#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ce6 s PRO 2 N 0.00 0.42 0.06 1.61 0.04 -1.26 -3.17 135.00 132.69 1ce6 s PRO 2 Ca 0.00 1.30 -0.03 0.00 0.04 0.00 0.00 61.00 62.31 1ce6 s PRO 2 Cb 0.00 -1.68 -0.03 0.00 0.04 0.00 0.00 34.50 32.84 1ce6 s PRO 2 CO 0.00 -2.96 0.04 -1.01 0.04 0.00 0.00 177.00 173.11 1ce6 s HIS 3 N -2.60 0.37 0.22 0.56 3.76 0.44 -4.89 115.29 113.15 1ce6 s HIS 3 Ca 0.67 -0.85 -0.23 0.00 -0.15 0.00 0.00 55.06 54.51 1ce6 s HIS 3 Cb -0.23 -0.26 0.04 0.00 1.11 0.00 0.00 32.58 33.23 1ce6 s HIS 3 CO 0.60 -0.41 0.83 -1.54 -0.85 0.00 0.00 174.74 173.37 1ce6 s SER 4 N -2.73 -0.22 0.01 1.40 1.04 -1.26 0.20 113.70 112.13 1ce6 s SER 4 Ca 0.04 -0.51 0.00 0.00 0.48 0.00 0.00 55.95 55.96 1ce6 s SER 4 Cb 0.05 0.62 -0.01 0.00 0.10 0.00 0.00 66.02 66.79 1ce6 s SER 4 CO -0.09 -1.15 -0.02 -0.32 0.98 0.00 0.00 173.24 172.65 1ce6 s MET 5 N -3.63 0.14 0.02 4.02 1.75 -0.84 0.30 119.30 121.05 1ce6 s MET 5 Ca 0.11 -0.19 -0.02 0.00 -1.25 0.00 0.00 55.69 54.34 1ce6 s MET 5 Cb -0.04 -0.03 -0.01 0.00 2.84 0.00 0.00 34.83 37.59 1ce6 s MET 5 CO 0.05 0.00 0.03 1.03 -0.65 0.00 0.00 175.02 175.48 1ce6 s ARG 6 N -0.40 0.39 -0.30 4.11 1.81 -0.36 -2.32 118.95 121.89 1ce6 s ARG 6 Ca -0.04 -0.59 -0.02 0.00 -1.72 0.00 0.00 55.73 53.37 1ce6 s ARG 6 Cb -0.03 0.15 0.10 0.00 -0.45 0.00 0.00 34.95 34.72 1ce6 s ARG 6 CO -0.00 -0.08 0.10 0.71 -0.68 0.00 0.00 175.30 175.35 1ce6 s TYR 7 N -1.62 1.30 -0.47 -0.53 1.51 -0.11 -0.37 117.35 117.06 1ce6 s TYR 7 Ca -0.14 -1.45 -0.23 0.00 -1.01 0.00 0.00 57.07 54.24 1ce6 s TYR 7 Cb -0.08 -1.45 0.03 0.00 -0.11 0.00 0.00 41.96 40.35 1ce6 s TYR 7 CO -0.01 -0.85 0.79 -0.06 -1.11 0.00 0.00 175.55 174.32 1ce6 s PHE 8 N 1.76 2.96 -0.09 2.71 0.08 -0.33 -1.98 117.98 123.09 1ce6 s PHE 8 Ca 0.09 0.05 -0.01 0.00 0.12 0.00 0.00 56.93 57.18 1ce6 s PHE 8 Cb -0.17 -3.71 -0.03 0.00 -0.57 0.00 0.00 43.02 38.54 1ce6 s PHE 8 CO -0.27 -1.06 -0.05 -1.21 -0.10 0.00 0.00 175.22 172.53 1ce6 s GLU 9 N 3.33 3.00 -0.05 0.44 2.02 0.98 -1.16 118.70 127.27 1ce6 s GLU 9 Ca 0.28 -0.52 0.02 0.00 0.02 0.00 0.00 54.97 54.77 1ce6 s GLU 9 Cb -0.13 -2.69 0.01 0.00 0.10 0.00 0.00 34.13 31.42 1ce6 s GLU 9 CO 0.21 0.57 -0.09 0.99 0.02 0.00 0.00 175.26 176.95 1ce6 s THR 10 N -0.54 0.90 -0.13 3.63 2.01 0.88 -0.49 115.64 121.90 1ce6 s THR 10 Ca 0.08 -0.35 0.01 0.00 0.31 0.00 0.00 61.69 61.74 1ce6 s THR 10 Cb -0.12 -0.84 0.02 0.00 0.01 0.00 0.00 72.50 71.57 1ce6 s THR 10 CO 0.02 0.30 -0.13 0.00 -0.69 0.00 0.00 174.62 174.12 1ce6 s ALA 11 N 0.67 1.67 -0.28 7.40 0.00 -0.01 -0.64 121.76 130.58 1ce6 s ALA 11 Ca -0.12 -0.76 0.03 0.00 0.00 0.00 0.00 51.96 51.11 1ce6 s ALA 11 Cb -0.14 -0.93 0.07 0.00 0.00 0.00 0.00 23.12 22.11 1ce6 s ALA 11 CO 0.02 -0.27 -0.07 0.08 0.00 0.00 0.00 175.76 175.53 1ce6 s VAL 12 N 1.34 2.10 0.90 0.00 1.01 0.28 -1.20 120.40 124.83 1ce6 s VAL 12 Ca 0.00 -1.74 -0.11 0.00 0.00 0.00 0.00 61.98 60.13 1ce6 s VAL 12 Cb -0.14 -2.30 0.14 0.00 0.00 0.00 0.00 36.38 34.08 1ce6 s VAL 12 CO -0.07 -0.17 1.10 -0.94 0.00 0.00 0.00 175.10 175.02 1ce6 s SER 13 N 1.10 3.25 -0.27 3.32 1.04 0.98 -1.67 113.70 121.45 1ce6 s SER 13 Ca -0.04 1.77 -0.23 0.00 0.48 0.00 0.00 55.95 57.93 1ce6 s SER 13 Cb -0.20 -2.39 0.08 0.00 0.10 0.00 0.00 66.02 63.61 1ce6 s SER 13 CO -0.06 -2.82 0.74 0.00 0.98 0.00 0.00 173.24 172.08 1ce6 s ARG 14 N -4.79 0.78 0.65 4.02 1.70 -1.26 -3.04 118.95 117.01 1ce6 s ARG 14 Ca 0.64 1.01 -0.17 0.00 -0.47 0.00 0.00 55.73 56.74 1ce6 s ARG 14 Cb -0.20 0.33 -0.03 0.00 -0.57 0.00 0.00 34.95 34.48 1ce6 s ARG 14 CO 0.58 -0.11 0.88 -0.35 -1.08 0.00 0.00 175.30 175.22 1ce6 n PRO 15 N 3.03 0.67 -0.24 3.89 -0.04 -1.25 -3.31 135.00 137.75 1ce6 n PRO 15 Ca -0.15 0.27 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 1ce6 n PRO 15 Cb 0.56 -2.11 0.00 0.00 -0.04 0.00 0.00 33.50 31.91 1ce6 n PRO 15 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ce6 n GLY 16 N 1.32 1.53 3.12 0.55 0.00 -1.26 -4.95 105.19 105.51 1ce6 n GLY 16 Ca 0.13 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 1ce6 n GLY 16 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ce6 s LEU 17 N 0.00 2.07 0.00 0.99 2.96 -1.21 -5.03 118.68 118.45 1ce6 s LEU 17 Ca 0.00 -0.31 0.24 0.00 -0.22 0.00 0.00 54.13 53.84 1ce6 s LEU 17 Cb 0.00 -0.72 0.27 0.00 0.50 0.00 0.00 46.19 46.24 1ce6 s LEU 17 CO 0.00 0.14 1.30 -0.62 -1.32 0.00 0.00 176.35 175.86 1ce6 n GLU 18 N 2.51 2.29 -3.58 1.98 1.02 -1.26 -4.65 120.64 118.95 1ce6 n GLU 18 Ca -0.15 -1.88 -0.41 0.00 -0.02 0.00 0.00 57.16 54.71 1ce6 n GLU 18 Cb 0.55 -1.46 -0.09 0.00 -0.02 0.00 0.00 31.44 30.41 1ce6 n GLU 18 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1ce6 s GLU 19 N -1.97 2.60 0.73 3.49 2.12 -1.26 -5.06 118.70 119.34 1ce6 s GLU 19 Ca 0.29 -1.52 -0.14 0.00 0.36 0.00 0.00 54.97 53.96 1ce6 s GLU 19 Cb 0.20 -3.84 0.04 0.00 0.26 0.00 0.00 34.13 30.79 1ce6 s GLU 19 CO 0.30 -1.02 1.14 -2.14 -0.54 0.00 0.00 175.26 173.01 1ce6 s PRO 20 N 1.43 2.30 -0.19 4.30 0.02 -1.26 -4.85 135.00 136.75 1ce6 s PRO 20 Ca 0.04 1.48 -0.27 0.00 0.02 0.00 0.00 61.00 62.27 1ce6 s PRO 20 Cb -0.24 -1.88 -0.01 0.00 0.02 0.00 0.00 34.50 32.40 1ce6 s PRO 20 CO 0.02 -1.65 0.93 0.50 -0.33 0.00 0.00 177.00 176.46 1ce6 s ARG 21 N -4.24 4.29 -0.18 5.54 3.52 -0.67 -4.83 118.95 122.38 1ce6 s ARG 21 Ca 0.68 1.18 -0.03 0.00 -0.13 0.00 0.00 55.73 57.43 1ce6 s ARG 21 Cb -0.23 -3.60 -0.01 0.00 -1.56 0.00 0.00 34.95 29.55 1ce6 s ARG 21 CO 0.47 -0.45 -0.06 -0.47 -0.81 0.00 0.00 175.30 173.98 1ce6 s TYR 22 N 2.55 2.93 -0.14 5.12 5.04 -1.26 -0.56 117.35 131.04 1ce6 s TYR 22 Ca 0.41 -0.72 -0.01 0.00 -2.44 0.00 0.00 57.07 54.31 1ce6 s TYR 22 Cb -0.16 -2.00 0.04 0.00 0.35 0.00 0.00 41.96 40.18 1ce6 s TYR 22 CO 0.11 -0.35 -0.02 0.42 -1.34 0.00 0.00 175.55 174.37 1ce6 s ILE 23 N 0.93 0.73 -0.07 3.14 1.01 0.19 -0.45 121.20 126.68 1ce6 s ILE 23 Ca -0.01 -0.33 0.02 0.00 0.00 0.00 0.00 60.65 60.33 1ce6 s ILE 23 Cb -0.15 -0.95 -0.02 0.00 0.01 0.00 0.00 42.46 41.34 1ce6 s ILE 23 CO 0.01 0.12 -0.12 -0.55 0.00 0.00 0.00 174.94 174.40 1ce6 s SER 24 N 1.80 4.18 -0.04 3.58 0.15 -0.78 -0.08 113.70 122.51 1ce6 s SER 24 Ca 0.02 -0.18 -0.01 0.00 0.70 0.00 0.00 55.95 56.48 1ce6 s SER 24 Cb -0.14 -1.11 0.03 0.00 -1.71 0.00 0.00 66.02 63.08 1ce6 s SER 24 CO -0.07 0.30 0.02 -0.69 1.20 0.00 0.00 173.24 174.00 1ce6 s VAL 25 N -0.48 0.14 -0.07 4.45 1.01 -0.31 -1.36 120.40 123.79 1ce6 s VAL 25 Ca 0.06 0.20 -0.06 0.00 0.00 0.00 0.00 61.98 62.18 1ce6 s VAL 25 Cb -0.12 -0.30 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 1ce6 s VAL 25 CO 0.02 0.18 0.16 -0.83 0.00 0.00 0.00 175.10 174.63 1ce6 s GLY 26 N 1.60 2.17 0.11 4.51 0.00 0.15 -1.19 107.32 114.66 1ce6 s GLY 26 Ca -0.02 -0.68 0.06 0.00 0.00 0.00 0.00 44.72 44.08 1ce6 s GLY 26 CO -0.03 -0.47 -0.14 -0.19 0.00 0.00 0.00 173.10 172.27 1ce6 s TYR 27 N -1.15 1.34 -0.07 1.90 2.02 0.51 -1.21 117.35 120.68 1ce6 s TYR 27 Ca 0.20 -0.54 0.01 0.00 -0.37 0.00 0.00 57.07 56.37 1ce6 s TYR 27 Cb -0.12 -0.72 0.02 0.00 -0.40 0.00 0.00 41.96 40.74 1ce6 s TYR 27 CO 0.10 0.11 -0.07 0.08 -1.57 0.00 0.00 175.55 174.20 1ce6 s VAL 28 N -1.92 0.83 -1.64 0.71 1.01 0.70 -1.22 120.40 118.86 1ce6 s VAL 28 Ca 0.06 -0.25 -0.16 0.00 0.00 0.00 0.00 61.98 61.63 1ce6 s VAL 28 Cb -0.06 -0.83 0.13 0.00 0.00 0.00 0.00 36.38 35.62 1ce6 s VAL 28 CO 0.03 0.30 0.78 0.47 0.00 0.00 0.00 175.10 176.68 1ce6 n ASP 29 N 4.30 -3.21 -3.45 3.32 9.92 0.15 -0.55 116.55 127.03 1ce6 n ASP 29 Ca -0.19 -0.97 -0.20 0.00 -0.53 0.00 0.00 54.79 52.90 1ce6 n ASP 29 Cb 0.51 -2.98 0.06 0.00 -0.64 0.00 0.00 41.12 38.07 1ce6 n ASP 29 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1ce6 n ASN 30 N -2.72 -4.57 -3.67 -2.24 3.02 -1.26 -4.98 115.26 98.84 1ce6 n ASN 30 Ca 0.02 -0.78 -0.11 0.00 -0.03 0.00 0.00 54.58 53.69 1ce6 n ASN 30 Cb 0.52 -4.60 -0.11 0.00 -0.61 0.00 0.00 39.78 34.97 1ce6 n ASN 30 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1ce6 s LYS 31 N -5.18 0.26 0.10 3.52 2.36 0.29 -5.03 119.74 116.05 1ce6 s LYS 31 Ca 0.30 0.86 -0.33 0.00 -2.55 0.00 0.00 55.97 54.26 1ce6 s LYS 31 Cb -0.06 0.12 -0.12 0.00 -1.05 0.00 0.00 37.83 36.72 1ce6 s LYS 31 CO 0.78 -0.24 1.77 -1.91 1.55 0.00 0.00 175.35 177.29 1ce6 n GLU 32 N 5.14 2.49 0.00 4.03 2.13 -1.26 -0.21 120.64 132.96 1ce6 n GLU 32 Ca -0.11 0.91 0.00 0.00 0.66 0.00 0.00 57.16 58.62 1ce6 n GLU 32 Cb 0.51 -2.75 0.00 0.00 0.27 0.00 0.00 31.44 29.46 1ce6 n GLU 32 CO 0.00 0.00 0.00 1.97 -0.41 0.00 0.00 177.13 178.69 1ce6 n PHE 33 N 5.13 0.00 -3.60 4.31 -1.74 -0.35 -4.09 117.46 117.13 1ce6 n PHE 33 Ca 0.19 0.00 -0.16 0.00 -0.56 0.00 0.00 57.45 56.92 1ce6 n PHE 33 Cb 0.33 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.26 1ce6 n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1ce6 s VAL 34 N -0.26 0.01 0.01 1.97 -7.23 -1.21 -1.95 120.40 111.73 1ce6 s VAL 34 Ca 0.00 -0.05 -0.14 0.00 -1.81 0.00 0.00 61.98 59.99 1ce6 s VAL 34 Cb 0.00 -0.93 0.02 0.00 0.56 0.00 0.00 36.38 36.03 1ce6 s VAL 34 CO 0.00 -0.03 0.29 -0.60 -0.31 0.00 0.00 175.10 174.45 1ce6 s ARG 35 N -0.56 0.69 -0.04 4.82 6.06 -0.90 -0.68 118.95 128.35 1ce6 s ARG 35 Ca -0.07 -0.32 -0.04 0.00 -2.50 0.00 0.00 55.73 52.81 1ce6 s ARG 35 Cb -0.02 0.30 0.01 0.00 0.06 0.00 0.00 34.95 35.30 1ce6 s ARG 35 CO 0.06 -0.20 0.11 0.12 -2.50 0.00 0.00 