#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s68 n PHE 2 N 0.00 0.20 -4.23 1.12 7.35 -1.26 -5.02 117.46 115.62 1s68 n PHE 2 Ca 0.00 0.98 -0.19 0.00 -0.76 0.00 0.00 57.45 57.48 1s68 n PHE 2 Cb 0.00 -2.05 -0.16 0.00 0.35 0.00 0.00 39.48 37.62 1s68 n PHE 2 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 1s68 s LYS 3 N -0.50 0.75 0.57 -4.13 -0.14 -1.26 -5.12 119.74 109.92 1s68 s LYS 3 Ca 0.77 -0.18 -0.21 0.00 -1.36 0.00 0.00 55.97 54.99 1s68 s LYS 3 Cb -1.07 -0.74 -0.04 0.00 -1.68 0.00 0.00 37.83 34.30 1s68 s LYS 3 CO 0.56 0.03 1.34 0.15 -0.76 0.00 0.00 175.35 176.67 1s68 s LYS 4 N 0.43 2.97 0.34 1.68 -0.14 -1.26 -4.98 119.74 118.78 1s68 s LYS 4 Ca -0.06 2.19 -0.23 0.00 -1.36 0.00 0.00 55.97 56.52 1s68 s LYS 4 Cb -0.10 -2.14 -0.10 0.00 -1.68 0.00 0.00 37.83 33.82 1s68 s LYS 4 CO 0.00 -1.31 0.89 -0.47 -0.76 0.00 0.00 175.35 173.71 1s68 s TYR 5 N -1.33 3.55 0.26 3.18 5.04 -1.26 -5.01 117.35 121.78 1s68 s TYR 5 Ca 0.75 1.62 -0.30 0.00 -2.44 0.00 0.00 57.07 56.70 1s68 s TYR 5 Cb -0.40 -2.82 -0.10 0.00 0.35 0.00 0.00 41.96 38.99 1s68 s TYR 5 CO 0.46 0.13 1.42 -1.54 -1.34 0.00 0.00 175.55 174.67 1s68 s SER 6 N -1.84 6.67 0.49 4.32 1.04 -1.26 -5.01 113.70 118.12 1s68 s SER 6 Ca 0.53 2.66 -0.19 0.00 0.48 0.00 0.00 55.95 59.43 1s68 s SER 6 Cb -0.15 -2.63 -0.08 0.00 0.10 0.00 0.00 66.02 63.26 1s68 s SER 6 CO 0.20 -0.67 1.02 -0.94 0.98 0.00 0.00 173.24 173.82 1s68 s SER 7 N 0.25 6.39 0.09 7.02 1.04 -1.26 -5.05 113.70 122.17 1s68 s SER 7 Ca 0.58 1.84 0.06 0.00 0.48 0.00 0.00 55.95 58.90 1s68 s SER 7 Cb -0.41 -2.55 -0.04 0.00 0.10 0.00 0.00 66.02 63.12 1s68 s SER 7 CO 0.45 -0.75 -0.06 -0.76 0.98 0.00 0.00 173.24 173.10 1s68 s LEU 8 N -3.64 3.22 0.26 2.42 1.43 -1.26 -4.56 118.68 116.55 1s68 s LEU 8 Ca 0.65 -0.28 -0.02 0.00 -1.03 0.00 0.00 54.13 53.45 1s68 s LEU 8 Cb -0.14 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 1s68 s LEU 8 CO 0.22 0.19 0.47 -0.70 0.23 0.00 0.00 176.35 176.76 1s68 s GLU 9 N -2.17 3.55 0.33 1.70 2.56 -0.97 -4.83 118.70 118.87 1s68 s GLU 9 Ca 0.23 -0.24 -0.22 0.00 0.00 0.00 0.00 54.97 54.73 1s68 s GLU 9 Cb -0.11 -2.75 -0.10 0.00 2.00 0.00 0.00 34.13 33.17 1s68 s GLU 9 CO 0.15 0.30 0.88 -0.80 -0.56 0.00 0.00 175.26 175.23 1s68 s ASN 10 N -3.34 7.12 0.46 -1.70 0.01 -1.26 -0.25 114.94 115.97 1s68 s ASN 10 Ca 0.40 1.66 0.14 0.00 -0.71 0.00 0.00 52.86 54.35 1s68 s ASN 10 Cb -0.11 -2.52 1.04 0.00 0.41 0.00 0.00 41.25 40.08 1s68 s ASN 10 CO 0.31 -0.14 2.03 1.12 -1.51 0.00 0.00 177.10 178.91 1s68 h HIS 11 N 2.79 0.08 -0.00 2.20 2.07 -1.60 -1.69 115.15 119.00 1s68 h HIS 11 Ca -0.48 -0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.04 1s68 h HIS 11 Cb 1.19 -0.03 0.00 0.00 2.57 0.00 0.00 27.41 31.14 1s68 h HIS 11 CO 0.62 0.17 -0.01 2.48 -3.07 0.00 0.00 177.93 178.11 1s68 n TYR 12 N -4.40 0.00 -2.53 6.12 0.18 -1.26 -4.46 117.16 110.82 1s68 n TYR 12 Ca -0.02 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.35 1s68 n TYR 12 Cb 0.18 -0.14 -0.01 0.00 -0.38 0.00 0.00 39.34 39.00 1s68 n TYR 12 CO 0.00 0.00 0.00 1.21 -2.08 0.00 0.00 176.86 175.99 1s68 s ASN 13 N -2.29 6.65 0.28 9.48 3.04 -0.64 -4.77 114.94 126.69 1s68 s ASN 13 Ca 0.37 -2.35 0.01 0.00 0.04 0.00 0.00 52.86 50.93 1s68 s ASN 13 Cb 0.21 -2.58 0.55 0.00 -1.54 0.00 0.00 41.25 37.89 1s68 s ASN 13 CO 0.42 -1.37 1.81 0.28 -3.04 0.00 0.00 177.10 175.20 1s68 h SER 14 N 7.83 0.81 0.01 -4.21 0.02 -1.86 -1.72 113.55 114.42 1s68 h SER 14 Ca 0.42 0.06 -0.07 0.00 -0.84 0.00 0.00 61.79 61.36 1s68 h SER 14 Cb 0.88 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.31 1s68 h SER 14 CO 1.44 0.40 -0.20 0.11 -1.14 0.00 0.00 176.83 177.44 1s68 h LYS 15 N 0.87 0.34 -0.17 3.45 1.57 -1.97 0.43 116.57 121.09 1s68 h LYS 15 Ca 0.49 -0.11 -0.05 0.00 -1.87 0.00 0.00 60.65 59.11 1s68 h LYS 15 Cb 0.55 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 1s68 h LYS 15 CO -0.29 0.53 -0.08 0.35 -0.57 0.00 0.00 179.45 179.39 1s68 h PHE 16 N 0.31 0.41 -0.55 -1.35 3.57 -1.72 -1.38 116.94 116.23 1s68 h PHE 16 Ca 0.05 -0.10 -0.05 0.00 3.53 0.00 0.00 57.97 61.40 1s68 h PHE 16 Cb 0.53 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.15 1s68 h PHE 16 CO 0.01 0.66 0.12 0.82 -2.23 0.00 0.00 178.31 177.70 1s68 h ILE 17 N 0.04 1.23 -0.49 1.41 2.04 -1.18 -1.23 117.51 119.33 1s68 h ILE 17 Ca 0.04 -0.85 -0.07 0.00 1.00 0.00 0.00 64.86 64.98 1s68 h ILE 17 Cb 0.55 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 1s68 h ILE 17 CO 0.02 0.32 0.04 -0.33 0.00 0.00 0.00 178.15 178.20 1s68 h GLU 18 N 0.82 0.80 -0.57 2.37 5.08 -0.82 -1.93 114.58 120.33 1s68 h GLU 18 Ca 0.18 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1s68 h GLU 18 Cb 0.32 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 1s68 h GLU 18 CO 0.00 0.78 0.28 -0.22 -1.00 0.00 0.00 179.01 178.85 1s68 h LYS 19 N 0.75 0.82 -0.85 2.33 3.64 -0.41 -1.47 116.57 121.38 1s68 h LYS 19 Ca 0.15 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1s68 h LYS 19 Cb 0.40 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 1s68 h LYS 19 CO 0.01 0.66 0.51 -0.07 -2.27 0.00 0.00 179.45 178.30 1s68 h LEU 20 N 0.77 1.03 -0.25 5.20 3.38 -0.84 -1.89 115.31 122.72 1s68 h LEU 20 Ca 0.20 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1s68 h LEU 20 Cb 0.11 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1s68 h LEU 20 CO -0.03 0.79 0.15 1.88 0.09 0.00 0.00 178.44 181.32 1s68 h TYR 21 N 1.17 0.32 0.00 1.13 -1.99 -0.85 -0.29 116.97 116.46 1s68 h TYR 21 Ca 0.31 -0.00 -0.02 0.00 2.00 0.00 0.00 58.73 61.02 1s68 h TYR 21 Cb -0.04 -0.11 -0.00 0.00 2.00 0.00 0.00 36.73 38.58 1s68 h TYR 21 CO -0.00 0.25 -0.08 0.66 -0.00 0.00 0.00 178.16 178.99 1s68 h SER 22 N 0.31 0.00 0.09 3.88 4.64 -0.95 -2.03 113.55 119.48 1s68 h SER 22 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1s68 h SER 22 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1s68 h SER 22 CO -0.02 0.08 -0.31 0.18 -0.87 0.00 0.00 176.83 175.89 1s68 n LEU 23 N -3.39 1.63 -2.09 5.97 4.32 -0.74 -4.97 117.00 117.73 1s68 n LEU 23 Ca -0.01 -0.54 -0.14 0.00 -0.02 0.00 0.00 56.01 55.29 1s68 n LEU 23 Cb 0.24 -0.05 0.03 0.00 -1.62 0.00 0.00 43.42 42.02 1s68 n LEU 23 CO 0.28 0.30 0.06 0.61 -1.22 0.00 0.00 177.39 177.41 1s68 n GLY 24 N 1.36 -0.01 0.31 -0.72 0.00 -0.38 -4.93 105.19 100.81 1s68 n GLY 24 Ca 0.12 -0.19 0.11 0.00 0.00 0.00 0.00 46.02 46.06 1s68 n GLY 24 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1s68 n LEU 25 N -2.80 1.58 -0.33 0.99 4.32 -0.26 -4.21 117.00 116.29 1s68 n LEU 25 Ca -0.04 -0.61 0.14 0.00 -0.02 0.00 0.00 56.01 55.48 1s68 n LEU 25 Cb 0.56 -0.02 0.62 0.00 -1.62 0.00 0.00 43.42 42.96 1s68 n LEU 25 CO 0.33 0.31 0.91 1.07 -1.22 0.00 0.00 177.39 178.79 1s68 n THR 26 N -0.58 0.00 -1.76 -5.08 5.66 -1.26 -4.91 114.28 106.35 1s68 n THR 26 Ca 0.08 -0.17 -0.15 0.00 -3.05 0.00 0.00 64.05 60.76 1s68 n THR 26 Cb 0.41 0.22 0.10 0.00 -1.55 0.00 0.00 70.33 69.51 1s68 n THR 26 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1s68 n GLY 27 N 1.16 -0.77 3.21 1.09 0.00 -1.26 -4.22 105.19 104.39 1s68 n GLY 27 Ca 0.19 -1.78 0.04 0.00 0.00 0.00 0.00 46.02 44.48 1s68 n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s68 n GLY 28 N 0.40 -1.97 3.78 -0.02 0.00 -1.26 -4.81 105.19 101.31 1s68 n GLY 28 Ca 0.09 -1.36 -0.39 0.00 0.00 0.00 0.00 46.02 44.37 1s68 n GLY 28 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1s68 s GLU 29 N -0.82 4.28 0.38 1.61 2.12 -1.26 -4.52 118.70 120.49 1s68 s GLU 29 Ca 0.00 0.75 0.08 0.00 0.36 0.00 0.00 54.97 56.16 1s68 s GLU 29 Cb 0.00 -3.30 -0.06 0.00 0.26 0.00 0.00 34.13 31.03 1s68 s GLU 29 CO 0.00 0.47 0.08 -1.58 -0.54 0.00 0.00 175.26 173.69 1s68 s TRP 30 N -0.54 2.57 -0.02 5.30 0.52 0.19 -1.12 118.94 125.84 1s68 s TRP 30 Ca 0.30 -0.54 0.00 0.00 0.02 0.00 0.00 56.10 55.89 1s68 s TRP 30 Cb -0.19 -1.73 0.02 