#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m26 s LYS 2 N 0.00 4.08 0.48 1.61 2.20 0.13 -4.80 119.74 123.44 1m26 s LYS 2 Ca 0.00 0.05 -0.21 0.00 -0.36 0.00 0.00 55.97 55.45 1m26 s LYS 2 Cb 0.00 -3.60 -0.08 0.00 -1.51 0.00 0.00 37.83 32.64 1m26 s LYS 2 CO 0.00 -0.15 1.06 0.00 -0.36 0.00 0.00 175.35 175.91 1m26 s ALA 3 N 1.66 2.89 0.04 3.13 0.00 -1.26 -1.80 121.76 126.42 1m26 s ALA 3 Ca 0.15 0.68 -0.03 0.00 0.00 0.00 0.00 51.96 52.76 1m26 s ALA 3 Cb -0.15 -3.28 -0.02 0.00 0.00 0.00 0.00 23.12 19.66 1m26 s ALA 3 CO 0.09 -0.39 0.04 -0.59 0.00 0.00 0.00 175.76 174.90 1m26 s PHE 4 N -1.86 0.32 -0.29 0.00 -0.71 0.26 -4.95 117.98 110.75 1m26 s PHE 4 Ca 0.66 -0.72 0.03 0.00 -1.04 0.00 0.00 56.93 55.86 1m26 s PHE 4 Cb -0.19 -0.23 0.18 0.00 -1.21 0.00 0.00 43.02 41.56 1m26 s PHE 4 CO 0.23 -0.36 0.51 0.34 -1.34 0.00 0.00 175.22 174.61 1m26 s ASP 5 N -2.36 -0.74 0.27 1.98 3.68 -1.26 -0.92 116.67 117.30 1m26 s ASP 5 Ca -0.02 0.05 0.08 0.00 2.13 0.00 0.00 52.55 54.79 1m26 s ASP 5 Cb 0.01 1.65 0.34 0.00 -1.45 0.00 0.00 42.92 43.47 1m26 s ASP 5 CO -0.06 -0.32 1.61 0.44 0.13 0.00 0.00 175.17 176.97 1m26 h ASP 6 N 8.07 0.14 -3.43 -0.34 3.32 -1.71 -3.49 116.42 118.98 1m26 h ASP 6 Ca -0.07 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.90 1m26 h ASP 6 Cb 1.16 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.67 1m26 h ASP 6 CO 0.21 0.69 0.00 0.61 -1.72 0.00 0.00 179.24 179.03 1m26 n GLY 7 N 0.17 -1.79 3.79 2.75 0.00 -1.25 -4.97 105.19 103.89 1m26 n GLY 7 Ca -0.02 -1.88 -0.34 0.00 0.00 0.00 0.00 46.02 43.78 1m26 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m26 s ALA 8 N -1.75 3.62 0.00 4.61 0.00 -1.26 -3.98 121.76 123.00 1m26 s ALA 8 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.16 1m26 s ALA 8 Cb 0.00 -1.67 0.00 0.00 0.00 0.00 0.00 23.12 21.45 1m26 s ALA 8 CO 0.00 0.66 0.00 1.19 0.00 0.00 0.00 175.76 177.61 1m26 n PHE 9 N 1.54 0.00 0.06 0.00 3.01 0.80 -5.00 117.46 117.88 1m26 n PHE 9 Ca -0.16 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.38 1m26 n PHE 9 Cb 0.53 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.95 1m26 n PHE 9 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 1m26 n THR 10 N 0.00 0.69 -1.79 4.37 -1.04 -0.42 -4.85 114.28 111.25 1m26 n THR 10 Ca 0.00 -0.59 0.00 0.00 -2.04 0.00 0.00 64.05 61.42 1m26 n THR 10 Cb 0.00 -0.39 0.00 0.00 -1.82 0.00 0.00 70.33 68.12 1m26 n THR 10 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1m26 n GLY 11 N 1.26 -1.46 3.19 3.41 0.00 -1.18 -4.92 105.19 105.50 1m26 n GLY 11 Ca -0.04 -1.01 -0.29 0.00 0.00 0.00 0.00 46.02 44.67 1m26 n GLY 11 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1m26 s ILE 12 N -2.54 1.79 -0.18 -0.61 1.01 -1.26 -0.84 121.20 118.57 1m26 s ILE 12 Ca 0.00 -0.90 0.01 0.00 0.00 0.00 0.00 60.65 59.76 1m26 s ILE 12 Cb 0.00 -1.54 -0.11 0.00 0.01 0.00 0.00 42.46 40.82 1m26 s ILE 12 CO 0.00 0.50 -0.16 0.54 0.00 0.00 0.00 174.94 175.82 1m26 n ARG 13 N 3.25 0.44 -3.60 2.79 1.74 0.03 -4.73 116.66 116.58 1m26 n ARG 13 Ca -0.19 0.10 -0.16 0.00 -0.77 0.00 0.00 57.85 56.84 1m26 n ARG 13 Cb 0.52 -1.35 -0.07 0.00 -1.02 0.00 0.00 32.46 30.55 1m26 n ARG 13 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1m26 s GLU 14 N -2.35 0.91 -0.08 5.56 2.12 -0.78 -1.47 118.70 122.61 1m26 s GLU 14 Ca -0.24 0.39 0.03 0.00 0.36 0.00 0.00 54.97 55.51 1m26 s GLU 14 Cb 0.06 0.43 0.01 0.00 0.26 0.00 0.00 34.13 34.89 1m26 s GLU 14 CO 0.40 -0.24 -0.17 0.42 -0.54 0.00 0.00 175.26 175.13 1m26 s ILE 15 N -0.75 1.54 -0.20 -3.70 1.01 -0.00 0.11 121.20 119.21 1m26 s ILE 15 Ca -0.08 -0.71 0.00 0.00 0.00 0.00 0.00 60.65 59.86 1m26 s ILE 15 Cb -0.02 -1.37 0.02 0.00 0.01 0.00 0.00 42.46 41.10 1m26 s ILE 15 CO 0.06 0.45 -0.15 0.20 0.00 0.00 0.00 174.94 175.50 1m26 s ASN 16 N 0.54 3.62 0.24 3.58 0.01 0.10 -0.33 114.94 122.70 1m26 s ASN 16 Ca -0.16 -0.73 0.00 0.00 -0.71 0.00 0.00 52.86 51.26 1m26 s ASN 16 Cb -0.17 -1.55 -0.05 0.00 0.41 0.00 0.00 41.25 39.89 1m26 s ASN 16 CO 0.06 -0.04 0.11 -1.48 -1.51 0.00 0.00 177.10 174.23 1m26 s LEU 17 N 1.30 1.47 0.07 0.60 0.05 -0.74 -0.05 118.68 121.38 1m26 s LEU 17 Ca 0.03 -1.39 0.02 0.00 0.05 0.00 0.00 54.13 52.84 1m26 s LEU 17 Cb -0.14 0.15 -0.03 0.00 -2.05 0.00 0.00 46.19 44.11 1m26 s LEU 17 CO -0.09 -0.77 -0.08 -0.94 -0.55 0.00 0.00 176.35 173.92 1m26 s SER 18 N -3.26 1.07 0.23 1.48 1.04 -0.69 -0.58 113.70 112.99 1m26 s SER 18 Ca 0.38 -0.77 -0.12 0.00 0.48 0.00 0.00 55.95 55.93 1m26 s SER 18 Cb 0.08 0.05 -0.01 0.00 0.10 0.00 0.00 66.02 66.24 1m26 s SER 18 CO 0.13 -0.31 0.43 -0.72 0.98 0.00 0.00 173.24 173.75 1m26 s TYR 19 N -2.42 0.41 -0.07 5.02 1.13 -0.49 -0.28 117.35 120.66 1m26 s TYR 19 Ca 0.01 -0.76 -0.01 0.00 -1.41 0.00 0.00 57.07 54.90 1m26 s TYR 19 Cb -0.03 0.11 0.03 0.00 -1.10 0.00 0.00 41.96 40.97 1m26 s TYR 19 CO -0.02 -0.94 -0.02 1.21 -2.51 0.00 0.00 175.55 173.27 1m26 s ASN 20 N -3.02 1.47 0.00 -0.18 3.84 -1.00 -0.14 114.94 115.91 1m26 s ASN 20 Ca 0.23 -0.12 0.05 0.00 0.21 0.00 0.00 52.86 53.22 1m26 s ASN 20 Cb 0.00 -0.49 0.27 0.00 -0.55 0.00 0.00 41.25 40.48 1m26 s ASN 20 CO 0.08 -0.14 0.85 2.29 -2.79 0.00 0.00 177.10 177.38 1m26 n LYS 21 N 4.79 0.12 -0.00 0.43 2.85 -1.26 -1.72 118.16 123.37 1m26 n LYS 21 Ca -0.13 0.09 0.03 0.00 -1.05 0.00 0.00 58.31 57.26 1m26 n LYS 21 Cb 0.50 -1.50 -0.05 0.00 -0.65 0.00 0.00 35.03 33.34 1m26 n LYS 21 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1m26 n GLU 22 N -1.11 2.70 0.00 -1.58 1.02 -1.26 -4.72 120.64 115.69 1m26 n GLU 22 Ca 0.03 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1m26 n GLU 22 Cb 0.02 -0.98 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 1m26 n GLU 22 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1m26 n THR 23 N -1.43 0.00 -2.99 2.62 -2.24 -0.70 -5.05 114.28 104.50 1m26 n THR 23 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1m26 n THR 23 Cb 0.15 -0.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 1m26 n THR 23 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1m26 n ALA 24 N -2.70 0.00 -1.76 6.98 0.00 -1.20 -4.59 120.51 117.24 1m26 n ALA 24 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 1m26 n ALA 24 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1m26 n ALA 24 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1m26 s ILE 25 N -2.93 3.73 0.00 0.00 -1.09 -1.01 -2.36 121.20 117.54 1m26 s ILE 25 Ca 0.00 1.68 0.00 0.00 -2.23 0.00 0.00 60.65 60.10 1m26 s ILE 25 Cb 0.00 -4.05 0.00 0.00 -1.58 0.00 0.00 42.46 36.83 1m26 s ILE 25 CO 0.00 0.36 0.00 0.61 -1.23 0.00 0.00 174.94 174.68 1m26 n GLY 26 N 1.17 0.43 3.80 6.18 0.00 0.62 -1.42 105.19 115.97 1m26 n GLY 26 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1m26 n GLY 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1m26 s ASP 27 N -0.00 6.09 -0.09 1.61 1.01 -1.25 -4.28 116.67 119.75 1m26 s ASP 27 Ca 0.00 1.93 -0.04 0.00 0.71 0.00 0.00 52.55 55.15 1m26 s ASP 27 Cb 0.00 -2.56 0.05 0.00 1.01 0.00 0.00 42.92 41.42 1m26 s ASP 27 CO 0.00 -0.96 0.20 0.12 0.21 0.00 0.00 175.17 174.74 1m26 s PHE 28 N -2.08 -0.25 -0.06 4.23 5.36 0.07 -1.70 117.98 123.54 1m26 s PHE 28 Ca 0.67 0.67 -0.10 0.00 -0.96 0.00 0.00 56.93 57.21 1m26 s PHE 28 Cb -0.17 -0.08 0.02 0.00 -0.34 0.00 0.00 43.02 42.45 1m26 s PHE 28 CO 0.26 -0.24 0.25 -1.14 -1.46 0.00 0.00 175.22 172.89 1m26 s GLN 29 N 1.63 0.44 -0.02 10.12 -0.44 0.92 -1.25 119.66 131.07 1m26 s GLN 29 Ca -0.05 0.06 0.03 0.00 -2.50 0.00 0.00 55.36 52.90 1m26 s GLN 29 Cb -0.11 0.20 -0.00 0.00 -1.64 0.00 0.00 33.01 31.45 1m26 s GLN 29 CO -0.07 -0.09 -0.11 0.08 0.50 0.00 0.00 175.29 175.59 1m26 s VAL 30 N -0.56 0.94 -0.36 1.34 1.01 -1.26 0.01 120.40 121.52 1m26 s VAL 30 Ca -0.07 -0.47 -0.11 0.00 0.00 0.00 0.00 61.98 61.33 1m26 s VAL 30 Cb -0.04 -0.81 0.01 0.00 0.00 0.00 0.00 36.38 35.54 1m26 s VAL 30 CO 0.02 0.28 0.21 -0.69 0.00 0.00 0.00 175.10 174.92 1m26 s VAL 31 N -0.01 4.78 0.68 2.92 1.01 0.12 -1.17 120.40 128.72 1m26 s VAL 31 Ca -0.00 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.35 1m26 s VAL 31 Cb -0.08 -3.58 0.11 0.00 0.00 0.00 0.00 36.38 32.83 1m26 s VAL 31 CO 0.00 -0.14 0.94 -0.31 0.00 0.00 0.00 175.10 175.59 1m26 s TYR 32 N 1.61 1.79 -0.09 5.22 1.51 -0.14 -0.79 117.35 126.47 1m26 s TYR 32 Ca 0.04 -0.27 -0.01 0.00 -1.01 0.00 0.00 57.07 55.82 1m26 s TYR 32 Cb -0.18 -2.88 -0.03 0.00 -0.11 0.00 0.00 41.96 38.76 1m26 s TYR 32 CO 0.08 -1.51 -0.04 0.34 -1.11 0.00 0.00 175.55 173.31 1m26 s ASP 33 N -4.67 4.89 -0.41 2.29 2.15 -0.02 -0.50 116.67 120.40 1m26 s ASP 33 Ca 0.64 0.03 0.02 0.00 0.43 0.00 0.00 52.55 53.67 1m26 s ASP 33 Cb -0.06 -1.37 0.13 0.00 -0.30 0.00 0.00 42.92 41.31 1m26 s ASP 33 CO 0.43 0.34 0.20 -0.22 -0.17 0.00 0.00 175.17 175.74 1m26 s LEU 34 N -0.66 2.88 -1.47 -1.34 2.96 0.69 -1.30 118.68 120.44 1m26 s LEU 34 Ca 0.10 -2.42 -0.10 0.00 -0.22 0.00 0.00 