175.30 172.89 1ce6 s PHE 36 N -1.73 -0.12 -0.08 5.12 2.19 -0.46 0.34 117.98 123.23 1ce6 s PHE 36 Ca -0.11 0.31 -0.03 0.00 0.33 0.00 0.00 56.93 57.43 1ce6 s PHE 36 Cb -0.04 0.03 0.04 0.00 -1.31 0.00 0.00 43.02 41.74 1ce6 s PHE 36 CO 0.02 -0.07 0.08 0.34 1.83 0.00 0.00 175.22 177.42 1ce6 s ASP 37 N 0.13 1.48 0.41 6.13 -1.08 -1.26 -1.86 116.67 120.62 1ce6 s ASP 37 Ca -0.01 -0.12 0.29 0.00 -0.52 0.00 0.00 52.55 52.19 1ce6 s ASP 37 Cb -0.02 -0.13 1.45 0.00 -1.46 0.00 0.00 42.92 42.76 1ce6 s ASP 37 CO -0.00 -0.28 1.87 0.77 0.52 0.00 0.00 175.17 178.05 1ce6 h SER 38 N 8.43 0.00 0.57 -0.34 4.64 -1.14 -2.46 113.55 123.25 1ce6 h SER 38 Ca -0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 1ce6 h SER 38 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1ce6 h SER 38 CO 0.19 0.00 -0.44 0.47 -0.87 0.00 0.00 176.83 176.18 1ce6 n ASP 39 N -2.53 0.45 -4.55 4.97 8.00 -1.26 -4.84 116.55 116.78 1ce6 n ASP 39 Ca -0.01 -0.15 -0.29 0.00 0.71 0.00 0.00 54.79 55.05 1ce6 n ASP 39 Cb 0.11 0.16 0.22 0.00 -0.02 0.00 0.00 41.12 41.59 1ce6 n ASP 39 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ce6 s ALA 40 N -3.01 0.13 0.14 2.24 0.00 -0.93 -4.93 121.76 115.41 1ce6 s ALA 40 Ca 0.11 0.04 -0.13 0.00 0.00 0.00 0.00 51.96 51.99 1ce6 s ALA 40 Cb 0.18 -3.29 0.01 0.00 0.00 0.00 0.00 23.12 20.02 1ce6 s ALA 40 CO 0.68 -3.49 1.59 1.49 0.00 0.00 0.00 175.76 176.04 1ce6 h GLU 41 N -2.37 0.84 -3.13 0.00 4.57 -1.91 -3.36 114.58 109.21 1ce6 h GLU 41 Ca -0.56 -0.27 -0.61 0.00 -1.18 0.00 0.00 59.36 56.74 1ce6 h GLU 41 Cb 1.31 -0.08 -0.40 0.00 -0.16 0.00 0.00 28.75 29.43 1ce6 h GLU 41 CO 0.49 0.89 -0.74 1.21 -1.18 0.00 0.00 179.01 179.67 1ce6 s ASN 42 N -6.34 3.75 0.30 1.04 2.47 -1.26 -5.11 114.94 109.79 1ce6 s ASN 42 Ca -0.12 -2.46 -0.30 0.00 0.42 0.00 0.00 52.86 50.39 1ce6 s ASN 42 Cb 0.11 -1.04 -0.12 0.00 -1.45 0.00 0.00 41.25 38.76 1ce6 s ASN 42 CO 0.82 -0.29 1.60 -2.65 -3.72 0.00 0.00 177.10 172.85 1ce6 n PRO 43 N 3.76 2.72 -3.64 0.43 -0.02 -1.26 -4.98 135.00 132.02 1ce6 n PRO 43 Ca 0.07 0.97 -0.03 0.00 -2.02 0.00 0.00 63.50 62.48 1ce6 n PRO 43 Cb 0.36 -2.75 -0.05 0.00 -0.02 0.00 0.00 33.50 31.03 1ce6 n PRO 43 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1ce6 s ARG 44 N -0.59 0.10 0.22 -0.52 1.70 -1.26 -5.06 118.95 113.55 1ce6 s ARG 44 Ca 0.63 0.06 -0.30 0.00 -0.47 0.00 0.00 55.73 55.65 1ce6 s ARG 44 Cb -0.49 0.05 -0.10 0.00 -0.57 0.00 0.00 34.95 33.84 1ce6 s ARG 44 CO 0.49 -0.03 1.44 0.71 -1.08 0.00 0.00 175.30 176.84 1ce6 s TYR 45 N -0.63 3.07 0.10 5.89 1.51 -1.26 -4.55 117.35 121.48 1ce6 s TYR 45 Ca 0.08 0.98 0.07 0.00 -1.01 0.00 0.00 57.07 57.19 1ce6 s TYR 45 Cb -0.02 -3.80 -0.04 0.00 -0.11 0.00 0.00 41.96 37.98 1ce6 s TYR 45 CO -0.10 -2.68 -0.12 -1.21 -1.11 0.00 0.00 175.55 170.33 1ce6 s GLU 46 N -0.02 2.05 0.03 -0.62 0.41 0.15 -4.91 118.70 115.81 1ce6 s GLU 46 Ca 0.61 -1.05 -0.30 0.00 -0.41 0.00 0.00 54.97 53.82 1ce6 s GLU 46 Cb -0.41 -2.26 -0.05 0.00 -1.78 0.00 0.00 34.13 29.63 1ce6 s GLU 46 CO 0.40 0.51 1.19 -2.14 -0.49 0.00 0.00 175.26 174.73 1ce6 s PRO 47 N -2.11 4.42 0.00 0.39 0.02 -1.26 -2.11 135.00 134.34 1ce6 s PRO 47 Ca 0.20 1.73 0.11 0.00 0.02 0.00 0.00 61.00 63.06 1ce6 s PRO 47 Cb -0.11 -3.40 0.05 0.00 0.02 0.00 0.00 34.50 31.06 1ce6 s PRO 47 CO 0.12 -0.29 0.77 0.54 -0.33 0.00 0.00 177.00 177.81 1ce6 n ARG 48 N 4.21 1.26 -4.61 5.54 5.12 -0.82 -4.92 116.66 122.43 1ce6 n ARG 48 Ca 0.09 -0.93 -0.22 0.00 -1.93 0.00 0.00 57.85 54.86 1ce6 n ARG 48 Cb 0.47 -1.17 -0.15 0.00 -1.16 0.00 0.00 32.46 30.45 1ce6 n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ce6 s ALA 49 N -1.18 1.13 0.23 7.54 0.00 -1.24 -4.67 121.76 123.57 1ce6 s ALA 49 Ca 0.11 -0.57 -0.08 0.00 0.00 0.00 0.00 51.96 51.43 1ce6 s ALA 49 Cb 0.09 -0.31 0.37 0.00 0.00 0.00 0.00 23.12 23.27 1ce6 s ALA 49 CO 0.20 0.26 1.70 -1.00 0.00 0.00 0.00 175.76 176.92 1ce6 h PRO 50 N 5.89 0.25 0.00 0.00 0.13 -1.94 -0.69 132.00 135.65 1ce6 h PRO 50 Ca -0.34 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1ce6 h PRO 50 Cb 1.16 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1ce6 h PRO 50 CO 0.49 0.17 0.00 -2.67 -0.23 0.00 0.00 178.00 175.76 1ce6 n TRP 51 N -5.15 0.00 1.46 1.56 4.27 -1.26 -2.38 117.44 115.94 1ce6 n TRP 51 Ca 0.11 0.00 0.14 0.00 -3.89 0.00 0.00 57.50 53.86 1ce6 n TRP 51 Cb 0.38 -0.43 0.54 0.00 -1.36 0.00 0.00 31.31 30.45 1ce6 n TRP 51 CO 0.00 0.00 0.00 -1.33 -2.29 0.00 0.00 177.69 174.07 1ce6 n MET 52 N -1.43 1.19 0.11 -2.67 2.81 -0.27 -4.12 117.12 112.74 1ce6 n MET 52 Ca 0.04 -0.60 -0.02 0.00 -1.81 0.00 0.00 57.70 55.30 1ce6 n MET 52 Cb 0.13 -1.49 0.20 0.00 -0.71 0.00 0.00 33.22 31.34 1ce6 n MET 52 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1ce6 h GLU 53 N 1.47 0.16 0.00 0.03 5.08 -1.59 -3.11 114.58 116.62 1ce6 h GLU 53 Ca 0.00 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1ce6 h GLU 53 Cb 0.42 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1ce6 h GLU 53 CO 0.00 0.64 0.00 0.00 -1.00 0.00 0.00 179.01 178.65 1ce6 n GLN 54 N -3.94 0.03 -2.14 2.33 10.64 -1.26 -4.72 117.38 118.33 1ce6 n GLN 54 Ca -0.02 0.48 -0.42 0.00 -1.83 0.00 0.00 57.00 55.21 1ce6 n GLN 54 Cb 0.54 -1.60 -0.03 0.00 -0.86 0.00 0.00 30.24 28.30 1ce6 n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 1ce6 s GLU 55 N -3.11 4.32 0.72 2.61 0.41 -1.18 -5.01 118.70 117.47 1ce6 s GLU 55 Ca 0.01 2.12 -0.09 0.00 -0.41 0.00 0.00 54.97 56.60 1ce6 s GLU 55 Cb 0.03 -3.21 0.05 0.00 -1.78 0.00 0.00 34.13 29.22 1ce6 s GLU 55 CO 0.09 -0.42 1.07 0.20 -0.49 0.00 0.00 175.26 175.72 1ce6 s GLY 56 N 0.90 1.63 0.36 -1.39 0.00 -1.26 -4.86 107.32 102.70 1ce6 s GLY 56 Ca 0.63 -0.69 0.15 0.00 0.00 0.00 0.00 44.72 44.81 1ce6 s GLY 56 CO 0.33 -0.28 1.75 -2.55 0.00 0.00 0.00 173.10 172.35 1ce6 h PRO 57 N -0.71 0.46 -0.09 2.90 0.11 -1.98 -0.07 132.00 132.62 1ce6 h PRO 57 Ca -0.45 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 65.67 1ce6 h PRO 57 Cb 1.30 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 1ce6 h PRO 57 CO 0.63 0.30 -0.16 1.49 -0.21 0.00 0.00 178.00 180.05 1ce6 h GLU 58 N 0.47 -0.21 -0.01 1.05 4.81 -1.99 -0.70 114.58 118.00 1ce6 h GLU 58 Ca 0.62 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.88 1ce6 h GLU 58 Cb 1.40 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.81 1ce6 h GLU 58 CO -0.37 -0.14 -0.25 -0.92 -0.73 0.00 0.00 179.01 176.59 1ce6 h TYR 59 N -0.22 -0.74 -0.74 0.92 3.20 -1.37 -0.81 116.97 117.21 1ce6 h TYR 59 Ca 0.08 0.02 0.11 0.00 3.14 0.00 0.00 58.73 62.09 1ce6 h TYR 59 Cb 0.34 0.32 -0.05 0.00 1.54 0.00 0.00 36.73 38.88 1ce6 h TYR 59 CO -0.26 -0.27 0.49 -1.49 -1.64 0.00 0.00 178.16 174.99 1ce6 h TRP 60 N -0.31 0.62 0.75 -3.82 4.06 -1.45 -1.41 115.95 114.38 1ce6 h TRP 60 Ca 0.01 0.02 -0.03 0.00 2.06 0.00 0.00 58.89 60.94 1ce6 h TRP 60 Cb 0.34 -0.20 -0.00 0.00 -1.00 0.00 0.00 29.16 28.30 1ce6 h TRP 60 CO -0.44 0.27 -0.44 1.49 -3.56 0.00 0.00 178.44 175.76 1ce6 h GLU 61 N 0.56 -1.07 -0.30 0.49 4.22 -0.42 0.15 114.58 118.22 1ce6 h GLU 61 Ca 0.35 0.07 0.05 0.00 0.08 0.00 0.00 59.36 59.91 1ce6 h GLU 61 Cb 0.60 0.24 -0.04 0.00 0.50 0.00 0.00 28.75 30.05 1ce6 h GLU 61 CO -0.12 -0.71 0.03 0.00 -2.18 0.00 0.00 179.01 176.02 1ce6 h ARG 62 N -1.11 0.12 0.03 1.92 3.08 -0.60 0.13 114.38 117.95 1ce6 h ARG 62 Ca -0.10 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 59.97 1ce6 h ARG 62 Cb 0.89 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.88 1ce6 h ARG 62 CO 0.12 0.08 -0.19 0.93 -1.07 0.00 0.00 179.97 179.83 1ce6 h GLU 63 N 0.12 -0.32 -0.37 0.04 4.39 -1.13 -1.20 114.58 116.11 1ce6 h GLU 63 Ca 0.14 0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.91 1ce6 h GLU 63 Cb 0.17 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.85 1ce6 h GLU 63 CO -0.22 -0.21 0.12 1.15 -1.16 0.00 0.00 179.01 178.69 1ce6 h THR 64 N -0.33 0.88 -0.79 1.13 2.02 -0.39 -1.66 112.91 113.77 1ce6 h THR 64 Ca 0.05 -0.09 0.16 0.00 0.77 0.00 0.00 66.41 67.29 1ce6 h THR 64 Cb 0.39 0.59 -0.10 0.00 -1.74 0.00 0.00 68.15 67.29 1ce6 h THR 64 CO -0.16 0.05 0.33 -0.61 0.37 0.00 0.00 175.52 175.50 1ce6 h GLN 65 N 0.27 0.44 -0.32 6.66 5.75 -0.48 0.11 115.11 127.54 1ce6 h GLN 65 Ca 0.17 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.63 1ce6 h GLN 65 Cb 0.15 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.59 1ce6 h GLN 65 CO -0.18 0.29 0.17 0.87 -2.65 0.00 0.00 178.83 177.33 1ce6 h LYS 66 N 0.45 0.45 -1.00 1.69 1.57 -0.36 -1.98 116.57 117.38 1ce6 h LYS 66 Ca 0.45 -0.06 0.13 0.00 -1.87 0.00 0.00 60.65 59.30 1ce6 h LYS 66 Cb 0.72 -0.09 -0.09 0.00 0.08 0.00 0.00 32.23 32.85 1ce6 h LYS 66 CO -0.43 0.39 0.63 0.00 -0.57 0.00 0.00 179.45 179.47 1ce6 h ALA 67 N 1.03 1.54 -1.00 3.86 0.00 -0.00 0.55 119.26 125.25 1ce6 h ALA 67 Ca 0.11 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.07 1ce6 h ALA 67 Cb 0.08 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.62 1ce6 h ALA 67 CO -0.02 0.19 0.66 0.87 0.00 0.00 0.00 179.25 180.96 1ce6 h LYS 68 N 0.97 1.29 -0.45 0.00 1.57 -0.51 -0.85 116.57 118.57 1ce6 h LYS 68 Ca 0.51 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 59.16 1ce6 h LYS 68 Cb 0.54 -0.29 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 1ce6 h LYS 68 CO -0.28 0.85 0.10 0.78 -0.57 0.00 0.00 179.45 180.34 1ce6 h GLY 69 N 1.33 