca 0.53 -1.16 0.04 0.00 -2.23 0.00 0.00 60.65 57.83 2eh0 s ILE 53 Cb -0.26 -3.53 -0.04 0.00 -1.58 0.00 0.00 42.46 37.05 2eh0 s ILE 53 CO 0.82 -0.27 0.05 -0.54 -1.23 0.00 0.00 174.94 173.77 2eh0 s LYS 54 N -3.67 2.72 0.52 2.79 -0.14 -1.26 -5.00 119.74 115.69 2eh0 s LYS 54 Ca 0.33 -0.82 0.25 0.00 -1.36 0.00 0.00 55.97 54.37 2eh0 s LYS 54 Cb -0.09 -2.61 1.37 0.00 -1.68 0.00 0.00 37.83 34.82 2eh0 s LYS 54 CO 0.26 0.53 1.96 0.93 -0.76 0.00 0.00 175.35 178.27 2eh0 h GLU 55 N 3.12 0.06 -0.86 1.68 5.08 -1.93 -2.32 114.58 119.42 2eh0 h GLU 55 Ca -0.47 -0.00 -0.41 0.00 -1.00 0.00 0.00 59.36 57.48 2eh0 h GLU 55 Cb 1.17 -0.01 -0.41 0.00 0.50 0.00 0.00 28.75 30.00 2eh0 h GLU 55 CO 0.62 0.04 -1.00 0.39 -1.00 0.00 0.00 179.01 178.06 2eh0 n GLU 56 N -4.37 2.32 0.00 2.33 1.02 -1.26 -2.91 120.64 117.77 2eh0 n GLU 56 Ca 0.12 -3.78 0.00 0.00 -0.02 0.00 0.00 57.16 53.49 2eh0 n GLU 56 Cb 0.68 -1.78 0.00 0.00 -0.02 0.00 0.00 31.44 30.32 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 -0.46 0.00 -4.21 -0.32 -0.00 -0.87 -4.48 115.22 104.88 2eh0 n HIS 57 Ca 0.22 0.00 -0.18 0.00 0.46 0.00 0.00 57.72 58.22 2eh0 n HIS 57 Cb 0.82 -0.36 -0.07 0.00 -0.12 0.00 0.00 29.99 30.26 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 -3.30 0.14 -0.22 0.00 1.01 -1.12 -0.22 121.20 117.49 2eh0 s ILE 59 Ca 0.37 -1.18 0.01 0.00 0.00 0.00 0.00 60.65 59.85 2eh0 s ILE 59 Cb 0.01 -0.65 0.05 0.00 0.01 0.00 0.00 42.46 41.89 2eh0 s ILE 59 CO 0.25 -0.65 -0.09 -0.36 0.00 0.00 0.00 174.94 174.08 2eh0 s PHE 60 N -2.22 2.63 -0.31 3.97 0.08 0.13 -1.82 117.98 120.44 2eh0 s PHE 60 Ca -0.09 -1.82 -0.09 0.00 0.12 0.00 0.00 56.93 55.05 2eh0 s PHE 60 Cb -0.04 -1.70 0.00 0.00 -0.57 0.00 0.00 43.02 40.70 2eh0 s PHE 60 CO -0.04 -0.79 0.13 0.50 -0.10 0.00 0.00 175.22 174.93 2eh0 s ARG 61 N 1.32 3.20 -0.39 0.44 3.52 -0.85 -0.03 118.95 126.16 2eh0 s ARG 61 Ca -0.04 -0.80 -0.03 0.00 -0.13 0.00 0.00 55.73 54.73 2eh0 s ARG 61 Cb -0.18 -3.51 0.10 0.00 -1.56 0.00 0.00 34.95 29.80 2eh0 s ARG 61 CO -0.07 -0.45 0.17 0.45 -0.81 0.00 0.00 175.30 174.59 2eh0 s SER 62 N 1.57 5.20 0.06 -2.12 0.15 -0.08 -1.87 113.70 116.60 2eh0 s SER 62 Ca 0.04 -1.91 0.05 0.00 0.70 0.00 0.00 55.95 54.83 2eh0 s SER 62 Cb -0.17 -1.81 -0.03 0.00 -1.71 0.00 0.00 66.02 62.30 2eh0 s SER 62 CO 0.05 -0.49 -0.15 -0.70 1.20 0.00 0.00 173.24 173.14 2eh0 s GLU 63 N 1.16 0.94 -0.62 5.44 2.12 -1.06 -1.01 118.70 125.66 2eh0 s GLU 63 Ca 0.06 -0.88 -0.27 0.00 0.36 0.00 0.00 54.97 54.24 2eh0 s GLU 63 Cb -0.22 -0.98 0.03 0.00 0.26 0.00 