#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c0h s ALA 16 N 0.00 3.57 0.03 0.00 0.00 -1.26 -4.96 121.76 119.14 2c0h s ALA 16 Ca 0.00 1.45 -0.30 0.00 0.00 0.00 0.00 51.96 53.10 2c0h s ALA 16 Cb 0.00 -3.57 -0.05 0.00 0.00 0.00 0.00 23.12 19.51 2c0h s ALA 16 CO 0.00 -0.88 1.14 0.08 0.00 0.00 0.00 175.76 176.09 2c0h s VAL 17 N -0.92 4.28 0.00 0.00 1.01 -1.26 -5.00 120.40 118.51 2c0h s VAL 17 Ca 0.53 1.63 0.00 0.00 0.00 0.00 0.00 61.98 64.14 2c0h s VAL 17 Cb -0.44 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 31.89 2c0h s VAL 17 CO 0.57 0.12 0.00 0.54 0.00 0.00 0.00 175.10 176.32 2c0h n ARG 18 N 4.03 0.00 -2.77 2.72 1.74 -1.26 -3.97 116.66 117.14 2c0h n ARG 18 Ca 0.08 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.75 2c0h n ARG 18 Cb 0.48 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.88 2c0h n ARG 18 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2c0h s LEU 19 N 0.00 4.40 0.21 0.55 2.96 -1.26 -1.73 118.68 123.82 2c0h s LEU 19 Ca 0.00 1.63 -0.08 0.00 -0.22 0.00 0.00 54.13 55.46 2c0h s LEU 19 Cb 0.00 -3.50 -0.02 0.00 0.50 0.00 0.00 46.19 43.17 2c0h s LEU 19 CO 0.00 -0.18 0.31 -0.94 -1.32 0.00 0.00 176.35 174.22 2c0h s SER 20 N 0.68 0.03 -0.08 3.68 1.04 -0.05 -4.89 113.70 114.10 2c0h s SER 20 Ca 0.48 -1.09 0.02 0.00 0.48 0.00 0.00 55.95 55.85 2c0h s SER 20 Cb -0.21 0.48 -0.02 0.00 0.10 0.00 0.00 66.02 66.36 2c0h s SER 20 CO 0.27 -0.98 -0.14 -0.69 0.98 0.00 0.00 173.24 172.69 2c0h s VAL 21 N -4.06 3.06 -0.27 5.02 1.01 -1.26 -0.60 120.40 123.30 2c0h s VAL 21 Ca 0.27 -0.70 -0.00 0.00 0.00 0.00 0.00 61.98 61.55 2c0h s VAL 21 Cb 0.03 -2.23 0.08 0.00 0.00 0.00 0.00 36.38 34.26 2c0h s VAL 21 CO 0.08 0.57 0.03 -0.55 0.00 0.00 0.00 175.10 175.23 2c0h s SER 22 N -0.32 3.83 1.88 3.32 0.15 -0.19 -4.96 113.70 117.41 2c0h s SER 22 Ca 0.03 -1.39 0.00 0.00 0.70 0.00 0.00 55.95 55.29 2c0h s SER 22 Cb -0.13 -1.00 0.00 0.00 -1.71 0.00 0.00 66.02 63.18 2c0h s SER 22 CO 0.02 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 174.74 2c0h n GLY 23 N 4.76 3.11 1.16 9.45 0.00 -1.26 -1.48 105.19 120.93 2c0h n GLY 23 Ca -0.06 0.18 0.08 0.00 0.00 0.00 0.00 46.02 46.22 2c0h n GLY 23 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2c0h n THR 24 N 0.00 1.80 -4.22 2.61 -2.24 -1.26 -3.86 114.28 107.11 2c0h n THR 24 Ca 0.00 -1.36 -0.30 0.00 -2.27 0.00 0.00 64.05 60.12 2c0h n THR 24 Cb 0.00 0.10 -0.09 0.00 -2.10 0.00 0.00 70.33 68.23 2c0h n THR 24 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2c0h s ASN 25 N -1.23 4.65 -0.10 3.42 0.01 -0.55 -3.99 114.94 117.16 2c0h s ASN 25 Ca 0.42 -0.28 -0.08 0.00 -0.71 0.00 0.00 52.86 52.20 2c0h s ASN 25 Cb 0.28 -1.00 -0.04 0.00 0.41 0.00 0.00 41.25 40.90 2c0h s ASN 25 CO 0.17 0.19 0.18 -0.76 -1.51 0.00 0.00 177.10 175.38 2c0h s LEU 26 N -2.15 4.40 0.14 0.60 1.43 -1.26 -1.02 118.68 120.81 2c0h s LEU 26 Ca 0.22 0.54 0.08 0.00 -1.03 0.00 0.00 54.13 53.95 2c0h s LEU 26 Cb -0.11 -2.16 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 2c0h s LEU 26 CO 0.15 0.38 -0.19 0.20 0.23 0.00 0.00 176.35 177.12 2c0h s ASN 27 N -0.97 2.55 -0.09 2.29 0.02 0.23 -1.49 114.94 117.48 2c0h s ASN 27 Ca 0.16 -0.78 0.01 0.00 -1.02 0.00 0.00 52.86 51.22 2c0h s ASN 27 Cb -0.13 -0.14 0.02 0.00 0.02 0.00 0.00 41.25 41.02 2c0h s ASN 27 CO 0.05 -0.01 -0.09 -0.47 0.02 0.00 0.00 177.10 176.61 2c0h s TYR 28 N -1.69 1.40 -1.31 2.20 5.04 0.35 -0.87 117.35 122.47 2c0h s TYR 28 Ca 0.11 -0.62 -0.11 0.00 -2.44 0.00 0.00 57.07 54.02 2c0h s TYR 28 Cb -0.07 -1.12 0.09 0.00 0.35 0.00 0.00 41.96 41.20 2c0h s TYR 28 CO 0.05 -0.40 0.51 -1.71 -1.34 0.00 0.00 175.55 172.67 2c0h n ASN 29 N 4.47 -3.48 0.00 4.32 5.15 -0.70 -1.51 115.26 123.50 2c0h n ASN 29 Ca -0.17 -0.47 0.00 0.00 -0.60 0.00 0.00 54.58 53.34 2c0h n ASN 29 Cb 0.51 -2.89 0.00 0.00 -0.53 0.00 0.00 39.78 36.87 2c0h n ASN 29 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2c0h n GLY 30 N -1.17 0.59 3.53 8.20 0.00 -1.26 -5.04 105.19 110.03 2c0h n GLY 30 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 2c0h n GLY 30 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2c0h s HIS 31 N -2.30 2.78 0.15 1.61 3.76 -0.57 -5.05 115.29 115.67 2c0h s HIS 31 Ca 0.00 -0.10 -0.31 0.00 -0.15 0.00 0.00 55.06 54.50 2c0h s HIS 31 Cb 0.00 -1.62 -0.11 0.00 1.11 0.00 0.00 32.58 31.97 2c0h s HIS 31 CO 0.00 0.28 1.76 -1.58 -0.85 0.00 0.00 174.74 174.35 2c0h s HIS 32 N -0.85 2.45 0.27 1.40 2.46 -1.26 -0.49 115.29 119.27 2c0h s HIS 32 Ca 0.14 0.16 0.05 0.00 0.47 0.00 0.00 55.06 55.87 2c0h s HIS 32 Cb -0.11 -4.13 -0.06 0.00 -0.13 0.00 0.00 32.58 28.16 2c0h s HIS 32 CO 0.03 -4.51 -0.01 0.96 -2.47 0.00 0.00 174.74 168.74 2c0h s ILE 33 N 2.17 1.28 -0.05 0.89 -5.25 -0.56 -0.80 121.20 118.89 2c0h s ILE 33 Ca 0.78 -2.06 0.02 0.00 -0.99 0.00 0.00 60.65 58.40 2c0h s ILE 33 Cb -0.46 -2.48 0.01 0.00 2.95 0.00 0.00 42.46 42.47 2c0h s ILE 33 CO 0.34 -0.24 -0.10 0.12 -1.79 0.00 0.00 174.94 173.27 2c0h s PHE 34 N -3.25 1.15 -0.31 1.37 5.36 -0.81 -4.46 117.98 117.03 2c0h s PHE 34 Ca 0.31 -0.36 -0.25 0.00 -0.96 0.00 0.00 56.93 55.67 2c0h s PHE 34 Cb 0.06 -0.86 0.00 0.00 -0.34 0.00 0.00 43.02 41.89 2c0h s PHE 34 CO 0.11 -0.19 0.86 -0.51 -1.46 0.00 0.00 175.22 174.03 2c0h s LEU 35 N 0.51 4.06 -0.10 6.12 1.43 -0.52 -4.57 118.68 125.62 2c0h s LEU 35 Ca -0.09 0.76 0.02 0.00 -1.03 0.00 0.00 54.13 53.79 2c0h s LEU 35 Cb -0.13 -3.19 0.01 0.00 0.03 0.00 0.00 46.19 42.91 2c0h s LEU 35 CO 0.02 -0.67 -0.16 -0.55 0.23 0.00 0.00 176.35 175.21 2c0h s SER 36 N 1.61 2.39 0.00 2.29 0.15 -1.26 -0.72 113.70 118.17 2c0h s SER 36 Ca 0.35 -0.42 0.00 0.00 0.70 0.00 0.00 55.95 56.58 2c0h s SER 36 Cb -0.14 -1.09 0.00 0.00 -1.71 0.00 0.00 66.02 63.09 2c0h s SER 36 CO 0.13 0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.23 2c0h n GLY 37 N 3.96 -0.86 3.26 9.45 0.00 -0.76 -0.64 105.19 119.60 2c0h n GLY 37 Ca -0.20 -0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.56 2c0h n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c0h s ALA 38 N -1.00 -0.63 0.13 4.61 0.00 -1.09 -2.01 121.76 121.77 2c0h s ALA 38 Ca 0.00 -0.16 -0.30 0.00 0.00 0.00 0.00 51.96 51.50 2c0h s ALA 38 Cb 0.00 0.45 -0.06 0.00 0.00 0.00 0.00 23.12 23.51 2c0h s ALA 38 CO 0.00 -0.49 1.00 -0.80 0.00 0.00 0.00 175.76 175.46 2c0h s ASN 39 N -2.45 7.44 0.05 0.00 0.01 -0.22 -1.87 114.94 117.90 2c0h s ASN 39 Ca -0.01 1.88 -0.26 