0.79 1.00 3.86 0.00 0.66 -2.99 103.07 107.72 1ce6 h GLY 69 Ca 0.38 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 47.20 1ce6 h GLY 69 CO -0.09 0.47 0.42 1.46 0.00 0.00 0.00 176.54 178.79 1ce6 h GLN 70 N 0.61 0.91 -0.55 4.80 1.08 -0.02 -1.43 115.11 120.51 1ce6 h GLN 70 Ca 0.14 -0.08 0.11 0.00 -1.45 0.00 0.00 58.65 57.37 1ce6 h GLN 70 Cb 0.34 -0.19 -0.09 0.00 -0.05 0.00 0.00 27.48 27.49 1ce6 h GLN 70 CO 0.00 0.64 0.05 0.93 -0.95 0.00 0.00 178.83 179.50 1ce6 h GLU 71 N 0.92 0.17 -0.31 1.46 5.08 -1.04 0.73 114.58 121.58 1ce6 h GLU 71 Ca 0.24 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1ce6 h GLU 71 Cb -0.05 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 1ce6 h GLU 71 CO -0.05 0.11 0.19 1.96 -1.00 0.00 0.00 179.01 180.23 1ce6 h GLN 72 N 0.17 0.42 -0.54 2.33 1.08 -1.33 0.73 115.11 117.97 1ce6 h GLN 72 Ca 0.28 -0.03 0.08 0.00 -1.45 0.00 0.00 58.65 57.53 1ce6 h GLN 72 Cb 0.43 -0.09 -0.06 0.00 -0.05 0.00 0.00 27.48 27.71 1ce6 h GLN 72 CO -0.42 0.31 0.19 2.35 -0.95 0.00 0.00 178.83 180.31 1ce6 h TRP 73 N 0.41 0.34 0.00 2.96 7.01 0.23 0.23 115.95 127.13 1ce6 h TRP 73 Ca 0.11 0.03 -0.15 0.00 2.11 0.00 0.00 58.89 60.99 1ce6 h TRP 73 Cb -0.01 -0.07 -0.02 0.00 -2.10 0.00 0.00 29.16 26.96 1ce6 h TRP 73 CO -0.04 0.10 -0.74 0.74 -2.79 0.00 0.00 178.44 175.70 1ce6 h PHE 74 N 0.37 0.00 -0.30 2.65 -1.00 0.82 -0.93 116.94 118.55 1ce6 h PHE 74 Ca 0.27 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 61.02 1ce6 h PHE 74 Cb 0.31 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.85 1ce6 h PHE 74 CO -0.17 0.74 0.08 -0.09 -1.61 0.00 0.00 178.31 177.26 1ce6 h ARG 75 N 0.00 0.47 0.36 1.51 2.43 0.17 -1.66 114.38 117.67 1ce6 h ARG 75 Ca -0.01 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 59.03 1ce6 h ARG 75 Cb 1.32 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 1ce6 h ARG 75 CO 0.10 0.54 -0.17 0.28 -1.51 0.00 0.00 179.97 179.21 1ce6 h VAL 76 N 0.32 0.00 -0.90 0.20 2.07 -0.55 -2.85 116.25 114.54 1ce6 h VAL 76 Ca 0.09 -0.17 0.23 0.00 0.82 0.00 0.00 66.70 67.67 1ce6 h VAL 76 Cb 0.28 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 29.89 1ce6 h VAL 76 CO 0.00 0.00 0.02 0.28 0.02 0.00 0.00 177.57 177.89 1ce6 h SER 77 N -0.66 -0.42 -0.90 0.57 0.02 -1.25 1.13 113.55 112.05 1ce6 h SER 77 Ca -0.05 0.25 0.11 0.00 -0.84 0.00 0.00 61.79 61.26 1ce6 h SER 77 Cb 0.37 0.43 -0.08 0.00 0.14 0.00 0.00 62.40 63.26 1ce6 h SER 77 CO 0.08 -0.28 0.53 0.25 -1.14 0.00 0.00 176.83 176.28 1ce6 h LEU 78 N 0.06 0.76 0.43 5.07 5.85 -1.34 0.65 115.31 126.78 1ce6 h LEU 78 Ca 0.52 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 59.28 1ce6 h LEU 78 Cb 1.02 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.96 1ce6 h LEU 78 CO -0.82 0.40 -0.21 0.03 -0.34 0.00 0.00 178.44 177.51 1ce6 h ARG 79 N 0.85 -0.56 -0.77 1.25 3.08 0.15 -1.48 114.38 116.91 1ce6 h ARG 79 Ca 0.45 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.54 1ce6 h ARG 79 Cb 0.45 0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.59 1ce6 h ARG 79 CO -0.27 -0.30 0.49 -0.91 -1.07 0.00 0.00 179.97 177.90 1ce6 h ASN 80 N -0.71 0.90 -0.98 7.04 2.35 -0.56 -1.31 115.58 122.32 1ce6 h ASN 80 Ca -0.06 -0.04 0.16 0.00 -0.55 0.00 0.00 56.30 55.81 1ce6 h ASN 80 Cb 0.51 -0.23 -0.09 0.00 0.05 0.00 0.00 38.32 38.56 1ce6 h ASN 80 CO 0.10 0.68 0.61 -0.07 -1.65 0.00 0.00 177.43 177.10 1ce6 h LEU 81 N 1.05 0.77 -0.76 1.61 3.38 0.42 0.22 115.31 122.00 1ce6 h LEU 81 Ca 0.28 0.07 -0.06 0.00 0.09 0.00 0.00 57.88 58.26 1ce6 h LEU 81 Cb -0.08 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1ce6 h LEU 81 CO -0.06 0.34 0.25 0.25 0.09 0.00 0.00 178.44 179.31 1ce6 h LEU 82 N 0.78 1.09 -0.27 1.67 5.85 -0.15 -2.60 115.31 121.69 1ce6 h LEU 82 Ca 0.52 -0.20 -0.11 0.00 0.84 0.00 0.00 57.88 58.93 1ce6 h LEU 82 Cb 0.79 -0.29 -0.00 0.00 0.37 0.00 0.00 40.66 41.53 1ce6 h LEU 82 CO -0.30 1.01 -0.27 1.23 -0.34 0.00 0.00 178.44 179.76 1ce6 h GLY 83 N 1.12 0.71 0.44 3.75 0.00 -0.37 0.17 103.07 108.89 1ce6 h GLY 83 Ca 0.24 -0.74 0.07 0.00 0.00 0.00 0.00 47.33 46.91 1ce6 h GLY 83 CO -0.01 0.66 0.08 -0.97 0.00 0.00 0.00 176.54 176.30 1ce6 h TYR 84 N 0.38 0.12 -0.54 5.60 0.05 -0.61 -0.93 116.97 121.04 1ce6 h TYR 84 Ca 0.04 0.03 -0.23 0.00 0.05 0.00 0.00 58.73 58.62 1ce6 h TYR 84 Cb 0.84 0.01 -0.13 0.00 1.01 0.00 0.00 36.73 38.46 1ce6 h TYR 84 CO 0.07 -0.00 0.29 0.66 -1.05 0.00 0.00 178.16 178.13 1ce6 n TYR 85 N -5.11 1.74 -3.53 4.88 4.02 -0.99 -4.89 117.16 113.27 1ce6 n TYR 85 Ca 0.04 -1.07 -0.23 0.00 -0.01 0.00 0.00 57.90 56.63 1ce6 n TYR 85 Cb 0.21 -0.59 -0.06 0.00 -0.02 0.00 0.00 39.34 38.88 1ce6 n TYR 85 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1ce6 n ASN 86 N -0.25 -0.17 -4.87 7.72 3.02 -0.36 -4.85 115.26 115.50 1ce6 n ASN 86 Ca 0.31 -0.79 -0.30 0.00 -0.03 0.00 0.00 54.58 53.77 1ce6 n ASN 86 Cb 1.12 -0.99 -0.01 0.00 -0.61 0.00 0.00 39.78 39.29 1ce6 n ASN 86 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1ce6 s GLN 87 N -5.36 3.70 0.00 3.52 -0.21 0.57 -5.02 119.66 116.86 1ce6 s GLN 87 Ca 0.23 0.62 0.00 0.00 0.02 0.00 0.00 55.36 56.23 1ce6 s GLN 87 Cb -0.13 -2.21 0.00 0.00 1.00 0.00 0.00 33.01 31.66 1ce6 s GLN 87 CO 0.63 -0.33 0.00 -1.13 -2.12 0.00 0.00 175.29 172.34 1ce6 n SER 88 N -2.12 0.00 -3.80 5.90 3.41 -1.26 -4.78 113.62 110.97 1ce6 n SER 88 Ca 0.04 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.53 1ce6 n SER 88 Cb 0.54 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.40 1ce6 n SER 88 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ce6 s ALA 89 N -3.69 -0.60 -1.29 7.33 0.00 -1.26 -4.92 121.76 117.33 1ce6 s ALA 89 Ca 0.00 0.11 -0.06 0.00 0.00 0.00 0.00 51.96 52.01 1ce6 s ALA 89 Cb 0.00 0.11 0.01 0.00 0.00 0.00 0.00 23.12 23.24 1ce6 s ALA 89 CO 0.00 -0.25 0.80 0.41 0.00 0.00 0.00 175.76 176.71 1ce6 n GLY 90 N 1.27 -0.38 3.78 0.00 0.00 -1.26 -5.01 105.19 103.58 1ce6 n GLY 90 Ca -0.22 0.09 -0.26 0.00 0.00 0.00 0.00 46.02 45.63 1ce6 n GLY 90 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ce6 s GLY 91 N -3.01 2.45 -0.05 -0.02 0.00 -1.26 -4.67 107.32 100.75 1ce6 s GLY 91 Ca 0.40 -1.67 0.02 0.00 0.00 0.00 0.00 44.72 43.47 1ce6 s GLY 91 CO 0.49 -1.96 -0.11 -0.45 0.00 0.00 0.00 173.10 171.07 1ce6 s SER 92 N -3.98 4.34 0.09 1.64 0.15 -1.26 -3.84 113.70 110.84 1ce6 s SER 92 Ca 0.34 -0.12 0.02 0.00 0.70 0.00 0.00 55.95 56.90 1ce6 s SER 92 Cb 0.02 -1.00 -0.04 0.00 -1.71 0.00 0.00 66.02 63.29 1ce6 s SER 92 CO 0.19 0.35 -0.08 -1.00 1.20 0.00 0.00 173.24 173.90 1ce6 s HIS 93 N -0.79 0.92 -0.08 3.44 4.02 -1.17 -4.94 115.29 116.69 1ce6 s HIS 93 Ca 0.12 -0.77 0.02 0.00 1.02 0.00 0.00 55.06 55.45 1ce6 s HIS 93 Cb -0.11 -0.52 0.01 0.00 -1.02 0.00 0.00 32.58 30.95 1ce6 s HIS 93 CO 0.01 -0.09 -0.13 0.99 1.02 0.00 0.00 174.74 176.55 1ce6 s THR 94 N -2.94 1.25 -0.12 1.30 2.01 -1.26 -0.02 115.64 115.86 1ce6 s THR 94 Ca 0.07 -0.52 0.01 0.00 0.31 0.00 0.00 61.69 61.56 1ce6 s THR 94 Cb 0.01 -1.15 0.02 0.00 0.01 0.00 0.00 72.50 71.38 1ce6 s THR 94 CO -0.02 0.39 -0.15 -0.22 -0.69 0.00 0.00 174.62 173.92 1ce6 s LEU 95 N 0.84 1.74 0.24 4.42 2.96 -0.34 0.32 118.68 128.85 1ce6 s LEU 95 Ca -0.11 -0.46 0.11 0.00 -0.22 0.00 0.00 54.13 53.45 1ce6 s LEU 95 Cb -0.15 -1.15 -0.05 0.00 0.50 0.00 0.00 46.19 45.34 1ce6 s LEU 95 CO 0.02 -0.00 -0.19 -1.10 -1.32 0.00 0.00 176.35 173.75 1ce6 s GLN 96 N 1.15 1.55 -0.04 1.98 -0.21 0.68 -0.83 119.66 123.94 1ce6 s GLN 96 Ca -0.03 -1.67 -0.06 0.00 0.02 0.00 0.00 55.36 53.62 1ce6 s GLN 96 Cb -0.14 -1.61 0.01 0.00 1.00 0.00 0.00 33.01 32.27 1ce6 s GLN 96 CO -0.05 0.30 0.16 -1.14 -2.12 0.00 0.00 175.29 172.44 1ce6 s GLN 97 N -3.36 0.31 -0.06 2.91 0.74 0.35 -0.53 119.66 120.02 1ce6 s GLN 97 Ca 0.26 -0.02 0.04 0.00 0.05 0.00 0.00 55.36 55.69 1ce6 s GLN 97 Cb -0.05 0.14 0.00 0.00 1.10 0.00 0.00 33.01 34.20 1ce6 s GLN 97 CO 0.12 -0.06 -0.17 -1.64 -0.55 0.00 0.00 175.29 172.99 1ce6 s MET 98 N -0.49 2.05 0.17 1.67 -1.94 -0.62 -0.01 119.30 120.13 1ce6 s MET 98 Ca -0.06 -0.60 0.02 0.00 -1.71 0.00 0.00 55.69 53.34 1ce6 s MET 98 Cb -0.04 -1.68 -0.05 0.00 2.01 0.00 0.00 34.83 35.08 1ce6 s MET 98 CO 0.01 0.15 -0.00 -1.12 -0.01 0.00 0.00 175.02 174.04 1ce6 s SER 99 N 0.34 1.27 0.00 3.03 0.01 -0.84 -2.26 113.70 115.26 1ce6 s SER 99 Ca -0.11 -1.16 0.00 0.00 1.31 0.00 0.00 55.95 55.98 1ce6 s SER 99 Cb -0.15 0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.19 1ce6 s SER 99 CO 0.04 -0.55 0.00 0.61 0.41 0.00 0.00 173.24 173.75 1ce6 n GLY 100 N -0.25 0.02 3.09 3.44 0.00 -0.74 -0.93 105.19 109.82 1ce6 n GLY 100 Ca -0.07 -1.72 -0.12 0.00 0.00 0.00 0.00 46.02 44.11 1ce6 n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ce6 s ASP 102 N -0.85 5.27 0.09 0.00 1.01 -0.71 -1.99 116.67 119.49 1ce6 s ASP 102 Ca -0.09 -0.04 0.05 0.00 0.71 0.00 0.00 52.55 53.18 1ce6 s ASP 102 Cb -0.05 -1.37 -0.03 0.00 1.01 0.00 0.00 42.92 42.47 1ce6 s ASP 102 CO 0.01 0.22 -0.12 -0.76 0.21 0.00 0.00 175.17 174.73 1ce6 s LEU 103 N -2.00 2.36 0.71 1.23 1.43 0.53 -1.32 118.68 121.62 1ce6 s LEU 103 Ca 0.24 -0.74 -0.05 0.00 -1.03 0.00 0.00 54.13 52.56 1ce6 s LEU 103 Cb -0.12 -0.43 0.09 0.00 0.03 0.00 0.00 46.19 45.77 1ce6 s LEU 103 CO 0.16 -0.17 1.00 -0.83 0.23 0.00 0.00 176.35 176.74 1ce6 s GLY 104 N -2.19 1.75 0.57 -3.19 0.00 -0.62 -0.42 107.32 103.22 1ce6 