0.00 34.13 33.22 2eh0 s GLU 63 CO -0.04 0.23 1.18 0.50 -0.54 0.00 0.00 175.26 176.60 2eh0 s ARG 64 N -1.44 3.40 1.00 4.30 3.52 -1.26 -1.22 118.95 127.25 2eh0 s ARG 64 Ca 0.01 0.03 -0.20 0.00 -0.13 0.00 0.00 55.73 55.44 2eh0 s ARG 64 Cb -0.09 -4.07 -0.13 0.00 -1.56 0.00 0.00 34.95 29.10 2eh0 s ARG 64 CO 0.02 -1.79 -0.86 0.45 -0.81 0.00 0.00 175.30 172.31 2eh0 n SER 65 N 8.58 -4.45 0.34 -2.12 2.88 0.39 -4.56 113.62 114.68 2eh0 n SER 65 Ca 0.06 0.12 0.21 0.00 -1.33 0.00 0.00 58.87 57.93 2eh0 n SER 65 Cb 0.49 -0.74 1.11 0.00 -0.75 0.00 0.00 64.21 64.32 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 -1.13 0.00 1.25 -3.46 -0.73 -1.94 0.32 115.58 109.88 2eh0 h ASN 66 Ca -0.43 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.74 2eh0 h ASN 66 Cb 1.33 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.92 2eh0 h ASN 66 CO 0.25 0.00 -0.28 0.28 -0.37 0.00 0.00 177.43 177.31 2eh0 h SER 67 N 0.00 0.00 0.00 1.15 0.02 -2.02 -3.47 113.55 109.23 2eh0 h SER 67 Ca 0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2eh0 h SER 67 Cb 0.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.73 2eh0 h SER 67 CO -0.00 0.04 0.00 0.61 -1.14 0.00 0.00 176.83 176.34 2eh0 n GLY 68 N 1.30 0.99 3.59 -3.77 0.00 0.11 -5.08 105.19 102.33 2eh0 n GLY 68 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.96 3.91 0.19 1.61 -1.05 -1.25 -4.79 118.70 116.37 2eh0 s GLU 69 Ca 0.00 -0.36 -0.31 0.00 -0.15 0.00 0.00 54.97 54.15 2eh0 s GLU 69 Cb 0.00 -3.35 -0.10 0.00 -0.44 0.00 0.00 34.13 30.24 2eh0 s GLU 69 CO 0.00 0.07 1.57 0.08 0.95 0.00 0.00 175.26 177.93 2eh0 s VAL 70 N 0.96 2.51 -0.06 1.83 1.01 -1.26 -0.46 120.40 124.94 2eh0 s VAL 70 Ca 0.05 0.38 0.02 0.00 0.00 0.00 0.00 61.98 62.43 2eh0 s VAL 70 Cb -0.14 -3.25 0.02 0.00 0.00 0.00 0.00 36.38 33.01 2eh0 s VAL 70 CO 0.03 0.04 -0.09 -0.63 0.00 0.00 0.00 175.10 174.44 2eh0 s ILE 71 N 0.88 0.93 -0.17 2.22 -1.09 -0.36 -4.65 121.20 118.95 2eh0 s ILE 71 Ca 0.68 -0.35 -0.05 0.00 -2.23 0.00 0.00 60.65 58.70 2eh0 s ILE 71 Cb -0.44 -0.88 -0.03 0.00 -1.58 0.00 0.00 42.46 39.53 2eh0 s ILE 71 CO 0.34 0.31 0.01 -0.69 -1.23 0.00 0.00 174.94 173.68 2eh0 s VAL 72 N 0.78 4.28 -0.04 2.92 1.01 -1.26 -2.58 120.40 125.52 2eh0 s VAL 72 Ca -0.13 -0.21 0.05 0.00 0.00 0.00 0.00 61.98 61.69 2eh0 s VAL 72 Cb -0.15 -2.91 -0.01 0.00 0.00 0.00 0.00 36.38 33.31 2eh0 s VAL 72 CO 0.02 0.47 -0.20 -0.89 0.00 0.00 0.00 175.10 174.50 2eh0 s THR 73 N 0.43 1.61 -0.31 3.92 2.01 -0.78 -0.64 115.64 121.88 2eh0 s THR 73 Ca -0.01 -0.84 -0.14 0.00 0.31 