0.00 -0.71 0.00 0.00 52.86 53.77 2c0h s ASN 39 Cb 0.01 -2.59 -0.17 0.00 0.41 0.00 0.00 41.25 38.91 2c0h s ASN 39 CO -0.07 -0.10 1.52 -0.61 -1.51 0.00 0.00 177.10 176.33 2c0h h GLN 40 N 5.39 -0.26 -0.00 -0.60 5.75 -1.14 -0.49 115.11 123.76 2c0h h GLN 40 Ca -0.43 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.08 2c0h h GLN 40 Cb 1.21 0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.82 2c0h h GLN 40 CO 0.72 -0.05 -0.19 0.00 -2.65 0.00 0.00 178.83 176.66 2c0h n ALA 41 N -2.30 2.91 -3.41 3.38 0.00 -1.26 -2.42 120.51 117.42 2c0h n ALA 41 Ca -0.09 -0.30 -0.08 0.00 0.00 0.00 0.00 53.44 52.96 2c0h n ALA 41 Cb 0.18 -1.26 -0.04 0.00 0.00 0.00 0.00 19.45 18.33 2c0h n ALA 41 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 2c0h s TRP 42 N -2.59 0.13 -0.00 0.00 -2.14 -1.26 -0.71 118.94 112.36 2c0h s TRP 42 Ca 0.24 -0.52 -0.04 0.00 2.66 0.00 0.00 56.10 58.44 2c0h s TRP 42 Cb 0.19 0.38 -0.01 0.00 -3.10 0.00 0.00 33.47 30.93 2c0h s TRP 42 CO 0.52 -1.06 -0.08 0.28 -2.66 0.00 0.00 176.95 173.95 2c0h n VAL 43 N -0.40 0.77 -3.63 -0.66 0.31 -1.26 -4.82 118.33 108.64 2c0h n VAL 43 Ca -0.03 0.26 -0.40 0.00 -0.01 0.00 0.00 64.34 64.16 2c0h n VAL 43 Cb 0.61 -1.59 -0.10 0.00 -0.91 0.00 0.00 33.84 31.85 2c0h n VAL 43 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2c0h s ASN 44 N -5.40 5.58 -0.30 4.52 2.47 -1.26 -5.05 114.94 115.51 2c0h s ASN 44 Ca -0.06 -1.46 -0.40 0.00 0.42 0.00 0.00 52.86 51.36 2c0h s ASN 44 Cb 0.01 -1.97 -0.15 0.00 -1.45 0.00 0.00 41.25 37.69 2c0h s ASN 44 CO 0.09 -0.50 1.83 0.00 -3.72 0.00 0.00 177.10 174.80 2c0h n TYR 45 N 4.89 1.97 -0.89 0.43 9.36 -1.26 -0.88 117.16 130.78 2c0h n TYR 45 Ca -0.10 0.50 0.00 0.00 3.32 0.00 0.00 57.90 61.62 2c0h n TYR 45 Cb 0.43 -2.47 0.00 0.00 -0.63 0.00 0.00 39.34 36.68 2c0h n TYR 45 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2c0h n ALA 46 N 6.11 0.00 -2.70 2.98 0.00 -1.26 -4.85 120.51 120.79 2c0h n ALA 46 Ca 0.30 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.67 2c0h n ALA 46 Cb 0.14 -0.59 0.04 0.00 0.00 0.00 0.00 19.45 19.04 2c0h n ALA 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2c0h n ARG 47 N -1.55 1.55 -0.03 0.00 1.74 -0.05 -4.02 116.66 114.30 2c0h n ARG 47 Ca 0.00 -3.43 0.05 0.00 -0.77 0.00 0.00 57.85 53.69 2c0h n ARG 47 Cb 0.12 -1.46 -0.14 0.00 -1.02 0.00 0.00 32.46 29.96 2c0h n ARG 47 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2c0h n ASP 48 N -0.31 0.84 -4.02 0.55 8.00 -1.20 -4.71 116.55 115.69 2c0h n ASP 48 Ca 0.11 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.46 2c0h n ASP 48 Cb 0.81 1.59 -0.13 0.00 -0.02 0.00 0.00 41.12 43.37 2c0h n ASP 48 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2c0h s PHE 49 N -3.04 0.61 0.00 1.24 0.08 -1.26 -2.53 117.98 113.08 2c0h s PHE 49 Ca -0.07 -0.32 0.00 0.00 0.12 0.00 0.00 56.93 56.66 2c0h s PHE 49 Cb 0.10 -0.38 0.00 0.00 -0.57 0.00 0.00 43.02 42.17 2c0h s PHE 49 CO 0.74 -0.05 0.00 0.41 -0.10 0.00 0.00 175.22 176.22 2c0h n GLY 50 N 2.10 -1.35 3.46 4.36 0.00 -1.26 -4.82 105.19 107.68 2c0h n GLY 50 Ca -0.18 -1.56 -0.25 0.00 0.00 0.00 0.00 46.02 44.02 2c0h n GLY 50 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2c0h n HIS 51 N -0.94 -2.03 -2.66 1.61 8.25 -1.26 -1.38 115.22 116.81 2c0h n HIS 51 Ca 0.00 0.63 -0.19 0.00 -0.26 0.00 0.00 57.72 57.90 2c0h n HIS 51 Cb 0.00 -3.72 0.00 0.00 1.12 0.00 0.00 29.99 27.40 2c0h n HIS 51 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2c0h n ASN 52 N -2.54 -5.10 0.11 0.41 3.02 -1.26 -4.88 115.26 105.02 2c0h n ASN 52 Ca -0.02 -0.05 0.05 0.00 -0.03 0.00 0.00 54.58 54.52 2c0h n ASN 52 Cb 0.56 -4.24 0.01 0.00 -0.61 0.00 0.00 39.78 35.50 2c0h n ASN 52 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 2c0h h GLN 53 N -0.42 0.00 -0.61 3.52 4.20 -1.49 -3.34 115.11 116.98 2c0h h GLN 53 Ca -0.43 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.23 2c0h h GLN 53 Cb 1.31 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.07 2c0h h GLN 53 CO 0.50 0.27 0.21 -0.92 -0.67 0.00 0.00 178.83 178.22 2c0h h TYR 54 N 0.00 0.96 -0.52 2.96 3.20 -1.73 -2.53 116.97 119.31 2c0h h TYR 54 Ca -0.05 -0.09 0.11 0.00 3.14 0.00 0.00 58.73 61.84 2c0h h TYR 54 Cb 1.32 -0.28 -0.03 0.00 1.54 0.00 0.00 36.73 39.28 2c0h h TYR 54 CO 0.00 0.78 0.36 0.66 -1.64 0.00 0.00 178.16 178.32 2c0h h SER 55 N 0.86 0.23 -0.06 -2.11 4.64 -1.88 0.21 113.55 115.42 2c0h h SER 55 Ca 0.20 0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 61.41 2c0h h SER 55 Cb 0.26 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2c0h h SER 55 CO -0.01 0.13 -0.34 0.11 -0.87 0.00 0.00 176.83 175.86 2c0h h LYS 56 N 0.25 0.55 -0.02 4.77 1.57 -1.63 -3.28 116.57 118.79 2c0h h LYS 56 Ca 0.24 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2c0h h LYS 56 Cb 0.63 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.93 2c0h h LYS 56 CO -0.05 0.81 -0.16 0.41 -0.57 0.00 0.00 179.45 179.89 2c0h n GLY 57 N -0.16 0.19 0.31 3.86 0.00 -0.39 -4.68 105.19 104.32 2c0h n GLY 57 Ca -0.01 -0.50 0.11 0.00 0.00 0.00 0.00 46.02 45.61 2c0h n GLY 57 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2c0h h LYS 58 N 2.77 0.40 -0.62 1.61 3.64 -0.71 -1.33 116.57 122.33 2c0h h LYS 58 Ca 0.00 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 2c0h h LYS 58 Cb 0.67 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.37 2c0h h LYS 58 CO 0.00 0.26 0.25 0.66 -2.27 0.00 0.00 179.45 178.36 2c0h h SER 59 N 0.41 0.82 -0.10 4.20 4.64 -1.83 -0.08 113.55 121.61 2c0h h SER 59 Ca 0.52 -0.11 -0.09 0.00 -0.47 0.00 0.00 61.79 61.64 2c0h h SER 59 Cb 0.93 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 2c0h h SER 59 CO -0.50 0.73 -0.30 0.74 -0.87 0.00 0.00 176.83 176.64 2c0h h THR 60 N 0.89 1.39 -0.68 2.95 2.02 -1.63 -1.12 112.91 116.73 2c0h h THR 60 Ca 0.21 -1.63 0.05 0.00 0.77 0.00 0.00 66.41 65.81 2c0h h THR 60 Cb 0.17 2.17 -0.05 0.00 -1.74 0.00 0.00 68.15 68.70 2c0h h THR 60 CO -0.02 0.47 0.40 -0.26 0.37 0.00 0.00 175.52 176.48 2c0h h PHE 61 N -0.07 0.74 -0.28 3.16 0.04 -1.18 -1.73 116.94 117.62 2c0h h PHE 61 Ca -0.01 0.02 -0.18 0.00 2.80 0.00 0.00 57.97 60.61 2c0h h PHE 61 Cb 0.91 -0.23 -0.00 0.00 2.20 0.00 0.00 35.95 38.83 2c0h h PHE 61 CO 0.11 0.38 -0.53 1.49 -0.60 0.00 0.00 178.31 179.16 2c0h h GLU 62 N 0.75 0.82 -0.27 1.51 4.57 -0.98 -2.18 114.58 118.81 2c0h h GLU 62 Ca 0.30 -0.51 -0.10 