54.13 51.49 1m26 s LEU 34 Cb -0.12 -1.09 0.06 0.00 0.50 0.00 0.00 46.19 45.54 1m26 s LEU 34 CO 0.02 -0.30 0.89 0.59 -1.32 0.00 0.00 176.35 176.22 1m26 n ASN 35 N 3.82 -3.63 0.00 3.68 5.03 -1.26 -2.15 115.26 120.75 1m26 n ASN 35 Ca 0.06 -0.80 0.00 0.00 0.87 0.00 0.00 54.58 54.71 1m26 n ASN 35 Cb 0.36 -3.89 0.00 0.00 -1.02 0.00 0.00 39.78 35.23 1m26 n ASN 35 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1m26 n GLY 36 N -1.67 0.38 3.45 7.41 0.00 -1.26 -5.06 105.19 108.44 1m26 n GLY 36 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 1m26 n GLY 36 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1m26 s SER 37 N -2.30 3.86 0.25 1.61 0.01 -0.91 -5.09 113.70 111.12 1m26 s SER 37 Ca 0.00 -0.26 -0.30 0.00 1.31 0.00 0.00 55.95 56.70 1m26 s SER 37 Cb 0.00 -0.75 -0.10 0.00 0.21 0.00 0.00 66.02 65.38 1m26 s SER 37 CO 0.00 0.33 1.45 -2.84 0.41 0.00 0.00 173.24 172.59 1m26 s PRO 38 N -0.78 4.26 -0.27 12.44 0.02 -1.26 -0.22 135.00 149.18 1m26 s PRO 38 Ca 0.12 2.32 -0.01 0.00 0.02 0.00 0.00 61.00 63.45 1m26 s PRO 38 Cb -0.10 -3.10 0.04 0.00 0.02 0.00 0.00 34.50 31.36 1m26 s PRO 38 CO 0.01 -0.43 -0.04 -0.47 -0.33 0.00 0.00 177.00 175.73 1m26 s TYR 39 N -0.02 3.19 -0.54 6.54 6.14 0.34 -4.83 117.35 128.17 1m26 s TYR 39 Ca 0.59 -1.83 -0.28 0.00 0.64 0.00 0.00 57.07 56.19 1m26 s TYR 39 Cb -0.42 -2.06 0.02 0.00 0.42 0.00 0.00 41.96 39.92 1m26 s TYR 39 CO 0.44 -0.79 1.26 0.08 0.64 0.00 0.00 175.55 177.17 1m26 s VAL 40 N 1.25 3.98 0.76 3.14 1.01 -1.26 -0.97 120.40 128.32 1m26 s VAL 40 Ca -0.04 0.90 -0.11 0.00 0.00 0.00 0.00 61.98 62.73 1m26 s VAL 40 Cb -0.19 -4.59 0.05 0.00 0.00 0.00 0.00 36.38 31.65 1m26 s VAL 40 CO -0.03 -1.20 1.08 -0.83 0.00 0.00 0.00 175.10 174.12 1m26 s GLY 41 N 3.32 1.66 0.39 4.51 0.00 -0.32 -4.98 107.32 111.90 1m26 s GLY 41 Ca 0.48 0.14 -0.27 0.00 0.00 0.00 0.00 44.72 45.07 1m26 s GLY 41 CO 0.27 0.49 1.34 1.62 0.00 0.00 0.00 173.10 176.82 1m26 s GLN 42 N -4.97 4.03 -0.33 2.90 0.74 -1.26 -4.65 119.66 116.11 1m26 s GLN 42 Ca 0.60 2.25 -0.26 0.00 0.05 0.00 0.00 55.36 58.00 1m26 s GLN 42 Cb -0.16 -2.83 0.01 0.00 1.10 0.00 0.00 33.01 31.13 1m26 s GLN 42 CO 0.56 -0.47 0.93 1.21 -0.55 0.00 0.00 175.29 176.96 1m26 s ASN 43 N -0.59 6.75 -0.50 6.67 2.47 -1.26 -4.53 114.94 123.95 1m26 s ASN 43 Ca 0.55 0.75 -0.19 0.00 0.42 0.00 0.00 52.86 54.39 1m26 s ASN 43 Cb -0.40 -2.47 0.05 0.00 -1.45 0.00 0.00 41.25 36.98 1m26 s ASN 43 CO 0.52 -0.79 0.64 -1.00 -3.72 0.00 0.00 177.10 172.75 1m26 s HIS 44 N 3.36 3.04 -0.10 0.43 3.76 -0.38 -4.99 115.29 120.42 1m26 s HIS 44 Ca 0.39 -0.44 -0.10 0.00 -0.15 0.00 0.00 55.06 54.75 1m26 s HIS 44 Cb -0.13 -3.51 -0.05 0.00 1.11 0.00 0.00 32.58 30.01 1m26 s HIS 44 CO 0.16 -1.01 0.23 0.15 -0.85 0.00 0.00 174.74 173.42 1m26 s LYS 45 N 2.70 3.78 0.70 1.40 -0.14 -1.26 -0.75 119.74 126.18 1m26 s LYS 45 Ca 0.17 0.04 -0.15 0.00 -1.36 0.00 0.00 55.97 54.66 1m26 s LYS 45 Cb -0.18 -3.26 0.02 0.00 -1.68 0.00 0.00 37.83 32.73 1m26 s LYS 45 CO 0.13 0.61 1.18 0.45 -0.76 0.00 0.00 175.35 176.97 1m26 s SER 46 N -0.63 4.50 0.52 2.83 0.15 -1.26 -4.87 113.70 114.93 1m26 s SER 46 Ca 0.17 2.27 0.32 0.00 0.70 0.00 0.00 55.95 59.41 1m26 s SER 46 Cb -0.13 -2.58 1.29 0.00 -1.71 0.00 0.00 66.02 62.89 1m26 s SER 46 CO 0.06 -2.06 1.95 -0.26 1.20 0.00 0.00 173.24 174.13 1m26 h PHE 47 N -0.13 0.00 -1.12 3.44 0.04 -1.19 -3.46 116.94 114.53 1m26 h PHE 47 Ca -0.48 0.00 -0.65 0.00 2.80 0.00 0.00 57.97 59.65 1m26 h PHE 47 Cb 1.28 0.00 -0.13 0.00 2.20 0.00 0.00 35.95 39.31 1m26 h PHE 47 CO 0.49 0.00 -0.55 0.96 -0.60 0.00 0.00 178.31 178.60 1m26 s ILE 48 N -3.62 1.68 0.56 -0.55 -4.36 -1.26 -5.03 121.20 108.61 1m26 s ILE 48 Ca 0.02 -1.97 0.05 0.00 -0.26 0.00 0.00 60.65 58.48 1m26 s ILE 48 Cb 0.09 -2.65 0.05 0.00 1.25 0.00 0.00 42.46 41.20 1m26 s ILE 48 CO 0.54 0.00 0.40 0.42 0.24 0.00 0.00 174.94 176.54 1m26 s THR 49 N -2.77 1.52 0.00 8.37 -4.23 -1.26 -4.86 115.64 112.40 1m26 s THR 49 Ca 0.24 -1.51 0.00 0.00 -1.18 0.00 0.00 61.69 59.24 1m26 s THR 49 Cb 0.06 -2.02 0.00 0.00 1.34 0.00 0.00 72.50 71.88 1m26 s THR 49 CO 0.12 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.81 1m26 n GLY 50 N -1.80 1.02 3.94 3.99 0.00 -1.26 -5.10 105.19 105.98 1m26 n GLY 50 Ca -0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.75 1m26 n GLY 50 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1m26 s PHE 51 N -2.00 3.17 -0.19 1.61 0.08 -1.26 -4.87 117.98 