0.00 0.00 61.69 61.02 2eh0 s THR 73 Cb -0.13 -1.36 -0.03 0.00 0.01 0.00 0.00 72.50 70.98 2eh0 s THR 73 CO 0.02 0.46 0.31 -0.22 -0.69 0.00 0.00 174.62 174.50 2eh0 s LEU 74 N -0.19 4.26 -0.91 4.42 2.96 0.14 -2.00 118.68 127.36 2eh0 s LEU 74 Ca 0.00 -0.08 -0.03 0.00 -0.22 0.00 0.00 54.13 53.81 2eh0 s LEU 74 Cb -0.11 -2.29 0.23 0.00 0.50 0.00 0.00 46.19 44.52 2eh0 s LEU 74 CO 0.01 -0.23 0.81 -1.61 -1.32 0.00 0.00 176.35 174.02 2eh0 s GLU 75 N 1.94 3.38 1.16 1.98 2.02 -0.76 -2.29 118.70 126.13 2eh0 s GLU 75 Ca 0.11 -3.25 -0.18 0.00 0.02 0.00 0.00 54.97 51.68 2eh0 s GLU 75 Cb -0.16 -4.03 0.27 0.00 0.10 0.00 0.00 34.13 30.30 2eh0 s GLU 75 CO 0.11 -1.26 1.10 -1.25 0.02 0.00 0.00 175.26 173.99 2eh0 s PRO 76 N -1.29 -0.86 0.53 0.39 0.04 -1.26 -2.78 135.00 129.76 2eh0 s PRO 76 Ca 0.27 0.07 0.05 0.00 0.04 0.00 0.00 61.00 61.44 2eh0 s PRO 76 Cb -0.08 -1.63 0.05 0.00 0.04 0.00 0.00 34.50 32.89 2eh0 s PRO 76 CO -0.12 -3.50 0.43 0.00 0.04 0.00 0.00 177.00 173.85 2eh0 h GLU 78 N 0.00 0.15 -1.07 0.00 4.57 -1.90 -3.36 114.58 112.97 2eh0 h GLU 78 Ca -0.32 -0.26 -0.55 0.00 -1.18 0.00 0.00 59.36 57.04 2eh0 h GLU 78 Cb 1.21 0.10 -0.26 0.00 -0.16 0.00 0.00 28.75 29.63 2eh0 h GLU 78 CO 0.50 0.91 0.70 0.54 -1.18 0.00 0.00 179.01 180.49 2eh0 n ARG 79 N -3.30 2.35 -4.33 1.92 1.74 -1.26 -4.93 116.66 108.85 2eh0 n ARG 79 Ca -0.24 -2.82 -0.18 0.00 -0.77 0.00 0.00 57.85 53.84 2eh0 n ARG 79 Cb 1.05 -2.11 -0.10 0.00 -1.02 0.00 0.00 32.46 30.28 2eh0 n ARG 79 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2eh0 s SER 80 N -1.26 2.46 -0.68 0.55 0.01 -1.26 -4.90 113.70 108.62 2eh0 s SER 80 Ca 0.55 -0.99 -0.03 0.00 1.31 0.00 0.00 55.95 56.79 2eh0 s SER 80 Cb 0.44 -0.12 0.17 0.00 0.21 0.00 0.00 66.02 66.73 2eh0 s SER 80 CO 0.03 -0.18 0.51 -0.70 0.41 0.00 0.00 173.24 173.32 2eh0 s GLU 81 N -3.53 2.73 0.22 12.44 2.12 -1.26 -4.91 118.70 126.51 2eh0 s GLU 81 Ca 0.20 -2.69 0.11 0.00 0.36 0.00 0.00 54.97 52.96 2eh0 s GLU 81 Cb -0.01 -3.79 -0.05 0.00 0.26 0.00 0.00 34.13 30.54 2eh0 s GLU 81 CO 0.06 -1.20 -0.20 0.99 -0.54 0.00 0.00 175.26 174.38 2eh0 s THR 82 N -0.32 2.57 -0.22 -1.70 2.01 -1.26 -1.72 115.64 114.99 2eh0 s THR 82 Ca 0.19 -2.08 -0.06 0.00 0.31 0.00 0.00 61.69 60.04 2eh0 s THR 82 Cb -0.17 -2.28 0.11 0.00 0.01 0.00 0.00 72.50 70.17 2eh0 s THR 82 CO -0.05 -0.21 0.44 -0.31 -0.69 0.00 0.00 174.62 173.80 2eh0 s TYR 83 N -1.96 -0.90 -0.11 4.92 2.02 -0.56 -3.64 117.35 117.12 2eh0 s TYR 83 Ca 0.25 1.49 0.01 0.00 -0.37 0.00 0.00 57.07 58.44 2eh0 s TYR 83 Cb -0.07 