0.00 -1.18 0.00 0.00 59.36 57.87 2c0h h GLU 62 Cb 0.14 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 2c0h h GLU 62 CO -0.16 1.15 -0.24 0.66 -1.18 0.00 0.00 179.01 179.24 2c0h h SER 63 N 0.63 0.51 -0.41 1.04 4.64 -1.06 -1.42 113.55 117.48 2c0h h SER 63 Ca 0.02 -0.17 -0.03 0.00 -0.47 0.00 0.00 61.79 61.14 2c0h h SER 63 Cb 1.13 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 63.07 2c0h h SER 63 CO 0.12 0.74 0.14 0.74 -0.87 0.00 0.00 176.83 177.70 2c0h h THR 64 N 0.45 1.21 -0.73 2.95 2.02 -1.15 -1.34 112.91 116.32 2c0h h THR 64 Ca 0.07 -0.68 0.01 0.00 0.77 0.00 0.00 66.41 66.57 2c0h h THR 64 Cb 0.66 0.89 -0.04 0.00 -1.74 0.00 0.00 68.15 67.92 2c0h h THR 64 CO 0.05 0.24 0.49 -0.07 0.37 0.00 0.00 175.52 176.60 2c0h h LEU 65 N 0.51 0.84 -0.05 2.58 3.38 -1.14 -1.50 115.31 119.92 2c0h h LEU 65 Ca 0.13 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 2c0h h LEU 65 Cb 0.24 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2c0h h LEU 65 CO -0.01 0.60 0.03 -1.28 0.09 0.00 0.00 178.44 177.87 2c0h h SER 66 N 0.99 0.07 -0.42 -0.43 0.87 -1.05 -1.19 113.55 112.38 2c0h h SER 66 Ca 0.27 -0.12 0.07 0.00 -1.23 0.00 0.00 61.79 60.78 2c0h h SER 66 Cb -0.11 -0.02 -0.06 0.00 -0.44 0.00 0.00 62.40 61.77 2c0h h SER 66 CO -0.06 0.17 0.05 0.44 -0.53 0.00 0.00 176.83 176.90 2c0h h ASP 67 N -0.04 -0.06 -0.28 6.23 3.32 -1.14 -2.23 116.42 122.22 2c0h h ASP 67 Ca 0.02 0.08 -0.05 0.00 0.02 0.00 0.00 57.03 57.10 2c0h h ASP 67 Cb 0.12 0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 2c0h h ASP 67 CO -0.00 0.00 -0.03 0.24 -1.72 0.00 0.00 179.24 177.73 2c0h h MET 68 N 0.17 0.52 -0.58 3.56 2.86 -1.11 -2.48 114.93 117.87 2c0h h MET 68 Ca 0.21 -0.18 0.05 0.00 -2.06 0.00 0.00 59.70 57.72 2c0h h MET 68 Cb 0.28 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 31.85 2c0h h MET 68 CO -0.30 0.70 0.31 0.37 1.06 0.00 0.00 176.91 179.05 2c0h h GLN 69 N 0.29 0.57 0.00 1.72 4.15 -1.09 -1.04 115.11 119.71 2c0h h GLN 69 Ca 0.08 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.43 2c0h h GLN 69 Cb 0.48 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 28.04 2c0h h GLN 69 CO 0.02 0.38 -0.14 0.66 -1.93 0.00 0.00 178.83 177.82 2c0h h SER 70 N 0.59 0.00 -0.66 -0.69 4.64 -1.27 -2.77 113.55 113.38 2c0h h SER 70 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 2c0h h SER 70 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 2c0h h SER 70 CO -0.17 0.14 0.00 1.41 -0.87 0.00 0.00 176.83 177.34 2c0h n HIS 71 N -3.48 1.16 -0.84 4.77 8.25 -0.66 -4.98 115.22 119.43 2c0h n HIS 71 Ca -0.01 -0.56 0.00 0.00 -0.26 0.00 0.00 57.72 56.89 2c0h n HIS 71 Cb 0.30 -0.11 0.00 0.00 1.12 0.00 0.00 29.99 31.30 2c0h n HIS 71 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2c0h n GLY 72 N 1.28 0.56 3.81 -1.41 0.00 -0.65 -2.45 105.19 106.34 2c0h n GLY 72 Ca 0.24 -0.18 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 2c0h n GLY 72 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2c0h s GLY 73 N -2.17 2.39 0.00 -0.02 0.00 -0.49 -4.71 107.32 102.33 2c0h s GLY 73 Ca 0.00 0.47 0.00 0.00 0.00 0.00 0.00 44.72 45.19 2c0h s GLY 73 CO 0.00 0.77 0.44 1.16 0.00 0.00 0.00 173.10 175.47 2c0h n ASN 74 N -1.01 0.69 -3.56 1.64 0.23 0.18 -4.31 115.26 109.11 2c0h n ASN 74 Ca 0.08 -1.19 -0.17 0.00 -0.53 0.00 0.00 54.58 52.78 2c0h n ASN 74 Cb 0.53 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.17 2c0h n ASN 74 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 2c0h s SER 75 N -0.19 -0.57 -0.02 0.53 1.04 -1.15 -0.85 113.70 112.50 2c0h s SER 75 Ca 0.00 0.60 0.02 0.00 0.48 0.00 0.00 55.95 57.04 2c0h s SER 75 Cb 0.00 0.50 0.01 0.00 0.10 0.00 0.00 66.02 66.62 2c0h s SER 75 CO 0.00 -0.58 -0.06 -0.69 0.98 0.00 0.00 173.24 172.88 2c0h s VAL 76 N -1.24 0.59 -0.21 5.02 1.01 -0.36 -2.69 120.40 122.52 2c0h s VAL 76 Ca -0.11 -0.25 -0.10 0.00 0.00 0.00 0.00 61.98 61.52 2c0h s VAL 76 Cb -0.01 -0.54 -0.05 0.00 0.00 0.00 0.00 36.38 35.78 2c0h s VAL 76 CO 0.09 0.20 0.13 -0.60 0.00 0.00 0.00 175.10 174.91 2c0h s ARG 77 N 0.27 4.12 -0.01 2.72 3.52 -0.78 -0.86 118.95 127.94 2c0h s ARG 77 Ca -0.04 -0.25 0.03 0.00 -0.13 0.00 0.00 55.73 55.34 2c0h s ARG 77 Cb -0.08 -3.43 -0.01 0.00 -1.56 0.00 0.00 34.95 29.87 2c0h s ARG 77 CO 0.00 0.21 -0.11 0.54 -0.81 0.00 0.00 175.30 175.13 2c0h s VAL 78 N 0.60 0.87 -0.02 7.11 0.11 -0.25 -0.51 120.40 128.31 2c0h s VAL 78 Ca 0.07 -0.50 -0.16 0.00 -2.93 0.00 0.00 61.98 58.46 2c0h s VAL 78 Cb -0.12 -0.73 -0.05 0.00 -1.53 0.00 0.00 36.38 33.94 2c0h s VAL 78 CO 0.00 0.23 0.45 0.26 -3.33 0.00 0.00 175.10 172.71 2c0h s TRP 79 N -0.29 3.68 0.00 1.54 0.52 0.12 -0.35 118.94 124.15 2c0h s TRP 79 Ca 0.04 1.00 0.00 0.00 0.02 0.00 0.00 56.10 57.16 2c0h s TRP 79 Cb -0.04 -2.39 0.00 0.00 -1.15 0.00 0.00 33.47 29.88 2c0h s TRP 79 CO -0.00 0.49 0.00 -0.11 0.02 0.00 0.00 176.95 177.35 2c0h n LEU 80 N 2.36 0.00 0.07 2.99 7.94 0.35 -4.81 117.00 125.90 2c0h n LEU 80 Ca -0.11 0.00 -0.21 0.00 -1.11 0.00 0.00 56.01 54.57 2c0h n LEU 80 Cb 0.52 0.00 -0.12 0.00 0.53 0.00 0.00 43.42 44.34 2c0h n LEU 80 CO 0.40 0.00 -0.01 0.45 -1.11 0.00 0.00 177.39 177.12 2c0h h HIS 81 N 0.00 0.97 0.00 1.96 3.86 -1.44 -3.43 115.15 117.07 2c0h h HIS 81 Ca 0.00 -0.59 0.00 0.00 -1.16 0.00 0.00 60.37 58.62 2c0h h HIS 81 Cb 0.00 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 28.38 2c0h h HIS 81 CO 0.00 1.43 0.00 -0.89 0.86 0.00 0.00 177.93 179.33 2c0h n ILE 82 N -3.86 0.00 -1.39 2.45 5.41 -0.50 -1.78 119.36 119.69 2c0h n ILE 82 Ca -0.13 0.00 0.06 0.00 1.00 0.00 0.00 62.75 63.68 2c0h n ILE 82 Cb 0.93 0.00 0.08 0.00 -0.71 0.00 0.00 39.64 39.94 2c0h n ILE 82 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2c0h n GLU 83 N 0.00 0.82 -1.62 0.38 1.02 -1.26 -1.24 120.64 118.73 2c0h n GLU 83 Ca 0.00 -1.91 0.00 0.00 -0.02 0.00 0.00 57.16 55.23 2c0h n GLU 83 Cb 0.00 -1.09 0.00 0.00 -0.02 0.00 0.00 31.44 30.33 2c0h n GLU 83 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2c0h n GLY 84 N -0.84 0.38 0.22 0.62 0.00 -0.73 -4.14 105.19 100.70 2c0h n GLY 84 Ca 0.09 -0.96 -0.04 0.00 0.00 0.00 0.00 46.02 45.11 2c0h n GLY 84 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2c0h h GLU 85 N 0.00 0.57 0.00 1.61 3.07 -1.86 -3.39 114.58 114.59 2c0h h GLU 85 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 2c0h h GLU 85 Cb 0.63 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 