0.00 -1.15 0.00 0.00 33.47 30.42 1s68 s TRP 30 CO 0.18 0.35 0.00 0.54 0.02 0.00 0.00 176.95 178.05 1s68 s VAL 31 N -2.58 0.10 -0.11 4.03 0.11 0.13 -0.78 120.40 121.30 1s68 s VAL 31 Ca 0.37 0.06 0.01 0.00 -2.93 0.00 0.00 61.98 59.49 1s68 s VAL 31 Cb 0.03 -0.17 -0.02 0.00 -1.53 0.00 0.00 36.38 34.70 1s68 s VAL 31 CO 0.20 0.09 -0.12 0.00 -3.33 0.00 0.00 175.10 171.94 1s68 s ALA 32 N 0.65 2.69 0.01 1.54 0.00 -0.49 -1.83 121.76 124.33 1s68 s ALA 32 Ca -0.06 -0.91 0.02 0.00 0.00 0.00 0.00 51.96 51.01 1s68 s ALA 32 Cb -0.09 -1.18 -0.01 0.00 0.00 0.00 0.00 23.12 21.84 1s68 s ALA 32 CO -0.01 0.35 -0.06 1.03 0.00 0.00 0.00 175.76 177.07 1s68 s ARG 33 N -0.02 0.46 0.35 0.00 0.52 -0.67 0.18 118.95 119.76 1s68 s ARG 33 Ca -0.03 -0.41 -0.28 0.00 -0.52 0.00 0.00 55.73 54.50 1s68 s ARG 33 Cb -0.14 -0.35 -0.12 0.00 0.52 0.00 0.00 34.95 34.86 1s68 s ARG 33 CO 0.04 0.09 1.33 -1.91 0.02 0.00 0.00 175.30 174.86 1s68 n GLU 34 N 2.37 2.24 -3.12 3.54 2.13 -0.61 -0.73 120.64 126.45 1s68 n GLU 34 Ca -0.17 0.78 -0.43 0.00 0.66 0.00 0.00 57.16 58.01 1s68 n GLU 34 Cb 0.57 -2.40 -0.07 0.00 0.27 0.00 0.00 31.44 29.81 1s68 n GLU 34 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1s68 s LYS 35 N -1.91 3.25 0.01 5.31 2.20 0.60 -4.67 119.74 124.54 1s68 s LYS 35 Ca 0.55 -0.43 -0.23 0.00 -0.36 0.00 0.00 55.97 55.50 1s68 s LYS 35 Cb -0.55 -3.96 -0.05 0.00 -1.51 0.00 0.00 37.83 31.76 1s68 s LYS 35 CO 0.62 -1.02 0.70 0.42 -0.36 0.00 0.00 175.35 175.71 1s68 s ILE 36 N 2.77 4.85 -0.90 5.43 1.01 -1.26 -3.86 121.20 129.24 1s68 s ILE 36 Ca 0.21 1.46 -0.19 0.00 0.00 0.00 0.00 60.65 62.14 1s68 s ILE 36 Cb -0.15 -4.04 0.13 0.00 0.01 0.00 0.00 42.46 38.41 1s68 s ILE 36 CO 0.18 0.36 1.10 -2.28 0.00 0.00 0.00 174.94 174.30 1s68 s HIS 37 N 0.07 3.08 0.00 3.97 5.65 -1.26 -4.80 115.29 122.00 1s68 s HIS 37 Ca 0.36 -1.32 0.00 0.00 0.25 0.00 0.00 55.06 54.35 1s68 s HIS 37 Cb -0.19 -4.28 0.00 0.00 -1.18 0.00 0.00 32.58 26.93 1s68 s HIS 37 CO 0.20 -1.50 0.00 0.41 -0.65 0.00 0.00 174.74 173.20 1s68 n GLY 38 N 5.47 3.99 3.12 1.59 0.00 -1.26 -4.61 105.19 113.50 1s68 n GLY 38 Ca 0.21 -0.47 -0.12 0.00 0.00 0.00 0.00 46.02 45.64 1s68 n GLY 38 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1s68 s THR 39 N 2.79 0.05 0.22 2.61 -1.32 -0.24 -4.78 115.64 114.97 1s68 s THR 39 Ca 0.00 -0.39 -0.30 0.00 -1.21 0.00 0.00 61.69 59.79 1s68 s THR 39 Cb 0.00 -0.41 -0.10 0.00 -1.51 0.00 0.00 72.50 70.49 1s68 s THR 39 CO 0.00 -0.22 1.43 0.21 -2.21 0.00 0.00 174.62 173.84 1s68 s ASN 40 N -0.80 6.70 -0.04 8.08 3.84 -1.26 -0.93 114.94 130.53 1s68 s ASN 40 Ca -0.09 2.59 -0.11 0.00 0.21 0.00 0.00 52.86 55.46 1s68 s ASN 40 Cb -0.05 -2.61 0.02 0.00 -0.55 0.00 0.00 41.25 38.06 1s68 s ASN 40 CO 0.01 -0.68 0.26 0.12 -2.79 0.00 0.00 177.10 174.02 1s68 s PHE 41 N 0.25 -0.17 0.01 0.43 5.36 -0.76 -3.88 117.98 119.22 1s68 s PHE 41 Ca 0.61 0.34 -0.09 0.00 -0.96 0.00 0.00 56.93 56.83 1s68 s PHE 41 Cb -0.41 0.07 0.01 0.00 -0.34 0.00 0.00 43.02 42.34 1s68 s PHE 41 CO 0.40 -0.28 0.19 -1.54 -1.46 0.00 0.00 175.22 172.52 1s68 s SER 42 N -0.82 -0.00 -0.25 6.13 1.04 -0.41 -0.95 113.70 118.43 1s68 s SER 42 Ca -0.09 -0.23 -0.05 0.00 0.48 0.00 0.00 55.95 56.07 1s68 s SER 42 Cb -0.05 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.33 1s68 s SER 42 CO 0.02 -0.46 0.00 -0.76 0.98 0.00 0.00 173.24 173.02 1s68 s LEU 43 N -1.66 3.29 -0.69 2.42 1.43 0.10 -1.50 118.68 122.08 1s68 s LEU 43 Ca -0.11 -0.57 -0.19 0.00 -1.03 0.00 0.00 54.13 52.23 1s68 s LEU 43 Cb -0.05 -1.78 0.11 0.00 0.03 0.00 0.00 46.19 44.50 1s68 s LEU 43 CO -0.00 -0.10 0.84 -0.63 0.23 0.00 0.00 176.35 176.69 1s68 s ILE 44 N 1.46 4.76 -0.38 -0.59 1.01 0.56 -0.50 121.20 127.52 1s68 s ILE 44 Ca 0.04 -1.08 -0.20 0.00 0.00 0.00 0.00 60.65 59.41 1s68 s ILE 44 Cb -0.16 -4.58 0.01 0.00 0.01 0.00 0.00 42.46 37.74 1s68 s ILE 44 CO -0.01 -1.26 0.59 -0.63 0.00 0.00 0.00 174.94 173.62 1s68 s ILE 45 N 2.78 4.92 0.32 2.92 1.01 0.75 -1.14 121.20 132.77 1s68 s ILE 45 Ca 0.18 0.31 0.08 0.00 0.00 0.00 0.00 60.65 61.22 1s68 s ILE 45 Cb -0.18 -4.08 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 1s68 s ILE 45 CO 0.03 -0.37 0.13 -1.61 0.00 0.00 0.00 174.94 173.11 1s68 s GLU 46 N 2.61 2.43 0.23 2.79 2.02 0.81 -1.01 118.70 128.58 1s68 s GLU 46 Ca 0.21 -1.45 -0.06 0.00 0.02 0.00 0.00 54.97 53.69 1s68 s GLU 46 Cb -0.15 -2.23 0.32 0.00 0.10 0.00 0.00 34.13 32.17 1s68 s GLU 46 CO 0.16 0.19 1.83 -0.09 0.02 0.00 0.00 175.26 177.37 1s68 h ARG 47 N 1.59 0.83 0.00 1.61 1.12 -1.89 -3.06 114.38 114.58 1s68 h ARG 47 Ca -0.44 -0.05 0.00 0.00 -1.11 0.00 0.00 59.98 58.38 1s68 h ARG 47 Cb 1.25 -0.19 0.00 0.00 -0.01 0.00 0.00 29.97 31.02 1s68 h ARG 47 CO 0.62 0.55 -1.01 -0.40 -3.11 0.00 0.00 179.97 176.61 1s68 n ASP 48 N -4.69 0.77 -3.75 -3.80 5.75 -1.26 -4.92 116.55 104.65 1s68 n ASP 48 Ca 0.12 -0.67 -0.07 0.00 -0.01 0.00 0.00 54.79 54.16 1s68 n ASP 48 Cb 0.20 0.94 -0.01 0.00 -1.03 0.00 0.00 41.12 41.21 1s68 n ASP 48 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1s68 s LYS 49 N -3.08 1.79 -0.02 0.11 -2.85 -1.16 -5.16 119.74 109.37 1s68 s LYS 49 Ca 0.06 -1.01 0.02 0.00 -1.00 0.00 0.00 55.97 54.05 1s68 s LYS 49 Cb 0.16 0.59 0.00 0.00 -2.06 0.00 0.00 37.83 36.52 1s68 s LYS 49 CO 0.84 -0.82 -0.09 0.54 0.10 0.00 0.00 175.35 175.92 1s68 s VAL 50 N -3.68 0.73 -0.09 1.79 0.11 -1.26 -0.13 120.40 117.87 1s68 s VAL 50 Ca 0.12 -0.35 0.02 0.00 -2.93 0.00 0.00 61.98 58.84 1s68 s VAL 50 Cb -0.06 -0.65 0.01 0.00 -1.53 0.00 0.00 36.38 34.16 1s68 s VAL 50 CO 0.07 0.23 -0.15 -0.89 -3.33 0.00 0.00 175.10 171.03 1s68 s THR 51 N 0.10 1.41 0.11 5.04 2.01 -0.29 -4.97 115.64 119.06 1s68 s THR 51 Ca -0.01 -0.62 -0.21 0.00 0.31 0.00 0.00 61.69 61.15 1s68 s THR 51 Cb -0.07 -1.28 -0.07 0.00 0.01 0.00 0.00 72.50 71.09 1s68 s THR 51 CO 0.00 0.42 0.64 0.00 -0.69 0.00 0.00 174.62 174.99 1s68 s ALA 53 N -1.14 -0.31 0.45 0.00 0.00 -0.56 -0.34 121.76 119.86 1s68 s ALA 53 Ca 0.32 -0.20 0.06 0.00 0.00 0.00 0.00 51.96 52.14 1s68 s ALA 53 Cb -0.21 0.16 0.06 0.00 0.00 0.00 0.00 23.12 23.14 1s68 s ALA 53 CO 0.21 -0.25 0.52 0.36 0.00 0.00 0.00 175.76 176.61 1s68 n LYS 54 N 1.21 0.74 0.22 0.00 2.85 -0.32 -1.28 118.16 121.58 1s68 n LYS 54 Ca -0.22 -2.59 0.18 0.00 -1.05 0.00 0.00 58.31 54.63 1s68 n LYS 54 Cb 0.56 -0.01 0.85 0.00 -0.65 0.00 0.00 35.03 35.79 1s68 n LYS 54 CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 177.40 177.42 1s68 h ARG 55 N 0.00 0.00 -0.00 -1.58 0.11 -1.96 0.14 114.38 111.08 1s68 h ARG 55 Ca -0.24 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.84 1s68 h ARG 55 Cb 1.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.08 1s68 h ARG 55 CO 0.36 0.00 -0.32 0.25 0.10 0.00 0.00 179.97 180.36 1s68 n THR 56 N -3.66 0.00 0.00 0.08 -2.24 -1.26 -4.69 114.28 102.51 1s68 n THR 56 Ca 0.01 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1s68 n THR 56 Cb 0.33 0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.82 1s68 n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1s68 n GLY 57 N 1.39 0.81 3.57 3.38 0.00 0.03 -5.09 105.19 109.28 1s68 n GLY 57 Ca 0.10 -2.10 -0.48 0.00 0.00 0.00 0.00 46.02 43.54 1s68 n GLY 57 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1s68 n PRO 58 N -0.75 1.10 -2.89 1.61 -0.02 -1.26 -1.18 135.00 131.61 1s68 n PRO 58 Ca 0.00 0.39 -0.40 0.00 -2.02 0.00 0.00 63.50 61.47 1s68 n PRO 58 Cb 0.00 -1.82 -0.05 0.00 -0.02 0.00 0.00 33.50 31.61 1s68 n PRO 58 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1s68 s ILE 59 N -0.44 4.66 0.52 4.25 2.07 0.53 -4.81 121.20 127.98 1s68 s ILE 59 Ca 0.70 1.79 -0.19 0.00 -1.41 0.00 0.00 60.65 61.53 1s68 s ILE 59 Cb -0.83 -4.19 -0.07 0.00 0.13 0.00 0.00 42.46 37.50 1s68 s ILE 59 CO 0.54 0.34 1.05 -0.76 -1.91 0.00 0.00 174.94 174.20 1s68 s LEU 60 N 0.00 3.76 0.30 8.50 1.43 -1.26 -4.86 118.68 126.56 1s68 s LEU 