114.52 1m26 s PHE 51 Ca 0.00 0.39 -0.04 0.00 0.12 0.00 0.00 56.93 57.40 1m26 s PHE 51 Cb 0.00 -2.61 -0.02 0.00 -0.57 0.00 0.00 43.02 39.82 1m26 s PHE 51 CO 0.00 -0.70 -0.02 0.99 -0.10 0.00 0.00 175.22 175.39 1m26 s THR 52 N -2.82 3.79 0.46 0.64 2.01 0.80 -4.86 115.64 115.66 1m26 s THR 52 Ca 0.53 -0.37 -0.22 0.00 0.31 0.00 0.00 61.69 61.94 1m26 s THR 52 Cb -0.10 -2.70 -0.09 0.00 0.01 0.00 0.00 72.50 69.62 1m26 s THR 52 CO 0.42 0.44 1.04 -2.84 -0.69 0.00 0.00 174.62 172.99 1m26 s PRO 53 N 0.92 3.93 -0.05 4.92 0.02 -1.26 -1.39 135.00 142.08 1m26 s PRO 53 Ca 0.00 1.41 -0.03 0.00 0.02 0.00 0.00 61.00 62.40 1m26 s PRO 53 Cb -0.14 -2.24 0.03 0.00 0.02 0.00 0.00 34.50 32.16 1m26 s PRO 53 CO 0.01 -0.32 0.13 0.08 -0.33 0.00 0.00 177.00 176.57 1m26 s VAL 54 N -1.88 -0.03 -0.19 3.83 1.01 0.25 -4.96 120.40 118.43 1m26 s VAL 54 Ca 0.64 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.74 1m26 s VAL 54 Cb -0.18 -0.20 0.01 0.00 0.00 0.00 0.00 36.38 36.01 1m26 s VAL 54 CO 0.22 0.05 -0.17 -0.75 0.00 0.00 0.00 175.10 174.45 1m26 s LYS 55 N 0.74 3.06 -0.50 2.72 2.20 -1.26 -1.79 119.74 124.91 1m26 s LYS 55 Ca -0.06 -0.79 -0.10 0.00 -0.36 0.00 0.00 55.97 54.66 1m26 s LYS 55 Cb -0.08 -2.65 0.13 0.00 -1.51 0.00 0.00 37.83 33.73 1m26 s LYS 55 CO -0.03 -0.20 0.38 0.42 -0.36 0.00 0.00 175.35 175.55 1m26 s ILE 56 N 1.31 4.36 -0.34 5.43 1.01 0.55 -4.99 121.20 128.53 1m26 s ILE 56 Ca 0.05 -1.82 -0.14 0.00 0.00 0.00 0.00 60.65 58.74 1m26 s ILE 56 Cb -0.13 -3.85 -0.02 0.00 0.01 0.00 0.00 42.46 38.47 1m26 s ILE 56 CO -0.11 -0.80 0.32 -0.44 0.00 0.00 0.00 174.94 173.91 1m26 s SER 57 N 2.70 6.14 0.17 3.58 0.01 -1.26 -0.82 113.70 124.22 1m26 s SER 57 Ca 0.06 -0.26 -0.04 0.00 1.31 0.00 0.00 55.95 57.03 1m26 s SER 57 Cb -0.26 -2.18 -0.05 0.00 0.21 0.00 0.00 66.02 63.74 1m26 s SER 57 CO -0.01 -0.29 0.40 -0.76 0.41 0.00 0.00 173.24 172.99 1m26 s LEU 58 N 1.93 4.24 -1.40 2.44 1.43 -0.54 -4.97 118.68 121.80 1m26 s LEU 58 Ca 0.10 0.55 -0.11 0.00 -1.03 0.00 0.00 54.13 53.64 1m26 s LEU 58 Cb -0.17 -3.29 0.08 0.00 0.03 0.00 0.00 46.19 42.84 1m26 s LEU 58 CO 0.11 0.00 2.22 -0.67 0.23 0.00 0.00 176.35 178.24 1m26 n ASP 59 N -0.21 5.35 -4.72 2.29 4.64 -1.26 -4.86 116.55 117.78 1m26 n ASP 59 Ca -0.03 -2.93 -0.41 0.00 -1.38 0.00 0.00 54.79 50.04 1m26 n ASP 59 Cb 0.52 -1.55 0.01 0.00 -1.04 0.00 0.00 41.12 39.06 1m26 n ASP 59 CO 0.00 0.00 0.00 0.33 -0.82 0.00 0.00 177.20 176.71 1m26 n PHE 60 N 4.53 2.42 0.08 -0.67 7.35 -1.26 -0.50 117.46 129.41 1m26 n PHE 60 Ca 0.52 0.49 0.06 0.00 -0.76 0.00 0.00 57.45 57.77 1m26 n PHE 60 Cb 0.35 -2.43 -0.03 0.00 0.35 0.00 0.00 39.48 37.71 1m26 n PHE 60 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 1m26 h PRO 61 N 2.38 0.00 -0.02 -7.13 0.13 -1.94 -3.45 132.00 121.97 1m26 h PRO 61 Ca -0.48 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.50 1m26 h PRO 61 Cb 1.28 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 1m26 h PRO 61 CO 0.61 0.13 -0.66 0.66 -0.23 0.00 0.00 178.00 178.51 1m26 h SER 62 N 0.00 0.12 -3.24 1.44 4.64 -1.88 -3.43 113.55 111.21 1m26 h SER 62 Ca -0.07 -0.08 -0.61 0.00 -0.47 0.00 0.00 61.79 60.57 1m26 h SER 62 Cb 1.26 -0.04 -0.12 0.00 -0.31 0.00 0.00 62.40 63.19 1m26 h SER 62 CO 0.02 0.75 -0.50 -0.70 -0.87 0.00 0.00 176.83 175.53 1m26 s GLU 63 N -3.57 4.11 -0.01 4.77 2.12 0.34 -4.94 118.70 121.53 1m26 s GLU 63 Ca -0.02 -0.24 -0.16 0.00 0.36 0.00 0.00 54.97 54.91 1m26 s GLU 63 Cb 0.12 -3.37 0.03 0.00 0.26 0.00 0.00 34.13 31.17 1m26 s GLU 63 CO 0.79 0.32 0.35 1.52 -0.54 0.00 0.00 175.26 177.70 1m26 s TYR 64 N 0.28 -0.22 0.14 5.30 -0.85 -1.26 -4.22 117.35 116.52 1m26 s TYR 64 Ca 0.08 0.31 -0.31 0.00 -0.52 0.00 0.00 57.07 56.62 1m26 s TYR 64 Cb -0.11 0.13 -0.09 0.00 0.38 0.00 0.00 41.96 42.27 1m26 s TYR 64 CO -0.01 -0.43 1.42 0.42 -1.52 0.00 0.00 175.55 175.43 1m26 s ILE 65 N -1.52 3.13 -0.10 -3.49 1.01 -1.26 -2.65 121.20 116.32 1m26 s ILE 65 Ca -0.12 0.82 0.11 0.00 0.00 0.00 0.00 60.65 61.46 1m26 s ILE 65 Cb -0.04 -3.53 -0.16 0.00 0.01 0.00 0.00 42.46 38.75 1m26 s ILE 65 CO 0.04 0.07 0.27 0.23 0.00 0.00 0.00 174.94 175.55 1m26 n MET 66 N 3.80 0.92 -3.65 2.79 2.81 0.13 -4.73 117.12 119.19 1m26 n MET 66 Ca 0.11 -0.08 -0.13 0.00 -1.81 0.00 0.00 57.70 55.79 1m26 n MET 66 Cb 0.41 -1.21 -0.08 0.00 -0.71 0.00 0.00 33.22 31.64 1m26 n MET 66 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1m26 s GLU 67 N -2.60 0.74 -0.11 0.03 