2c0h h GLU 85 CO 0.00 0.38 -0.70 -1.13 -1.40 0.00 0.00 179.01 176.15 2c0h n SER 86 N -4.83 3.51 -3.93 1.42 3.41 -1.26 -5.08 113.62 106.86 2c0h n SER 86 Ca 0.06 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.57 2c0h n SER 86 Cb 0.13 0.48 -0.10 0.00 -0.26 0.00 0.00 64.21 64.46 2c0h n SER 86 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2c0h s THR 87 N -1.59 0.10 0.00 6.66 -4.23 -1.26 -4.75 115.64 110.57 2c0h s THR 87 Ca 0.00 -0.83 0.00 0.00 -1.18 0.00 0.00 61.69 59.68 2c0h s THR 87 Cb 0.00 -0.38 0.00 0.00 1.34 0.00 0.00 72.50 73.46 2c0h s THR 87 CO 0.00 -0.46 0.00 -0.81 -0.54 0.00 0.00 174.62 172.81 2c0h n PRO 88 N 1.48 -0.22 -3.16 3.99 -0.04 -1.26 -4.15 135.00 131.64 2c0h n PRO 88 Ca -0.23 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 62.84 2c0h n PRO 88 Cb 0.55 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.96 2c0h n PRO 88 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2c0h s GLU 89 N -2.37 4.33 0.01 0.54 0.41 -0.57 -4.95 118.70 116.10 2c0h s GLU 89 Ca 0.00 0.65 0.03 0.00 -0.41 0.00 0.00 54.97 55.24 2c0h s GLU 89 Cb 0.00 -3.48 -0.03 0.00 -1.78 0.00 0.00 34.13 28.83 2c0h s GLU 89 CO 0.00 0.00 -0.06 -0.06 -0.49 0.00 0.00 175.26 174.65 2c0h s PHE 90 N 1.09 2.91 0.87 1.61 0.08 -1.26 -1.01 117.98 122.27 2c0h s PHE 90 Ca 0.31 -0.03 -0.11 0.00 0.12 0.00 0.00 56.93 57.22 2c0h s PHE 90 Cb -0.16 -1.61 0.17 0.00 -0.57 0.00 0.00 43.02 40.85 2c0h s PHE 90 CO 0.13 0.39 1.20 0.16 -0.10 0.00 0.00 175.22 177.00 2c0h s ASP 91 N -1.49 3.61 0.61 1.36 1.47 0.84 -4.88 116.67 118.19 2c0h s ASP 91 Ca 0.18 0.07 0.40 0.00 1.18 0.00 0.00 52.55 54.38 2c0h s ASP 91 Cb -0.11 -0.25 2.00 0.00 -0.34 0.00 0.00 42.92 44.22 2c0h s ASP 91 CO 0.08 -2.39 2.21 0.78 0.68 0.00 0.00 175.17 176.53 2c0h h ASN 92 N -1.23 0.00 -0.14 2.11 2.35 -2.01 -2.38 115.58 114.28 2c0h h ASN 92 Ca -0.42 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.33 2c0h h ASN 92 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.62 2c0h h ASN 92 CO 0.40 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 176.77 2c0h n ASN 93 N -3.05 2.88 0.00 5.81 3.02 -1.26 -4.96 115.26 117.70 2c0h n ASN 93 Ca -0.02 -1.92 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 2c0h n ASN 93 Cb 0.16 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.25 2c0h n ASN 93 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2c0h n GLY 94 N 1.36 0.77 3.83 7.41 0.00 -0.90 -5.08 105.19 112.59 2c0h n GLY 94 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 2c0h n GLY 94 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2c0h s TYR 95 N -2.26 3.38 -0.14 1.61 2.02 -1.26 -4.80 117.35 115.89 2c0h s TYR 95 Ca 0.00 1.50 -0.17 0.00 -0.37 0.00 0.00 57.07 58.02 2c0h s TYR 95 Cb 0.00 -2.78 -0.04 0.00 -0.40 0.00 0.00 41.96 38.74 2c0h s TYR 95 CO 0.00 -0.19 0.45 0.08 -1.57 0.00 0.00 175.55 174.32 2c0h s VAL 96 N -2.34 5.19 -0.05 0.71 1.01 -1.26 -0.11 120.40 123.55 2c0h s VAL 96 Ca 0.60 0.87 0.21 0.00 0.00 0.00 0.00 61.98 63.66 2c0h s VAL 96 Cb -0.09 -3.79 -0.32 0.00 0.00 0.00 0.00 36.38 32.18 2c0h s VAL 96 CO 0.21 0.30 0.41 0.35 0.00 0.00 0.00 175.10 176.37 2c0h n THR 97 N 3.86 0.19 -3.78 3.92 -2.24 -0.18 -4.60 114.28 111.45 2c0h n THR 97 Ca -0.07 -0.53 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 2c0h n THR 97 Cb 0.51 -0.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.69 2c0h n THR 97 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c0h n GLY 98 N 1.37 -0.70 3.19 3.38 0.00 -1.25 -4.95 105.19 106.24 2c0h n GLY 98 Ca -0.08 -1.03 -0.17 0.00 0.00 0.00 0.00 46.02 44.74 2c0h n GLY 98 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2c0h s ILE 99 N -3.00 1.12 0.68 -0.61 -4.36 -1.26 -1.51 121.20 112.25 2c0h s ILE 99 Ca 0.00 -1.51 -0.13 0.00 -0.26 0.00 0.00 60.65 58.75 2c0h s ILE 99 Cb 0.00 -1.27 0.00 0.00 1.25 0.00 0.00 42.46 42.44 2c0h s ILE 99 CO 0.00 -0.38 1.07 1.51 0.24 0.00 0.00 174.94 177.38 2c0h s ASP 100 N -2.14 5.32 0.00 4.36 -4.77 -1.26 -4.92 116.67 113.27 2c0h s ASP 100 Ca 0.03 1.75 0.24 0.00 -3.30 0.00 0.00 52.55 51.26 2c0h s ASP 100 Cb -0.07 -2.52 1.33 0.00 -1.09 0.00 0.00 42.92 40.57 2c0h s ASP 100 CO 0.02 -1.48 1.78 -0.46 0.70 0.00 0.00 175.17 175.72 2c0h n ASN 101 N -2.81 0.00 -0.27 2.11 0.23 -1.26 -2.20 115.26 111.07 2c0h n ASN 101 Ca 0.08 -0.48 0.03 0.00 -0.53 0.00 0.00 54.58 53.68 2c0h n ASN 101 Cb 0.53 -0.11 0.05 0.00 -2.08 0.00 0.00 39.78 38.18 2c0h n ASN 101 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 2c0h n THR 102 N -1.11 0.56 0.28 5.53 -2.24 -1.26 -4.72 114.28 111.32 2c0h n THR 102 Ca 0.15 -0.78 -0.16 0.00 -2.27 0.00 0.00 64.05 60.99 2c0h n THR 102 Cb 0.12 0.77 -0.08 0.00 -2.10 0.00 0.00 70.33 69.03 2c0h n THR 102 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2c0h h LEU 103 N 1.01 -0.58 -0.50 3.22 5.85 -1.78 -0.12 115.31 122.42 2c0h h LEU 103 Ca 0.00 -0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 2c0h h LEU 103 Cb 0.44 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 2c0h h LEU 103 CO 0.00 -0.38 0.14 0.40 -0.34 0.00 0.00 178.44 178.26 2c0h h ILE 104 N -0.72 1.23 -0.30 4.05 2.04 -1.86 -1.44 117.51 120.52 2c0h h ILE 104 Ca -0.07 -0.79 -0.09 0.00 1.00 0.00 0.00 64.86 64.91 2c0h h ILE 104 Cb 0.54 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 2c0h h ILE 104 CO 0.11 0.29 -0.18 0.77 0.00 0.00 0.00 178.15 179.14 2c0h h SER 105 N 0.68 0.54 -0.21 1.72 4.64 -1.84 0.56 113.55 119.65 2c0h h SER 105 Ca 0.16 -0.17 -0.01 0.00 -0.47 0.00 0.00 61.79 61.30 2c0h h SER 105 Cb 0.29 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 2c0h h SER 105 CO -0.00 0.74 0.09 0.44 -0.87 0.00 0.00 176.83 177.23 2c0h h ASP 106 N 0.49 0.28 -0.82 4.97 5.19 -0.87 -1.09 116.42 124.58 2c0h h ASP 106 Ca 0.08 -0.14 -0.04 0.00 -0.62 0.00 0.00 57.03 56.31 2c0h h ASP 106 Cb 0.60 -0.07 -0.04 0.00 0.18 0.00 0.00 39.33 40.00 2c0h h ASP 106 CO 0.04 0.35 0.37 0.24 -3.12 0.00 0.00 179.24 177.12 2c0h h MET 107 N 0.20 1.19 -0.50 3.56 2.86 -0.86 -2.47 114.93 118.91 2c0h h MET 107 Ca 0.07 -0.19 -0.09 0.00 -2.06 0.00 0.00 59.70 57.43 2c0h h MET 107 Cb 0.14 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 31.58 2c0h h MET 107 CO -0.01 0.93 -0.05 -0.09 1.06 0.00 0.00 176.91 178.75 2c0h h ARG 108 N 1.17 0.87 -0.58 1.72 2.43 -0.79 -0.82 114.38 118.37 2c0h h ARG 108 Ca 0.28 -0.27 -0.05 0.00 -0.81 0.00 0.00 59.98 