0.32 -0.02 0.00 -0.40 0.00 0.00 41.96 41.79 2eh0 s TYR 83 CO 0.13 -0.56 -0.13 0.08 -1.57 0.00 0.00 175.55 173.50 2eh0 s VAL 84 N 2.64 3.12 -1.58 0.71 1.01 -0.12 -1.24 120.40 124.95 2eh0 s VAL 84 Ca 0.02 -0.66 -0.03 0.00 0.00 0.00 0.00 61.98 61.31 2eh0 s VAL 84 Cb -0.13 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 33.97 2eh0 s VAL 84 CO -0.14 0.54 0.39 0.59 0.00 0.00 0.00 175.10 176.48 2eh0 n ASN 85 N 3.18 -5.90 0.00 3.32 4.13 -1.19 -1.55 115.26 117.24 2eh0 n ASN 85 Ca -0.18 -0.19 0.00 0.00 1.68 0.00 0.00 54.58 55.89 2eh0 n ASN 85 Cb 0.53 -4.79 0.00 0.00 -1.54 0.00 0.00 39.78 33.98 2eh0 n ASN 85 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2eh0 n GLY 86 N -1.34 2.85 1.87 7.41 0.00 -1.26 -4.94 105.19 109.78 2eh0 n GLY 86 Ca -0.15 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 2eh0 n GLY 86 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2eh0 n LYS 87 N -1.22 0.12 -3.93 1.61 4.76 -0.59 -5.03 118.16 113.87 2eh0 n LYS 87 Ca 0.00 -1.26 -0.35 0.00 -2.87 0.00 0.00 58.31 53.84 2eh0 n LYS 87 Cb 0.00 -0.38 -0.06 0.00 -1.84 0.00 0.00 35.03 32.76 2eh0 n LYS 87 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2eh0 s ARG 88 N -3.81 3.39 -0.24 1.97 3.00 -1.26 -0.94 118.95 121.06 2eh0 s ARG 88 Ca 0.33 -0.27 0.00 0.00 -1.00 0.00 0.00 55.73 54.79 2eh0 s ARG 88 Cb -0.02 -3.10 0.06 0.00 0.00 0.00 0.00 34.95 31.90 2eh0 s ARG 88 CO 0.22 0.71 -0.04 0.54 0.00 0.00 0.00 175.30 176.73 2eh0 s VAL 89 N -1.19 1.43 0.00 7.11 0.11 -1.24 -4.74 120.40 121.88 2eh0 s VAL 89 Ca 0.22 -1.19 0.00 0.00 -2.93 0.00 0.00 61.98 58.08 2eh0 s VAL 89 Cb -0.12 -1.74 0.00 0.00 -1.53 0.00 0.00 36.38 32.99 2eh0 s VAL 89 CO 0.12 -0.14 0.89 -1.54 -3.33 0.00 0.00 175.10 171.10 2eh0 n SER 90 N 4.70 1.72 -4.16 3.54 3.41 -1.26 -4.66 113.62 116.92 2eh0 n SER 90 Ca -0.11 -1.78 -0.10 0.00 -0.26 0.00 0.00 58.87 56.62 2eh0 n SER 90 Cb 0.44 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.29 2eh0 n SER 90 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2eh0 s GLN 91 N -0.78 0.81 -0.71 4.33 -1.52 -1.26 -4.74 119.66 115.78 2eh0 s GLN 91 Ca 0.00 -1.33 -0.26 0.00 -1.95 0.00 0.00 55.36 51.82 2eh0 s GLN 91 Cb 0.00 -0.09 -0.03 0.00 -0.22 0.00 0.00 33.01 32.67 2eh0 s GLN 91 CO 0.00 -0.06 1.89 -1.25 -0.25 0.00 0.00 175.29 175.62 2eh0 s PRO 92 N -3.87 2.60 0.10 2.91 0.04 -1.25 -4.44 135.00 131.10 2eh0 s PRO 92 Ca 0.12 0.31 0.08 0.00 0.04 0.00 0.00 61.00 61.55 2eh0 s PRO 92 Cb 0.06 -4.61 -0.03 0.00 0.04 0.00 0.00 34.50 29.96 2eh0 s PRO 92 CO -0.05 -2.94 -0.19 