s GLY 104 Ca 0.03 -1.28 0.33 0.00 0.00 0.00 0.00 44.72 43.81 1ce6 s GLY 104 CO 0.02 -0.80 1.70 1.48 0.00 0.00 0.00 173.10 175.49 1ce6 h SER 105 N -0.59 0.00 -0.01 1.64 4.64 -1.89 0.76 113.55 118.10 1ce6 h SER 105 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1ce6 h SER 105 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1ce6 h SER 105 CO 0.50 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.56 1ce6 n ASP 106 N -3.80 0.75 -0.85 4.97 5.75 -1.26 -4.85 116.55 117.26 1ce6 n ASP 106 Ca 0.22 -1.27 -0.11 0.00 -0.01 0.00 0.00 54.79 53.61 1ce6 n ASP 106 Cb 1.21 -0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 41.25 1ce6 n ASP 106 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1ce6 n TRP 107 N -0.40 0.00 -4.05 2.11 7.02 0.26 -5.00 117.44 117.38 1ce6 n TRP 107 Ca 0.21 0.00 -0.36 0.00 -1.02 0.00 0.00 57.50 56.33 1ce6 n TRP 107 Cb 0.23 -2.14 -0.07 0.00 -2.42 0.00 0.00 31.31 26.91 1ce6 n TRP 107 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1ce6 s ARG 108 N -2.88 3.27 0.36 -0.99 0.52 -1.26 -4.81 118.95 113.15 1ce6 s ARG 108 Ca 0.00 -0.27 -0.25 0.00 -0.52 0.00 0.00 55.73 54.69 1ce6 s ARG 108 Cb 0.00 -3.03 -0.13 0.00 0.52 0.00 0.00 34.95 32.31 1ce6 s ARG 108 CO 0.00 0.73 0.81 -0.11 0.02 0.00 0.00 175.30 176.75 1ce6 n LEU 109 N 1.82 1.16 0.04 2.53 7.94 -1.26 -1.59 117.00 127.63 1ce6 n LEU 109 Ca -0.18 1.04 0.00 0.00 -1.11 0.00 0.00 56.01 55.76 1ce6 n LEU 109 Cb 0.54 -1.22 0.00 0.00 0.53 0.00 0.00 43.42 43.27 1ce6 n LEU 109 CO 0.32 -2.06 -0.17 0.18 -1.11 0.00 0.00 177.39 174.55 1ce6 n LEU 110 N 1.10 0.64 -4.09 -1.96 4.77 -0.44 -4.77 117.00 112.25 1ce6 n LEU 110 Ca 0.11 0.11 -0.12 0.00 -0.03 0.00 0.00 56.01 56.07 1ce6 n LEU 110 Cb 0.36 -0.18 -0.11 0.00 -2.33 0.00 0.00 43.42 41.16 1ce6 n LEU 110 CO 0.57 -0.49 -0.39 -0.13 -1.33 0.00 0.00 177.39 175.61 1ce6 s ARG 111 N -2.00 0.61 -0.10 3.23 0.52 -1.23 -4.98 118.95 115.00 1ce6 s ARG 111 Ca 0.00 -0.93 -0.00 0.00 -0.52 0.00 0.00 55.73 54.28 1ce6 s ARG 111 Cb 0.00 -0.23 -0.03 0.00 0.52 0.00 0.00 34.95 35.21 1ce6 s ARG 111 CO 0.00 0.02 -0.08 0.20 0.02 0.00 0.00 175.30 175.46 1ce6 s GLY 112 N -2.03 1.65 -0.05 -3.53 0.00 -1.26 -1.74 107.32 100.36 1ce6 s GLY 112 Ca -0.04 -0.88 0.04 0.00 0.00 0.00 0.00 44.72 43.84 1ce6 s GLY 112 CO -0.01 -0.42 -0.16 -0.19 0.00 0.00 0.00 173.10 172.32 1ce6 s TYR 113 N -0.26 1.62 -0.29 1.90 2.02 0.34 -4.79 117.35 117.90 1ce6 s TYR 113 Ca 0.03 -0.50 -0.14 0.00 -0.37 0.00 0.00 57.07 56.09 1ce6 s TYR 113 Cb -0.13 -1.11 0.12 0.00 -0.40 0.00 0.00 41.96 40.44 1ce6 s TYR 113 CO 0.03 -0.19 0.78 -1.17 -1.57 0.00 0.00 175.55 173.42 1ce6 s LEU 114 N 0.20 -0.87 -0.27 -1.29 2.96 -1.25 -1.79 118.68 116.35 1ce6 s LEU 114 Ca -0.07 1.29 -0.25 0.00 -0.22 0.00 0.00 54.13 54.88 1ce6 s LEU 114 Cb -0.12 2.13 0.12 0.00 0.50 0.00 0.00 46.19 48.81 1ce6 s LEU 114 CO 0.03 -0.19 1.02 0.00 -1.32 0.00 0.00 176.35 175.88 1ce6 s GLN 115 N 2.13 0.52 0.38 1.98 -2.07 -0.96 -0.46 119.66 121.19 1ce6 s GLN 115 Ca -0.07 0.59 0.08 0.00 -1.82 0.00 0.00 55.36 54.14 1ce6 s GLN 115 Cb -0.07 0.26 -0.06 0.00 -1.09 0.00 0.00 33.01 32.05 1ce6 s GLN 115 CO -0.18 -0.07 0.09 -0.06 -1.32 0.00 0.00 175.29 173.75 1ce6 s PHE 116 N 0.16 2.58 -0.15 9.60 0.40 0.14 -1.59 117.98 129.12 1ce6 s PHE 116 Ca 0.03 -0.53 -0.14 0.00 -0.60 0.00 0.00 56.93 55.68 1ce6 s PHE 116 Cb -0.05 -1.74 0.04 0.00 0.51 0.00 0.00 43.02 41.78 1ce6 s PHE 116 CO -0.05 0.34 0.41 0.00 0.70 0.00 0.00 175.22 176.61 1ce6 s ALA 117 N -2.57 -1.01 -0.14 5.36 0.00 0.31 -2.21 121.76 121.50 1ce6 s ALA 117 Ca 0.38 1.12 0.02 0.00 0.00 0.00 0.00 51.96 53.48 1ce6 s ALA 117 Cb 0.03 -0.63 0.01 0.00 0.00 0.00 0.00 23.12 22.53 1ce6 s ALA 117 CO 0.21 -0.20 -0.21 -0.47 0.00 0.00 0.00 175.76 175.09 1ce6 s TYR 118 N 0.14 2.60 -1.18 0.00 5.04 -0.47 -0.23 117.35 123.24 1ce6 s TYR 118 Ca -0.01 -1.33 -0.06 0.00 -2.44 0.00 0.00 57.07 53.23 1ce6 s TYR 118 Cb -0.03 -1.78 0.01 0.00 0.35 0.00 0.00 41.96 40.51 1ce6 s TYR 118 CO 0.01 -0.62 0.84 0.39 -1.34 0.00 0.00 175.55 174.83 1ce6 n GLU 119 N 4.15 -5.86 -0.88 4.97 -0.58 0.15 -2.30 120.64 120.28 1ce6 n GLU 119 Ca -0.20 0.71 0.00 0.00 -0.42 0.00 0.00 57.16 57.25 1ce6 n GLU 119 Cb 0.51 -5.31 0.00 0.00 -0.57 0.00 0.00 31.44 26.07 1ce6 n GLU 119 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ce6 n GLY 120 N -1.65 0.50 3.59 0.62 0.00 -1.26 -5.00 105.19 101.99 1ce6 n GLY 120 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 1ce6 n GLY 120 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ce6 s ARG 121 N -0.52 2.12 0.35 1.61 0.52 -0.97 -5.09 118.95 116.96 1ce6 s ARG 121 Ca 0.00 -1.34 -0.29 0.00 -0.52 0.00 0.00 55.73 53.58 1ce6 s ARG 121 Cb 0.00 -2.14 -0.11 0.00 0.52 0.00 0.00 34.95 33.22 1ce6 s ARG 121 CO 0.00 0.41 1.42 -0.51 0.02 0.00 0.00 175.30 176.64 1ce6 s ASP 122 N -3.15 6.53 0.06 0.23 1.01 -1.26 -1.37 116.67 118.72 1ce6 s ASP 122 Ca 0.27 2.88 -0.00 0.00 0.71 0.00 0.00 52.55 56.41 1ce6 s ASP 122 Cb -0.08 -2.66 -0.00 0.00 1.01 0.00 0.00 42.92 41.20 1ce6 s ASP 122 CO 0.17 -0.73 -0.00 0.00 0.21 0.00 0.00 175.17 174.81 1ce6 n TYR 123 N 0.82 0.00 -3.74 4.23 9.36 -0.94 -4.56 117.16 122.33 1ce6 n TYR 123 Ca 0.01 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.11 1ce6 n TYR 123 Cb 0.40 -0.00 -0.11 0.00 -0.63 0.00 0.00 39.34 39.00 1ce6 n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1ce6 s ILE 124 N -1.56 -0.01 -0.01 2.97 2.07 -1.21 -0.61 121.20 122.84 1ce6 s ILE 124 Ca -0.00 0.04 0.00 0.00 -1.41 0.00 0.00 60.65 59.28 1ce6 s ILE 124 Cb 0.00 -0.50 0.01 0.00 0.13 0.00 0.00 42.46 42.11 1ce6 s ILE 124 CO 0.00 0.02 -0.01 0.00 -1.91 0.00 0.00 174.94 173.04 1ce6 s ALA 125 N 0.58 0.21 0.13 1.50 0.00 -0.85 0.27 121.76 123.58 1ce6 s ALA 125 Ca -0.03 0.06 -0.31 0.00 0.00 0.00 0.00 51.96 51.68 1ce6 s ALA 125 Cb -0.05 -0.17 -0.08 0.00 0.00 0.00 0.00 23.12 22.83 1ce6 s ALA 125 CO -0.03 -0.02 1.35 -1.17 0.00 0.00 0.00 175.76 175.89 1ce6 s LEU 126 N 0.48 4.38 0.78 0.00 2.96 0.40 -1.46 118.68 126.21 1ce6 s LEU 126 Ca -0.04 2.31 -0.11 0.00 -0.22 0.00 0.00 54.13 56.06 1ce6 s LEU 126 Cb -0.07 -3.59 0.06 0.00 0.50 0.00 0.00 46.19 43.09 1ce6 s LEU 126 CO -0.01 -0.61 1.08 0.20 -1.32 0.00 0.00 176.35 175.70 1ce6 s ASN 127 N 0.94 4.52 0.30 3.68 0.01 0.04 -4.58 114.94 119.86 1ce6 s ASN 127 Ca 0.62 1.68 0.15 0.00 -0.71 0.00 0.00 52.86 54.61 1ce6 s ASN 127 Cb -0.36 -2.42 0.84 0.00 0.41 0.00 0.00 41.25 39.72 1ce6 s ASN 127 CO 0.32 -2.00 1.41 1.21 -1.51 0.00 0.00 177.10 176.53 1ce6 n GLU 128 N -3.49 0.10 0.03 -0.60 2.13 -1.26 -0.26 120.64 117.29 1ce6 n GLU 128 Ca 0.08 0.58 0.14 0.00 0.66 0.00 0.00 57.16 58.62 1ce6 n GLU 128 Cb 0.54 -2.00 0.53 0.00 0.27 0.00 0.00 31.44 30.78 1ce6 n GLU 128 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 1ce6 n ASP 129 N -2.08 0.28 -2.46 4.31 5.75 -1.26 -4.77 116.55 116.31 1ce6 n ASP 129 Ca -0.01 0.49 -0.21 0.00 -0.01 0.00 0.00 54.79 55.05 1ce6 n ASP 129 Cb 0.19 -0.55 -0.00 0.00 -1.03 0.00 0.00 41.12 39.72 1ce6 n ASP 129 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1ce6 n LEU 130 N -1.74 -2.05 0.00 -2.12 4.77 0.64 -4.79 117.00 111.70 1ce6 n LEU 130 Ca 0.06 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1ce6 n LEU 130 Cb 0.37 -2.94 0.00 0.00 -2.33 0.00 0.00 43.42 38.52 1ce6 n LEU 130 CO 0.28 -0.16 -0.14 0.29 -1.33 0.00 0.00 177.39 176.34 1ce6 n LYS 131 N -3.14 0.35 -4.07 3.23 5.02 -1.26 -4.58 118.16 113.71 1ce6 n LYS 131 Ca -0.23 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 55.83 1ce6 n LYS 131 Cb 0.68 -0.64 -0.06 0.00 -0.02 0.00 0.00 35.03 34.99 1ce6 n LYS 131 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1ce6 s THR 132 N -1.29 3.02 0.29 -0.18 -4.23 -1.26 -4.83 115.64 107.17 1ce6 s THR 132 Ca 0.00 -1.66 0.11 0.00 -1.18 0.00 0.00 61.69 58.95 1ce6 s THR 132 Cb 0.00 -2.99 -0.05 0.00 1.34 0.00 0.00 72.50 70.80 1ce6 s THR 132 CO 0.00 -0.17 -0.10 0.26 -0.54 0.00 0.00 174.62 174.07 1ce6 s TRP 133 N -2.43 2.46 -0.17 3.99 0.52 -1.26 -0.78 118.94 121.27 1ce6 s TRP 133 Ca 0.38 -0.34 -0.01 0.00 0.02 0.00 0.00 56.10 56.16 1ce6 s TRP 133 Cb -0.02 -1.18 0.05 0.00 -1.15 0.00 0.00 33.47 31.16 1ce6 s TRP 133 CO 0.23 0.63 -0.03 0.99 0.02 0.00 0.00 176.95 178.79 1ce6 s THR 134 N -2.47 0.99 -0.25 2.01 2.01 -0.54 -4.85 115.64 112.54 1ce6 s THR 134 Ca 0.32 -0.63 -0.16 0.00 0.31 0.00 0.00 61.69 61.52 1ce6 s THR 134 Cb -0.04 -1.24 -0.04 0.00 0.01 0.00 0.00 72.50 71.20 1ce6 s THR 134 CO 0.17 0.04 0.42 0.00 -0.69 0.00 0.00 174.62 174.56 1ce6 s ALA 135 N 1.67 3.57 0.25 7.40 0.00 -1.26 -2.02 121.76 131.37 1ce6 s ALA 135 Ca -0.00 -0.67 -0.06 0.00 0.00 0.00 0.00 51.96 51.23 1ce6 s ALA 135 Cb -0.16 -2.73 0.25 0.00 0.00 0.00 0.00 23.12 20.48 1ce6 s ALA 135 CO -0.07 -0.57 1.93 0.00 0.00 0.00 0.00 175.76 177.04 1ce6 h ALA 136 N 7.88 1.25 -4.18 0.00 0.00 -1.10 -3.46 119.26 119.64 1ce6 h ALA 136 Ca -0.32 -0.07 -0.30 0.00 0.00 0.00 0.00 54.91 54.22 1ce6 h ALA 136 Cb 1.16 -0.40 -0.08 0.00 0.00 0.00 0.00 17.79 18.47 1ce6 h ALA 136 CO 0.68 0.64 -0.29 -0.40 0.00 0.00 0.00 179.25 179.89 1ce6 n ASP 137 N -4.40 -0.40 -0.01 0.00 5.68 -1.26 -5.04 116.55 111.12 1ce6 n ASP 137 Ca 0.12 -2.37 -0.11 0.00 -0.50 0.00 0.00 54.79 51.93 1ce6 n ASP 137 Cb 0.01 1.04 -0.04 0.00 -1.14 0.00 0.00 41.12 40.99 1ce6 n ASP 137 CO 0.00 0.00 0.00 -0.03 -1.33 0.00 0.00 177.20 