59.13 2c0h h ARG 108 Cb 0.15 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 2c0h h ARG 108 CO -0.03 0.90 0.19 0.00 -1.51 0.00 0.00 179.97 179.52 2c0h h ALA 109 N 1.14 0.76 -0.35 2.80 0.00 -0.95 -0.60 119.26 122.05 2c0h h ALA 109 Ca 0.14 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2c0h h ALA 109 Cb 0.55 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2c0h h ALA 109 CO 0.03 0.42 0.13 -0.92 0.00 0.00 0.00 179.25 178.92 2c0h h TYR 110 N 0.82 0.55 -0.69 0.00 3.20 -1.26 -1.93 116.97 117.66 2c0h h TYR 110 Ca 0.19 -0.04 0.01 0.00 3.14 0.00 0.00 58.73 62.03 2c0h h TYR 110 Cb 0.28 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.35 2c0h h TYR 110 CO 0.02 0.51 0.46 -0.07 -1.64 0.00 0.00 178.16 177.44 2c0h h LEU 111 N 0.43 0.78 -0.54 2.82 3.38 -0.85 -0.65 115.31 120.68 2c0h h LEU 111 Ca 0.12 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 2c0h h LEU 111 Cb 0.20 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2c0h h LEU 111 CO -0.01 0.56 -0.10 0.45 0.09 0.00 0.00 178.44 179.43 2c0h h HIS 112 N 0.92 1.14 -0.59 1.13 3.86 -0.86 -0.89 115.15 119.85 2c0h h HIS 112 Ca 0.26 -0.23 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 2c0h h HIS 112 Cb -0.07 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 28.09 2c0h h HIS 112 CO -0.00 1.05 0.33 0.00 0.86 0.00 0.00 177.93 180.17 2c0h h ALA 113 N 0.93 0.76 -0.70 2.45 0.00 -0.86 -2.56 119.26 119.27 2c0h h ALA 113 Ca 0.14 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2c0h h ALA 113 Cb 0.67 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2c0h h ALA 113 CO 0.05 0.27 0.32 0.00 0.00 0.00 0.00 179.25 179.89 2c0h h ALA 114 N 1.15 0.91 -1.00 0.00 0.00 -0.93 -2.75 119.26 116.65 2c0h h ALA 114 Ca 0.21 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.98 2c0h h ALA 114 Cb 0.04 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.50 2c0h h ALA 114 CO -0.03 0.49 0.66 0.37 0.00 0.00 0.00 179.25 180.74 2c0h h GLN 115 N 0.99 1.29 0.00 0.00 4.15 -0.98 -0.71 115.11 119.85 2c0h h GLN 115 Ca 0.24 -0.08 -0.01 0.00 0.77 0.00 0.00 58.65 59.57 2c0h h GLN 115 Cb 0.15 -0.29 -0.00 0.00 0.21 0.00 0.00 27.48 27.55 2c0h h GLN 115 CO -0.03 0.85 -0.04 0.00 -1.93 0.00 0.00 178.83 177.68 2c0h h ARG 116 N 1.33 0.00 -0.45 1.69 3.08 -1.16 -2.14 114.38 116.74 2c0h h ARG 116 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.42 2c0h h ARG 116 Cb -0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.94 2c0h h ARG 116 CO -0.09 0.04 0.00 0.72 -1.07 0.00 0.00 179.97 179.57 2c0h n HIS 117 N -3.40 0.72 -3.88 3.04 8.25 -0.35 -5.01 115.22 114.59 2c0h n HIS 117 Ca -0.02 -0.55 -0.27 0.00 -0.26 0.00 0.00 57.72 56.62 2c0h n HIS 117 Cb 0.17 -0.07 0.01 0.00 1.12 0.00 0.00 29.99 31.22 2c0h n HIS 117 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2c0h n ASN 118 N 0.69 -2.35 -4.28 0.41 3.02 -0.77 -4.74 115.26 107.23 2c0h n ASN 118 Ca 0.17 -0.87 -0.32 0.00 -0.03 0.00 0.00 54.58 53.53 2c0h n ASN 118 Cb 0.56 -3.63 -0.16 0.00 -0.61 0.00 0.00 39.78 35.94 2c0h n ASN 118 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2c0h s ILE 119 N -3.58 2.14 0.00 2.41 1.01 -0.79 -4.78 121.20 117.62 2c0h s ILE 119 Ca 0.29 -1.04 -0.18 0.00 0.00 0.00 0.00 60.65 59.72 2c0h s ILE 119 Cb -0.15 -1.78 -0.06 0.00 0.01 0.00 0.00 42.46 40.49 2c0h s ILE 119 CO 0.85 0.57 0.52 -0.76 0.00 0.00 0.00 174.94 176.12 2c0h s LEU 120 N -0.18 4.45 -0.13 2.97 1.43 -0.03 -4.29 118.68 122.90 2c0h s LEU 120 Ca -0.03 1.09 -0.04 0.00 -1.03 0.00 0.00 54.13 54.12 2c0h s LEU 120 Cb -0.14 -2.79 -0.03 0.00 0.03 0.00 0.00 46.19 43.26 2c0h s LEU 120 CO 0.03 0.20 0.02 -0.63 0.23 0.00 0.00 176.35 176.21 2c0h s ILE 121 N -0.60 4.44 -0.23 -0.59 -1.09 0.42 -1.22 121.20 122.33 2c0h s ILE 121 Ca 0.28 -0.18 -0.02 0.00 -2.23 0.00 0.00 60.65 58.50 2c0h s ILE 121 Cb -0.18 -2.93 0.02 0.00 -1.58 0.00 0.00 42.46 37.79 2c0h s ILE 121 CO 0.16 0.54 -0.07 -0.36 -1.23 0.00 0.00 174.94 173.98 2c0h s PHE 122 N -0.30 3.00 -0.14 3.97 0.08 -0.04 0.06 117.98 124.61 2c0h s PHE 122 Ca 0.07 -1.41 -0.18 0.00 0.12 0.00 0.00 56.93 55.53 2c0h s PHE 122 Cb -0.12 -2.05 -0.04 0.00 -0.57 0.00 0.00 43.02 40.24 2c0h s PHE 122 CO 0.02 -0.69 0.47 -0.06 -0.10 0.00 0.00 175.22 174.86 2c0h s PHE 123 N 1.36 3.47 -0.27 0.36 0.08 -0.81 -1.09 117.98 121.08 2c0h s PHE 123 Ca 0.02 0.83 -0.11 0.00 0.12 0.00 0.00 56.93 57.80 2c0h s PHE 123 Cb -0.16 -2.57 -0.05 0.00 -0.57 0.00 0.00 43.02 39.68 2c0h s PHE 123 CO -0.05 0.10 0.18 0.99 -0.10 0.00 0.00 175.22 176.33 2c0h s THR 124 N 0.90 5.24 -0.05 0.64 2.01 0.53 -0.92 115.64 123.99 2c0h s THR 124 Ca 0.25 0.15 -0.18 0.00 0.31 0.00 0.00 61.69 62.21 2c0h s THR 124 Cb -0.15 -3.49 -0.13 0.00 0.01 0.00 0.00 72.50 68.75 2c0h s THR 124 CO 0.10 0.27 0.76 -0.07 -0.69 0.00 0.00 174.62 174.98 2c0h h LEU 125 N 8.24 -0.27 -9.33 4.42 3.38 -1.13 0.10 115.31 120.72 2c0h h LEU 125 Ca -0.36 -0.21 -0.56 0.00 0.09 0.00 0.00 57.88 56.84 2c0h h LEU 125 Cb 1.19 0.07 -0.14 0.00 0.09 0.00 0.00 40.66 41.87 2c0h h LEU 125 CO 0.57 0.24 -0.67 0.26 0.09 0.00 0.00 178.44 178.93 2c0h s TRP 126 N -3.32 2.21 -0.06 1.13 0.52 -1.05 -1.41 118.94 116.96 2c0h s TRP 126 Ca -0.11 -0.62 0.01 0.00 0.02 0.00 0.00 56.10 55.40 2c0h s TRP 126 Cb 0.01 -1.31 0.02 0.00 -1.15 0.00 0.00 33.47 31.03 2c0h s TRP 126 CO 0.38 0.41 -0.08 1.21 0.02 0.00 0.00 176.95 178.89 2c0h s ASN 127 N -3.55 1.48 0.00 2.95 2.47 -0.38 -0.96 114.94 116.96 2c0h s ASN 127 Ca 0.32 -0.22 0.14 0.00 0.42 0.00 0.00 52.86 53.52 2c0h s ASN 127 Cb 0.04 -0.66 0.33 0.00 -1.45 0.00 0.00 41.25 39.52 2c0h s ASN 127 CO 0.15 -0.03 1.24 0.61 -3.72 0.00 0.00 177.10 175.35 2c0h n GLY 128 N 4.11 2.00 0.07 1.21 0.00 0.61 -4.64 105.19 108.55 2c0h n GLY 128 Ca -0.22 -0.48 0.12 0.00 0.00 0.00 0.00 46.02 45.44 2c0h n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c0h h ALA 129 N 2.76 0.60 -2.88 4.61 0.00 -1.68 -3.33 119.26 119.35 2c0h h ALA 129 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 2c0h h ALA 129 Cb 0.76 0.00 -0.23 0.00 0.00 0.00 0.00 17.79 18.33 2c0h h ALA 129 CO 0.00 0.00 -0.43 0.54 0.00 0.00 0.00 179.25 179.36 2c0h s VAL 130 N -3.17 0.05 -0.29 0.00 0.11 -1.26 -4.75 120.40 111.08 2c0h s VAL 130 Ca 0.06 -0.38 0.01 0.00 -2.93 0.00 0.00 61.98 58.74 2c0h s VAL 130 Cb 0.13 -0.42 0.06 0.00 -1.53 0.00 0.00 36.38 34.62 2c0h s VAL 130 CO 0.72 -0.21 -0.04 -0.75 -3.33 0.00 0.00 175.10 171.49 2c0h s