0.14 0.04 0.00 0.00 177.00 173.99 2eh0 s VAL 93 N 9.40 1.59 0.52 -0.36 -7.23 -0.97 -4.90 120.40 118.45 2eh0 s VAL 93 Ca 0.68 -1.53 -0.22 0.00 -1.81 0.00 0.00 61.98 59.09 2eh0 s VAL 93 Cb -0.11 -1.48 -0.06 0.00 0.56 0.00 0.00 36.38 35.29 2eh0 s VAL 93 CO 0.14 -0.12 1.33 -1.10 -0.31 0.00 0.00 175.10 175.04 2eh0 s GLN 94 N -1.97 3.32 0.23 4.82 -0.21 -1.26 -0.68 119.66 123.92 2eh0 s GLN 94 Ca 0.06 2.18 -0.16 0.00 0.02 0.00 0.00 55.36 57.45 2eh0 s GLN 94 Cb -0.10 -2.34 -0.08 0.00 1.00 0.00 0.00 33.01 31.49 2eh0 s GLN 94 CO 0.04 -1.03 0.67 -0.51 -2.12 0.00 0.00 175.29 172.35 2eh0 s LEU 95 N -3.32 4.25 -0.29 2.90 2.01 0.18 -4.80 118.68 119.62 2eh0 s LEU 95 Ca 0.69 1.26 -0.12 0.00 0.01 0.00 0.00 54.13 55.97 2eh0 s LEU 95 Cb -0.39 -3.67 -0.04 0.00 0.01 0.00 0.00 46.19 42.10 2eh0 s LEU 95 CO 0.47 -0.03 0.23 -0.60 1.01 0.00 0.00 176.35 177.43 2eh0 s ARG 96 N -2.33 3.91 -0.84 1.70 6.06 -1.26 -4.88 118.95 121.30 2eh0 s ARG 96 Ca 0.45 -0.29 -0.22 0.00 -2.50 0.00 0.00 55.73 53.17 2eh0 s ARG 96 Cb -0.14 -3.68 -0.18 0.00 0.06 0.00 0.00 34.95 31.01 2eh0 s ARG 96 CO 0.20 -0.23 2.25 -1.13 -2.50 0.00 0.00 175.30 173.88 2eh0 n SER 97 N 5.12 1.03 0.00 -2.12 3.41 -1.26 -0.25 113.62 119.55 2eh0 n SER 97 Ca -0.13 -1.56 0.00 0.00 -0.26 0.00 0.00 58.87 56.93 2eh0 n SER 97 Cb 0.51 -1.46 0.00 0.00 -0.26 0.00 0.00 64.21 63.01 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 6.36 0.43 3.86 5.00 0.00 -0.77 -4.85 105.19 115.22 2eh0 n GLY 98 Ca 0.46 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.02 6.71 -0.58 1.61 4.22 0.65 -4.92 114.94 121.61 2eh0 s ASN 99 Ca 0.00 1.16 -0.20 0.00 -2.14 0.00 0.00 52.86 51.68 2eh0 s ASN 99 Cb 0.00 -2.32 0.08 0.00 1.28 0.00 0.00 41.25 40.29 2eh0 s ASN 99 CO 0.00 -0.18 0.73 -0.60 -2.04 0.00 0.00 177.10 175.01 2eh0 s ARG 100 N -2.99 3.09 -0.24 3.55 3.52 -1.26 -3.48 118.95 121.13 2eh0 s ARG 100 Ca 0.52 -1.09 -0.20 0.00 -0.13 0.00 0.00 55.73 54.83 2eh0 s ARG 100 Cb -0.10 -4.21 -0.02 0.00 -1.56 0.00 0.00 34.95 29.05 2eh0 s ARG 100 CO 0.19 -1.50 0.60 0.42 -0.81 0.00 0.00 175.30 174.20 2eh0 s ILE 101 N 2.94 5.02 -0.04 4.11 1.01 0.26 -3.20 121.20 131.30 2eh0 s ILE 101 Ca 0.15 1.08 0.06 0.00 0.00 0.00 0.00 60.65 61.95 2eh0 s ILE 101 Cb -0.21 -3.91 -0.02 0.00 0.01 0.00 0.00 42.46 38.33 2eh0 s ILE 101 CO 0.09 0.07 -0.23 -0.63 0.00 0.00 0.00 174.94 174.24 2eh0 s ILE 102 N 2.24 2.29 0.05 2.92 1.09 -0.37 0.46 121.20 129.87 2eh0 s ILE 102 Ca 0.26 -1.01 0.04 0.00 -1.10 0.00 0.00 60.65 58.84 2eh0 s ILE 102 Cb -0.16 -1.83 -0.02 0.00 -1.06 