175.84 1ce6 h MET 138 N 0.00 -0.39 -0.09 0.11 1.85 -1.98 -2.50 114.93 111.92 1ce6 h MET 138 Ca -0.15 0.03 0.03 0.00 -0.61 0.00 0.00 59.70 58.99 1ce6 h MET 138 Cb 0.75 0.09 -0.06 0.00 0.43 0.00 0.00 31.60 32.81 1ce6 h MET 138 CO 0.22 -0.26 -0.50 0.00 -0.40 0.00 0.00 176.91 175.97 1ce6 h ALA 139 N 0.38 -0.88 -1.40 0.39 0.00 -1.97 0.24 119.26 116.01 1ce6 h ALA 139 Ca 0.10 -0.06 0.41 0.00 0.00 0.00 0.00 54.91 55.35 1ce6 h ALA 139 Cb 0.57 0.96 -0.06 0.00 0.00 0.00 0.00 17.79 19.26 1ce6 h ALA 139 CO -0.38 -1.05 1.19 0.00 0.00 0.00 0.00 179.25 179.01 1ce6 h ALA 140 N -0.43 3.30 -0.43 0.00 0.00 -1.75 0.46 119.26 120.41 1ce6 h ALA 140 Ca 0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1ce6 h ALA 140 Cb 0.64 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1ce6 h ALA 140 CO -0.38 -1.91 0.20 1.96 0.00 0.00 0.00 179.25 179.12 1ce6 h GLN 141 N 0.00 0.62 -0.71 0.00 1.08 -0.10 -1.12 115.11 114.87 1ce6 h GLN 141 Ca 0.66 -0.09 0.06 0.00 -1.45 0.00 0.00 58.65 57.83 1ce6 h GLN 141 Cb 3.04 -0.11 -0.06 0.00 -0.05 0.00 0.00 27.48 30.30 1ce6 h GLN 141 CO -0.01 0.53 0.41 0.82 -0.95 0.00 0.00 178.83 179.64 1ce6 h ILE 142 N 0.55 1.00 -0.51 2.54 2.04 -0.09 0.47 117.51 123.50 1ce6 h ILE 142 Ca 0.15 -0.26 -0.04 0.00 1.00 0.00 0.00 64.86 65.70 1ce6 h ILE 142 Cb 0.12 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.34 1ce6 h ILE 142 CO -0.02 0.14 0.13 0.74 0.00 0.00 0.00 178.15 179.14 1ce6 h THR 143 N 0.76 1.21 -0.18 -0.27 2.02 -1.45 -0.98 112.91 114.02 1ce6 h THR 143 Ca 0.31 -0.75 -0.06 0.00 0.77 0.00 0.00 66.41 66.69 1ce6 h THR 143 Cb 0.17 0.68 -0.00 0.00 -1.74 0.00 0.00 68.15 67.25 1ce6 h THR 143 CO -0.17 0.28 -0.10 -0.09 0.37 0.00 0.00 175.52 175.81 1ce6 h ARG 144 N 0.74 0.39 -0.45 6.66 2.43 0.23 0.28 114.38 124.67 1ce6 h ARG 144 Ca 0.17 -0.18 0.09 0.00 -0.81 0.00 0.00 59.98 59.25 1ce6 h ARG 144 Cb 0.26 -0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.72 1ce6 h ARG 144 CO -0.00 0.70 -0.04 -0.09 -1.51 0.00 0.00 179.97 179.03 1ce6 h ARG 145 N 0.07 0.06 -0.29 0.20 2.43 0.19 0.31 114.38 117.36 1ce6 h ARG 145 Ca 0.04 -0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.05 1ce6 h ARG 145 Cb 0.59 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 1ce6 h ARG 145 CO 0.03 0.04 -0.46 -0.22 -1.51 0.00 0.00 179.97 177.85 1ce6 h LYS 146 N 0.06 0.76 0.00 0.20 3.64 -1.08 -2.47 116.57 117.67 1ce6 h LYS 146 Ca 0.22 -0.43 -0.04 0.00 -1.27 0.00 0.00 60.65 59.14 1ce6 h LYS 146 Cb 0.33 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1ce6 h LYS 146 CO -0.41 1.05 -0.17 -1.49 -2.27 0.00 0.00 179.45 176.16 1ce6 h TRP 147 N 0.60 0.00 0.15 1.91 4.06 0.44 -1.38 115.95 121.73 1ce6 h TRP 147 Ca 0.04 0.00 -0.30 0.00 2.06 0.00 0.00 58.89 60.69 1ce6 h TRP 147 Cb 1.02 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 29.19 1ce6 h TRP 147 CO 0.05 0.17 -1.42 0.93 -3.56 0.00 0.00 178.44 174.62 1ce6 h GLU 148 N 0.00 0.31 -0.38 0.49 5.08 -0.35 -2.18 114.58 117.55 1ce6 h GLU 148 Ca -0.00 -0.54 -0.05 0.00 -1.00 0.00 0.00 59.36 57.77 1ce6 h GLU 148 Cb 0.77 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.20 1ce6 h GLU 148 CO 0.02 1.22 0.05 0.37 -1.00 0.00 0.00 179.01 179.68 1ce6 h GLN 149 N 0.09 0.64 0.00 2.33 -0.00 -1.22 -2.72 115.11 114.22 1ce6 h GLN 149 Ca -0.21 -0.18 0.00 0.00 -0.00 0.00 0.00 58.65 58.27 1ce6 h GLN 149 Cb 2.03 -0.07 0.00 0.00 0.00 0.00 0.00 27.48 29.44 1ce6 h GLN 149 CO 0.20 0.70 0.00 0.66 0.00 0.00 0.00 178.83 180.39 1ce6 h SER 150 N 0.48 0.00 -2.54 -0.69 4.64 -1.34 -3.47 113.55 110.64 1ce6 h SER 150 Ca 0.12 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.19 1ce6 h SER 150 Cb 0.38 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.49 1ce6 h SER 150 CO 0.01 0.00 -0.36 0.61 -0.87 0.00 0.00 176.83 176.22 1ce6 n GLY 151 N 0.62 -0.09 0.25 -0.77 0.00 -0.86 -4.92 105.19 99.43 1ce6 n GLY 151 Ca 0.03 -0.27 0.02 0.00 0.00 0.00 0.00 46.02 45.80 1ce6 n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ce6 h ALA 152 N 0.61 0.87 -0.98 4.61 0.00 -1.76 -2.64 119.26 119.96 1ce6 h ALA 152 Ca -0.32 0.11 0.34 0.00 0.00 0.00 0.00 54.91 55.04 1ce6 h ALA 152 Cb 1.22 0.09 -0.17 0.00 0.00 0.00 0.00 17.79 18.94 1ce6 h ALA 152 CO 0.35 -0.22 0.43 0.00 0.00 0.00 0.00 179.25 179.81 1ce6 h ALA 153 N 1.48 1.83 -0.68 0.00 0.00 -1.88 0.52 119.26 120.53 1ce6 h ALA 153 Ca 0.35 0.25 -0.00 0.00 0.00 0.00 0.00 54.91 55.51 1ce6 h ALA 153 Cb 0.49 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1ce6 h ALA 153 CO -0.37 -0.71 0.41 0.93 0.00 0.00 0.00 179.25 179.52 1ce6 h GLU 154 N 0.13 0.91 -0.06 0.00 5.08 -1.71 0.63 114.58 119.56 1ce6 h GLU 154 Ca 0.74 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 59.01 1ce6 h GLU 154 Cb 1.76 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 30.82 1ce6 h GLU 154 CO -0.73 0.64 -0.03 1.25 -1.00 0.00 0.00 179.01 179.14 1ce6 h HIS 155 N 0.93 0.15 -0.34 4.33 -0.00 -0.12 -1.77 115.15 118.34 1ce6 h HIS 155 Ca 0.25 -0.04 -0.06 0.00 -0.00 0.00 0.00 60.37 60.52 1ce6 h HIS 155 Cb -0.05 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 27.32 1ce6 h HIS 155 CO 0.00 0.49 -0.02 1.88 -0.00 0.00 0.00 177.93 180.29 1ce6 h TYR 156 N -0.24 0.66 -0.96 5.26 0.05 -1.15 -2.76 116.97 117.84 1ce6 h TYR 156 Ca 0.01 -0.12 0.20 0.00 0.05 0.00 0.00 58.73 58.88 1ce6 h TYR 156 Cb 0.45 -0.17 -0.11 0.00 1.01 0.00 0.00 36.73 37.91 1ce6 h TYR 156 CO 0.06 0.73 0.53 -0.22 -1.05 0.00 0.00 178.16 178.22 1ce6 h LYS 157 N 0.40 0.59 -0.11 4.88 3.64 0.30 0.25 116.57 126.52 1ce6 h LYS 157 Ca 0.09 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1ce6 h LYS 157 Cb 0.48 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1ce6 h LYS 157 CO 0.02 0.39 0.03 0.00 -2.27 0.00 0.00 179.45 177.62 1ce6 h ALA 158 N 1.67 0.14 0.35 5.00 0.00 -1.08 -1.67 119.26 123.68 1ce6 h ALA 158 Ca 0.57 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.34 1ce6 h ALA 158 Cb 0.98 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1ce6 h ALA 158 CO -0.44 -0.24 -0.19 -0.92 0.00 0.00 0.00 179.25 177.47 1ce6 h TYR 159 N -0.03 -0.50 -0.81 0.00 3.20 -0.80 0.27 116.97 118.30 1ce6 h TYR 159 Ca 0.03 -0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.03 1ce6 h TYR 159 Cb 0.24 0.17 -0.06 0.00 1.54 0.00 0.00 36.73 38.62 1ce6 h TYR 159 CO 0.00 -0.30 0.53 -0.07 -1.64 0.00 0.00 178.16 176.68 1ce6 h LEU 160 N -0.51 0.57 0.00 2.82 3.38 -0.57 0.56 115.31 121.55 1ce6 h LEU 160 Ca -0.04 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1ce6 h LEU 160 Cb 0.41 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1ce6 h LEU 160 CO 0.06 0.30 -1.49 -0.62 0.09 0.00 0.00 178.44 176.79 1ce6 n GLU 161 N -4.52 0.63 0.00 1.13 1.02 -0.63 -4.01 120.64 114.26 1ce6 n GLU 161 Ca 0.15 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 1ce6 n GLU 161 Cb 0.45 -1.70 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 1ce6 n GLU 161 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ce6 n GLY 162 N 1.27 -0.16 0.35 0.62 0.00 0.92 -4.51 105.19 103.67 1ce6 n GLY 162 Ca -0.04 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.03 1ce6 n GLY 162 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ce6 h GLU 163 N 0.00 0.76 0.16 1.61 5.08 -1.68 0.13 114.58 120.64 1ce6 h GLU 163 Ca 0.00 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1ce6 h GLU 163 Cb 0.00 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.08 1ce6 h GLU 163 CO 0.00 0.50 -0.08 0.00 -1.00 0.00 0.00 179.01 178.43 1ce6 h VAL 165 N -0.33 0.55 -0.23 0.00 2.07 -1.60 -2.25 116.25 114.45 1ce6 h VAL 165 Ca -0.02 -0.18 0.06 0.00 0.82 0.00 0.00 66.70 67.38 1ce6 h VAL 165 Cb 0.26 0.63 -0.07 0.00 -1.52 0.00 0.00 31.29 30.60 1ce6 h VAL 165 CO 0.04 0.03 -0.20 -0.33 0.02 0.00 0.00 177.57 177.13 1ce6 h GLU 166 N -0.71 -0.20 0.00 1.57 3.07 -0.75 -1.92 114.58 115.64 1ce6 h GLU 166 Ca -0.06 0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 58.79 1ce6 h GLU 166 Cb 0.52 0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 28.47 1ce6 h GLU 166 CO 0.10 -0.13 -0.12 -1.49 -1.40 0.00 0.00 179.01 175.97 1ce6 h TRP 167 N -0.21 0.00 -0.18 4.33 4.06 -1.06 -2.53 115.95 120.36 1ce6 h TRP 167 Ca 0.13 0.00 -0.21 0.00 2.06 0.00 0.00 58.89 60.88 1ce6 h TRP 167 Cb 0.41 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.58 1ce6 h TRP 167 CO -0.36 0.12 -0.70 1.25 -3.56 0.00 0.00 178.44 175.19 1ce6 h LEU 168 N 0.00 0.88 -0.79 -4.49 5.85 -0.74 -2.26 115.31 113.76 1ce6 h LEU 168 Ca -0.00 -0.54 0.08 0.00 0.84 0.00 0.00 57.88 58.25 1ce6 h LEU 168 Cb 0.48 -0.26 -0.06 0.00 0.37 0.00 0.00 40.66 41.19 1ce6 h LEU 168 CO 0.02 1.33 0.46 0.45 -0.34 0.00 0.00 178.44 180.35 1ce6 h HIS 169 N 0.54 0.83 0.61 1.25 3.86 -0.96 0.08 115.15 121.35 1ce6 h HIS 169 Ca -0.03 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.18 1ce6 h HIS 169 Cb 1.31 -0.26 0.01 0.00 1.06 0.00 0.00 27.41 29.53 1ce6 h HIS 169 CO 0.07 0.38 -0.29 -0.09 0.86 0.00 0.00 177.93 178.86 1ce6 h ARG 170 N 0.80 -0.78 -0.96 2.45 2.43 -1.39 -0.28 114.38 116.66 1ce6 h ARG 170 Ca 0.36 0.05 0.18 0.00 -0.81 0.00 0.00 59.98 59.77 1ce6 h ARG 170 Cb 0.26 0.18 -0.09 0.00 -0.42 0.00 0.00 29.97 29.90 1ce6 h ARG 170 CO -0.21 -0.47 0.61 1.88 -1.51 0.00 0.00 179.97 180.26 1ce6 h TYR 171 N -0.99 0.87 -0.32 2.20 0.05 -1.14 0.38 116.97 118.03 1ce6 h TYR 171 Ca -0.08 0.03 -0.10 0.00 