LYS 131 N -0.79 2.24 0.00 1.54 2.20 -1.26 -5.03 119.74 118.64 2c0h s LYS 131 Ca -0.09 -1.39 0.00 0.00 -0.36 0.00 0.00 55.97 54.14 2c0h s LYS 131 Cb -0.05 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.21 2c0h s LYS 131 CO 0.02 -0.65 0.00 1.04 -0.36 0.00 0.00 175.35 175.40 2c0h n GLN 132 N 4.50 3.08 0.25 4.03 6.02 -1.26 -5.01 117.38 128.98 2c0h n GLN 132 Ca -0.11 0.00 0.16 0.00 -0.01 0.00 0.00 57.00 57.04 2c0h n GLN 132 Cb 0.42 0.00 0.62 0.00 1.02 0.00 0.00 30.24 32.31 2c0h n GLN 132 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2c0h h SER 133 N 0.00 0.00 -0.53 1.08 4.64 -1.99 -2.02 113.55 114.73 2c0h h SER 133 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2c0h h SER 133 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2c0h h SER 133 CO 0.00 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.31 2c0h n THR 134 N -2.93 2.17 -0.04 2.95 -2.24 -1.26 -4.62 114.28 108.30 2c0h n THR 134 Ca 0.01 -1.39 0.13 0.00 -2.27 0.00 0.00 64.05 60.53 2c0h n THR 134 Cb 0.31 -0.05 0.53 0.00 -2.10 0.00 0.00 70.33 69.02 2c0h n THR 134 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 2c0h h HIS 135 N 3.46 0.35 -0.75 4.78 2.76 -1.60 -1.06 115.15 123.08 2c0h h HIS 135 Ca 0.00 0.01 0.21 0.00 -2.20 0.00 0.00 60.37 58.39 2c0h h HIS 135 Cb 1.57 -0.11 -0.03 0.00 1.55 0.00 0.00 27.41 30.39 2c0h h HIS 135 CO 0.78 0.17 0.53 0.10 -1.30 0.00 0.00 177.93 178.21 2c0h h TYR 136 N 0.33 0.09 0.18 5.26 -0.00 -1.84 0.78 116.97 121.77 2c0h h TYR 136 Ca 0.25 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.97 2c0h h TYR 136 Cb 0.55 -0.03 0.00 0.00 0.00 0.00 0.00 36.73 37.26 2c0h h TYR 136 CO -0.00 0.03 -0.08 0.00 -0.00 0.00 0.00 178.16 178.10 2c0h h ARG 137 N 0.07 -0.23 -0.73 0.10 3.08 -1.44 -2.20 114.38 113.04 2c0h h ARG 137 Ca 0.36 0.02 -0.06 0.00 0.07 0.00 0.00 59.98 60.36 2c0h h ARG 137 Cb 1.34 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 31.41 2c0h h ARG 137 CO -0.03 0.04 0.20 1.25 -1.07 0.00 0.00 179.97 180.36 2c0h h LEU 138 N -0.48 1.08 -0.65 3.04 5.85 -1.51 -3.13 115.31 119.50 2c0h h LEU 138 Ca -0.02 -0.22 0.11 0.00 0.84 0.00 0.00 57.88 58.59 2c0h h LEU 138 Cb 0.37 -0.28 -0.08 0.00 0.37 0.00 0.00 40.66 41.03 2c0h h LEU 138 CO 0.04 1.02 0.21 -1.13 -0.34 0.00 0.00 178.44 178.24 2c0h h ASN 139 N 1.09 0.16 -0.82 1.25 -0.73 -0.77 -1.43 115.58 114.33 2c0h h ASN 139 Ca 0.23 0.10 0.06 0.00 1.87 0.00 0.00 56.30 58.56 2c0h h ASN 139 Cb 0.34 0.10 -0.06 0.00 0.27 0.00 0.00 38.32 38.98 2c0h h ASN 139 CO -0.00 0.08 0.50 1.23 -0.37 0.00 0.00 177.43 178.87 2c0h h GLY 140 N 0.36 1.22 1.98 1.57 0.00 -1.34 -1.44 103.07 105.42 2c0h h GLY 140 Ca 0.34 -0.36 -0.10 0.00 0.00 0.00 0.00 47.33 47.22 2c0h h GLY 140 CO -0.37 0.25 -0.44 1.41 0.00 0.00 0.00 176.54 177.38 2c0h h LEU 141 N 0.92 0.03 -0.14 3.11 3.38 -1.32 -1.36 115.31 119.92 2c0h h LEU 141 Ca 0.36 -0.01 -0.23 0.00 0.09 0.00 0.00 57.88 58.08 2c0h h LEU 141 Cb 0.16 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 40.92 2c0h h LEU 141 CO -0.17 0.47 -0.88 -0.03 0.09 0.00 0.00 178.44 177.91 2c0h h MET 142 N 0.02 0.67 0.00 1.13 4.05 -0.64 -3.38 114.93 116.78 2c0h h MET 142 Ca -0.00 -0.62 0.00 0.00 -0.28 0.00 0.00 59.70 58.80 2c0h h MET 142 Cb 0.79 0.15 0.00 0.00 -0.80 0.00 0.00 31.60 31.75 2c0h h MET 142 CO 0.06 1.23 -1.35 1.33 0.23 0.00 0.00 176.91 178.40 2c0h n VAL 143 N -3.87 0.00 -3.95 -5.77 0.24 -0.61 -4.86 118.33 99.50 2c0h n VAL 143 Ca -0.08 -0.27 -0.34 0.00 -2.04 0.00 0.00 64.34 61.61 2c0h n VAL 143 Cb 0.80 0.48 -0.14 0.00 -1.47 0.00 0.00 33.84 33.51 2c0h n VAL 143 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2c0h s ASP 144 N -3.35 4.79 0.52 -1.34 -1.08 -0.52 -5.01 116.67 110.69 2c0h s ASP 144 Ca -0.01 -1.55 0.21 0.00 -0.52 0.00 0.00 52.55 50.68 2c0h s ASP 144 Cb 0.11 -1.67 1.38 0.00 -1.46 0.00 0.00 42.92 41.28 2c0h s ASP 144 CO 0.68 -0.30 2.12 0.71 0.52 0.00 0.00 175.17 178.90 2c0h h THR 145 N 6.56 0.83 -0.05 1.71 1.35 -1.85 -1.43 112.91 120.02 2c0h h THR 145 Ca -0.17 -0.29 -0.15 0.00 -0.55 0.00 0.00 66.41 65.25 2c0h h THR 145 Cb 1.05 1.17 -0.01 0.00 -1.73 0.00 0.00 68.15 68.62 2c0h h THR 145 CO 0.53 0.08 -0.62 0.03 -0.25 0.00 0.00 175.52 175.29 2c0h h ARG 146 N 0.00 0.19 -0.18 4.72 3.08 -1.95 -1.06 114.38 119.17 2c0h h ARG 146 Ca -0.00 -0.13 -0.06 0.00 0.07 0.00 0.00 59.98 59.85 2c0h h ARG 146 Cb 0.16 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.23 2c0h h ARG 146 CO 0.01 0.75 -0.13 0.87 -1.07 0.00 0.00 179.97 180.40 2c0h h LYS 147 N 0.14 0.41 -0.66 0.04 1.57 -1.65 -2.72 116.57 113.70 2c0h h LYS 147 Ca -0.01 -0.20 0.09 0.00 -1.87 0.00 0.00 60.65 58.66 2c0h h LYS 147 Cb 1.13 -0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.36 2c0h h LYS 147 CO 0.09 0.74 0.31 1.25 -0.57 0.00 0.00 179.45 181.27 2c0h h LEU 148 N 0.09 0.38 -1.42 2.94 5.85 -1.17 -1.63 115.31 120.34 2c0h h LEU 148 Ca 0.04 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 2c0h h LEU 148 Cb 0.64 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 2c0h h LEU 148 CO 0.03 0.22 0.23 -0.61 -0.34 0.00 0.00 178.44 177.98 2c0h h GLN 149 N 0.53 0.62 -0.59 1.25 5.75 -1.16 -2.07 115.11 119.44 2c0h h GLN 149 Ca 0.33 -0.06 -0.06 0.00 -0.15 0.00 0.00 58.65 58.70 2c0h h GLN 149 Cb 0.35 -0.13 -0.03 0.00 1.07 0.00 0.00 27.48 28.75 2c0h h GLN 149 CO -0.27 0.47 0.13 0.66 -2.65 0.00 0.00 178.83 177.17 2c0h h SER 150 N 0.63 0.87 -0.48 -0.69 4.64 -0.98 -0.66 113.55 116.89 2c0h h SER 150 Ca 0.16 -0.17 -0.03 0.00 -0.47 0.00 0.00 61.79 61.28 2c0h h SER 150 Cb 0.05 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 61.89 2c0h h SER 150 CO -0.02 0.86 0.20 0.22 -0.87 0.00 0.00 176.83 177.21 2c0h h TYR 151 N 0.89 0.72 -0.26 4.77 3.20 -1.03 -1.29 116.97 123.97 2c0h h TYR 151 Ca 0.19 -0.05 -0.00 0.00 3.14 0.00 0.00 58.73 62.00 2c0h h TYR 151 Cb 0.34 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 2c0h h TYR 151 CO 0.02 0.60 0.14 0.82 -1.64 0.00 0.00 178.16 178.11 2c0h h ILE 152 N 0.63 1.12 -0.09 1.81 2.04 -1.01 -0.79 117.51 121.22 2c0h h ILE 152 Ca 0.16 -0.30 -0.24 0.00 1.00 0.00 0.00 64.86 65.48 2c0h h ILE 152 Cb 0.18 0.85 0.01 0.00 -0.74 0.00 0.00 36.82 37.12 2c0h h ILE 152 CO -0.01 0.11 -0.88 0.44 0.00 0.00 0.00 178.15 177.81 2c0h h ASP 153 N 0.30 0.87 0.00 1.72 3.32 -1.07 -1.75 116.42 119.81 2c0h h ASP 153 Ca 0.09 -0.62 0.00 0.00 0.02 0.00 0.00 57.03 56.52 2c0h h ASP 153 Cb 0.06 