60 Ca 0.42 1.92 0.06 0.00 -1.03 0.00 0.00 54.13 55.50 1s68 s LEU 60 Cb -0.21 -4.56 0.83 0.00 0.03 0.00 0.00 46.19 42.28 1s68 s LEU 60 CO 0.25 -0.90 1.65 -0.65 0.23 0.00 0.00 176.35 176.93 1s68 h PRO 61 N 1.27 0.25 -0.40 1.29 0.11 -2.00 -0.29 132.00 132.23 1s68 h PRO 61 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1s68 h PRO 61 Cb 1.22 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1s68 h PRO 61 CO 0.58 0.17 0.00 0.00 -0.21 0.00 0.00 178.00 178.54 1s68 n ALA 62 N -2.57 2.43 -2.27 -0.75 0.00 -1.26 -4.95 120.51 111.13 1s68 n ALA 62 Ca 0.25 -0.97 -0.41 0.00 0.00 0.00 0.00 53.44 52.31 1s68 n ALA 62 Cb 0.77 -0.90 -0.04 0.00 0.00 0.00 0.00 19.45 19.28 1s68 n ALA 62 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1s68 s GLU 63 N -1.49 4.66 -0.18 0.00 2.12 -0.12 -5.03 118.70 118.66 1s68 s GLU 63 Ca 0.39 1.50 -0.13 0.00 0.36 0.00 0.00 54.97 57.08 1s68 s GLU 63 Cb 0.22 -3.37 -0.05 0.00 0.26 0.00 0.00 34.13 31.20 1s68 s GLU 63 CO 0.31 0.16 0.27 0.34 -0.54 0.00 0.00 175.26 175.81 1s68 s ASP 64 N 0.09 6.38 -0.41 -1.70 3.68 -1.26 -4.84 116.67 118.61 1s68 s ASP 64 Ca 0.48 0.44 0.05 0.00 2.13 0.00 0.00 52.55 55.65 1s68 s ASP 64 Cb -0.24 -2.17 0.18 0.00 -1.45 0.00 0.00 42.92 39.24 1s68 s ASP 64 CO 0.30 0.09 0.37 0.33 0.13 0.00 0.00 175.17 176.39 1s68 n PHE 65 N 3.73 -0.97 -1.94 -5.34 7.35 -1.26 -4.94 117.46 114.09 1s68 n PHE 65 Ca -0.12 -3.27 -0.14 0.00 -0.76 0.00 0.00 57.45 53.16 1s68 n PHE 65 Cb 0.52 0.23 -0.03 0.00 0.35 0.00 0.00 39.48 40.55 1s68 n PHE 65 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 1s68 n PHE 66 N 2.67 -0.87 -2.84 -5.13 3.72 -1.26 -1.69 117.46 112.06 1s68 n PHE 66 Ca 0.29 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.55 1s68 n PHE 66 Cb 0.49 -2.82 0.03 0.00 -0.94 0.00 0.00 39.48 36.24 1s68 n PHE 66 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1s68 n GLY 67 N -0.56 -0.02 0.34 1.37 0.00 -1.26 -4.90 105.19 100.16 1s68 n GLY 67 Ca -0.15 -0.20 0.18 0.00 0.00 0.00 0.00 46.02 45.85 1s68 n GLY 67 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1s68 h TYR 68 N -1.06 0.00 0.00 1.61 -0.00 -1.75 -2.17 116.97 113.60 1s68 h TYR 68 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.40 1s68 h TYR 68 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.95 1s68 h TYR 68 CO 0.31 0.00 0.01 1.05 -0.00 0.00 0.00 178.16 179.53 1s68 h GLU 69 N 0.00 0.00 -0.24 0.10 9.09 -1.90 -0.15 114.58 121.48 1s68 h GLU 69 Ca 0.03 0.00 -0.06 0.00 0.05 0.00 0.00 59.36 59.38 1s68 h GLU 69 Cb 0.42 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.51 1s68 h GLU 69 CO -0.00 0.00 -0.11 0.97 0.05 0.00 0.00 179.01 179.92 1s68 h ILE 70 N 0.00 1.21 -0.12 -1.06 6.09 -1.78 0.20 117.51 122.05 1s68 h ILE 70 Ca 0.00 -0.89 -0.18 0.00 -1.37 0.00 0.00 64.86 62.41 1s68 h ILE 70 Cb 0.01 1.14 0.01 0.00 0.47 0.00 0.00 36.82 38.45 1s68 h ILE 70 CO 0.00 0.29 -0.65 0.40 -3.07 0.00 0.00 178.15 175.12 1s68 h ILE 71 N 0.37 1.33 -0.77 2.19 1.08 -1.25 0.26 117.51 120.70 1s68 h ILE 71 Ca 0.07 -1.91 0.04 0.00 -0.39 0.00 0.00 64.86 62.67 1s68 h ILE 71 Cb 0.42 2.12 -0.04 0.00 -3.07 0.00 0.00 36.82 36.25 1s68 h ILE 71 CO 0.02 0.59 0.51 0.25 -0.69 0.00 0.00 178.15 178.83 1s68 h LEU 72 N 0.31 0.80 0.01 1.44 5.85 -1.29 -1.03 115.31 121.39 1s68 h LEU 72 Ca -0.05 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 1s68 h LEU 72 Cb 1.29 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.13 1s68 h LEU 72 CO 0.13 0.55 -0.03 0.50 -0.34 0.00 0.00 178.44 179.25 1s68 h LYS 73 N 0.93 0.01 0.00 1.25 3.64 -0.87 -2.75 116.57 118.79 1s68 h LYS 73 Ca 0.31 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.65 1s68 h LYS 73 Cb 0.08 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1s68 h LYS 73 CO -0.09 0.98 -0.11 -0.91 -2.27 0.00 0.00 179.45 177.05 1s68 h ASN 74 N -0.94 0.00 -0.15 4.20 2.35 -0.85 -2.81 115.58 117.38 1s68 h ASN 74 Ca -0.01 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 1s68 h ASN 74 Cb 1.00 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.35 1s68 h ASN 74 CO 0.01 0.11 -0.06 -1.22 -1.65 0.00 0.00 177.43 174.62 1s68 n TYR 75 N -3.56 0.52 -0.21 1.19 4.02 -0.40 -4.73 117.16 113.99 1s68 n TYR 75 Ca -0.02 -1.09 0.01 0.00 -0.01 0.00 0.00 57.90 56.79 1s68 n TYR 75 Cb 0.24 -0.27 0.12 0.00 -0.02 0.00 0.00 39.34 39.41 1s68 n TYR 75 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1s68 h ALA 76 N 0.92 0.81 -0.05 -0.72 0.00 -1.21 -1.27 119.26 117.74 1s68 h ALA 76 Ca 0.03 0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 1s68 h ALA 76 Cb 1.27 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1s68 h ALA 76 CO 0.14 -0.22 -0.49 -0.44 0.00 0.00 0.00 179.25 178.25 1s68 h ASP 77 N 0.38 0.12 -0.39 0.00 3.32 -1.85 -1.87 116.42 116.15 1s68 h ASP 77 Ca 0.32 -0.06 -0.05 0.00 0.02 0.00 0.00 57.03 57.27 1s68 h ASP 77 Cb 0.43 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 1s68 h ASP 77 CO -0.34 0.60 0.06 0.28 -1.72 0.00 0.00 179.24 178.12 1s68 h SER 78 N 0.09 0.62 -0.05 6.45 0.02 -1.53 -0.78 113.55 118.38 1s68 h SER 78 Ca 0.00 -0.26 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 1s68 h SER 78 Cb 0.90 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.28 1s68 h SER 78 CO 0.07 0.73 0.03 0.40 -1.14 0.00 0.00 176.83 176.92 1s68 h ILE 79 N 0.49 1.01 -0.47 3.27 2.04 -1.08 -2.16 117.51 120.62 1s68 h ILE 79 Ca 0.12 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.93 1s68 h ILE 79 Cb 0.37 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 1s68 h ILE 79 CO 0.01 0.01 0.18 0.11 0.00 0.00 0.00 178.15 178.46 1s68 h LYS 80 N 0.07 0.67 -0.49 2.37 1.57 -1.20 -1.90 116.57 117.66 1s68 h LYS 80 Ca 0.02 -0.09 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 1s68 h LYS 80 Cb -0.01 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 1s68 h LYS 80 CO -0.00 0.56 -0.01 0.00 -0.57 0.00 0.00 179.45 179.43 1s68 h ALA 81 N 1.54 1.07 -0.16 3.86 0.00 -0.82 -1.55 119.26 123.21 1s68 h ALA 81 Ca 0.16 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1s68 h ALA 81 Cb 0.14 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1s68 h ALA 81 CO -0.02 0.58 0.02 0.28 0.00 0.00 0.00 179.25 180.12 1s68 h VAL 82 N 0.76 1.23 -0.90 0.00 2.07 -0.74 -3.00 116.25 115.67 1s68 h VAL 82 Ca 0.15 -0.73 0.10 0.00 0.82 0.00 0.00 66.70 67.03 1s68 h VAL 82 Cb 0.47 1.41 -0.07 0.00 -1.52 0.00 0.00 31.29 31.58 1s68 h VAL 82 CO 0.02 0.22 0.58 1.56 0.02 0.00 0.00 177.57 179.97 1s68 h GLN 83 N 0.04 0.86 -0.03 1.57 4.20 -1.05 -2.10 115.11 118.61 1s68 h GLN 83 Ca 0.05 -0.05 0.01 0.00 0.06 0.00 0.00 58.65 58.72 1s68 h GLN 83 Cb 0.32 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 27.90 1s68 h GLN 83 CO 0.00 0.57 0.04 -0.44 -0.67 0.00 0.00 178.83 178.33 1s68 h ASP 84 N 0.89 0.00 0.08 1.46 3.32 -1.14 -2.46 116.42 118.57 1s68 h ASP 84 Ca 0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.47 1s68 h ASP 84 Cb 0.41 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.96 1s68 h ASP 84 CO -0.18 0.00 -0.54 2.30 -1.72 0.00 0.00 179.24 179.10 1s68 n ILE 85 N -3.88 0.00 -0.04 0.35 -5.35 -0.79 -4.52 119.36 105.13 1s68 n ILE 85 Ca -0.02 -0.16 -0.12 0.00 -0.27 0.00 0.00 62.75 62.17 1s68 n ILE 85 Cb 0.12 0.96 -0.07 0.00 -1.74 0.00 0.00 39.64 38.91 1s68 n ILE 85 CO 0.00 0.00 0.00 0.24 -1.76 0.00 0.00 176.55 175.03 1s68 h MET 86 N 1.54 0.20 -0.52 6.28 2.86 -1.41 0.20 114.93 124.07 1s68 h MET 86 Ca 0.00 -0.08 0.15 0.00 -2.06 0.00 0.00 59.70 57.71 1s68 h MET 86 Cb 0.64 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.27 1s68 h MET 86 CO 0.00 0.51 0.43 0.93 1.06 0.00 0.00 176.91 179.84 1s68 h GLU 87 N -0.13 0.00 0.02 1.72 5.08 -1.80 -2.54 114.58 116.93 1s68 h GLU 87 Ca 0.03 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 58.01 1s68 h GLU 87 Cb 0.44 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.63 1s68 h GLU 87 CO 0.01 0.00 -2.31 2.41 -1.00 0.00 0.00 179.01 178.12 1s68 n THR 88 N -4.09 1.53 1.98 1.13 -1.04 -1.15 -4.37 114.28 108.27 1s68 n THR 88 Ca 0.10 -0.67 0.01 0.00 -2.04 0.00 0.00 64.05 61.45 1s68 n THR 88 Cb 0.65 -1.24 0.08 0.00 -1.82 0.00 0.00 70.33 68.00 1s68 n THR 88 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1s68 n SER 89 N -3.17 0.03 -2.00 8.00 3.41 0.68 -4.88 113.62 115.69 1s68 n SER 89 Ca -0.38 -1.92 -0.18 0.00 -0.26 0.00 0.00 58.87 56.13 1s68 n SER 89 Cb 1.04 -0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.95 1s68 n SER 89 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1s68 n ALA 90 N -0.52 -0.49 -2.81 7.33 0.00 -0.99 -4.97 120.51 118.06 1s68 n ALA 90 Ca 0.02 0.21 -0.35 0.00 0.00 0.00 0.00 53.44 53.32 1s68 n ALA 90 Cb 0.01 -1.87 -0.09 0.00 0.00 0.00 0.00 19.45 17.51 1s68 n ALA 90 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1s68 s VAL 91 N -2.71 4.84 -0.16 0.00 1.01 -1.21 -1.91 120.40 120.26 1s68 s VAL 91 Ca 0.00 -0.02 0.20 0.00 0.00 0.00 0.00 61.98 62.16 1s68 s VAL 91 Cb 0.00 -3.15 -0.11 0.00 0.00 0.00 0.00 36.38 33.12 1s68 s VAL 91 CO 0.00 0.50 0.83 1.33 0.00 0.00 0.00 175.10 177.77 1s68 n VAL 92 N 3.11 0.74 -3.59 2.92 0.24 0.72 -4.67 118.33 117.80 1s68 n VAL 92 Ca -0.17 -0.60 -0.13 0.00 -2.04 0.00 0.00 64.34 61.39 1s68 n VAL 92 Cb 0.53 -0.42 -0.06 0.00 -1.47 0.00 0.00 33.84 32.41 1s68 n VAL 92 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1s68 s SER 93 N -5.37 -0.56 -0.22 -1.34 1.04 -1.07 -4.20 113.70 101.98 1s68 s SER 93 Ca -0.03 0.86 0.01 0.00 0.48 0.00 0.00 55.95 57.27 1s68 s SER 93 Cb 0.10 0.79 0.05 0.00 0.10 0.00 0.00 66.02 67.06 1s68 s SER 93 CO 0.82 -0.35 -0.09 -0.31 0.98 0.00 0.00 173.24 174.29 1s68 s TYR 94 N -0.44 2.59 -0.47 5.02 1.51 -0.18 -1.51 117.35 123.87 1s68 s TYR 94 Ca -0.03 -1.80 -0.15 0.00 -1.01 0.00 0.00 57.07 54.09 1s68 s TYR 94 Cb -0.03 -1.68 0.08 0.00 -0.11 0.00 0.00 41.96 40.22 1s68 s TYR 94 CO 0.02 -0.78 0.38 -1.14 -1.11 0.00 0.00 175.55 172.91 1s68 s GLN 95 N 1.33 2.92 -0.39 -0.62 0.74 -0.04 -0.18 119.66 123.44 1s68 s GLN 95 Ca -0.04 -1.39 -0.23 0.00 0.05 0.00 0.00 55.36 53.76 1s68 s GLN 95 Cb -0.18 -4.09 0.01 0.00 1.10 0.00 0.00 33.01 29.86 1s68 s GLN 95 CO -0.07 -1.03 0.76 0.08 -0.55 0.00 0.00 175.29 174.48 1s68 s VAL 96 N 1.61 4.74 -0.10 1.34 1.01 0.35 -1.00 120.40 128.35 1s68 s VAL 96 Ca 0.04 0.71 -0.10 0.00 0.00 0.00 0.00 61.98 62.62 1s68 s VAL 96 Cb -0.24 -4.22 -0.05 0.00 0.00 0.00 0.00 36.38 31.87 1s68 s VAL 96 CO 0.06 -0.49 0.22 -0.36 0.00 0.00 0.00 175.10 174.53 1s68 s PHE 97 N 3.08 3.60 0.33 5.22 0.40 0.41 -0.72 117.98 130.31 1s68 s PHE 97 Ca 0.30 0.64 -0.16 0.00 -0.60 0.00 0.00 56.93 57.11 1s68 s PHE 97 Cb -0.13 -2.09 0.06 0.00 0.51 0.00 0.00 43.02 41.37 1s68 s PHE 97 CO 0.18 0.63 0.80 0.41 0.70 0.00 0.00 175.22 177.94 1s68 n GLY 98 N 2.21 0.94 3.57 4.36 0.00 -0.13 -1.21 105.19 114.93 1s68 n GLY 98 Ca -0.17 -1.22 -0.35 0.00 0.00 0.00 0.00 46.02 44.28 1s68 n GLY 98 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1s68 s GLU 99 N -2.08 3.86 -0.33 1.61 2.56 0.53 -1.83 118.70 123.02 1s68 s GLU 99 Ca 0.17 -0.40 -0.19 0.00 0.00 0.00 0.00 54.97 54.54 1s68 s GLU 99 Cb -0.04 -3.22 -0.01 0.00 2.00 0.00 0.00 34.13 32.86 1s68 s GLU 99 CO 0.10 0.14 0.58 0.12 -0.56 0.00 0.00 175.26 175.64 1s68 s PHE 100 N 0.73 3.19 0.07 5.30 5.36 -0.10 -0.96 117.98 131.56 1s68 s PHE 100 Ca 0.03 0.38 0.01 0.00 -0.96 0.00 0.00 56.93 56.38 1s68 s PHE 100 Cb -0.13 -2.99 -0.04 0.00 -0.34 0.00 0.00 43.02 39.52 1s68 s PHE 100 CO 0.02 -0.52 -0.05 0.00 -1.46 0.00 0.00 175.22 173.21 1s68 s ALA 101 N 2.54 0.72 0.00 11.12 0.00 -0.49 -1.08 121.76 134.57 1s68 s ALA 101 Ca 0.22 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 50.96 1s68 s ALA 101 Cb -0.15 0.20 0.00 0.00 0.00 0.00 0.00 23.12 23.17 1s68 s ALA 101 CO 0.13 -0.27 0.00 0.41 0.00 0.00 0.00 175.76 176.03 1s68 n GLY 102 N 0.19 0.06 3.73 0.00 0.00 -1.26 -0.68 105.19 107.23 1s68 n GLY 102 Ca -0.14 -1.74 -0.42 0.00 0.00 0.00 0.00 46.02 43.72 1s68 n GLY 102 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1s68 n PRO 103 N -0.85 2.53 0.00 1.61 -0.02 -1.25 -2.49 135.00 134.52 1s68 n PRO 103 Ca 0.00 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.38 1s68 n PRO 103 Cb 0.00 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 30.84 1s68 n PRO 103 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s68 n GLY 104 N 2.00 2.49 0.00 -1.23 0.00 -1.26 -4.88 105.19 102.30 1s68 n GLY 104 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1s68 n GLY 104 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1s68 n ILE 105 N -2.00 0.00 -2.53 -0.61 5.41 -1.04 -4.96 119.36 113.63 1s68 n ILE 105 Ca 0.00 0.18 0.00 0.00 1.00 0.00 0.00 62.75 63.93 1s68 n ILE 105 Cb 0.00 -0.60 0.00 0.00 -0.71 0.00 0.00 39.64 38.33 1s68 n ILE 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1s68 n GLN 106 N -1.12 1.41 -4.87 0.38 1.13 -1.26 -5.04 117.38 108.01 1s68 n GLN 106 Ca 0.00 0.00 -0.33 0.00 -1.94 0.00 0.00 57.00 54.73 1s68 n GLN 106 Cb 0.00 0.00 -0.14 0.00 0.11 0.00 0.00 30.24 30.21 1s68 n GLN 106 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 1s68 s LYS 107 N -0.82 2.86 -1.14 -1.09 2.20 -1.26 -4.78 119.74 115.70 1s68 s LYS 107 Ca 0.00 -0.70 -0.11 0.00 -0.36 0.00 0.00 55.97 54.80 1s68 s LYS 107 Cb 0.00 -2.47 -0.03 0.00 -1.51 0.00 0.00 37.83 33.82 1s68 s LYS 107 CO 0.00 0.45 0.82 0.09 -0.36 0.00 0.00 175.35 176.35 1s68 n ASN 108 N 2.83 -4.80 -4.52 1.43 3.02 -1.26 -5.03 115.26 106.92 1s68 n ASN 108 Ca -0.18 -0.86 -0.25 0.00 -0.03 0.00 0.00 54.58 53.27 1s68 n ASN 108 Cb 0.52 -4.21 -0.10 0.00 -0.61 0.00 0.00 39.78 35.38 1s68 n ASN 108 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1s68 s VAL 109 N -3.48 2.09 -0.50 2.41 -7.23 -1.26 -5.10 120.40 107.33 1s68 s VAL 109 Ca 0.36 -2.17 0.05 0.00 -1.81 0.00 0.00 61.98 58.40 1s68 s VAL 109 Cb -0.09 -2.63 0.19 0.00 0.56 0.00 0.00 36.38 34.40 1s68 s VAL 109 CO 0.81 -0.21 0.43 -0.67 -0.31 0.00 0.00 175.10 175.15 1s68 n ASP 110 N -0.76 0.76 -0.06 4.85 2.03 -1.26 -4.85 116.55 117.25 1s68 n ASP 110 Ca -0.05 -2.70 0.01 0.00 0.52 0.00 0.00 54.79 52.57 1s68 n ASP 110 Cb 0.64 -0.62 0.01 0.00 -0.72 0.00 0.00 41.12 40.43 1s68 n ASP 110 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1s68 n TYR 111 N 2.30 0.04 -4.63 -0.67 0.53 -1.26 -4.57 117.16 108.89 1s68 n TYR 111 Ca 0.26 -0.37 0.00 0.00 -1.02 0.00 0.00 57.90 56.78 1s68 n TYR 111 Cb 0.45 -0.03 0.00 0.00 -1.03 0.00 0.00 39.34 38.72 1s68 n TYR 111 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1s68 n ASP 113 N -1.85 0.44 -4.57 0.00 8.00 -1.26 -3.91 116.55 113.40 1s68 n ASP 113 Ca 0.00 0.84 -0.54 0.00 0.71 0.00 0.00 54.79 55.80 1s68 n ASP 113 Cb 0.00 -1.33 -0.06 0.00 -0.02 0.00 0.00 41.12 39.71 1s68 n ASP 113 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1s68 n LYS 114 N -0.54 0.90 -3.93 -1.24 5.02 -1.25 -4.71 118.16 112.41 1s68 n LYS 114 Ca 0.12 0.33 -0.10 0.00 -2.02 0.00 0.00 58.31 56.63 1s68 n LYS 114 Cb 0.46 -1.94 -0.01 0.00 -0.02 0.00 0.00 35.03 33.51 1s68 n LYS 114 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1s68 s ASP 115 N 0.43 0.25 -0.16 4.39 3.68 0.15 -4.98 116.67 120.43 1s68 s ASP 115 Ca 0.86 -1.17 0.00 0.00 2.13 0.00 0.00 52.55 54.38 1s68 s ASP 115 Cb -1.02 0.74 0.02 0.00 -1.45 0.00 0.00 42.92 41.21 1s68 s ASP 115 CO 0.49 -1.45 -0.15 0.12 0.13 0.00 0.00 175.17 174.31 1s68 s PHE 116 N -2.96 2.29 -0.34 -5.34 5.36 -1.26 -1.40 117.98 114.34 1s68 s PHE 116 Ca 0.21 -1.32 -0.05 0.00 -0.96 0.00 0.00 56.93 54.81 1s68 s PHE 116 Cb -0.03 -1.65 0.05 0.00 -0.34 0.00 0.00 43.02 41.05 1s68 s PHE 116 CO 0.13 -0.70 0.09 0.71 -1.46 0.00 0.00 175.22 173.99 1s68 s TYR 117 N 1.45 3.30 0.25 10.12 1.51 -0.13 -4.06 117.35 129.77 1s68 s TYR 117 Ca 0.04 -1.68 -0.30 0.00 -1.01 0.00 0.00 57.07 54.12 1s68 s TYR 117 Cb -0.13 -2.36 -0.09 0.00 -0.11 0.00 0.00 41.96 39.27 1s68 s TYR 117 CO -0.11 -0.79 1.28 0.08 -1.11 0.00 0.00 175.55 174.91 1s68 s VAL 118 N 1.33 3.11 0.00 0.71 1.01 -0.30 -0.35 120.40 125.90 1s68 s VAL 118 Ca -0.02 0.98 0.00 0.00 0.00 0.00 0.00 61.98 62.95 1s68 s VAL 118 Cb -0.20 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.55 1s68 s VAL 118 CO 0.01 0.18 0.00 2.22 0.00 0.00 0.00 175.10 177.51 1s68 n PHE 119 N 1.95 0.00 -3.48 5.22 1.16 -0.35 -1.16 117.46 120.80 1s68 n PHE 119 Ca 0.04 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.49 1s68 n PHE 119 Cb 0.43 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.26 1s68 n PHE 119 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1s68 s ASP 120 N -0.37 -0.54 -0.07 5.98 1.01 -1.10 -5.05 116.67 116.54 1s68 s ASP 120 Ca 0.00 0.25 -0.03 0.00 0.71 0.00 0.00 52.55 53.48 1s68 s ASP 120 Cb 0.00 0.52 0.04 0.00 1.01 0.00 0.00 42.92 44.49 1s68 s ASP 120 CO 0.00 -0.74 0.15 -0.63 0.21 0.00 0.00 175.17 174.16 1s68 s ILE 121 N -2.65 -0.11 -0.22 0.77 1.01 -1.26 -0.44 121.20 118.29 1s68 s ILE 121 Ca -0.02 0.23 -0.08 0.00 0.00 0.00 0.00 60.65 60.78 1s68 s ILE 121 Cb -0.01 -0.26 -0.04 0.00 0.01 0.00 0.00 42.46 42.16 1s68 s ILE 121 CO -0.04 0.10 0.08 -0.63 0.00 0.00 0.00 174.94 174.45 1s68 s ILE 122 N 1.51 4.71 -0.11 2.92 1.01 -0.17 -0.63 121.20 130.44 1s68 s ILE 122 Ca -0.06 -0.05 -0.03 0.00 0.00 0.00 0.00 60.65 60.52 1s68 s ILE 122 Cb -0.12 -3.17 -0.03 0.00 0.01 0.00 0.00 42.46 39.15 1s68 s ILE 122 CO -0.06 0.39 0.00 -0.69 0.00 0.00 0.00 174.94 174.58 1s68 s VAL 123 N 0.98 4.28 -0.14 2.92 1.01 0.17 -0.86 120.40 128.77 1s68 s VAL 123 Ca 0.05 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 61.80 1s68 s VAL 123 Cb -0.14 -2.83 0.01 0.00 0.00 0.00 0.00 36.38 33.43 1s68 s VAL 123 CO 0.03 0.57 -0.19 -0.89 0.00 0.00 0.00 175.10 174.62 1s68 s THR 124 N -0.49 1.85 0.53 3.92 2.01 -0.57 -1.65 115.64 121.25 1s68 s THR 124 Ca 0.09 -0.84 0.03 0.00 0.31 0.00 0.00 61.69 61.27 1s68 s THR 124 Cb -0.12 -1.67 0.04 0.00 0.01 0.00 0.00 72.50 70.76 1s68 s THR 124 CO 0.02 0.51 0.74 0.42 -0.69 0.00 0.00 174.62 175.62 1s68 s THR 125 N 1.01 2.69 0.50 -0.82 -4.23 -0.46 -0.20 115.64 114.13 1s68 s THR 125 Ca -0.04 -0.76 0.29 0.00 -1.18 0.00 0.00 61.69 60.01 1s68 s THR 125 Cb -0.15 -2.93 0.33 0.00 1.34 0.00 0.00 72.50 71.09 1s68 s THR 125 CO -0.05 0.00 2.17 -0.33 -0.54 0.00 0.00 174.62 175.87 1s68 h GLU 126 N 0.17 0.00 -0.00 3.99 5.08 -1.73 -0.96 114.58 121.14 1s68 h GLU 126 Ca -0.41 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 1s68 h GLU 126 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1s68 h GLU 126 CO 0.49 0.06 -0.12 -1.13 -1.00 0.00 0.00 179.01 177.31 1s68 n SER 127 N -3.72 0.39 0.00 1.42 3.41 -1.26 -4.92 113.62 108.94 1s68 n SER 127 Ca -0.02 -0.42 0.00 0.00 -0.26 0.00 0.00 58.87 58.16 1s68 n SER 127 Cb 0.16 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 1s68 n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1s68 n GLY 128 N 1.31 0.67 3.71 5.00 0.00 -0.36 -5.06 105.19 110.46 1s68 n GLY 128 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1s68 n GLY 128 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1s68 s ASP 129 N -2.74 7.01 -0.24 1.61 1.01 -1.26 -4.78 116.67 117.28 1s68 s ASP 129 Ca 0.00 2.08 0.02 0.00 0.71 0.00 0.00 52.55 55.36 1s68 s ASP 129 Cb 0.00 -2.58 0.05 0.00 1.01 0.00 0.00 42.92 41.40 1s68 s ASP 129 CO 0.00 -0.53 -0.13 -0.69 0.21 0.00 0.00 175.17 174.03 1s68 s VAL 130 N 1.23 2.08 0.05 -1.27 1.01 -1.26 -1.36 120.40 120.88 1s68 s VAL 130 Ca 0.60 -1.42 -0.00 0.00 0.00 0.00 0.00 61.98 61.16 1s68 s VAL 130 Cb -0.31 -2.12 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 1s68 s VAL 130 CO 0.29 0.11 -0.04 0.42 0.00 0.00 0.00 175.10 175.88 1s68 s THR 131 N 1.18 0.26 0.10 3.92 -4.23 -0.66 -4.97 115.64 111.23 1s68 s THR 131 Ca -0.05 -1.55 -0.22 0.00 -1.18 0.00 0.00 61.69 58.68 1s68 s THR 131 Cb -0.18 -1.16 -0.07 0.00 1.34 0.00 0.00 72.50 72.43 1s68 s THR 131 CO -0.07 -0.82 0.67 -0.31 -0.54 0.00 0.00 174.62 173.54 1s68 s TYR 132 N -3.12 3.83 0.45 3.99 1.51 -1.26 -0.66 117.35 122.09 1s68 s TYR 132 Ca 0.01 1.42 -0.23 0.00 -1.01 0.00 0.00 57.07 57.26 1s68 s TYR 132 Cb 0.02 -2.64 -0.08 0.00 -0.11 0.00 0.00 41.96 39.15 1s68 s TYR 132 CO -0.07 0.51 1.14 0.08 -1.11 0.00 0.00 175.55 176.10 1s68 s VAL 133 N -0.92 3.25 0.79 0.71 1.01 0.19 -4.79 120.40 120.64 1s68 s VAL 133 Ca 0.33 0.94 -0.11 0.00 0.00 0.00 0.00 61.98 63.14 1s68 s VAL 133 Cb -0.21 -3.48 0.06 0.00 0.00 0.00 0.00 36.38 32.76 1s68 s VAL 133 CO 0.22 -0.01 1.09 1.51 0.00 0.00 0.00 175.10 177.91 1s68 s ASP 134 N -1.41 4.54 0.45 3.32 -4.77 -1.26 -4.74 116.67 112.80 1s68 s ASP 134 Ca 0.62 1.42 0.11 0.00 -3.30 0.00 0.00 52.55 51.41 1s68 s ASP 134 Cb -0.27 -2.17 1.01 0.00 -1.09 0.00 0.00 42.92 40.40 1s68 s ASP 134 CO 0.33 -1.95 2.06 -0.78 0.70 0.00 0.00 175.17 175.53 1s68 h ASP 135 N -1.08 0.21 -0.18 2.11 1.82 -1.10 -0.97 116.42 117.25 1s68 h ASP 135 Ca -0.46 -0.01 -0.10 0.00 -0.39 0.00 0.00 57.03 56.06 1s68 h ASP 135 Cb 1.26 -0.05 -0.00 0.00 0.68 0.00 0.00 39.33 41.21 1s68 h ASP 135 CO 0.58 0.21 -0.27 1.88 -1.61 0.00 0.00 179.24 180.02 1s68 h TYR 136 N 0.24 0.61 -0.06 0.28 -1.99 -1.92 -2.41 116.97 111.73 1s68 h TYR 136 Ca 0.06 -0.21 -0.06 0.00 2.00 0.00 0.00 58.73 60.52 1s68 h TYR 136 Cb 0.07 -0.12 -0.01 0.00 2.00 0.00 0.00 36.73 38.67 1s68 h TYR 136 CO 0.00 0.91 -0.25 0.52 -0.00 0.00 0.00 178.16 179.34 1s68 h MET 137 N 0.14 0.10 -0.50 4.88 2.86 -1.84 -1.74 114.93 118.84 1s68 h MET 137 Ca 0.02 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.56 1s68 h MET 137 Cb 0.85 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.48 1s68 h MET 137 CO 0.06 0.35 0.05 1.98 1.06 0.00 0.00 176.91 180.41 1s68 h MET 138 N 0.09 0.85 -0.23 1.72 -1.53 -1.03 0.16 114.93 114.96 1s68 h MET 138 Ca 0.01 -0.25 -0.00 0.00 -3.44 0.00 0.00 59.70 56.02 1s68 h MET 138 Cb 0.50 -0.09 -0.01 0.00 -0.55 0.00 0.00 31.60 31.45 1s68 h MET 138 CO 0.04 0.86 0.13 1.49 0.14 0.00 0.00 176.91 179.57 1s68 h GLU 139 N 0.72 0.32 -0.64 0.39 4.81 -0.97 -0.02 114.58 119.20 1s68 h GLU 139 Ca 0.15 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.37 1s68 h GLU 139 Cb 0.45 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.72 1s68 h GLU 139 CO 0.02 0.29 0.39 1.03 -0.73 0.00 0.00 179.01 180.01 1s68 h SER 140 N 0.27 0.64 -0.25 1.04 0.87 -1.05 -0.07 113.55 114.99 1s68 h SER 140 Ca 0.08 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.64 1s68 h SER 140 Cb 0.06 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 1s68 h SER 140 CO -0.01 0.44 0.13 0.15 -0.53 0.00 0.00 176.83 177.01 1s68 h PHE 141 N 0.77 0.36 -0.09 2.24 3.57 -0.37 -0.70 116.94 122.73 1s68 h PHE 141 Ca 0.26 -0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.66 1s68 h PHE 141 Cb 0.04 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 1s68 h PHE 141 CO -0.05 0.33 -0.33 0.00 -2.23 0.00 0.00 178.31 176.04 1s68 h ASN 143 N 0.15 0.00 0.02 0.00 2.35 -0.77 0.61 115.58 117.93 1s68 h ASN 143 Ca 0.02 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.69 1s68 h ASN 143 Cb 0.65 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.02 1s68 h ASN 143 CO 0.05 0.41 -0.42 0.74 -1.65 0.00 0.00 177.43 176.56 1s68 h THR 144 N 0.00 1.54 -0.01 2.81 2.02 -0.87 -3.36 112.91 115.03 1s68 h THR 144 Ca -0.00 -2.33 0.00 0.00 0.77 0.00 0.00 66.41 64.85 1s68 h THR 144 Cb 1.28 3.08 0.00 0.00 -1.74 0.00 0.00 68.15 70.77 1s68 h THR 144 CO 0.05 0.56 -0.10 0.49 0.37 0.00 0.00 175.52 176.88 1s68 n PHE 145 N -4.50 0.00 -2.51 3.16 3.01 -0.29 -4.99 117.46 111.35 1s68 n PHE 145 Ca -0.16 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.21 1s68 n PHE 145 Cb 0.57 -0.04 0.04 0.00 -0.01 0.00 0.00 39.48 40.05 1s68 n PHE 145 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1s68 n LYS 146 N 0.06 -1.51 -4.36 -1.08 4.76 -0.19 -4.37 118.16 111.45 1s68 n LYS 146 Ca 0.16 0.48 -0.30 0.00 -2.87 0.00 0.00 58.31 55.78 1s68 n LYS 146 Cb 0.39 -3.97 -0.11 0.00 -1.84 0.00 0.00 35.03 29.50 1s68 n LYS 146 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1s68 s PHE 147 N -3.22 2.73 0.64 2.13 0.40 0.03 -4.92 117.98 115.77 1s68 s PHE 147 Ca 0.23 -0.15 -0.09 0.00 -0.60 0.00 0.00 56.93 56.31 1s68 s PHE 147 Cb -0.03 -1.48 -0.01 0.00 0.51 0.00 0.00 43.02 42.02 1s68 s PHE 147 CO 0.41 0.38 1.00 0.15 0.70 0.00 0.00 175.22 177.87 1s68 s LYS 148 N -1.88 3.12 0.14 0.44 1.02 -1.26 -4.62 119.74 116.69 1s68 s LYS 148 Ca 0.19 0.40 0.05 0.00 0.02 0.00 0.00 55.97 56.63 1s68 s LYS 148 Cb -0.11 -2.13 -0.04 0.00 -0.52 0.00 0.00 37.83 35.03 1s68 s LYS 148 CO 0.11 -0.76 -0.12 -1.64 -0.92 0.00 0.00 175.35 172.01 1s68 s MET 149 N -5.17 1.05 -0.05 1.68 -1.94 -1.26 -1.15 119.30 112.46 1s68 s MET 149 Ca 0.55 -1.34 -0.30 0.00 -1.71 0.00 0.00 55.69 52.90 1s68 s MET 149 Cb -0.11 -0.80 -0.06 0.00 2.01 0.00 0.00 34.83 35.87 1s68 s MET 149 CO 0.50 0.13 1.64 0.00 -0.01 0.00 0.00 175.02 177.29 1s68 s ALA 150 N -2.63 3.62 0.15 3.03 0.00 -0.31 -4.63 121.76 120.98 1s68 s ALA 150 Ca 0.12 0.93 -0.32 0.00 0.00 0.00 0.00 51.96 52.70 1s68 s ALA 150 Cb -0.02 -3.74 -0.18 0.00 0.00 0.00 0.00 23.12 19.19 1s68 s ALA 150 CO 0.02 -1.38 0.77 -2.30 0.00 0.00 0.00 175.76 172.88 1s68 n PRO 151 N 7.05 0.20 -2.69 0.00 -0.02 -1.26 -4.62 135.00 133.66 1s68 n PRO 151 Ca 0.17 0.07 -0.42 0.00 -2.02 0.00 0.00 63.50 61.30 1s68 n PRO 151 Cb 0.43 -1.29 -0.03 0.00 -0.02 0.00 0.00 33.50 32.60 1s68 n PRO 151 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1s68 s LEU 152 N 1.76 4.28 0.00 2.45 2.96 -1.26 -1.58 118.68 127.30 1s68 s LEU 152 Ca 0.72 1.57 0.18 0.00 -0.22 0.00 0.00 54.13 56.39 1s68 s LEU 152 Cb -1.00 -3.56 0.18 0.00 0.50 0.00 0.00 46.19 42.30 1s68 s LEU 152 CO 0.56 -0.39 1.11 0.18 -1.32 0.00 0.00 176.35 176.49 1s68 n LEU 153 N 4.67 2.62 0.00 -0.68 4.77 0.13 -1.13 117.00 127.38 1s68 n LEU 153 Ca 0.08 -1.10 0.00 0.00 -0.03 0.00 0.00 56.01 54.96 1s68 n LEU 153 Cb 0.49 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1s68 n LEU 153 CO 0.52 0.48 0.00 0.61 -1.33 0.00 0.00 177.39 177.67 1s68 n GLY 154 N 1.04 3.88 3.23 -0.72 0.00 -1.19 -4.71 105.19 106.72 1s68 n GLY 154 Ca 0.11 -1.65 -0.28 0.00 0.00 0.00 0.00 46.02 44.20 1s68 n GLY 154 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s68 s ARG 155 N -3.41 1.90 0.00 1.61 0.52 -1.26 -1.40 118.95 116.91 1s68 s ARG 155 Ca 0.00 -0.79 0.00 0.00 -0.52 0.00 0.00 55.73 54.42 1s68 s ARG 155 Cb 0.00 -1.77 0.00 0.00 0.52 0.00 0.00 34.95 33.70 1s68 s ARG 155 CO 0.00 0.43 0.00 0.41 0.02 0.00 0.00 175.30 176.16 1s68 n GLY 156 N 2.67 -0.58 3.79 -3.53 0.00 0.04 -4.94 105.19 102.64 1s68 n GLY 156 Ca -0.16 -0.69 -0.36 0.00 0.00 0.00 0.00 46.02 44.81 1s68 n GLY 156 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s68 s LYS 157 N -0.79 4.14 0.24 1.61 -0.14 -1.26 0.52 119.74 124.07 1s68 s LYS 157 Ca 0.00 1.42 -0.05 0.00 -1.36 0.00 0.00 55.97 55.98 1s68 s LYS 157 Cb 0.00 -2.44 0.46 0.00 -1.68 0.00 0.00 37.83 34.17 1s68 s LYS 157 CO 0.00 -0.14 1.70 0.35 -0.76 0.00 0.00 175.35 176.49 1s68 h PHE 158 N 2.32 0.33 -0.14 3.18 3.57 -1.79 -1.53 116.94 122.87 1s68 h PHE 158 Ca -0.48 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.05 1s68 h PHE 158 Cb 1.21 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.91 1s68 h PHE 158 CO 0.58 -0.05 0.03 1.05 -2.23 0.00 0.00 178.31 177.70 1s68 h GLU 159 N 0.31 0.19 0.05 1.11 4.11 -1.92 -0.61 114.58 117.80 1s68 h GLU 159 Ca 0.41 -0.02 -0.07 0.00 0.07 0.00 0.00 59.36 59.76 1s68 h GLU 159 Cb 0.69 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.91 1s68 h GLU 159 CO -0.48 0.18 -0.31 0.93 0.07 0.00 0.00 179.01 179.40 1s68 h GLU 160 N 0.19 0.10 -0.21 1.06 5.08 -1.69 -3.33 114.58 115.78 1s68 h GLU 160 Ca 0.05 -0.16 -0.08 0.00 -1.00 0.00 0.00 59.36 58.17 1s68 h GLU 160 Cb 0.08 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1s68 h GLU 160 CO -0.00 1.08 -0.21 -0.07 -1.00 0.00 0.00 179.01 178.81 1s68 h LEU 161 N -0.80 0.36 -1.83 1.33 3.38 -1.26 -2.43 115.31 114.07 1s68 h LEU 161 Ca -0.06 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 1s68 h LEU 161 Cb 1.22 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 1s68 h LEU 161 CO 0.04 0.58 -0.09 -0.29 0.09 0.00 0.00 178.44 178.77 1s68 h ILE 162 N 0.33 0.34 -0.00 1.22 6.09 -1.26 -2.55 117.51 121.68 1s68 h ILE 162 Ca 0.06 -0.55 0.00 0.00 -1.37 0.00 0.00 64.86 63.00 1s68 h ILE 162 Cb 0.56 1.41 0.00 0.00 0.47 0.00 0.00 36.82 39.25 1s68 h ILE 162 CO 0.04 0.09 -0.17 0.29 -3.07 0.00 0.00 178.15 175.33 1s68 n LYS 163 N -3.38 0.40 -1.49 2.19 5.02 -0.91 -4.89 118.16 115.09 1s68 n LYS 163 Ca -0.01 -0.14 -0.36 0.00 -2.02 0.00 0.00 58.31 55.78 1s68 n LYS 163 Cb 0.26 -1.50 0.08 0.00 -0.02 0.00 0.00 35.03 33.85 1s68 n LYS 163 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1s68 n LEU 164 N -1.18 4.36 -4.68 -0.35 4.77 -0.96 -4.87 117.00 114.09 1s68 n LEU 164 Ca 0.11 0.73 -0.42 0.00 -0.03 0.00 0.00 56.01 56.40 1s68 n LEU 164 Cb 0.31 -1.46 -0.03 0.00 -2.33 0.00 0.00 43.42 39.91 1s68 n LEU 164 CO 0.27 -1.68 1.23 -2.16 -1.33 0.00 0.00 177.39 173.72 1s68 s PRO 165 N -3.32 4.24 0.54 3.23 0.04 -1.26 -4.88 135.00 133.58 1s68 s PRO 165 Ca 0.77 2.12 0.35 0.00 0.04 0.00 0.00 61.00 64.28 1s68 s PRO 165 Cb -0.36 -3.64 1.60 0.00 0.04 0.00 0.00 34.50 32.14 1s68 s PRO 165 CO 0.47 -0.67 2.04 -0.91 0.04 0.00 0.00 177.00 177.97 1s68 h ASN 166 N 8.25 0.00 -0.69 6.66 4.21 -1.89 -2.64 115.58 129.48 1s68 h ASN 166 Ca -0.40 0.00 -0.42 0.00 1.21 0.00 0.00 56.30 56.69 1s68 h ASN 166 Cb 1.18 0.00 -0.25 0.00 -1.12 0.00 0.00 38.32 38.14 1s68 h ASN 166 CO 0.92 0.00 0.12 -0.90 -1.29 0.00 0.00 177.43 176.29 1s68 n ASP 167 N -2.95 4.33 -4.68 5.81 3.85 -1.26 -3.95 116.55 117.70 1s68 n ASP 167 Ca -0.00 -3.76 -0.35 0.00 -0.71 0.00 0.00 54.79 49.97 1s68 n ASP 167 Cb 0.22 -0.70 0.10 0.00 -1.35 0.00 0.00 41.12 39.40 1s68 n ASP 167 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1s68 n LEU 168 N -1.01 4.71 -4.77 -2.12 -0.00 -1.00 -4.46 117.00 108.36 1s68 n LEU 168 Ca 0.47 0.68 -0.40 0.00 -0.00 0.00 0.00 56.01 56.76 1s68 n LEU 168 Cb 1.05 -1.50 -0.02 0.00 -0.00 0.00 0.00 43.42 42.95 1s68 n LEU 168 CO 0.44 -1.56 0.90 -1.81 -0.00 0.00 0.00 177.39 175.36 1s68 s ASP 169 N -1.78 6.77 0.50 1.45 -0.00 -0.34 -1.38 116.67 121.89 1s68 s ASP 169 Ca 0.76 2.50 -0.23 0.00 -0.00 0.00 0.00 52.55 55.57 1s68 s ASP 169 Cb -0.33 -2.63 -0.07 0.00 -0.00 0.00 0.00 42.92 39.89 1s68 s ASP 169 CO 0.47 -0.51 1.39 -0.55 -0.00 0.00 0.00 175.17 175.97 1s68 s SER 170 N -0.78 5.58 0.00 0.27 0.15 0.38 -4.65 113.70 114.65 1s68 s SER 170 Ca 0.51 2.83 0.06 0.00 0.70 0.00 0.00 55.95 60.05 1s68 s SER 170 Cb -0.35 -2.64 0.10 0.00 -1.71 0.00 0.00 66.02 61.41 1s68 s SER 170 CO 0.46 -1.37 0.88 1.33 1.20 0.00 0.00 173.24 175.74 1s68 n VAL 171 N -0.61 0.42 -0.26 4.45 0.24 -1.26 -4.73 118.33 116.58 1s68 n VAL 171 Ca 0.08 -0.71 -0.05 0.00 -2.04 0.00 0.00 64.34 61.62 1s68 n VAL 171 Cb 0.43 0.86 0.06 0.00 -1.47 0.00 0.00 33.84 33.72 1s68 n VAL 171 CO 0.00 0.00 0.00 0.58 -2.14 0.00 0.00 176.83 175.27 1s68 h VAL 172 N 1.12 1.19 -0.27 3.34 2.07 -1.91 0.90 116.25 122.69 1s68 h VAL 172 Ca 0.00 -0.36 -0.13 0.00 0.82 0.00 0.00 66.70 67.04 1s68 h VAL 172 Cb 0.41 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1s68 h VAL 172 CO 0.00 0.19 -0.35 1.56 0.02 0.00 0.00 177.57 178.98 1s68 h GLN 173 N 0.99 0.60 -0.60 1.57 1.08 -1.85 0.30 115.11 117.22 1s68 h GLN 173 Ca 0.27 -0.29 -0.06 0.00 -1.45 0.00 0.00 58.65 57.12 1s68 h GLN 173 Cb -0.11 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.29 1s68 h GLN 173 CO -0.06 0.87 0.13 -0.44 -0.95 0.00 0.00 178.83 178.38 1s68 h ASP 174 N 0.51 0.92 -0.15 1.46 5.19 -1.78 -0.11 116.42 122.46 