0.00 0.00 42.46 39.39 2eh0 s ILE 102 CO 0.09 0.58 -0.11 -0.04 -0.10 0.00 0.00 174.94 175.36 2eh0 s MET 103 N -0.50 0.70 0.01 2.79 -1.94 -0.66 -1.49 119.30 118.21 2eh0 s MET 103 Ca 0.07 -0.78 0.00 0.00 -1.71 0.00 0.00 55.69 53.27 2eh0 s MET 103 Cb -0.11 -0.62 0.00 0.00 2.01 0.00 0.00 34.83 36.11 2eh0 s MET 103 CO 0.01 0.14 0.00 0.41 -0.01 0.00 0.00 175.02 175.57 2eh0 n GLY 104 N 1.62 0.59 3.40 -0.03 0.00 -0.70 -3.66 105.19 106.41 2eh0 n GLY 104 Ca -0.20 0.55 -0.14 0.00 0.00 0.00 0.00 46.02 46.22 2eh0 n GLY 104 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2eh0 s LYS 105 N 0.00 0.66 -1.17 1.61 2.36 -1.17 -4.91 119.74 117.13 2eh0 s LYS 105 Ca 0.00 0.55 -0.09 0.00 -2.55 0.00 0.00 55.97 53.89 2eh0 s LYS 105 Cb 0.00 0.32 0.07 0.00 -1.05 0.00 0.00 37.83 37.17 2eh0 s LYS 105 CO 0.00 -0.11 0.39 -1.71 1.55 0.00 0.00 175.35 175.47 2eh0 n ASN 106 N 2.40 -3.27 -3.20 1.43 2.85 -1.26 -4.86 115.26 109.34 2eh0 n ASN 106 Ca -0.15 -0.30 -0.24 0.00 -0.11 0.00 0.00 54.58 53.78 2eh0 n ASN 106 Cb 0.56 -2.75 -0.06 0.00 1.24 0.00 0.00 39.78 38.78 2eh0 n ASN 106 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 2eh0 n HIS 107 N -3.73 1.68 -3.36 1.20 8.25 -1.24 -5.00 115.22 113.03 2eh0 n HIS 107 Ca -0.02 -3.86 -0.27 0.00 -0.26 0.00 0.00 57.72 53.31 2eh0 n HIS 107 Cb 0.54 -0.45 -0.02 0.00 1.12 0.00 0.00 29.99 31.17 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 -2.44 5.06 -0.18 1.59 1.01 -1.26 -1.65 120.40 122.54 2eh0 s VAL 108 Ca 0.40 -0.13 -0.24 0.00 0.00 0.00 0.00 61.98 62.00 2eh0 s VAL 108 Cb 0.23 -3.78 0.06 0.00 0.00 0.00 0.00 36.38 32.89 2eh0 s VAL 108 CO -0.08 -0.40 0.64 -0.36 0.00 0.00 0.00 175.10 174.90 2eh0 s PHE 109 N -2.16 -0.67 -0.16 5.22 0.40 0.17 -4.36 117.98 116.43 2eh0 s PHE 109 Ca 0.42 1.48 -0.05 0.00 -0.60 0.00 0.00 56.93 58.19 2eh0 s PHE 109 Cb -0.10 0.28 -0.03 0.00 0.51 0.00 0.00 43.02 43.68 2eh0 s PHE 109 CO 0.32 -0.42 -0.01 0.50 0.70 0.00 0.00 175.22 176.31 2eh0 s ARG 110 N -0.19 3.74 0.20 0.44 3.52 -0.10 -0.57 118.95 125.98 2eh0 s ARG 110 Ca -0.04 -0.47 -0.26 0.00 -0.13 0.00 0.00 55.73 54.83 2eh0 s ARG 110 Cb -0.03 -2.99 -0.08 0.00 -1.56 0.00 0.00 34.95 30.28 2eh0 s ARG 110 CO 0.04 0.27 0.83 0.12 -0.81 0.00 0.00 175.30 175.74 2eh0 s PHE 111 N 0.32 3.91 -0.16 5.12 5.36 -1.23 -1.30 117.98 130.00 2eh0 s PHE 111 Ca -0.02 1.71 0.00 0.00 -0.96 0.00 0.00 56.93 57.67 2eh0 s PHE 111 Cb -0.14 -2.83 0.03 0.00 -0.34 0.00 0.00 43.02 39.74 2eh0 s PHE 111 CO 0.02 0.48 -0.14 -0.80 -1.46 0.00 0.00 175.22 173.32 2eh0 s ASN 112 N -1.20 