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.35 2c0h h ASP 153 CO -0.01 1.41 -1.36 1.41 -1.72 0.00 0.00 179.24 178.97 2c0h n HIS 154 N -3.88 0.00 0.07 4.55 8.25 -0.49 -4.60 115.22 119.11 2c0h n HIS 154 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 2c0h n HIS 154 Cb 0.80 -0.18 0.00 0.00 1.12 0.00 0.00 29.99 31.72 2c0h n HIS 154 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2c0h n ALA 155 N -1.78 3.00 0.01 -1.41 0.00 -0.66 -4.12 120.51 115.55 2c0h n ALA 155 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.32 2c0h n ALA 155 Cb 0.42 0.13 -0.09 0.00 0.00 0.00 0.00 19.45 19.91 2c0h n ALA 155 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2c0h h LEU 156 N 0.00 -0.02 -0.07 0.00 5.85 -1.22 -2.24 115.31 117.61 2c0h h LEU 156 Ca 0.00 -0.37 -0.00 0.00 0.84 0.00 0.00 57.88 58.35 2c0h h LEU 156 Cb 0.15 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 2c0h h LEU 156 CO 0.00 0.36 0.04 0.11 -0.34 0.00 0.00 178.44 178.61 2c0h h LYS 157 N -0.41 0.09 -0.85 1.25 1.57 -1.56 -1.07 116.57 115.59 2c0h h LYS 157 Ca -0.00 -0.01 0.14 0.00 -1.87 0.00 0.00 60.65 58.91 2c0h h LYS 157 Cb 0.39 -0.02 -0.09 0.00 0.08 0.00 0.00 32.23 32.59 2c0h h LYS 157 CO 0.00 0.11 0.45 -1.35 -0.57 0.00 0.00 179.45 178.10 2c0h h PRO 158 N 0.05 0.64 -0.03 3.15 0.11 -1.81 0.03 132.00 134.15 2c0h h PRO 158 Ca 0.02 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 2c0h h PRO 158 Cb 0.04 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.01 2c0h h PRO 158 CO -0.00 0.42 -0.01 1.98 -0.21 0.00 0.00 178.00 180.18 2c0h h MET 159 N 0.66 0.05 -0.42 1.05 4.05 -1.13 -1.96 114.93 117.23 2c0h h MET 159 Ca 0.46 -0.02 -0.09 0.00 -0.28 0.00 0.00 59.70 59.77 2c0h h MET 159 Cb 0.62 -0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.40 2c0h h MET 159 CO -0.34 0.41 -0.11 0.00 0.23 0.00 0.00 176.91 177.09 2c0h h ALA 160 N 0.64 1.01 -0.43 0.39 0.00 -0.97 -2.49 119.26 117.42 2c0h h ALA 160 Ca 0.01 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.46 2c0h h ALA 160 Cb 0.39 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2c0h h ALA 160 CO 0.00 0.59 -0.28 -0.97 0.00 0.00 0.00 179.25 178.60 2c0h h ASN 161 N 0.68 0.99 -0.03 0.00 -1.24 -0.99 -2.85 115.58 112.14 2c0h h ASN 161 Ca 0.12 -0.43 -0.10 0.00 0.71 0.00 0.00 56.30 56.60 2c0h h ASN 161 Cb 0.59 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.35 2c0h h ASN 161 CO 0.04 1.20 -0.29 0.00 -1.29 0.00 0.00 177.43 177.09 2c0h h ALA 162 N 0.82 1.06 -0.02 1.57 0.00 -1.14 -3.26 119.26 118.28 2c0h h ALA 162 Ca 0.09 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2c0h h ALA 162 Cb 0.86 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2c0h h ALA 162 CO 0.08 0.58 -0.29 1.28 0.00 0.00 0.00 179.25 180.89 2c0h n LEU 163 N -4.10 2.22 0.31 0.00 4.77 -0.96 -4.61 117.00 114.63 2c0h n LEU 163 Ca -0.01 -0.78 0.19 0.00 -0.03 0.00 0.00 56.01 55.38 2c0h n LEU 163 Cb 0.43 -0.01 0.97 0.00 -2.33 0.00 0.00 43.42 42.48 2c0h n LEU 163 CO 0.42 0.39 1.09 0.07 -1.33 0.00 0.00 177.39 178.04 2c0h h LYS 164 N 3.03 0.00 -0.36 3.23 2.10 -1.55 -1.92 116.57 121.11 2c0h h LYS 164 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2c0h h LYS 164 Cb 0.80 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.13 2c0h h LYS 164 CO 0.00 0.02 0.00 0.09 -2.00 0.00 0.00 179.45 177.56 2c0h n ASN 165 N -3.26 2.89 -4.68 7.07 3.02 -1.26 -4.89 115.26 114.16 2c0h n ASN 165 Ca -0.02 -1.92 -0.43 0.00 -0.03 0.00 0.00 54.58 52.19 2c0h n ASN 165 Cb 0.16 -0.23 -0.02 0.00 -0.61 0.00 0.00 39.78 39.08 2c0h n ASN 165 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2c0h s GLU 166 N -1.54 4.35 0.48 3.52 0.41 -0.73 -4.92 118.70 120.28 2c0h s GLU 166 Ca 0.37 1.47 0.23 0.00 -0.41 0.00 0.00 54.97 56.62 2c0h s GLU 166 Cb 0.21 -3.59 1.25 0.00 -1.78 0.00 0.00 34.13 30.21 2c0h s GLU 166 CO 0.29 -0.46 2.02 0.87 -0.49 0.00 0.00 175.26 177.49 2c0h h LYS 167 N 7.37 0.00 -0.01 1.61 1.57 -1.90 -2.29 116.57 122.92 2c0h h LYS 167 Ca -0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 2c0h h LYS 167 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.43 2c0h h LYS 167 CO 0.90 0.17 -0.03 0.00 -0.57 0.00 0.00 179.45 179.92 2c0h n ALA 168 N -2.35 2.67 -2.56 3.86 0.00 -1.26 -4.79 120.51 116.08 2c0h n ALA 168 Ca -0.02 -0.31 -0.43 0.00 0.00 0.00 0.00 53.44 52.68 2c0h n ALA 168 Cb 0.27 -1.33 -0.02 0.00 0.00 0.00 0.00 19.45 18.36 2c0h n ALA 168 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2c0h s LEU 169 N -2.11 3.57 -0.06 0.00 2.96 -0.87 -0.44 118.68 121.74 2c0h s LEU 169 Ca 0.39 0.41 -0.25 0.00 -0.22 0.00 0.00 54.13 54.46 2c0h s LEU 169 Cb 0.21 -3.44 -0.23 0.00 0.50 0.00 0.00 46.19 43.23 2c0h s LEU 169 CO 0.38 -1.35 1.03 1.23 -1.32 0.00 0.00 176.35 176.32 2c0h h GLY 170 N 11.59 0.15 0.00 7.98 0.00 -0.68 -3.46 103.07 118.65 2c0h h GLY 170 Ca -0.24 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2c0h h GLY 170 CO 1.14 0.22 0.00 0.61 0.00 0.00 0.00 176.54 178.51 2c0h n GLY 171 N 1.00 -0.86 3.01 4.60 0.00 -1.08 -4.35 105.19 107.51 2c0h n GLY 171 Ca -0.10 -1.06 -0.23 0.00 0.00 0.00 0.00 46.02 44.64 2c0h n GLY 171 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2c0h s TRP 172 N -3.00 1.27 -0.26 1.61 0.52 -0.41 -1.92 118.94 116.75 2c0h s TRP 172 Ca 0.00 -0.43 -0.06 0.00 0.02 0.00 0.00 56.10 55.63 2c0h s TRP 172 Cb 0.00 -0.94 -0.01 0.00 -1.15 0.00 0.00 33.47 31.37 2c0h s TRP 172 CO 0.00 -0.22 0.05 0.34 0.02 0.00 0.00 176.95 177.13 2c0h s ASP 173 N 0.58 4.94 0.19 2.95 -1.08 -0.10 -1.11 116.67 123.04 2c0h s ASP 173 Ca -0.12 -0.45 -0.09 0.00 -0.52 0.00 0.00 52.55 51.37 2c0h s ASP 173 Cb -0.14 -1.86 0.10 0.00 -1.46 0.00 0.00 42.92 39.56 2c0h s ASP 173 CO 0.03 -0.09 1.71 0.40 0.52 0.00 0.00 175.17 177.73 2c0h h ILE 174 N 5.71 1.26 -2.18 4.11 1.08 -1.44 -0.10 117.51 125.95 2c0h h ILE 174 Ca -0.36 -0.93 -0.05 0.00 -0.39 0.00 0.00 64.86 63.13 2c0h h ILE 174 Cb 1.15 0.56 -0.22 0.00 -3.07 0.00 0.00 36.82 35.24 2c0h h ILE 174 CO 0.59 0.36 0.02 -0.32 -0.69 0.00 0.00 178.15 178.11 2c0h s MET 175 N -5.35 0.73 -0.18 2.37 1.75 -1.26 -2.53 119.30 114.83 2c0h s MET 175 Ca -0.12 0.94 -0.28 0.00 -1.25 0.00 0.00 55.69 54.98 2c0h s MET 175 Cb 0.14 0.31 -0.00 0.00 2.84 0.00 0.00 34.83 38.12 2c0h s MET 175 CO 0.84 -0.10 0.95 1.21 -0.65 0.00 0.00 175.02 177.27 2c0h s ASN 176 N 0.58 7.08 -1.00 1.11 2.47 -0.13 -2.00 114.94 123.05 2c0h s ASN 