2.12 -0.86 -0.71 118.70 117.31 1m26 s GLU 67 Ca -0.02 0.93 0.03 0.00 0.36 0.00 0.00 54.97 56.26 1m26 s GLU 67 Cb 0.07 0.34 0.01 0.00 0.26 0.00 0.00 34.13 34.81 1m26 s GLU 67 CO 0.44 -0.10 -0.20 0.08 -0.54 0.00 0.00 175.26 174.94 1m26 s VAL 68 N 0.49 1.83 0.16 3.70 1.01 -0.82 -0.89 120.40 125.88 1m26 s VAL 68 Ca -0.01 -0.86 -0.01 0.00 0.00 0.00 0.00 61.98 61.10 1m26 s VAL 68 Cb -0.05 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 1m26 s VAL 68 CO -0.01 0.51 0.08 -0.94 0.00 0.00 0.00 175.10 174.73 1m26 s SER 69 N 0.67 0.37 0.00 3.32 1.04 -0.77 -0.03 113.70 118.30 1m26 s SER 69 Ca -0.12 -1.28 0.00 0.00 0.48 0.00 0.00 55.95 55.03 1m26 s SER 69 Cb -0.16 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.26 1m26 s SER 69 CO 0.03 -0.76 0.00 0.61 0.98 0.00 0.00 173.24 174.10 1m26 n GLY 70 N -0.19 -0.98 3.04 7.32 0.00 -0.80 -0.45 105.19 113.13 1m26 n GLY 70 Ca -0.03 -0.78 -0.16 0.00 0.00 0.00 0.00 46.02 45.06 1m26 n GLY 70 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1m26 s TYR 71 N -3.00 0.71 -0.06 1.61 2.02 -0.97 -1.93 117.35 115.74 1m26 s TYR 71 Ca 0.00 -0.30 0.05 0.00 -0.37 0.00 0.00 57.07 56.45 1m26 s TYR 71 Cb 0.00 -0.44 -0.02 0.00 -0.40 0.00 0.00 41.96 41.11 1m26 s TYR 71 CO 0.00 -0.03 -0.20 0.95 -1.57 0.00 0.00 175.55 174.70 1m26 s THR 72 N -0.75 2.48 0.38 -0.71 -4.23 -0.36 -0.38 115.64 112.06 1m26 s THR 72 Ca -0.03 -0.92 -0.09 0.00 -1.18 0.00 0.00 61.69 59.48 1m26 s THR 72 Cb -0.06 -1.94 0.04 0.00 1.34 0.00 0.00 72.50 71.87 1m26 s THR 72 CO 0.00 0.57 0.67 -0.83 -0.54 0.00 0.00 174.62 174.49 1m26 s GLY 73 N -0.29 0.93 -0.17 3.99 0.00 0.02 -0.59 107.32 111.22 1m26 s GLY 73 Ca 0.01 -1.14 -0.18 0.00 0.00 0.00 0.00 44.72 43.41 1m26 s GLY 73 CO 0.03 -0.63 0.48 0.21 0.00 0.00 0.00 173.10 173.19 1m26 s ASN 74 N -3.17 6.59 -0.18 1.64 3.84 -1.26 -0.96 114.94 121.45 1m26 s ASN 74 Ca 0.22 0.71 -0.03 0.00 0.21 0.00 0.00 52.86 53.97 1m26 s ASN 74 Cb -0.03 -2.28 0.06 0.00 -0.55 0.00 0.00 41.25 38.44 1m26 s ASN 74 CO 0.16 -0.09 0.03 -0.69 -2.79 0.00 0.00 177.10 173.72 1m26 s VAL 75 N 1.18 0.51 -1.80 -5.21 1.01 0.36 -4.80 120.40 111.65 1m26 s VAL 75 Ca 0.24 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.75 1m26 s VAL 75 Cb -0.15 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.26 1m26 s VAL 75 CO 0.10 -0.15 0.00 -1.20 0.00 0.00 0.00 175.10 173.85 1m26 n SER 76 N 5.06 -5.59 0.00 3.32 7.64 -1.26 -1.11 113.62 121.68 1m26 n SER 76 Ca -0.09 0.13 0.00 0.00 1.01 0.00 0.00 58.87 59.92 1m26 n SER 76 Cb 0.48 -4.73 0.00 0.00 -1.01 0.00 0.00 64.21 58.95 1m26 n SER 76 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1m26 n GLY 77 N -0.84 1.67 3.78 0.23 0.00 -1.26 -5.03 105.19 103.74 1m26 n GLY 77 Ca -0.23 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.42 1m26 n GLY 77 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1m26 s TYR 78 N -2.39 3.56 -0.22 1.61 2.02 -0.27 -5.05 117.35 116.61 1m26 s TYR 78 Ca 0.00 0.72 -0.19 0.00 -0.37 0.00 0.00 57.07 57.23 1m26 s TYR 78 Cb 0.00 -2.29 -0.03 0.00 -0.40 0.00 0.00 41.96 39.25 1m26 s TYR 78 CO 0.00 0.42 0.57 0.08 -1.57 0.00 0.00 175.55 175.05 1m26 s VAL 79 N -0.17 5.05 0.27 0.71 1.01 -1.26 -0.49 120.40 125.52 1m26 s VAL 79 Ca 0.19 1.05 0.02 0.00 0.00 0.00 0.00 61.98 63.24 1m26 s VAL 79 Cb -0.14 -3.89 -0.03 0.00 0.00 0.00 0.00 36.38 32.32 1m26 s VAL 79 CO 0.07 0.11 0.25 0.68 0.00 0.00 0.00 175.10 176.21 1m26 s VAL 80 N 2.01 0.00 -0.47 2.92 -7.23 -0.13 -4.82 120.40 112.67 1m26 s VAL 80 Ca 0.25 -1.92 -0.25 0.00 -1.81 0.00 0.00 61.98 58.25 1m26 s VAL 80 Cb -0.16 -2.50 0.03 0.00 0.56 0.00 0.00 36.38 34.31 1m26 s VAL 80 CO 0.09 0.00 0.92 -0.69 -0.31 0.00 0.00 175.10 175.12 1m26 s VAL 81 N -3.72 4.47 -0.05 1.32 1.01 0.12 -0.80 120.40 122.74 1m26 s VAL 81 Ca 0.38 0.69 0.13 0.00 0.00 0.00 0.00 61.98 63.18 1m26 s VAL 81 Cb 0.04 -4.44 -0.14 0.00 0.00 0.00 0.00 36.38 31.84 1m26 s VAL 81 CO 0.19 -0.86 1.02 0.03 0.00 0.00 0.00 175.10 175.49 1m26 h ARG 82 N 9.10 0.00 -3.45 2.72 3.08 -1.00 -2.66 114.38 122.18 1m26 h ARG 82 Ca -0.24 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.69 1m26 h ARG 82 Cb 1.08 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 30.94 1m26 h ARG 82 CO 1.03 0.56 -0.39 -1.54 -1.07 0.00 0.00 179.97 178.55 1m26 s SER 83 N -6.23 -0.01 -0.02 7.04 1.04 -1.16 -1.17 113.70 113.20 1m26 s SER 83 Ca -0.01 -0.24 -0.03 0.00 0.48 0.00 0.00 55.95 56.15 1m26 s SER 83 Cb 0.09 