1s68 h ASP 174 Ca 0.05 -0.24 -0.01 0.00 -0.62 0.00 0.00 57.03 56.21 1s68 h ASP 174 Cb 0.85 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 40.11 1s68 h ASP 174 CO 0.07 0.93 0.07 0.22 -3.12 0.00 0.00 179.24 177.41 1s68 h TYR 175 N 0.88 0.22 -0.80 4.55 3.20 -0.43 -1.05 116.97 123.54 1s68 h TYR 175 Ca 0.19 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.04 1s68 h TYR 175 Cb 0.38 -0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.54 1s68 h TYR 175 CO 0.03 0.26 0.48 -0.91 -1.64 0.00 0.00 178.16 176.38 1s68 h ASN 176 N 0.12 0.95 -0.36 -2.11 2.35 -0.16 0.70 115.58 117.08 1s68 h ASN 176 Ca 0.05 -0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1s68 h ASN 176 Cb 0.12 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.24 1s68 h ASN 176 CO -0.01 0.73 0.21 0.15 -1.65 0.00 0.00 177.43 176.87 1s68 h PHE 177 N 1.09 0.47 -0.68 1.19 3.57 -0.82 -2.17 116.94 119.59 1s68 h PHE 177 Ca 0.29 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.75 1s68 h PHE 177 Cb -0.05 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.51 1s68 h PHE 177 CO -0.01 0.34 0.29 1.15 -2.23 0.00 0.00 178.31 177.85 1s68 h THR 178 N 0.46 1.23 -0.08 4.41 2.02 -0.72 -1.27 112.91 118.96 1s68 h THR 178 Ca 0.13 -0.70 0.03 0.00 0.77 0.00 0.00 66.41 66.63 1s68 h THR 178 Cb 0.01 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 66.79 1s68 h THR 178 CO -0.02 0.29 -0.08 0.58 0.37 0.00 0.00 175.52 176.65 1s68 h VAL 179 N 0.97 0.77 -0.32 3.16 2.07 -0.40 0.47 116.25 122.98 1s68 h VAL 179 Ca 0.23 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.65 1s68 h VAL 179 Cb 0.16 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1s68 h VAL 179 CO -0.02 0.00 -0.21 0.44 0.02 0.00 0.00 177.57 177.79 1s68 h ASP 180 N -0.10 0.60 0.03 0.57 3.32 -1.07 -1.74 116.42 118.03 1s68 h ASP 180 Ca 0.06 -0.20 -0.38 0.00 0.02 0.00 0.00 57.03 56.53 1s68 h ASP 180 Cb 0.19 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.52 1s68 h ASP 180 CO -0.14 0.81 -2.18 1.41 -1.72 0.00 0.00 179.24 177.42 1s68 n HIS 181 N -4.13 0.46 0.89 4.55 8.25 -0.51 -4.55 115.22 120.18 1s68 n HIS 181 Ca 0.00 0.14 0.11 0.00 -0.26 0.00 0.00 57.72 57.70 1s68 n HIS 181 Cb 0.40 -1.05 -0.02 0.00 1.12 0.00 0.00 29.99 30.43 1s68 n HIS 181 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1s68 n ALA 182 N -3.51 4.22 0.00 -1.41 0.00 0.16 -5.07 120.51 114.89 1s68 n ALA 182 Ca -0.43 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.49 1s68 n ALA 182 Cb 0.92 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 19.50 1s68 n ALA 182 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s68 n GLY 183 N 1.47 2.37 0.29 0.00 0.00 -0.65 -4.68 105.19 104.00 1s68 n GLY 183 Ca 0.04 -1.75 -0.07 0.00 0.00 0.00 0.00 46.02 44.25 1s68 n GLY 183 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1s68 h LEU 184 N 0.00 0.89 0.17 0.99 5.85 -1.82 -2.58 115.31 118.81 1s68 h LEU 184 Ca 0.00 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.59 1s68 h LEU 184 Cb 0.00 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.78 1s68 h LEU 184 CO 0.00 0.79 -0.24 0.58 -0.34 0.00 0.00 178.44 179.23 1s68 h VAL 185 N 0.93 0.48 0.00 1.05 2.07 -1.91 0.09 116.25 118.97 1s68 h VAL 185 Ca 0.23 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.64 1s68 h VAL 185 Cb 0.15 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 1s68 h VAL 185 CO -0.03 0.00 -0.53 0.44 0.02 0.00 0.00 177.57 177.47 1s68 h ASP 186 N -0.47 0.00 -0.63 0.57 3.32 -1.83 -2.46 116.42 114.92 1s68 h ASP 186 Ca 0.01 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 1s68 h ASP 186 Cb 0.46 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.99 1s68 h ASP 186 CO -0.10 0.53 0.24 0.00 -1.72 0.00 0.00 179.24 178.20 1s68 h ALA 187 N 1.47 0.82 0.00 3.45 0.00 -1.15 -0.90 119.26 122.95 1s68 h ALA 187 Ca -0.01 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 1s68 h ALA 187 Cb 1.03 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1s68 h ALA 187 CO 0.07 0.44 -0.21 -0.91 0.00 0.00 0.00 179.25 178.65 1s68 h ASN 188 N 0.88 0.00 0.52 0.00 2.35 -0.74 -2.82 115.58 115.77 1s68 h ASN 188 Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 1s68 h ASN 188 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 1s68 h ASN 188 CO -0.02 0.21 -0.61 0.29 -1.65 0.00 0.00 177.43 175.65 1s68 n LYS 189 N -3.65 0.08 -2.25 0.81 5.02 -0.82 -4.81 118.16 112.54 1s68 n LYS 189 Ca -0.01 0.01 -0.38 0.00 -2.02 0.00 0.00 58.31 55.91 1s68 n LYS 189 Cb 0.33 -1.54 -0.02 0.00 -0.02 0.00 0.00 35.03 33.79 1s68 n LYS 189 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1s68 s VAL 191 N -1.40 4.38 0.34 0.00 1.01 -1.26 -4.35 120.40 119.12 1s68 s VAL 191 Ca 0.58 -0.98 -0.21 0.00 0.00 0.00 0.00 61.98 61.36 1s68 s VAL 191 Cb -0.32 -3.48 -0.10 0.00 0.00 0.00 0.00 36.38 32.49 1s68 s VAL 191 CO 0.40 -0.26 0.86 0.26 0.00 0.00 0.00 175.10 176.36 1s68 s TRP 192 N 1.51 3.50 0.30 5.22 0.52 -0.28 -4.97 118.94 124.74 1s68 s TRP 192 Ca 0.01 1.54 -0.29 0.00 0.02 0.00 0.00 56.10 57.38 1s68 s TRP 192 Cb -0.20 -2.77 -0.10 0.00 -1.15 0.00 0.00 33.47 29.26 1s68 s TRP 192 CO 0.05 0.11 1.24 -0.80 0.02 0.00 0.00 176.95 177.57 1s68 s ASN 193 N -1.93 6.95 -0.49 2.95 0.01 -1.26 -4.58 114.94 116.58 1s68 s ASN 193 Ca 0.53 2.52 -0.03 0.00 -0.71 0.00 0.00 52.86 55.17 1s68 s ASN 193 Cb -0.14 -2.64 0.13 0.00 0.41 0.00 0.00 41.25 39.02 1s68 s ASN 193 CO 0.19 -0.40 0.29 0.00 -1.51 0.00 0.00 177.10 175.66 1s68 s ALA 194 N -1.00 3.32 -0.01 0.60 0.00 -1.26 -4.90 121.76 118.51 1s68 s ALA 194 Ca 0.48 -2.82 0.00 0.00 0.00 0.00 0.00 51.96 49.62 1s68 s ALA 194 Cb -0.37 -2.50 0.02 0.00 0.00 0.00 0.00 23.12 20.27 1s68 s ALA 194 CO 0.47 -1.92 0.02 -1.21 0.00 0.00 0.00 175.76 173.12 1s68 s GLU 195 N 0.66 -0.01 -1.41 0.00 2.02 -1.26 -4.51 118.70 114.19 1s68 s GLU 195 Ca 0.12 0.12 -0.10 0.00 0.02 0.00 0.00 54.97 55.12 1s68 s GLU 195 Cb -0.22 -0.17 0.07 0.00 0.10 0.00 0.00 34.13 33.91 1s68 s GLU 195 CO -0.04 -0.11 2.26 0.00 0.02 0.00 0.00 175.26 177.39 1s68 n ALA 196 N 3.79 6.02 0.15 5.21 0.00 -1.26 -1.20 120.51 133.22 1s68 n ALA 196 Ca -0.22 -4.00 0.03 0.00 0.00 0.00 0.00 53.44 49.25 1s68 n ALA 196 Cb 0.54 -3.21 0.15 0.00 0.00 0.00 0.00 19.45 16.93 1s68 n ALA 196 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1s68 h LYS 197 N 5.54 0.00 -0.29 0.00 1.57 -1.94 -3.47 116.57 117.97 1s68 h LYS 197 Ca 0.58 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 59.24 1s68 h LYS 197 Cb 0.53 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.79 1s68 h LYS 197 CO 1.73 0.50 -0.11 0.41 -0.57 0.00 0.00 179.45 181.41 1s68 n GLY 198 N 0.77 0.83 0.08 3.86 0.00 -1.26 -4.90 105.19 104.57 1s68 n GLY 198 Ca 0.01 -0.50 -0.10 0.00 0.00 0.00 0.00 46.02 45.42 1s68 n GLY 198 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1s68 h GLU 199 N 0.15 0.07 -4.69 1.61 5.08 -1.94 -3.47 114.58 111.39 1s68 h GLU 199 Ca -0.12 -0.12 -0.27 0.00 -1.00 0.00 0.00 59.36 57.84 1s68 h GLU 199 Cb 0.49 0.05 -0.15 0.00 0.50 0.00 0.00 28.75 29.64 1s68 h GLU 199 CO 0.18 0.96 -0.63 0.14 -1.00 0.00 0.00 179.01 178.66 1s68 s VAL 200 N -2.67 0.29 -0.16 3.13 -7.23 -1.26 -5.10 120.40 107.40 1s68 s VAL 200 Ca -0.02 -1.98 -0.22 0.00 -1.81 0.00 0.00 61.98 57.95 1s68 s VAL 200 Cb 0.09 -2.43 -0.10 0.00 0.56 0.00 0.00 36.38 34.51 1s68 s VAL 200 CO 0.83 -0.14 0.69 0.33 -0.31 0.00 0.00 175.10 176.51 1s68 n PHE 201 N -0.30 0.68 -2.45 2.82 7.35 -1.26 -4.51 117.46 119.79 1s68 n PHE 201 Ca -0.01 0.54 -0.41 0.00 -0.76 0.00 0.00 57.45 56.81 1s68 n PHE 201 Cb 0.65 -1.05 -0.04 0.00 0.35 0.00 0.00 39.48 39.40 1s68 n PHE 201 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1s68 s THR 202 N 0.99 3.82 0.64 -2.13 2.01 -1.26 -0.47 115.64 119.24 1s68 s THR 202 Ca 0.48 1.48 -0.14 0.00 0.31 0.00 0.00 61.69 63.82 1s68 s THR 202 Cb -0.69 -3.95 -0.01 0.00 0.01 0.00 0.00 72.50 67.86 1s68 s THR 202 CO 0.36 0.21 1.07 0.00 -0.69 0.00 0.00 174.62 175.57 1s68 s ALA 203 N 0.15 2.64 0.42 7.40 0.00 -0.48 -4.68 121.76 127.22 1s68 s ALA 203 Ca 0.53 0.36 0.31 0.00 0.00 0.00 0.00 51.96 53.16 1s68 s ALA 203 Cb -0.30 -3.24 1.62 0.00 0.00 0.00 0.00 23.12 21.19 1s68 s ALA 203 CO 0.34 -1.04 2.12 1.49 0.00 0.00 0.00 175.76 178.67 1s68 h GLU 204 N 0.05 0.00 0.00 0.00 4.81 -1.89 -3.44 114.58 114.10 1s68 h GLU 204 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1s68 h GLU 204 Cb 1.