0.05 0.00 0.00 58.73 58.62 1ce6 h TYR 171 Cb 0.67 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 38.13 1ce6 h TYR 171 CO -0.00 0.24 -0.22 -0.07 -1.05 0.00 0.00 178.16 177.05 1ce6 h LEU 172 N 0.67 0.61 -0.45 3.88 3.38 -0.75 0.68 115.31 123.33 1ce6 h LEU 172 Ca 0.52 -0.21 -0.12 0.00 0.09 0.00 0.00 57.88 58.17 1ce6 h LEU 172 Cb 0.93 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1ce6 h LEU 172 CO -0.28 0.83 -0.17 0.11 0.09 0.00 0.00 178.44 179.02 1ce6 h LYS 173 N 0.54 0.90 -0.02 1.13 1.79 0.15 -2.07 116.57 118.99 1ce6 h LYS 173 Ca 0.08 -0.38 -0.24 0.00 -2.18 0.00 0.00 60.65 57.93 1ce6 h LYS 173 Cb 0.67 -0.04 0.02 0.00 -1.58 0.00 0.00 32.23 31.31 1ce6 h LYS 173 CO 0.05 1.03 -0.93 -0.91 -1.08 0.00 0.00 179.45 177.61 1ce6 h ASN 174 N 0.74 0.85 -0.26 0.86 -0.26 -0.54 -3.21 115.58 113.76 1ce6 h ASN 174 Ca 0.10 -0.73 0.00 0.00 -0.56 0.00 0.00 56.30 55.12 1ce6 h ASN 174 Cb 0.73 -0.26 0.00 0.00 -1.06 0.00 0.00 38.32 37.73 1ce6 h ASN 174 CO 0.06 1.46 0.00 0.61 -1.06 0.00 0.00 177.43 178.50 1ce6 n GLY 175 N 1.04 1.46 0.11 2.83 0.00 0.24 -4.60 105.19 106.27 1ce6 n GLY 175 Ca -0.11 -0.36 -0.03 0.00 0.00 0.00 0.00 46.02 45.53 1ce6 n GLY 175 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ce6 n ASN 176 N 0.31 -0.29 0.01 1.61 5.15 -0.78 -0.62 115.26 120.66 1ce6 n ASN 176 Ca 0.11 0.86 0.04 0.00 -0.60 0.00 0.00 54.58 54.99 1ce6 n ASN 176 Cb 0.49 -0.25 0.44 0.00 -0.53 0.00 0.00 39.78 39.93 1ce6 n ASN 176 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ce6 h ALA 177 N -0.24 1.72 0.00 5.20 0.00 -1.89 -2.71 119.26 121.34 1ce6 h ALA 177 Ca 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ce6 h ALA 177 Cb 0.11 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1ce6 h ALA 177 CO -0.26 0.26 -0.11 1.15 0.00 0.00 0.00 179.25 180.29 1ce6 h THR 178 N 0.52 0.00 0.77 0.00 2.02 -1.34 -3.39 112.91 111.49 1ce6 h THR 178 Ca 0.14 -0.88 -0.04 0.00 0.77 0.00 0.00 66.41 66.41 1ce6 h THR 178 Cb -0.06 0.00 0.01 0.00 -1.74 0.00 0.00 68.15 66.36 1ce6 h THR 178 CO -0.03 0.00 -0.37 -0.07 0.37 0.00 0.00 175.52 175.42 1ce6 h LEU 179 N -0.88 -0.88 -1.17 2.58 3.38 -0.95 -3.23 115.31 114.17 1ce6 h LEU 179 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1ce6 h LEU 179 Cb 0.11 0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1ce6 h LEU 179 CO 0.00 -0.53 0.00 0.18 0.09 0.00 0.00 178.44 178.18 1ce6 n LEU 180 N -5.35 0.86 -4.97 1.67 4.77 -1.02 -4.76 117.00 108.19 1ce6 n LEU 180 Ca -0.13 -0.43 -0.21 0.00 -0.03 0.00 0.00 56.01 55.21 1ce6 n LEU 180 Cb 0.41 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1ce6 n LEU 180 CO 0.31 0.19 0.15 0.00 -1.33 0.00 0.00 177.39 176.71 1ce6 s ARG 181 N -0.78 3.14 -0.09 3.23 1.70 -1.22 -5.00 118.95 119.93 1ce6 s ARG 181 Ca 0.00 -0.74 -0.08 0.00 -0.47 0.00 0.00 55.73 54.45 1ce6 s ARG 181 Cb 0.00 -2.71 0.02 0.00 -0.57 0.00 0.00 34.95 31.70 1ce6 s ARG 181 CO 0.00 -0.04 0.23 0.95 -1.08 0.00 0.00 175.30 175.36 1ce6 s THR 182 N -2.33 -0.00 -0.21 4.99 -4.23 -1.26 -4.57 115.64 108.02 1ce6 s THR 182 Ca 0.45 0.02 -0.01 0.00 -1.18 0.00 0.00 61.69 60.96 1ce6 s THR 182 Cb -0.10 -0.33 0.01 0.00 1.34 0.00 0.00 72.50 73.42 1ce6 s THR 182 CO 0.34 0.01 -0.10 -1.81 -0.54 0.00 0.00 174.62 172.51 1ce6 s ASP 183 N 0.24 3.91 0.56 3.99 1.01 0.12 -4.89 116.67 121.60 1ce6 s ASP 183 Ca -0.01 -0.63 -0.21 0.00 0.71 0.00 0.00 52.55 52.42 1ce6 s ASP 183 Cb -0.03 -1.63 -0.04 0.00 1.01 0.00 0.00 42.92 42.23 1ce6 s ASP 183 CO -0.01 -0.05 1.28 -0.44 0.21 0.00 0.00 175.17 176.16 1ce6 s SER 184 N 1.37 5.30 0.76 0.27 0.01 -1.26 -1.91 113.70 118.24 1ce6 s SER 184 Ca 0.04 2.57 -0.11 0.00 1.31 0.00 0.00 55.95 59.75 1ce6 s SER 184 Cb -0.15 -2.62 0.05 0.00 0.21 0.00 0.00 66.02 63.51 1ce6 s SER 184 CO -0.07 -1.53 1.09 -2.84 0.41 0.00 0.00 173.24 170.30 1ce6 s PRO 185 N -3.05 2.40 -0.27 12.44 0.02 -1.26 -4.43 135.00 140.86 1ce6 s PRO 185 Ca 0.73 0.67 0.01 0.00 0.02 0.00 0.00 61.00 62.43 1ce6 s PRO 185 Cb -0.35 -1.95 0.08 0.00 0.02 0.00 0.00 34.50 32.29 1ce6 s PRO 185 CO 0.40 -1.41 0.00 0.15 -0.33 0.00 0.00 177.00 175.82 1ce6 s LYS 186 N -5.17 1.31 0.18 5.54 -0.14 -0.39 -4.87 119.74 116.20 1ce6 s LYS 186 Ca 0.60 -1.10 0.04 0.00 -1.36 0.00 0.00 55.97 54.14 1ce6 s LYS 186 Cb -0.14 -2.51 -0.03 0.00 -1.68 0.00 0.00 37.83 33.46 1ce6 s LYS 186 CO 0.54 -0.74 0.26 0.00 -0.76 0.00 0.00 175.35 174.65 1ce6 s ALA 187 N 1.40 3.85 -0.01 5.17 0.00 -1.24 -0.98 121.76 129.96 1ce6 s ALA 187 Ca 0.01 -1.14 -0.28 0.00 0.00 0.00 0.00 51.96 50.54 1ce6 s ALA 187 Cb -0.18 -1.65 0.09 0.00 0.00 0.00 0.00 23.12 21.38 1ce6 s ALA 187 CO -0.11 0.44 0.81 -3.38 0.00 0.00 0.00 175.76 173.52 1ce6 s HIS 188 N -1.83 -0.46 0.05 0.00 -3.43 -0.51 -4.96 115.29 104.15 1ce6 s HIS 188 Ca 0.34 0.51 0.05 0.00 -0.80 0.00 0.00 55.06 55.16 1ce6 s HIS 188 Cb -0.10 0.50 -0.04 0.00 -1.43 0.00 0.00 32.58 31.51 1ce6 s HIS 188 CO 0.27 -0.58 -0.09 0.08 -2.00 0.00 0.00 174.74 172.42 1ce6 s VAL 189 N -2.45 3.42 0.08 -5.38 1.01 -1.26 0.29 120.40 116.11 1ce6 s VAL 189 Ca -0.01 -1.04 0.07 0.00 0.00 0.00 0.00 61.98 61.01 1ce6 s VAL 189 Cb -0.01 -2.53 -0.03 0.00 0.00 0.00 0.00 36.38 33.81 1ce6 s VAL 189 CO -0.04 0.26 -0.19 0.42 0.00 0.00 0.00 175.10 175.55 1ce6 s THR 190 N -1.08 1.58 0.10 3.92 -4.23 -0.48 -4.92 115.64 110.53 1ce6 s THR 190 Ca 0.19 -1.41 0.07 0.00 -1.18 0.00 0.00 61.69 59.36 1ce6 s THR 190 Cb -0.11 -1.43 -0.04 0.00 1.34 0.00 0.00 72.50 72.26 1ce6 s THR 190 CO 0.10 -0.03 -0.12 -2.28 -0.54 0.00 0.00 174.62 171.76 1ce6 s HIS 191 N -1.09 2.70 -0.21 3.99 2.46 -1.26 -2.02 115.29 119.86 1ce6 s HIS 191 Ca 0.05 -0.18 -0.27 0.00 0.47 0.00 0.00 55.06 55.14 1ce6 s HIS 191 Cb -0.10 -1.42 0.07 0.00 -0.13 0.00 0.00 32.58 31.00 1ce6 s HIS 191 CO 0.03 0.41 0.73 -1.01 -2.47 0.00 0.00 174.74 172.43 1ce6 s HIS 192 N -1.18 -0.73 -0.02 3.88 3.76 -1.01 -5.02 115.29 114.97 1ce6 s HIS 192 Ca 0.20 1.66 -0.27 0.00 -0.15 0.00 0.00 55.06 56.51 1ce6 s HIS 192 Cb -0.11 0.31 -0.04 0.00 1.11 0.00 0.00 32.58 33.86 1ce6 s HIS 192 CO 0.12 -0.43 0.83 -1.25 -0.85 0.00 0.00 174.74 173.17 1ce6 s PRO 193 N -0.06 4.51 -0.09 8.40 0.04 -1.26 0.04 135.00 146.57 1ce6 s PRO 193 Ca -0.03 1.15 -0.12 0.00 0.04 0.00 0.00 61.00 62.03 1ce6 s PRO 193 Cb -0.04 -3.44 -0.04 0.00 0.04 0.00 0.00 34.50 31.02 1ce6 s PRO 193 CO 0.03 0.05 -0.24 -2.13 0.04 0.00 0.00 177.00 174.75 1ce6 n ARG 194 N 3.67 0.37 0.00 4.56 0.63 -1.16 -4.80 116.66 119.93 1ce6 n ARG 194 Ca 0.02 0.15 0.00 0.00 -0.92 0.00 0.00 57.85 57.09 1ce6 n ARG 194 Cb 0.51 -1.14 0.00 0.00 0.45 0.00 0.00 32.46 32.28 1ce6 n ARG 194 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1ce6 n SER 195 N -4.16 0.00 -0.09 6.15 7.64 -1.22 -5.01 113.62 116.93 1ce6 n SER 195 Ca -0.10 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 59.63 1ce6 n SER 195 Cb 0.36 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.46 1ce6 n SER 195 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1ce6 h LYS 196 N 0.00 0.00 -0.42 1.43 1.57 -2.02 -3.39 116.57 113.74 1ce6 h LYS 196 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ce6 h LYS 196 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1ce6 h LYS 196 CO 0.00 0.79 0.00 0.41 -0.57 0.00 0.00 179.45 180.08 1ce6 n GLY 197 N 1.54 3.16 3.56 3.86 0.00 -1.26 -4.95 105.19 111.09 1ce6 n GLY 197 Ca -0.20 -0.74 -0.25 0.00 0.00 0.00 0.00 46.02 44.83 1ce6 n GLY 197 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ce6 s GLU 198 N -1.84 1.89 -0.02 1.61 2.02 -1.26 0.86 118.70 121.96 1ce6 s GLU 198 Ca 0.38 -1.82 -0.03 0.00 0.02 0.00 0.00 54.97 53.52 1ce6 s GLU 198 Cb 0.26 -1.81 0.00 0.00 0.10 0.00 0.00 34.13 32.68 1ce6 s GLU 198 CO 0.17 0.18 0.06 0.08 0.02 0.00 0.00 175.26 175.78 1ce6 s VAL 199 N -2.55 0.03 -0.24 2.63 1.01 0.32 -2.99 120.40 118.61 1ce6 s VAL 199 Ca 0.33 -0.24 -0.13 0.00 0.00 0.00 0.00 61.98 61.94 1ce6 s VAL 199 Cb -0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 36.38 36.16 1ce6 s VAL 199 CO 0.17 -0.13 0.29 -0.89 0.00 0.00 0.00 175.10 174.55 1ce6 s THR 200 N -0.39 5.25 -0.19 3.92 2.01 0.11 -0.20 115.64 126.15 1ce6 s THR 200 Ca -0.04 0.44 -0.03 0.00 0.31 0.00 0.00 61.69 62.36 1ce6 s THR 200 Cb -0.03 -3.63 -0.01 0.00 0.01 0.00 0.00 72.50 68.84 1ce6 s THR 200 CO 0.00 0.25 -0.05 -0.22 -0.69 0.00 0.00 174.62 173.92 1ce6 s LEU 201 N 1.51 2.97 -0.24 4.42 2.96 -1.08 -2.42 118.68 126.80 1ce6 s LEU 201 Ca 0.13 -0.32 -0.03 0.00 -0.22 0.00 0.00 54.13 53.69 1ce6 s LEU 201 Cb -0.15 -1.74 0.01 0.00 0.50 0.00 0.00 46.19 44.81 1ce6 s LEU 201 CO 0.08 0.05 -0.05 -0.60 -1.32 0.00 0.00 176.35 174.51 1ce6 s ARG 202 N 1.08 3.07 -0.33 1.98 3.52 -0.86 -1.57 118.95 125.85 1ce6 s ARG 202 Ca 0.01 -0.83 -0.19 0.00 -0.13 0.00 0.00 55.73 54.59 1ce6 s ARG 202 Cb -0.15 -3.01 -0.01 0.00 -1.56 0.00 0.00 34.95 30.23 1ce6 s ARG 202 CO -0.00 -0.32 0.57 0.00 -0.81 0.00 0.00 175.30 174.74 1ce6 s TRP 204 N 2.51 3.45 -0.08 0.00 0.52 0.14 -1.53 118.94 123.96 1ce6 s TRP 204 Ca 0.22 0.40 0.00 0.00 0.02 0.00 0.00 56.10 56.74 1ce6 s TRP 204 Cb -0.15 -1.88 0.02 0.00 -1.15 0.00 0.00 33.47 30.32 1ce6 s TRP 204 CO 0.13 0.65 -0.05 0.00 0.02 0.00 0.00 176.95 177.69 1ce6 s ALA 205 N -1.02 0.98 0.14 0.98 0.00 -0.58 -1.43 121.76 120.82 1ce6 s ALA 205 Ca 0.16 -0.28 0.04 0.00 0.00 0.00 0.00 51.96 51.88 1ce6 s ALA 205 Cb -0.12 -0.68 -0.04 0.00 0.00 0.00 0.00 