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.48 1m26 s SER 83 CO 0.80 -0.49 0.08 -0.22 0.98 0.00 0.00 173.24 174.39 1m26 s LEU 84 N -1.76 1.72 -0.02 2.42 2.96 -0.73 -2.29 118.68 120.99 1m26 s LEU 84 Ca -0.09 0.06 0.01 0.00 -0.22 0.00 0.00 54.13 53.89 1m26 s LEU 84 Cb -0.04 0.31 0.01 0.00 0.50 0.00 0.00 46.19 46.98 1m26 s LEU 84 CO -0.01 -0.09 -0.04 -0.89 -1.32 0.00 0.00 176.35 174.00 1m26 s THR 85 N -0.26 0.40 -0.14 3.68 2.01 0.40 -1.47 115.64 120.26 1m26 s THR 85 Ca -0.03 -0.14 0.03 0.00 0.31 0.00 0.00 61.69 61.85 1m26 s THR 85 Cb -0.02 -0.39 0.01 0.00 0.01 0.00 0.00 72.50 72.11 1m26 s THR 85 CO 0.00 0.15 -0.22 -0.36 -0.69 0.00 0.00 174.62 173.50 1m26 s PHE 86 N 0.35 2.62 -0.18 4.92 0.08 -0.09 -1.85 117.98 123.83 1m26 s PHE 86 Ca -0.04 -1.31 -0.02 0.00 0.12 0.00 0.00 56.93 55.68 1m26 s PHE 86 Cb -0.07 -1.79 -0.01 0.00 -0.57 0.00 0.00 43.02 40.58 1m26 s PHE 86 CO -0.00 -0.60 -0.07 0.21 -0.10 0.00 0.00 175.22 174.65 1m26 s LYS 87 N 0.81 3.42 0.44 0.44 2.20 -0.07 -0.10 119.74 126.88 1m26 s LYS 87 Ca -0.07 -0.63 0.04 0.00 -0.36 0.00 0.00 55.97 54.94 1m26 s LYS 87 Cb -0.16 -2.86 0.04 0.00 -1.51 0.00 0.00 37.83 33.34 1m26 s LYS 87 CO -0.02 0.01 0.32 0.25 -0.36 0.00 0.00 175.35 175.56 1m26 n THR 88 N 4.15 0.00 1.23 3.43 -2.24 0.06 0.19 114.28 121.10 1m26 n THR 88 Ca -0.18 -1.74 0.12 0.00 -2.27 0.00 0.00 64.05 59.98 1m26 n THR 88 Cb 0.52 -0.11 0.63 0.00 -2.10 0.00 0.00 70.33 69.27 1m26 n THR 88 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1m26 n ASN 89 N -1.85 0.00 -0.02 3.42 6.94 -1.08 -3.69 115.26 118.98 1m26 n ASN 89 Ca -0.02 -0.25 -0.02 0.00 -0.02 0.00 0.00 54.58 54.27 1m26 n ASN 89 Cb 0.50 -0.21 -0.03 0.00 -2.36 0.00 0.00 39.78 37.68 1m26 n ASN 89 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1m26 n LYS 90 N -1.21 3.03 -3.68 -3.83 5.02 -1.26 -5.07 118.16 111.16 1m26 n LYS 90 Ca 0.13 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.36 1m26 n LYS 90 Cb 0.16 -1.09 -0.02 0.00 -0.02 0.00 0.00 35.03 34.06 1m26 n LYS 90 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1m26 s LYS 91 N -2.09 1.21 -0.16 1.97 2.47 -1.24 -5.15 119.74 116.76 1m26 s LYS 91 Ca -0.02 -0.61 -0.02 0.00 -1.56 0.00 0.00 55.97 53.75 1m26 s LYS 91 Cb 0.01 0.45 -0.02 0.00 -1.46 0.00 0.00 37.83 36.82 1m26 s LYS 91 CO 0.15 -0.55 -0.08 0.99 0.16 0.00 0.00 175.35 176.02 1m26 s THR 92 N -3.39 3.41 -0.28 3.43 2.01 -1.26 -0.76 115.64 118.80 1m26 s THR 92 Ca 0.09 -0.52 -0.06 0.00 0.31 0.00 0.00 61.69 61.52 1m26 s THR 92 Cb -0.02 -2.49 0.01 0.00 0.01 0.00 0.00 72.50 70.01 1m26 s THR 92 CO -0.01 0.49 0.05 -0.31 -0.69 0.00 0.00 174.62 174.15 1m26 s TYR 93 N 0.63 3.12 -0.04 4.92 1.51 0.86 -5.00 117.35 123.35 1m26 s TYR 93 Ca -0.05 -0.99 0.00 0.00 -1.01 0.00 0.00 57.07 55.02 1m26 s TYR 93 Cb -0.15 -2.22 0.00 0.00 -0.11 0.00 0.00 41.96 39.48 1m26 s TYR 93 CO 0.03 -0.57 0.00 0.41 -1.11 0.00 0.00 175.55 174.30 1m26 n GLY 94 N 4.84 0.57 3.77 0.71 0.00 -1.26 -0.91 105.19 112.91 1m26 n GLY 94 Ca -0.15 -2.32 -0.39 0.00 0.00 0.00 0.00 46.02 43.16 1m26 n GLY 94 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1m26 s PRO 95 N -0.54 4.03 -0.12 1.61 0.04 -1.26 -4.97 135.00 133.78 1m26 s PRO 95 Ca 0.00 2.01 0.01 0.00 0.04 0.00 0.00 61.00 63.06 1m26 s PRO 95 Cb 0.00 -2.74 -0.01 0.00 0.04 0.00 0.00 34.50 31.79 1m26 s PRO 95 CO 0.00 -0.39 -0.17 0.71 0.04 0.00 0.00 177.00 177.19 1m26 s TYR 96 N -1.32 2.73 0.00 0.56 2.02 -0.54 -4.96 117.35 115.83 1m26 s TYR 96 Ca 0.56 -0.77 0.00 0.00 -0.37 0.00 0.00 57.07 56.49 1m26 s TYR 96 Cb -0.35 -1.80 0.00 0.00 -0.40 0.00 0.00 41.96 39.41 1m26 s TYR 96 CO 0.44 -0.28 0.00 0.41 -1.57 0.00 0.00 175.55 174.56 1m26 n GLY 97 N 3.51 0.05 3.29 0.71 0.00 -1.26 -1.76 105.19 109.73 1m26 n GLY 97 Ca -0.18 -1.85 -0.36 0.00 0.00 0.00 0.00 46.02 43.63 1m26 n GLY 97 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1m26 s VAL 98 N 0.00 3.44 -1.50 1.61 1.01 -0.31 -4.77 120.40 119.87 1m26 s VAL 98 Ca 0.00 -0.69 -0.11 0.00 0.00 0.00 0.00 61.98 61.17 1m26 s VAL 98 Cb 0.00 -2.68 0.01 0.00 0.00 0.00 0.00 36.38 33.70 1m26 s VAL 98 CO 0.00 0.25 2.51 0.35 0.00 0.00 0.00 175.10 178.21 1m26 n THR 99 N 4.78 4.02 -3.96 3.92 -2.24 -1.26 -3.77 114.28 115.78 1m26 n THR 99 Ca -0.17 -3.06 -0.13 0.00 -2.27 0.00 0.00 64.05 58.42 1m26 n THR 99 Cb 0.49 -2.55 -0.14 0.00 -2.10 0.00 0.00 70.33 66.03 1m26 n THR 99 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1m26 s SER 100 