2.85 -0.48 6.13 -0.87 -1.09 -1.85 114.94 118.43 2eh0 s ASN 112 Ca 0.38 -0.57 0.06 0.00 -1.57 0.00 0.00 52.86 51.16 2eh0 s ASN 112 Cb -0.24 -1.21 0.21 0.00 -0.02 0.00 0.00 41.25 40.00 2eh0 s ASN 112 CO 0.28 -0.07 0.49 1.57 -2.57 0.00 0.00 177.10 176.80 2eh0 n HIS 113 N 4.74 0.62 0.97 2.20 -0.00 -1.26 -3.61 115.22 118.89 2eh0 n HIS 113 Ca -0.17 -3.68 0.06 0.00 0.46 0.00 0.00 57.72 54.39 2eh0 n HIS 113 Cb 0.49 -0.22 0.33 0.00 -0.12 0.00 0.00 29.99 30.48 2eh0 n HIS 113 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 2eh0 n PRO 114 N 1.87 0.49 -0.08 1.57 -0.04 -1.26 -2.48 135.00 135.06 2eh0 n PRO 114 Ca 0.25 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.62 2eh0 n PRO 114 Cb 0.47 -1.36 -0.03 0.00 -0.04 0.00 0.00 33.50 32.53 2eh0 n PRO 114 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2eh0 n GLU 115 N -0.86 0.49 -0.11 0.54 1.02 -1.26 -4.42 120.64 116.04 2eh0 n GLU 115 Ca 0.08 0.43 -0.06 0.00 -0.02 0.00 0.00 57.16 57.59 2eh0 n GLU 115 Cb 0.04 -1.61 0.12 0.00 -0.02 0.00 0.00 31.44 29.97 2eh0 n GLU 115 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 2eh0 h GLN 116 N -1.00 0.81 0.00 3.49 -0.00 -1.82 -2.56 115.11 114.04 2eh0 h GLN 116 Ca -0.07 -0.26 0.00 0.00 -0.00 0.00 0.00 58.65 58.32 2eh0 h GLN 116 Cb 0.79 -0.07 0.00 0.00 0.00 0.00 0.00 27.48 28.20 2eh0 h GLN 116 CO -0.04 0.87 0.47 0.00 0.00 0.00 0.00 178.83 180.12 2eh0 h ALA 117 N 1.17 1.43 -0.48 3.38 0.00 -1.71 0.31 119.26 123.36 2eh0 h ALA 117 Ca 0.13 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 2eh0 h ALA 117 Cb 0.57 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2eh0 h ALA 117 CO 0.03 -0.43 -0.12 0.07 0.00 0.00 0.00 179.25 178.81 2eh0 h ARG 118 N 0.00 0.90 0.00 0.00 0.11 -1.66 -2.22 114.38 111.50 2eh0 h ARG 118 Ca 0.00 -0.32 0.00 0.00 0.10 0.00 0.00 59.98 59.76 2eh0 h ARG 118 Cb 0.94 -0.06 0.00 0.00 1.11 0.00 0.00 29.97 31.96 2eh0 h ARG 118 CO 0.00 0.96 0.00 0.00 0.10 0.00 0.00 179.97 181.03 2eh0 n ALA 119 N -2.49 2.10 -0.33 0.08 0.00 0.11 -3.60 120.51 116.39 2eh0 n ALA 119 Ca 0.01 -0.10 0.15 0.00 0.00 0.00 0.00 53.44 53.51 2eh0 n ALA 119 Cb 0.39 -1.36 0.34 0.00 0.00 0.00 0.00 19.45 18.82 2eh0 n ALA 119 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2eh0 h GLU 120 N 0.00 0.54 0.00 0.00 4.11 -1.44 0.84 114.58 118.63 2eh0 h GLU 120 Ca 0.00 -0.03 -0.03 0.00 0.07 0.00 0.00 59.36 59.37 2eh0 h GLU 120 Cb 0.26 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 2eh0 h GLU 120 CO 0.00 0.36 -0.13 0.00 0.07 0.00 0.00 179.01 179.31 2eh0 h ARG 