23.12 22.27 1ce6 s ALA 205 CO 0.05 -0.24 -0.09 -0.51 0.00 0.00 0.00 175.76 174.97 1ce6 s LEU 206 N 1.41 2.53 -1.22 0.00 1.43 -0.15 -2.29 118.68 120.38 1ce6 s LEU 206 Ca -0.02 -1.01 -0.12 0.00 -1.03 0.00 0.00 54.13 51.94 1ce6 s LEU 206 Cb -0.13 -0.28 -0.01 0.00 0.03 0.00 0.00 46.19 45.79 1ce6 s LEU 206 CO -0.03 -0.36 0.70 0.61 0.23 0.00 0.00 176.35 177.50 1ce6 n GLY 207 N -0.15 -0.72 3.31 -3.19 0.00 -0.89 -1.26 105.19 102.30 1ce6 n GLY 207 Ca -0.11 0.34 -0.25 0.00 0.00 0.00 0.00 46.02 46.01 1ce6 n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ce6 s PHE 208 N -3.61 1.89 -0.10 1.61 -0.12 -1.11 -4.54 117.98 112.01 1ce6 s PHE 208 Ca 0.30 -0.41 -0.07 0.00 -0.05 0.00 0.00 56.93 56.69 1ce6 s PHE 208 Cb -0.10 -1.03 0.03 0.00 -0.63 0.00 0.00 43.02 41.30 1ce6 s PHE 208 CO 0.86 0.24 0.24 -0.47 -0.05 0.00 0.00 175.22 176.04 1ce6 s TYR 209 N -1.22 -0.29 1.25 3.49 5.04 -0.80 -0.56 117.35 124.26 1ce6 s TYR 209 Ca 0.09 0.70 -0.20 0.00 -2.44 0.00 0.00 57.07 55.22 1ce6 s TYR 209 Cb -0.10 0.08 0.31 0.00 0.35 0.00 0.00 41.96 42.60 1ce6 s TYR 209 CO 0.05 -0.17 1.08 -1.25 -1.34 0.00 0.00 175.55 173.92 1ce6 s PRO 210 N 0.57 -1.63 0.14 4.97 0.04 -1.26 0.14 135.00 137.97 1ce6 s PRO 210 Ca -0.04 -0.07 -0.17 0.00 0.04 0.00 0.00 61.00 60.76 1ce6 s PRO 210 Cb -0.05 -1.55 -0.01 0.00 0.04 0.00 0.00 34.50 32.93 1ce6 s PRO 210 CO -0.03 -3.98 1.77 0.00 0.04 0.00 0.00 177.00 174.80 1ce6 h ALA 211 N -2.77 0.47 -1.00 8.56 0.00 -1.95 -3.45 119.26 119.12 1ce6 h ALA 211 Ca -0.44 -0.06 -0.80 0.00 0.00 0.00 0.00 54.91 53.62 1ce6 h ALA 211 Cb 1.30 -0.15 0.05 0.00 0.00 0.00 0.00 17.79 18.99 1ce6 h ALA 211 CO 0.31 -0.04 0.14 -3.47 0.00 0.00 0.00 179.25 176.19 1ce6 n ASP 212 N -4.79 0.14 -3.49 0.00 2.03 -1.26 -4.94 116.55 104.23 1ce6 n ASP 212 Ca -0.00 1.16 -0.10 0.00 0.52 0.00 0.00 54.79 56.37 1ce6 n ASP 212 Cb 0.05 -0.92 -0.03 0.00 -0.72 0.00 0.00 41.12 39.51 1ce6 n ASP 212 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1ce6 s ILE 213 N 0.36 0.00 -0.12 5.18 2.07 -1.26 -4.75 121.20 122.67 1ce6 s ILE 213 Ca 0.93 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 60.16 1ce6 s ILE 213 Cb -1.30 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 40.32 1ce6 s ILE 213 CO 0.60 0.00 -0.07 -0.89 -1.91 0.00 0.00 174.94 172.67 1ce6 s THR 214 N -2.86 1.00 -0.15 4.00 2.01 -0.40 -4.97 115.64 114.27 1ce6 s THR 214 Ca 0.02 -0.33 -0.00 0.00 0.31 0.00 0.00 61.69 61.68 1ce6 s THR 214 Cb -0.01 -1.06 -0.01 0.00 0.01 0.00 0.00 72.50 71.43 1ce6 s THR 214 CO -0.07 0.31 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.28 1ce6 s LEU 215 N 1.71 2.62 0.04 4.42 1.43 -1.26 -0.05 118.68 127.59 1ce6 s LEU 215 Ca 0.04 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.76 1ce6 s LEU 215 Cb -0.13 -1.60 -0.02 0.00 0.03 0.00 0.00 46.19 44.47 1ce6 s LEU 215 CO -0.08 0.10 -0.08 0.42 0.23 0.00 0.00 176.35 176.94 1ce6 s THR 216 N 0.72 0.60 0.14 5.49 -4.23 -0.53 -4.98 115.64 112.85 1ce6 s THR 216 Ca -0.06 -0.96 0.08 0.00 -1.18 0.00 0.00 61.69 59.57 1ce6 s THR 216 Cb -0.15 -0.63 -0.04 0.00 1.34 0.00 0.00 72.50 73.02 1ce6 s THR 216 CO 0.02 -0.27 -0.11 0.26 -0.54 0.00 0.00 174.62 173.97 1ce6 s TRP 217 N -1.15 2.65 -0.27 3.99 0.52 -1.26 -1.16 118.94 122.26 1ce6 s TRP 217 Ca -0.07 -0.21 -0.23 0.00 0.02 0.00 0.00 56.10 55.62 1ce6 s TRP 217 Cb -0.09 -1.35 0.08 0.00 -1.15 0.00 0.00 33.47 30.96 1ce6 s TRP 217 CO 0.01 0.46 0.74 1.14 0.02 0.00 0.00 176.95 179.31 1ce6 s GLN 218 N -2.51 0.78 -0.42 4.98 -2.07 -0.38 -1.10 119.66 118.94 1ce6 s GLN 218 Ca 0.23 1.02 -0.27 0.00 -1.82 0.00 0.00 55.36 54.51 1ce6 s GLN 218 Cb -0.10 0.33 0.02 0.00 -1.09 0.00 0.00 33.01 32.18 1ce6 s GLN 218 CO 0.14 -0.11 1.02 -1.17 -1.32 0.00 0.00 175.29 173.85 1ce6 s LEU 219 N 0.68 3.86 0.00 2.60 0.20 -0.99 -2.28 118.68 122.74 1ce6 s LEU 219 Ca -0.02 0.49 0.00 0.00 0.69 0.00 0.00 54.13 55.29 1ce6 s LEU 219 Cb -0.05 -3.39 0.00 0.00 -0.43 0.00 0.00 46.19 42.32 1ce6 s LEU 219 CO -0.05 -1.05 0.00 -0.46 -0.29 0.00 0.00 176.35 174.50 1ce6 n ASN 220 N 7.28 0.00 0.00 3.68 0.23 -0.23 -3.62 115.26 122.59 1ce6 n ASN 220 Ca 0.09 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.14 1ce6 n ASN 220 Cb 0.48 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.18 1ce6 n ASN 220 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1ce6 n GLY 221 N -0.70 -0.28 3.24 4.83 0.00 -1.26 -5.13 105.19 105.90 1ce6 n GLY 221 Ca 0.00 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 1ce6 n GLY 221 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ce6 n GLU 222 N 0.00 -0.02 -1.71 1.61 2.13 -1.24 -4.87 120.64 116.53 1ce6 n GLU 222 Ca 0.00 0.02 -0.29 0.00 0.66 0.00 0.00 57.16 57.54 1ce6 n GLU 222 Cb 0.00 -1.42 0.16 0.00 0.27 0.00 0.00 31.44 30.45 1ce6 n GLU 222 CO 0.00 0.00 0.00 -1.83 -0.41 0.00 0.00 177.13 174.89 1ce6 s GLU 223 N -2.51 0.78 -0.05 5.31 1.03 -1.26 -2.35 118.70 119.65 1ce6 s GLU 223 Ca 0.52 -0.09 0.05 0.00 0.03 0.00 0.00 54.97 55.48 1ce6 s GLU 223 Cb -0.26 -1.83 -0.00 0.00 -0.80 0.00 0.00 34.13 31.23 1ce6 s GLU 223 CO 0.71 -2.37 -0.20 -0.51 -1.33 0.00 0.00 175.26 171.57 1ce6 s LEU 224 N -6.00 1.96 0.00 1.83 1.43 -0.26 -4.65 118.68 112.99 1ce6 s LEU 224 Ca 0.69 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 53.38 1ce6 s LEU 224 Cb -0.09 -1.10 0.00 0.00 0.03 0.00 0.00 46.19 45.03 1ce6 s LEU 224 CO 0.53 0.18 0.02 1.07 0.23 0.00 0.00 176.35 178.37 1ce6 n THR 225 N 3.13 0.00 -3.58 5.49 5.66 -1.26 -4.71 114.28 119.02 1ce6 n THR 225 Ca -0.18 -0.34 -0.38 0.00 -3.05 0.00 0.00 64.05 60.10 1ce6 n THR 225 Cb 0.53 1.02 -0.06 0.00 -1.55 0.00 0.00 70.33 70.27 1ce6 n THR 225 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 175.07 170.44 1ce6 s GLN 226 N -0.64 3.82 -1.07 1.09 0.74 -1.26 -4.43 119.66 117.92 1ce6 s GLN 226 Ca 0.00 0.30 -0.28 0.00 0.05 0.00 0.00 55.36 55.44 1ce6 s GLN 226 Cb 0.00 -3.21 0.04 0.00 1.10 0.00 0.00 33.01 30.93 1ce6 s GLN 226 CO 0.00 0.71 0.62 -0.25 -0.55 0.00 0.00 175.29 175.82 1ce6 n ASP 227 N 1.85 -3.90 -3.66 6.67 8.00 -1.26 -4.78 116.55 119.46 1ce6 n ASP 227 Ca -0.15 -1.17 -0.29 0.00 0.71 0.00 0.00 54.79 53.88 1ce6 n ASP 227 Cb 0.53 -1.47 -0.13 0.00 -0.02 0.00 0.00 41.12 40.03 1ce6 n ASP 227 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1ce6 s MET 228 N -6.90 1.05 -0.28 -1.24 1.75 -1.26 -2.41 119.30 110.00 1ce6 s MET 228 Ca 0.38 -1.72 -0.29 0.00 -1.25 0.00 0.00 55.69 52.82 1ce6 s MET 228 Cb -0.21 -2.07 0.01 0.00 2.84 0.00 0.00 34.83 35.40 1ce6 s MET 228 CO 0.90 -1.14 1.04 -2.00 -0.65 0.00 0.00 175.02 173.16 1ce6 s GLU 229 N 0.70 4.15 -0.26 4.11 2.12 -0.91 -4.86 118.70 123.75 1ce6 s GLU 229 Ca 0.16 1.17 -0.05 0.00 0.36 0.00 0.00 54.97 56.61 1ce6 s GLU 229 Cb -0.23 -3.69 0.01 0.00 0.26 0.00 0.00 34.13 30.47 1ce6 s GLU 229 CO -0.03 -0.76 0.01 -1.17 -0.54 0.00 0.00 175.26 172.77 1ce6 s LEU 230 N 3.39 3.39 0.31 2.70 2.96 -1.26 -0.16 118.68 130.01 1ce6 s LEU 230 Ca 0.44 -0.62 -0.27 0.00 -0.22 0.00 0.00 54.13 53.46 1ce6 s LEU 230 Cb -0.14 -1.79 -0.10 0.00 0.50 0.00 0.00 46.19 44.67 1ce6 s LEU 230 CO 0.11 -0.12 0.96 0.54 -1.32 0.00 0.00 176.35 176.53 1ce6 s VAL 231 N 1.46 4.10 0.01 1.68 0.11 -0.60 -4.98 120.40 122.17 1ce6 s VAL 231 Ca 0.03 1.81 -0.33 0.00 -2.93 0.00 0.00 61.98 60.56 1ce6 s VAL 231 Cb -0.16 -4.03 -0.12 0.00 -1.53 0.00 0.00 36.38 30.54 1ce6 s VAL 231 CO -0.01 0.20 1.84 1.21 -3.33 0.00 0.00 175.10 175.01 1ce6 n GLU 232 N 0.70 2.37 -1.56 1.54 2.13 -1.26 -4.45 120.64 120.10 1ce6 n GLU 232 Ca 0.01 0.87 -0.50 0.00 0.66 0.00 0.00 57.16 58.20 1ce6 n GLU 232 Cb 0.49 -2.72 -0.04 0.00 0.27 0.00 0.00 31.44 29.44 1ce6 n GLU 232 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1ce6 n THR 233 N 4.83 0.91 -4.27 6.31 -1.04 -1.26 -4.91 114.28 114.85 1ce6 n THR 233 Ca 0.21 -0.23 -0.18 0.00 -2.04 0.00 0.00 64.05 61.80 1ce6 n THR 233 Cb 0.32 -0.72 -0.11 0.00 -1.82 0.00 0.00 70.33 68.00 1ce6 n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ce6 s ARG 234 N -0.41 1.11 0.22 -2.82 1.70 -0.30 -4.98 118.95 113.46 1ce6 s ARG 234 Ca 0.74 -1.33 -0.30 0.00 -0.47 0.00 0.00 55.73 54.37 1ce6 s ARG 234 Cb -0.89 -0.99 -0.08 0.00 -0.57 0.00 0.00 34.95 32.42 1ce6 s ARG 234 CO 0.53 0.19 1.00 -1.25 -1.08 0.00 0.00 175.30 174.69 1ce6 s PRO 235 N -2.90 4.74 0.26 3.89 0.04 -1.26 -0.61 135.00 139.17 1ce6 s PRO 235 Ca 0.12 1.59 0.18 0.00 0.04 0.00 0.00 61.00 62.93 1ce6 s PRO 235 Cb -0.04 -3.28 0.08 0.00 0.04 0.00 0.00 34.50 31.30 1ce6 s PRO 235 CO 0.04 0.33 1.31 0.00 0.04 0.00 0.00 177.00 178.72 1ce6 h ALA 236 N 4.48 0.72 0.00 8.56 0.00 -1.29 -3.46 119.26 128.26 1ce6 h ALA 236 Ca -0.45 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.09 1ce6 h ALA 236 Cb 1.21 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1ce6 h ALA 236 CO 0.69 0.46 0.00 0.41 0.00 0.00 0.00 179.25 180.81 1ce6 n GLY 237 N 1.22 0.51 0.45 0.00 0.00 -1.26 -4.88 105.19 101.24 1ce6 n GLY 237 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 1ce6 n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ce6 n ASP 238 N 0.00 2.96 0.00 1.61 5.75 -1.26 -4.94 116.55 120.66 1ce6 n ASP 238 Ca 0.00 -2.75 0.00 0.00 -0.01 0.00 0.00 54.79 52.03 1ce6 n ASP 238 Cb 0.00 -0.38 0.00 0.00 -1.03 0.00 0.00 41.12 39.71 1ce6 n ASP 238 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ce6 n GLY 239 N -0.68 2.17 3.99 6.12 0.00 -1.26 -5.05 105.19 110.48 1ce6 n GLY 239 Ca 0.15 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.98 1ce6 n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ce6 s THR 240 N -2.44 3.96 0.36 2.61 -4.23 -1.26 -4.86 115.64 109.77 1ce6 s THR 240 Ca 0.00 -0.93 0.09 0.00 -1.18 0.00 0.00 61.69 59.67 1ce6 s THR 240 Cb 0.00 -3.38 -0.06 0.00 1.34 0.00 0.00 72.50 70.40 1ce6 s THR 240 CO 0.00 -0.16 -0.02 -0.36 -0.54 0.00 0.00 174.62 173.54 1ce6 s PHE 241 N -2.25 2.49 0.11 3.99 0.40 0.28 -0.82 117.98 122.19 1ce6 s PHE 241 Ca 0.46 -0.52 0.03 0.00 -0.60 0.00 0.00 56.93 56.31 1ce6 s PHE 241 Cb -0.10 -1.53 -0.04 0.00 0.51 0.00 0.00 43.02 41.86 1ce6 s PHE 241 CO 0.32 0.50 -0.08 -0.65 0.70 0.00 0.00 175.22 176.00 1ce6 s GLN 242 N -3.69 0.89 -0.17 0.44 -0.21 0.23 -2.09 119.66 115.06 1ce6 s GLN 242 Ca 0.34 -1.30 -0.32 0.00 0.02 0.00 0.00 55.36 54.10 1ce6 s GLN 242 Cb 0.03 -0.41 0.14 0.00 1.00 0.00 0.00 33.01 33.77 1ce6 s GLN 242 CO 0.18 0.04 1.13 0.21 -2.12 0.00 0.00 175.29 174.72 1ce6 s LYS 243 N -3.47 0.42 0.15 2.91 2.20 -0.97 -1.15 119.74 119.82 1ce6 s LYS 243 Ca 0.11 -0.05 -0.13 0.00 -0.36 0.00 0.00 55.97 55.54 1ce6 s LYS 243 Cb 0.02 0.20 0.01 0.00 -1.51 0.00 0.00 37.83 36.55 1ce6 s LYS 243 CO -0.02 -0.16 0.35 1.67 -0.36 0.00 0.00 175.35 176.83 1ce6 s TRP 244 N -1.92 0.07 -0.01 4.03 1.48 -1.26 -1.53 118.94 119.80 1ce6 s TRP 244 Ca 0.06 -0.43 0.01 0.00 -1.06 0.00 0.00 56.10 54.68 1ce6 s TRP 244 Cb -0.01 0.13 0.01 0.00 -1.16 0.00 0.00 33.47 32.44 1ce6 s TRP 244 CO -0.04 -0.72 -0.02 0.00 -4.06 0.00 0.00 176.95 172.10 1ce6 s ALA 245 N -3.88 0.30 0.32 2.67 0.00 -0.58 -1.56 121.76 119.02 1ce6 s ALA 245 Ca 0.09 -0.04 0.10 0.00 0.00 0.00 0.00 51.96 52.11 1ce6 s ALA 245 Cb 0.02 -0.16 -0.05 0.00 0.00 0.00 0.00 23.12 22.93 1ce6 s ALA 245 CO -0.06 0.02 -0.08 -1.54 0.00 0.00 0.00 175.76 174.11 1ce6 s SER 246 N 0.29 3.94 -0.24 0.00 1.04 0.78 0.21 113.70 119.71 1ce6 s SER 246 Ca -0.03 -1.02 -0.12 0.00 0.48 0.00 0.00 55.95 55.26 1ce6 s SER 246 Cb -0.06 -0.46 0.08 0.00 0.10 0.00 0.00 66.02 65.69 1ce6 s SER 246 CO -0.01 -0.13 0.57 0.54 0.98 0.00 0.00 173.24 175.20 1ce6 s VAL 247 N -2.52 -0.23 -0.89 5.02 0.11 -0.61 -2.15 120.40 119.14 1ce6 s VAL 247 Ca 0.32 0.05 -0.24 0.00 -2.93 0.00 0.00 61.98 59.18 1ce6 s VAL 247 Cb -0.01 -0.85 -0.02 0.00 -1.53 0.00 0.00 36.38 33.97 1ce6 s VAL 247 CO 0.17 0.02 1.78 -0.69 -3.33 0.00 0.00 175.10 173.06 1ce6 s VAL 248 N 1.86 3.57 -0.08 2.04 1.01 -1.01 -2.63 120.40 125.16 1ce6 s VAL 248 Ca -0.08 -0.37 -0.15 0.00 0.00 0.00 0.00 61.98 61.39 1ce6 s VAL 248 Cb -0.08 -4.30 -0.05 0.00 0.00 0.00 0.00 36.38 31.95 1ce6 s VAL 248 CO -0.17 -1.23 0.37 -0.69 0.00 0.00 0.00 175.10 173.38 1ce6 s VAL 249 N 8.51 5.18 0.08 2.92 1.01 0.73 -4.84 120.40 133.99 1ce6 s VAL 249 Ca 0.62 0.73 -0.31 0.00 0.00 0.00 0.00 61.98 63.03 1ce6 s VAL 249 Cb -0.06 -3.69 -0.09 0.00 0.00 0.00 0.00 36.38 32.55 1ce6 s VAL 249 CO 0.00 0.48 1.73 -2.16 0.00 0.00 0.00 175.10 175.15 1ce6 s PRO 250 N -0.31 4.17 0.33 2.72 0.04 -1.26 0.12 135.00 140.82 1ce6 s PRO 250 Ca 0.21 2.43 -0.21 0.00 0.04 0.00 0.00 61.00 63.47 1ce6 s PRO 250 Cb -0.15 -3.64 -0.15 0.00 0.04 0.00 0.00 34.50 30.61 1ce6 s PRO 250 CO 0.09 -0.78 0.17 -0.11 0.04 0.00 0.00 177.00 176.41 1ce6 n LEU 251 N 5.76 -2.34 0.00 -3.56 0.00 0.25 -1.74 117.00 115.37 1ce6 n LEU 251 Ca 0.17 0.83 0.00 0.00 0.00 0.00 0.00 56.01 57.00 1ce6 n LEU 251 Cb 0.40 -0.84 0.00 0.00 0.00 0.00 0.00 43.42 42.98 1ce6 n LEU 251 CO 0.64 -3.66 0.00 0.61 0.00 0.00 0.00 177.39 174.97 1ce6 n GLY 252 N 2.11 1.69 3.56 -3.96 0.00 -1.26 -4.85 105.19 102.48 1ce6 n GLY 252 Ca 0.12 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1ce6 n GLY 252 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ce6 s LYS 253 N 0.00 3.40 0.00 1.61 1.02 -0.71 -4.65 119.74 120.40 1ce6 s LYS 253 Ca 0.00 0.02 0.00 0.00 0.02 0.00 0.00 55.97 56.01 1ce6 s LYS 253 Cb 0.00 -4.06 0.00 0.00 -0.52 0.00 0.00 37.83 33.25 1ce6 s LYS 253 CO 0.00 -1.75 0.00 0.39 -0.92 0.00 0.00 175.35 173.07 1ce6 n GLU 254 N 8.44 0.00 0.00 1.68 1.02 -1.26 -4.14 120.64 126.37 1ce6 n GLU 254 Ca 0.06 0.00 0.07 0.00 -0.02 0.00 0.00 57.16 57.27 1ce6 n GLU 254 Cb 0.49 -0.33 0.42 0.00 -0.02 0.00 0.00 31.44 31.99 1ce6 n GLU 254 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1ce6 n GLN 255 N -1.67 0.48 0.17 3.49 7.27 -1.26 -1.33 117.38 124.53 1ce6 n GLN 255 Ca 0.00 0.00 0.06 0.00 0.07 0.00 0.00 57.00 57.13 1ce6 n GLN 255 Cb 0.00 -1.46 0.08 0.00 2.41 0.00 0.00 30.24 31.27 1ce6 n GLN 255 CO 0.00 0.00 0.00 -0.91 0.07 0.00 0.00 177.06 176.22 1ce6 h ASN 256 N 0.00 0.00 -2.92 1.69 4.21 -1.94 -3.45 115.58 113.16 1ce6 h ASN 256 Ca 0.00 0.00 -0.62 0.00 1.21 0.00 0.00 56.30 56.89 1ce6 h ASN 256 Cb 0.00 0.00 -0.05 0.00 -1.12 0.00 0.00 38.32 37.15 1ce6 h ASN 256 CO 0.00 0.30 -0.34 -0.31 -1.29 0.00 0.00 177.43 175.78 1ce6 s TYR 257 N -3.06 3.60 0.01 1.19 1.51 -0.44 -1.07 117.35 119.10 1ce6 s TYR 257 Ca 0.05 0.67 -0.03 0.00 -1.01 0.00 0.00 57.07 56.75 1ce6 s TYR 257 Cb 0.07 -2.06 -0.01 0.00 -0.11 0.00 0.00 41.96 39.85 1ce6 s TYR 257 CO 0.72 0.62 0.04 0.95 -1.11 0.00 0.00 175.55 176.76 1ce6 s THR 258 N -1.25 0.09 0.05 -0.71 -4.23 -0.97 -4.68 115.64 103.95 1ce6 s THR 258 Ca 0.26 -0.76 0.08 0.00 -1.18 0.00 0.00 61.69 60.10 1ce6 s THR 258 Cb -0.14 -0.31 -0.03 0.00 1.34 0.00 0.00 72.50 73.37 1ce6 s THR 258 CO 0.14 -0.42 -0.23 0.00 -0.54 0.00 0.00 174.62 173.58 1ce6 s ARG 260 N -1.22 1.95 -0.16 0.00 0.52 -0.31 -1.89 118.95 117.85 1ce6 s ARG 260 Ca 0.09 -0.98 -0.01 0.00 -0.52 0.00 0.00 55.73 54.31 1ce6 s ARG 260 Cb -0.09 -1.97 -0.01 0.00 0.52 0.00 0.00 34.95 33.40 1ce6 s ARG 260 CO 0.02 0.53 -0.13 0.08 0.02 0.00 0.00 175.30 175.82 1ce6 s VAL 261 N -0.67 2.94 -0.13 3.52 1.01 0.55 -1.46 120.40 126.16 1ce6 s VAL 261 Ca 0.10 -0.68 -0.01 0.00 0.00 0.00 0.00 61.98 61.39 1ce6 s VAL 261 Cb -0.10 -2.25 -0.02 0.00 0.00 0.00 0.00 36.38 34.00 1ce6 s VAL 261 CO 0.00 0.50 -0.08 -0.31 0.00 0.00 0.00 175.10 175.21 1ce6 s TYR 262 N 0.74 2.91 -0.17 5.22 1.51 0.93 -1.36 117.35 127.13 1ce6 s TYR 262 Ca -0.05 -0.37 -0.29 0.00 -1.01 0.00 0.00 57.07 55.35 1ce6 s TYR 262 Cb -0.15 -1.86 0.10 0.00 -0.11 0.00 0.00 41.96 39.94 1ce6 s TYR 262 CO 0.01 -0.03 0.89 -1.58 -1.11 0.00 0.00 175.55 173.73 1ce6 s HIS 263 N 0.12 -0.52 0.00 2.71 2.46 -1.26 -1.28 115.29 117.52 1ce6 s HIS 263 Ca -0.04 1.04 0.00 0.00 0.47 0.00 0.00 55.06 56.54 1ce6 s HIS 263 Cb -0.14 0.40 0.00 0.00 -0.13 0.00 0.00 32.58 32.71 1ce6 s HIS 263 CO 0.04 -0.39 0.91 0.39 -2.47 0.00 0.00 174.74 173.21 1ce6 n GLU 264 N 1.36 0.00 0.00 2.88 1.02 -1.26 -0.81 120.64 123.84 1ce6 n GLU 264 Ca -0.13 0.85 0.00 0.00 -0.02 0.00 0.00 57.16 57.85 1ce6 n GLU 264 Cb 0.57 -1.41 0.00 0.00 -0.02 0.00 0.00 31.44 30.58 1ce6 n GLU 264 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ce6 n GLY 265 N -0.99 0.00 3.53 0.62 0.00 -1.26 -4.52 105.19 102.57 1ce6 n GLY 265 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1ce6 n GLY 265 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ce6 s LEU 266 N -1.42 4.49 0.54 0.99 2.96 0.01 -4.52 118.68 121.74 1ce6 s LEU 266 Ca 0.00 -0.24 0.29 0.00 -0.22 0.00 0.00 54.13 53.96 1ce6 s LEU 266 Cb 0.00 -2.60 1.45 0.00 0.50 0.00 0.00 46.19 45.54 1ce6 s LEU 266 CO 0.00 -0.60 1.93 -0.65 -1.32 0.00 0.00 176.35 175.71 1ce6 h PRO 267 N 8.64 0.00 -1.45 0.98 0.11 -1.85 -3.42 132.00 135.01 1ce6 h PRO 267 Ca -0.27 0.00 0.10 0.00 0.11 0.00 0.00 66.00 65.94 1ce6 h PRO 267 Cb 1.11 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 31.94 1ce6 h PRO 267 CO 0.82 0.00 0.57 -1.83 -0.21 0.00 0.00 178.00 177.35 1ce6 s GLU 268 N -4.95 0.38 -0.39 1.05 -1.05 -1.26 -5.14 118.70 107.34 1ce6 s GLU 268 Ca -0.05 0.45 -0.36 0.00 -0.15 0.00 0.00 54.97 54.86 1ce6 s GLU 268 Cb 0.20 0.19 -0.15 0.00 -0.44 0.00 0.00 34.13 33.92 1ce6 s GLU 268 CO 0.73 -0.05 1.38 -2.30 0.95 0.00 0.00 175.26 175.97 1ce6 n PRO 269 N 2.01 0.00 -2.01 -4.83 -0.02 -1.26 -4.90 135.00 123.99 1ce6 n PRO 269 Ca -0.12 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 60.95 1ce6 n PRO 269 Cb 0.56 -1.18 -0.02 0.00 -0.02 0.00 0.00 33.50 32.84 1ce6 n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1ce6 s LEU 270 N 3.02 4.38 -0.04 2.45 1.43 -0.46 -4.78 118.68 124.68 1ce6 s LEU 270 Ca 0.86 2.64 0.03 0.00 -1.03 0.00 0.00 54.13 56.63 1ce6 s LEU 270 Cb -1.18 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 41.43 1ce6 s LEU 270 CO 0.61 -0.71 -0.12 -0.89 0.23 0.00 0.00 176.35 175.46 1ce6 s THR 271 N 0.22 1.08 0.19 5.49 2.01 -1.26 -0.33 115.64 123.04 1ce6 s THR 271 Ca 0.61 -0.50 -0.23 0.00 0.31 0.00 0.00 61.69 61.87 1ce6 s THR 271 Cb -0.42 -0.96 0.06 0.00 0.01 0.00 0.00 72.50 71.20 1ce6 s THR 271 CO 0.41 0.33 0.95 -1.48 -0.69 0.00 0.00 174.62 174.14 1ce6 s LEU 272 N 0.27 -0.12 0.00 4.42 2.34 -0.79 -5.00 118.68 119.80 1ce6 s LEU 272 Ca -0.06 -0.55 -0.04 0.00 0.06 0.00 0.00 54.13 53.53 1ce6 s LEU 272 Cb -0.11 2.23 0.02 0.00 -0.56 0.00 0.00 46.19 47.76 1ce6 s LEU 272 CO 0.02 -1.02 0.26 -2.11 -1.06 0.00 0.00 176.35 172.44 1ce6 n ARG 273 N -0.53 0.38 0.00 1.48 1.85 -1.26 -1.76 116.66 116.81 1ce6 n ARG 273 Ca -0.05 -0.86 0.15 0.00 -1.00 0.00 0.00 57.85 56.08 1ce6 n ARG 273 Cb 0.60 1.01 0.65 0.00 -1.05 0.00 0.00 32.46 33.67 1ce6 n ARG 273 CO 0.00 0.00 0.00 1.87 -0.01 0.00 0.00 177.63 179.49