N 2.36 0.21 0.00 3.42 0.15 -1.26 -5.08 113.70 113.50 1m26 s SER 100 Ca 0.56 -0.03 0.00 0.00 0.70 0.00 0.00 55.95 57.18 1m26 s SER 100 Cb 0.16 -0.03 0.00 0.00 -1.71 0.00 0.00 66.02 64.43 1m26 s SER 100 CO -0.07 0.01 0.00 0.61 1.20 0.00 0.00 173.24 174.99 1m26 n GLY 101 N 3.12 0.16 3.55 9.45 0.00 -1.26 -4.39 105.19 115.81 1m26 n GLY 101 Ca -0.13 -1.79 -0.37 0.00 0.00 0.00 0.00 46.02 43.72 1m26 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1m26 s THR 102 N -0.76 4.97 0.68 2.61 2.01 0.25 -4.87 115.64 120.52 1m26 s THR 102 Ca 0.00 0.05 -0.11 0.00 0.31 0.00 0.00 61.69 61.94 1m26 s THR 102 Cb 0.00 -3.34 0.00 0.00 0.01 0.00 0.00 72.50 69.17 1m26 s THR 102 CO 0.00 0.30 1.06 -2.16 -0.69 0.00 0.00 174.62 173.13 1m26 s PRO 103 N 1.57 3.01 0.01 4.92 0.04 -1.26 -1.23 135.00 142.06 1m26 s PRO 103 Ca 0.07 0.95 -0.19 0.00 0.04 0.00 0.00 61.00 61.87 1m26 s PRO 103 Cb -0.15 -2.00 0.04 0.00 0.04 0.00 0.00 34.50 32.43 1m26 s PRO 103 CO 0.07 -1.04 0.42 -0.59 0.04 0.00 0.00 177.00 175.90 1m26 s PHE 104 N -3.03 -0.30 -0.14 0.56 -0.12 -0.81 -4.91 117.98 109.23 1m26 s PHE 104 Ca 0.58 0.38 -0.24 0.00 -0.05 0.00 0.00 56.93 57.60 1m26 s PHE 104 Cb -0.14 0.21 0.06 0.00 -0.63 0.00 0.00 43.02 42.52 1m26 s PHE 104 CO 0.54 -0.53 0.59 0.54 -0.05 0.00 0.00 175.22 176.32 1m26 s ASN 105 N -1.69 -0.58 -0.36 1.98 6.03 -1.26 -1.90 114.94 117.16 1m26 s ASN 105 Ca -0.09 0.89 0.01 0.00 -1.03 0.00 0.00 52.86 52.64 1m26 s ASN 105 Cb -0.02 0.87 0.11 0.00 -3.03 0.00 0.00 41.25 39.18 1m26 s ASN 105 CO 0.01 -0.39 0.14 -0.22 -2.03 0.00 0.00 177.10 174.62 1m26 s LEU 106 N -0.44 2.73 0.24 3.54 2.96 0.95 -4.99 118.68 123.67 1m26 s LEU 106 Ca -0.06 -2.04 -0.11 0.00 -0.22 0.00 0.00 54.13 51.70 1m26 s LEU 106 Cb -0.03 -1.02 -0.08 0.00 0.50 0.00 0.00 46.19 45.56 1m26 s LEU 106 CO 0.05 -0.36 0.59 -2.16 -1.32 0.00 0.00 176.35 173.14 1m26 s PRO 107 N 1.10 3.87 -0.13 0.98 0.05 -1.26 -1.95 135.00 137.65 1m26 s PRO 107 Ca 0.13 0.38 0.01 0.00 0.05 0.00 0.00 61.00 61.57 1m26 s PRO 107 Cb -0.20 -2.64 0.02 0.00 0.05 0.00 0.00 34.50 31.73 1m26 s PRO 107 CO -0.14 0.30 -0.15 0.42 0.05 0.00 0.00 177.00 177.48 1m26 s ILE 108 N -1.81 1.56 -0.04 0.56 1.01 0.11 -4.98 121.20 117.61 1m26 s ILE 108 Ca 0.48 -0.66 -0.05 0.00 0.00 0.00 0.00 60.65 60.42 1m26 s ILE 108 Cb -0.11 -1.44 -0.28 0.00 0.01 0.00 0.00 42.46 40.64 1m26 s ILE 108 CO 0.20 0.45 0.67 -0.33 0.00 0.00 0.00 174.94 175.94 1m26 h GLU 109 N 7.65 0.27 -2.86 2.79 5.08 -1.98 -3.47 114.58 122.06 1m26 h GLU 109 Ca -0.34 -0.47 -0.17 0.00 -1.00 0.00 0.00 59.36 57.39 1m26 h GLU 109 Cb 1.16 0.17 -0.29 0.00 0.50 0.00 0.00 28.75 30.30 1m26 h GLU 109 CO 0.51 1.14 -0.43 1.21 -1.00 0.00 0.00 179.01 180.44 1m26 s ASN 110 N -7.00 -0.26 0.00 1.42 2.47 -1.26 -5.13 114.94 105.17 1m26 s ASN 110 Ca -0.14 0.67 0.00 0.00 0.42 0.00 0.00 52.86 53.81 1m26 s ASN 110 Cb 0.06 0.60 0.00 0.00 -1.45 0.00 0.00 41.25 40.47 1m26 s ASN 110 CO 0.83 -0.19 0.00 0.61 -3.72 0.00 0.00 177.10 174.64 1m26 n GLY 111 N 4.44 0.92 2.99 1.21 0.00 -1.26 -4.99 105.19 108.49 1m26 n GLY 111 Ca -0.22 -2.23 -0.10 0.00 0.00 0.00 0.00 46.02 43.47 1m26 n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1m26 s LEU 112 N 0.00 2.24 -0.11 0.99 1.43 0.96 -4.96 118.68 119.23 1m26 s LEU 112 Ca 0.00 -0.50 -0.25 0.00 -1.03 0.00 0.00 54.13 52.35 1m26 s LEU 112 Cb 0.00 0.06 -0.03 0.00 0.03 0.00 0.00 46.19 46.26 1m26 s LEU 112 CO 0.00 -0.28 0.79 -0.63 0.23 0.00 0.00 176.35 176.46 1m26 s ILE 113 N -1.43 4.95 -0.01 -0.59 1.01 -1.26 -1.41 121.20 122.46 1m26 s ILE 113 Ca -0.15 1.60 0.02 0.00 0.00 0.00 0.00 60.65 62.12 1m26 s ILE 113 Cb -0.10 -4.12 0.03 0.00 0.01 0.00 0.00 42.46 38.28 1m26 s ILE 113 CO -0.01 0.13 0.87 1.33 0.00 0.00 0.00 174.94 177.27 1m26 n VAL 114 N 4.25 0.74 0.00 2.92 0.24 0.01 -4.50 118.33 121.99 1m26 n VAL 114 Ca 0.02 -0.78 0.00 0.00 -2.04 0.00 0.00 64.34 61.54 1m26 n VAL 114 Cb 0.50 0.58 0.00 0.00 -1.47 0.00 0.00 33.84 33.45 1m26 n VAL 114 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1m26 n GLY 115 N -0.42 0.71 3.05 7.63 0.00 -1.24 -0.14 105.19 114.78 1m26 n GLY 115 Ca 0.01 -0.69 -0.14 0.00 0.00 0.00 0.00 46.02 45.21 1m26 n GLY 115 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1m26 s PHE 116 N -2.00 0.66 0.08 1.61 0.08 -1.26 -1.38 117.98 115.78 1m26 s PHE 116 Ca 0.00 -0.45 -0.08 0.00 0.12 0.00 0.00 56.93 56.53 1m26 s PHE 116 Cb 0.00 -0.40 -0.01 0.00 -0.57 0.00 0.00 43.02 42.05 