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1s68 h GLU 204 CO 0.56 0.08 0.00 0.41 -0.73 0.00 0.00 179.01 179.33 1s68 n GLY 205 N -0.70 0.71 3.29 1.92 0.00 -1.25 -3.38 105.19 105.78 1s68 n GLY 205 Ca -0.02 -1.59 -0.09 0.00 0.00 0.00 0.00 46.02 44.32 1s68 n GLY 205 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1s68 s TYR 206 N -3.88 0.23 -0.14 1.61 -0.85 -0.48 -0.29 117.35 113.55 1s68 s TYR 206 Ca 0.00 -0.61 -0.02 0.00 -0.52 0.00 0.00 57.07 55.92 1s68 s TYR 206 Cb 0.00 -0.01 -0.02 0.00 0.38 0.00 0.00 41.96 42.31 1s68 s TYR 206 CO 0.00 -0.66 -0.07 0.08 -1.52 0.00 0.00 175.55 173.38 1s68 s VAL 207 N -3.91 3.60 -0.16 -3.49 1.01 0.10 -0.16 120.40 117.38 1s68 s VAL 207 Ca 0.11 -0.47 -0.01 0.00 0.00 0.00 0.00 61.98 61.61 1s68 s VAL 207 Cb 0.04 -2.54 -0.00 0.00 0.00 0.00 0.00 36.38 33.87 1s68 s VAL 207 CO -0.05 0.52 -0.13 -0.22 0.00 0.00 0.00 175.10 175.21 1s68 s LEU 208 N 0.20 2.57 0.18 3.92 0.20 0.90 -1.67 118.68 124.97 1s68 s LEU 208 Ca -0.04 -0.45 -0.15 0.00 0.69 0.00 0.00 54.13 54.19 1s68 s LEU 208 Cb -0.14 -1.60 0.02 0.00 -0.43 0.00 0.00 46.19 44.04 1s68 s LEU 208 CO 0.04 0.07 0.44 -1.59 -0.29 0.00 0.00 176.35 175.02 1s68 s LYS 209 N 0.90 1.28 0.51 1.98 -2.85 -0.76 -0.22 119.74 120.58 1s68 s LYS 209 Ca -0.03 -0.94 -0.21 0.00 -1.00 0.00 0.00 55.97 53.79 1s68 s LYS 209 Cb -0.15 0.47 -0.06 0.00 -2.06 0.00 0.00 37.83 36.03 1s68 s LYS 209 CO -0.01 -0.52 1.17 -2.14 0.10 0.00 0.00 175.35 173.95 1s68 s PRO 210 N -3.89 3.49 0.31 1.78 0.02 -1.26 0.20 135.00 135.64 1s68 s PRO 210 Ca 0.11 1.75 0.04 0.00 0.02 0.00 0.00 61.00 62.92 1s68 s PRO 210 Cb 0.01 -2.20 0.51 0.00 0.02 0.00 0.00 34.50 32.84 1s68 s PRO 210 CO -0.03 -0.77 1.78 0.00 -0.33 0.00 0.00 177.00 177.65 1s68 s TYR 212 N -4.59 3.24 0.10 0.00 1.51 -1.26 -0.49 117.35 115.86 1s68 s TYR 212 Ca -0.06 -0.92 -0.35 0.00 -1.01 0.00 0.00 57.07 54.73 1s68 s TYR 212 Cb 0.14 -2.45 -0.18 0.00 -0.11 0.00 0.00 41.96 39.36 1s68 s TYR 212 CO 0.77 -0.63 0.93 -2.30 -1.11 0.00 0.00 175.55 173.21 1s68 n PRO 213 N 5.01 0.28 -3.95 -1.71 -0.02 -1.26 -5.00 135.00 128.35 1s68 n PRO 213 Ca -0.12 0.10 -0.09 0.00 -2.02 0.00 0.00 63.50 61.37 1s68 n PRO 213 Cb 0.46 -1.45 -0.10 0.00 -0.02 0.00 0.00 33.50 32.39 1s68 n PRO 213 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1s68 s SER 214 N -0.29 0.21 0.10 2.55 1.04 -1.26 -5.08 113.70 110.97 1s68 s SER 214 Ca 0.79 -0.55 0.03 0.00 0.48 0.00 0.00 55.95 56.69 1s68 s SER 214 Cb -1.07 0.20 -0.04 0.00 0.10 0.00 0.00 66.02 65.21 1s68 s SER 214 CO 0.55 -0.47 -0.08 0.26 0.98 0.00 0.00 173.24 174.49 1s68 s TRP 215 N -2.44 0.95 0.55 5.02 0.52 -1.26 -1.34 118.94 120.94 1s68 s TRP 215 Ca -0.06 -0.79 -0.10 0.00 0.02 0.00 0.00 56.10 55.16 1s68 s TRP 215 Cb -0.02 -0.53 -0.05 0.00 -1.15 0.00 0.00 33.47 31.72 1s68 s TRP 215 CO -0.04 -0.08 0.94 -0.51 0.02 0.00 0.00 176.95 177.28 1s68 s LEU 216 N -2.77 3.44 0.64 2.99 1.43 0.74 -4.88 118.68 120.27 1s68 s LEU 216 Ca 0.09 1.29 0.35 0.00 -1.03 0.00 0.00 54.13 54.83 1s68 s LEU 216 Cb 0.01 -4.29 1.95 0.00 0.03 0.00 0.00 46.19 43.90 1s68 s LEU 216 CO -0.02 -0.71 2.17 0.03 0.23 0.00 0.00 176.35 178.05 1s68 h ARG 217 N 0.14 0.00 -0.05 1.70 2.47 -2.01 -0.04 114.38 116.58 1s68 h ARG 217 Ca -0.45 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.27 1s68 h ARG 217 Cb 1.19 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.51 1s68 h ARG 217 CO 0.62 0.00 0.00 0.27 0.56 0.00 0.00 179.97 181.42 1s68 n ASN 218 N -3.33 1.53 0.00 7.04 2.04 -1.26 -4.93 115.26 116.35 1s68 n ASN 218 Ca -0.01 -1.55 0.00 0.00 -0.44 0.00 0.00 54.58 52.58 1s68 n ASN 218 Cb 0.22 -0.03 0.00 0.00 -2.53 0.00 0.00 39.78 37.45 1s68 n ASN 218 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1s68 n GLY 219 N 1.16 2.82 3.77 4.83 0.00 -0.03 -5.07 105.19 112.68 1s68 n GLY 219 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1s68 n GLY 219 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1s68 s ASN 220 N -1.25 6.40 0.27 1.61 0.01 -1.26 -4.71 114.94 116.01 1s68 s ASN 220 Ca 0.00 2.52 -0.24 0.00 -0.71 0.00 0.00 52.86 54.44 1s68 s ASN 220 Cb 0.00 -2.63 -0.09 0.00 0.41 0.00 0.00 41.25 38.94 1s68 s ASN 220 CO 0.00 -0.78 0.84 -0.60 -1.51 0.00 0.00 177.10 175.05 1s68 s ARG 221 N -2.25 4.46 -0.85 -0.60 3.52 -1.26 -0.18 118.95 121.79 1s68 s ARG 221 Ca 0.57 1.14 -0.24 0.00 -0.13 0.00 0.00 55.73 57.06 1s68 s ARG 221 Cb -0.35 -2.89 0.05 0.00 -1.56 0.00 0.00 34.95 30.20 1s68 s ARG 221 CO 0.45 0.36 1.29 0.08 -0.81 0.00 0.00 175.30 176.67 1s68 s VAL 222 N -1.52 3.94 -0.25 7.11 1.01 -0.45 -4.81 120.40 125.42 1s68 s VAL 222 Ca 0.46 -0.25 -0.25 0.00 0.00 0.00 0.00 61.98 61.93 1s68 s VAL 222 Cb -0.19 -4.93 0.08 0.00 0.00 0.00 0.00 36.38 31.34 1s68 s VAL 222 CO 0.23 -1.82 0.75 0.00 0.00 0.00 0.00 175.10 174.26 1s68 s ALA 223 N 5.05 -1.80 0.00 5.51 0.00 -1.26 -4.19 121.76 125.08 1s68 s ALA 223 Ca 0.37 1.96 0.04 0.00 0.00 0.00 0.00 51.96 54.34 1s68 s ALA 223 Cb -0.06 -1.11 -0.01 0.00 0.00 0.00 0.00 23.12 21.93 1s68 s ALA 223 CO 0.04 -0.33 -0.14 0.42 0.00 0.00 0.00 175.76 175.74 1s68 s ILE 224 N 0.24 1.10 -0.18 0.00 1.01 0.70 -2.28 121.20 121.79 1s68 s ILE 224 Ca -0.01 -0.71 -0.06 0.00 0.00 0.00 0.00 60.65 59.88 1s68 s ILE 224 Cb -0.05 -0.94 -0.03 0.00 0.01 0.00 0.00 42.46 41.45 1s68 s ILE 224 CO 0.01 0.22 0.03 -1.59 0.00 0.00 0.00 174.94 173.61 1s68 s LYS 225 N -0.56 3.82 -0.59 2.79 -2.85 0.65 -0.07 119.74 122.94 1s68 s LYS 225 Ca 0.04 -0.42 -0.05 0.00 -1.00 0.00 0.00 55.97 54.54 1s68 s LYS 225 Cb -0.06 -3.12 0.15 0.00 -2.06 0.00 0.00 37.83 32.74 1s68 s LYS 225 CO -0.00 0.20 0.42 0.00 0.10 0.00 0.00 175.35 176.07 1s68 s LYS 227 N 0.38 2.98 0.15 0.00 1.02 -1.26 -1.38 119.74 121.63 1s68 s LYS 227 Ca 0.14 -0.99 0.07 0.00 0.02 0.00 0.00 55.97 55.21 1s68 s LYS 227 Cb -0.20 -2.61 -0.04 0.00 -0.52 0.00 0.00 37.83 34.45 1s68 s LYS 227 CO -0.04 0.42 -0.04 0.54 -0.92 0.00 0.00 175.35 175.31 1s68 s ASN 228 N -3.74 4.63 0.27 2.83 4.22 -1.22 -4.91 114.94 117.02 1s68 s ASN 228 Ca 0.33 -0.40 0.07 0.00 -2.14 0.00 0.00 52.86 50.71 1s68 s ASN 228 Cb -0.08 -0.95 0.37 0.00 1.28 0.00 0.00 41.25 41.87 1s68 s ASN 228 CO 0.25 0.12 1.63 0.28 -2.04 0.00 0.00 177.10 177.34 1s68 h SER 229 N 2.99 0.19 -0.25 3.54 0.02 -1.94 -3.19 113.55 114.91 1s68 h SER 229 Ca -0.47 -0.10 0.07 0.00 -0.84 0.00 0.00 61.79 60.45 1s68 h SER 229 Cb 1.19 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.67 1s68 h SER 229 CO 0.56 0.69 0.18 0.50 -1.14 0.00 0.00 176.83 177.63 1s68 h LYS 230 N 0.14 0.00 0.00 3.45 3.64 -1.98 -2.42 116.57 119.39 1s68 h LYS 230 Ca 0.00 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1s68 h LYS 230 Cb 0.98 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.80 1s68 h LYS 230 CO 0.08 0.00 -0.20 0.35 -2.27 0.00 0.00 179.45 177.41 1s68 h PHE 231 N 0.00 0.00 0.00 1.91 3.57 -1.88 -3.32 116.94 117.23 1s68 h PHE 231 Ca 0.12 0.00 -0.17 0.00 3.53 0.00 0.00 57.97 61.45 1s68 h PHE 231 Cb 0.48 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.17 1s68 h PHE 231 CO 0.00 0.20 0.01 0.43 -2.23 0.00 0.00 178.31 176.71 1s68 n SER 232 N -3.61 4.16 0.00 0.41 7.64 -0.91 -5.08 113.62 116.23 1s68 n SER 232 Ca -0.01 -2.26 0.00 0.00 1.01 0.00 0.00 58.87 57.61 1s68 n SER 232 Cb 0.33 -1.10 0.00 0.00 -1.01 0.00 0.00 64.21 62.43 1s68 n SER 232 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41