121 N 0.55 0.00 -0.92 1.06 2.47 -1.77 -2.42 114.38 113.35 2eh0 h ARG 121 Ca 0.60 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 59.30 2eh0 h ARG 121 Cb 1.09 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.40 2eh0 h ARG 121 CO -0.47 0.13 0.02 0.39 0.56 0.00 0.00 179.97 180.60 2eh0 n GLU 122 N -3.39 1.81 -0.07 0.04 -0.58 0.29 -3.72 120.64 115.02 2eh0 n GLU 122 Ca -0.01 -0.71 -0.14 0.00 -0.42 0.00 0.00 57.16 55.89 2eh0 n GLU 122 Cb 0.31 -1.62 -0.06 0.00 -0.57 0.00 0.00 31.44 29.50 2eh0 n GLU 122 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 2eh0 n LYS 123 N 0.14 0.32 -3.52 3.49 4.81 -0.91 -4.93 118.16 117.56 2eh0 n LYS 123 Ca 0.07 0.12 -0.42 0.00 -0.87 0.00 0.00 58.31 57.21 2eh0 n LYS 123 Cb 0.50 -1.11 -0.10 0.00 0.02 0.00 0.00 35.03 34.34 2eh0 n LYS 123 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2eh0 s THR 124 N -2.27 4.85 -0.30 3.15 2.01 -1.24 -5.01 115.64 116.83 2eh0 s THR 124 Ca -0.20 -0.89 -0.16 0.00 0.31 0.00 0.00 61.69 60.74 2eh0 s THR 124 Cb 0.07 -3.77 0.19 0.00 0.01 0.00 0.00 72.50 69.00 2eh0 s THR 124 CO 0.28 -0.34 1.18 -0.55 -0.69 0.00 0.00 174.62 174.49 2eh0 s SER 125 N 1.81 -0.20 0.00 3.53 0.15 -1.26 -4.99 113.70 112.74 2eh0 s SER 125 Ca 0.03 0.31 0.00 0.00 0.70 0.00 0.00 55.95 56.99 2eh0 s SER 125 Cb -0.20 1.11 0.00 0.00 -1.71 0.00 0.00 66.02 65.22 2eh0 s SER 125 CO 0.07 -0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.07 2eh0 n GLY 126 N 3.52 1.11 0.00 9.45 0.00 -1.26 -5.17 105.19 112.83 2eh0 n GLY 126 Ca -0.16 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.01 2eh0 n GLY 126 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2eh0 n PRO 127 N -0.34 -0.28 -3.61 1.61 -0.04 -1.26 -5.11 135.00 125.97 2eh0 n PRO 127 Ca 0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.33 2eh0 n PRO 127 Cb 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.43 2eh0 n PRO 127 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2eh0 n SER 128 N -1.90 -1.11 -4.92 3.54 2.88 -1.26 -5.17 113.62 105.67 2eh0 n SER 128 Ca 0.00 -2.61 -0.25 0.00 -1.33 0.00 0.00 58.87 54.69 2eh0 n SER 128 Cb 0.00 2.10 -0.03 0.00 -0.75 0.00 0.00 64.21 65.53 2eh0 n SER 128 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2eh0 s SER 129 N -2.83 6.14 0.00 -3.46 0.01 -1.26 -5.37 113.70 106.92 2eh0 s SER 129 Ca 0.25 0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.57 2eh0 s SER 129 Cb -0.01 -1.78 0.00 0.00 0.21 0.00 0.00 66.02 64.44 2eh0 s SER 129 CO 0.18 0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.46