1m26 s PHE 116 CO 0.00 -0.07 0.16 -1.59 -0.10 0.00 0.00 175.22 173.62 1m26 s LYS 117 N -1.40 0.80 0.00 0.44 -2.85 -0.90 -1.63 119.74 114.20 1m26 s LYS 117 Ca -0.08 -0.97 0.00 0.00 -1.00 0.00 0.00 55.97 53.91 1m26 s LYS 117 Cb -0.09 0.32 0.00 0.00 -2.06 0.00 0.00 37.83 36.00 1m26 s LYS 117 CO 0.00 -0.24 0.00 0.41 0.10 0.00 0.00 175.35 175.62 1m26 n GLY 118 N 0.02 -0.63 3.37 0.59 0.00 -0.10 -0.45 105.19 107.98 1m26 n GLY 118 Ca -0.15 -0.57 -0.13 0.00 0.00 0.00 0.00 46.02 45.17 1m26 n GLY 118 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1m26 s SER 119 N -4.00 -0.50 -0.06 1.61 0.15 -0.79 -0.58 113.70 109.54 1m26 s SER 119 Ca 0.00 0.95 0.01 0.00 0.70 0.00 0.00 55.95 57.61 1m26 s SER 119 Cb 0.00 0.96 0.02 0.00 -1.71 0.00 0.00 66.02 65.29 1m26 s SER 119 CO 0.00 -0.17 -0.06 -0.63 1.20 0.00 0.00 173.24 173.59 1m26 s ILE 120 N 0.31 0.67 0.00 6.45 1.01 -0.74 0.03 121.20 128.93 1m26 s ILE 120 Ca -0.01 -0.17 0.00 0.00 0.00 0.00 0.00 60.65 60.47 1m26 s ILE 120 Cb -0.04 -0.69 0.00 0.00 0.01 0.00 0.00 42.46 41.75 1m26 s ILE 120 CO -0.00 0.27 0.00 0.61 0.00 0.00 0.00 174.94 175.81 1m26 n GLY 121 N 4.23 1.33 0.26 6.18 0.00 -1.26 -0.69 105.19 115.23 1m26 n GLY 121 Ca -0.21 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.72 1m26 n GLY 121 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1m26 h TYR 122 N 0.00 0.90 -3.82 1.61 0.05 -1.95 0.01 116.97 113.77 1m26 h TYR 122 Ca 0.00 -0.23 -0.37 0.00 0.05 0.00 0.00 58.73 58.17 1m26 h TYR 122 Cb 0.00 -0.20 -0.14 0.00 1.01 0.00 0.00 36.73 37.39 1m26 h TYR 122 CO 0.00 0.98 -0.59 -1.58 -1.05 0.00 0.00 178.16 175.92 1m26 s TRP 123 N -4.48 1.56 -0.23 4.88 0.51 -1.26 -4.42 118.94 115.50 1m26 s TRP 123 Ca -0.09 -1.25 -0.29 0.00 -2.12 0.00 0.00 56.10 52.35 1m26 s TRP 123 Cb 0.12 -0.88 -0.04 0.00 -0.81 0.00 0.00 33.47 31.86 1m26 s TRP 123 CO 0.85 -0.41 1.88 -1.17 -0.51 0.00 0.00 176.95 177.59 1m26 s LEU 124 N -3.34 3.68 0.03 2.99 2.96 -0.51 -4.38 118.68 120.12 1m26 s LEU 124 Ca 0.37 1.68 -0.18 0.00 -0.22 0.00 0.00 54.13 55.78 1m26 s LEU 124 Cb 0.07 -3.52 -0.21 0.00 0.50 0.00 0.00 46.19 43.02 1m26 s LEU 124 CO 0.15 -1.59 1.16 0.44 -1.32 0.00 0.00 176.35 175.19 1m26 h ASP 125 N 12.65 0.63 -5.28 3.68 3.32 -0.72 0.38 116.42 131.09 1m26 h ASP 125 Ca -0.37 -0.72 0.24 0.00 0.02 0.00 0.00 57.03 56.20 1m26 h ASP 125 Cb 1.19 -0.19 -0.12 0.00 0.22 0.00 0.00 39.33 40.43 1m26 h ASP 125 CO 0.99 1.26 0.66 -0.72 -1.72 0.00 0.00 179.24 179.71 1m26 s TYR 126 N -3.39 -0.12 0.10 4.55 -0.85 -1.22 -4.18 117.35 112.25 1m26 s TYR 126 Ca -0.12 -0.05 -0.24 0.00 -0.52 0.00 0.00 57.07 56.13 1m26 s TYR 126 Cb 0.05 0.58 0.07 0.00 0.38 0.00 0.00 41.96 43.03 1m26 s TYR 126 CO 0.84 -0.50 0.59 -0.59 -1.52 0.00 0.00 175.55 174.38 1m26 s PHE 127 N -2.82 -0.53 0.17 -3.49 -0.71 -1.26 -1.89 117.98 107.46 1m26 s PHE 127 Ca 0.12 0.47 0.04 0.00 -1.04 0.00 0.00 56.93 56.51 1m26 s PHE 127 Cb 0.01 0.49 -0.05 0.00 -1.21 0.00 0.00 43.02 42.26 1m26 s PHE 127 CO -0.02 -0.77 -0.06 -1.12 -1.34 0.00 0.00 175.22 171.91 1m26 s SER 128 N -2.37 1.67 -0.00 1.98 0.01 0.40 -4.96 113.70 110.43 1m26 s SER 128 Ca -0.02 -1.09 0.04 0.00 1.31 0.00 0.00 55.95 56.19 1m26 s SER 128 Cb -0.01 0.02 -0.01 0.00 0.21 0.00 0.00 66.02 66.23 1m26 s SER 128 CO -0.07 -0.43 -0.14 -0.04 0.41 0.00 0.00 173.24 172.98 1m26 s MET 129 N -3.81 1.07 0.01 12.44 -1.94 -1.26 -2.13 119.30 123.68 1m26 s MET 129 Ca 0.21 -0.52 -0.22 0.00 -1.71 0.00 0.00 55.69 53.45 1m26 s MET 129 Cb 0.04 -1.04 -0.05 0.00 2.01 0.00 0.00 34.83 35.79 1m26 s MET 129 CO 0.03 0.28 0.67 0.71 -0.01 0.00 0.00 175.02 176.70 1m26 s TYR 130 N -0.39 3.70 0.04 -0.03 1.51 -0.48 -4.98 117.35 116.72 1m26 s TYR 130 Ca 0.05 1.31 0.09 0.00 -1.01 0.00 0.00 57.07 57.50 1m26 s TYR 130 Cb -0.06 -2.70 -0.03 0.00 -0.11 0.00 0.00 41.96 39.07 1m26 s TYR 130 CO -0.00 0.31 -0.25 -0.51 -1.11 0.00 0.00 175.55 173.99 1m26 s LEU 131 N -0.08 2.16 0.22 -1.29 1.43 -1.26 -0.81 118.68 119.05 1m26 s LEU 131 Ca 0.34 -0.56 -0.20 0.00 -1.03 0.00 0.00 54.13 52.68 1m26 s LEU 131 Cb -0.19 -1.21 0.04 0.00 0.03 0.00 0.00 46.19 44.86 1m26 s LEU 131 CO 0.19 0.24 0.62 -0.55 0.23 0.00 0.00 176.35 177.08 1m26 s SER 132 N -1.17 -0.34 0.00 2.29 0.15 -0.50 -4.94 113.70 109.19 1m26 s SER 132 Ca 0.10 -0.42 0.28 0.00 0.70 0.00 0.00 55.95 56.62 1m26 s SER 132 Cb -0.10 0.64 1.11 0.00 -1.71 0.00 0.00 66.02 65.97 1m26 s SER 132 CO 0.02 -1.15 1.78 0.18 1.20 0.00 0.00 173.24 175.27