176 Ca -0.02 1.34 -0.14 0.00 0.42 0.00 0.00 52.86 54.46 2c0h s ASN 176 Cb -0.05 -2.51 0.01 0.00 -1.45 0.00 0.00 41.25 37.25 2c0h s ASN 176 CO -0.03 -0.52 0.70 -0.62 -3.72 0.00 0.00 177.10 172.92 2c0h n GLU 177 N 5.60 -1.14 0.22 0.43 1.02 0.11 -0.28 120.64 126.59 2c0h n GLU 177 Ca 0.08 0.63 0.17 0.00 -0.02 0.00 0.00 57.16 58.02 2c0h n GLU 177 Cb 0.48 -3.49 0.85 0.00 -0.02 0.00 0.00 31.44 29.25 2c0h n GLU 177 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2c0h h PRO 178 N -1.21 0.00 0.00 3.49 0.11 -1.81 -1.94 132.00 130.64 2c0h h PRO 178 Ca -0.57 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.54 2c0h h PRO 178 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 2c0h h PRO 178 CO 0.43 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.61 2c0h n GLU 179 N -3.72 0.05 0.15 1.05 4.71 -1.26 -1.90 120.64 119.71 2c0h n GLU 179 Ca 0.01 0.36 0.17 0.00 -0.01 0.00 0.00 57.16 57.69 2c0h n GLU 179 Cb 0.31 -1.61 0.76 0.00 -1.01 0.00 0.00 31.44 29.89 2c0h n GLU 179 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 2c0h h GLY 180 N 1.81 0.00 -0.10 0.62 0.00 -1.47 -0.07 103.07 103.85 2c0h h GLY 180 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2c0h h GLY 180 CO 0.00 0.00 -0.05 1.18 0.00 0.00 0.00 176.54 177.67 2c0h n GLU 181 N -4.06 1.72 -2.25 4.80 1.02 -0.80 -0.83 120.64 120.23 2c0h n GLU 181 Ca 0.04 -1.61 -0.32 0.00 -0.02 0.00 0.00 57.16 55.25 2c0h n GLU 181 Cb 0.39 -1.02 -0.02 0.00 -0.02 0.00 0.00 31.44 30.78 2c0h n GLU 181 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 2c0h s ILE 182 N -1.29 4.50 -0.53 -3.67 2.07 -1.17 -1.06 121.20 120.05 2c0h s ILE 182 Ca 0.09 1.12 -0.22 0.00 -1.41 0.00 0.00 60.65 60.23 2c0h s ILE 182 Cb 0.08 -3.72 0.05 0.00 0.13 0.00 0.00 42.46 39.00 2c0h s ILE 182 CO 0.01 -0.77 0.78 -0.54 -1.91 0.00 0.00 174.94 172.52 2c0h s LYS 183 N -4.30 3.23 0.69 3.50 1.02 -0.22 -3.97 119.74 119.68 2c0h s LYS 183 Ca 0.58 -0.56 -0.11 0.00 0.02 0.00 0.00 55.97 55.90 2c0h s LYS 183 Cb -0.11 -4.07 0.00 0.00 -0.52 0.00 0.00 37.83 33.13 2c0h s LYS 183 CO 0.36 -1.35 1.08 -1.25 -0.92 0.00 0.00 175.35 173.27 2c0h s PRO 184 N 3.29 3.04 0.00 -1.68 0.04 -1.26 -4.37 135.00 134.06 2c0h s PRO 184 Ca 0.23 0.57 0.00 0.00 0.04 0.00 0.00 61.00 61.84 2c0h s PRO 184 Cb -0.16 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.35 2c0h s PRO 184 CO 0.16 -0.93 0.00 0.41 0.04 0.00 0.00 177.00 176.68 2c0h n GLY 185 N -2.86 0.46 3.73 0.56 0.00 -0.30 -4.92 105.19 101.86 2c0h n GLY 185 Ca 0.07 -0.38 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 2c0h n GLY 185 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2c0h s GLU 186 N -0.70 4.28 0.46 1.61 2.02 -1.26 -4.63 118.70 120.48 2c0h s GLU 186 Ca 0.00 0.34 -0.20 0.00 0.02 0.00 0.00 54.97 55.13 2c0h s GLU 186 Cb 0.00 -3.42 -0.10 0.00 0.10 0.00 0.00 34.13 30.71 2c0h s GLU 186 CO 0.00 0.22 0.97 -1.12 0.02 0.00 0.00 175.26 175.35 2c0h s SER 187 N 0.44 6.79 -0.03 -0.19 0.01 -1.26 -0.56 113.70 118.89 2c0h s SER 187 Ca 0.23 1.69 -0.15 0.00 1.31 0.00 0.00 55.95 59.03 2c0h s SER 187 Cb -0.15 -2.54 0.03 0.00 0.21 0.00 0.00 66.02 63.58 2c0h s SER 187 CO 0.09 -0.46 0.33 -0.55 0.41 0.00 0.00 173.24 173.05 2c0h s SER 188 N -2.34 -0.24 0.41 2.44 0.15 -1.26 -4.87 113.70 107.99 2c0h s SER 188 Ca 0.62 0.21 0.22 0.00 0.70 0.00 0.00 55.95 57.70 2c0h s SER 188 Cb -0.10 0.39 0.82 0.00 -1.71 0.00 0.00 66.02 65.42 2c0h s SER 188 CO 0.18 -0.40 1.79 0.28 1.20 0.00 0.00 173.24 176.28 2c0h h SER 189 N 4.10 0.00 -3.58 5.45 0.02 -1.98 -3.40 113.55 114.16 2c0h h SER 189 Ca -0.29 0.00 -0.64 0.00 -0.84 0.00 0.00 61.79 60.02 2c0h h SER 189 Cb 1.18 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.57 2c0h h SER 189 CO 0.38 0.29 0.10 -0.70 -1.14 0.00 0.00 176.83 175.75 2c0h s GLU 190 N -3.65 3.55 0.30 3.45 2.56 -1.26 -4.98 118.70 118.66 2c0h s GLU 190 Ca 0.00 -0.12 0.04 0.00 0.00 0.00 0.00 54.97 54.90 2c0h s GLU 190 Cb 0.11 -3.85 0.68 0.00 2.00 0.00 0.00 34.13 33.07 2c0h s GLU 190 CO 0.66 -0.79 1.79 -1.35 -0.56 0.00 0.00 175.26 175.00 2c0h h PRO 191 N 8.58 0.80 0.00 4.30 0.11 -1.98 -2.06 132.00 141.76 2c0h h PRO 191 Ca -0.26 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2c0h h PRO 191 Cb 1.11 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.04 2c0h h PRO 191 CO 0.84 0.53 0.00 0.00 -0.21 0.00 0.00 178.00 179.16 2c0h n PHE 193 N -2.55 0.00 -2.53 0.00 3.72 -0.78 -4.67 117.46 110.65 2c0h n PHE 193 Ca 0.02 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.00 2c0h n PHE 193 Cb 0.29 -0.07 -0.03 0.00 -0.94 0.00 0.00 39.48 38.73 2c0h n PHE 193 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2c0h s ASP 194 N -2.42 7.16 -0.16 4.37 2.15 -0.82 -4.69 116.67 122.26 2c0h s ASP 194 Ca 0.25 1.82 0.17 0.00 0.43 0.00 0.00 52.55 55.21 2c0h s ASP 194 Cb 0.19 -2.57 0.38 0.00 -0.30 0.00 0.00 42.92 40.63 2c0h s ASP 194 CO 0.50 -0.45 1.25 0.35 -0.17 0.00 0.00 175.17 176.66 2c0h n THR 195 N 4.18 2.07 0.08 1.71 -2.24 0.27 -4.69 114.28 115.67 2c0h n THR 195 Ca 0.09 -2.26 0.04 0.00 -2.27 0.00 0.00 64.05 59.64 2c0h n THR 195 Cb 0.48 -0.25 0.43 0.00 -2.10 0.00 0.00 70.33 68.89 2c0h n THR 195 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2c0h h ARG 196 N 0.67 0.35 0.00 -0.78 3.08 -1.81 -0.46 114.38 115.42 2c0h h ARG 196 Ca 0.01 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2c0h h ARG 196 Cb 1.17 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.15 2c0h h ARG 196 CO 0.09 0.33 0.00 1.12 -1.07 0.00 0.00 179.97 180.44 2c0h h HIS 197 N 0.35 0.00 -0.00 3.04 2.07 -1.91 -2.40 115.15 116.29 2c0h h HIS 197 Ca 0.09 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.61 2c0h h HIS 197 Cb 0.15 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.13 2c0h h HIS 197 CO 0.00 0.00 -0.43 1.28 -3.07 0.00 0.00 177.93 175.71 2c0h n LEU 198 N -2.34 0.69 -4.70 6.12 4.77 -0.50 -4.82 117.00 116.22 2c0h n LEU 198 Ca 0.01 -0.10 -0.43 0.00 -0.03 0.00 0.00 56.01 55.46 2c0h n LEU 198 Cb 0.21 -0.20 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 2c0h n LEU 198 CO 0.19 0.15 1.34 -1.20 -1.33 0.00 0.00 177.39 176.54 2c0h n SER 199 N -1.22 3.75 0.00 -1.43 7.64 -0.91 -1.74 113.62 119.72 2c0h n SER 199 Ca 0.08 1.06 0.00 0.00 1.01 0.00 0.00 58.87 61.01 2c0h n SER 199 Cb 0.34 -1.53 0.00 0.00 -1.01 0.00 0.00 64.21 62.01 2c0h n SER 199 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2c0h n GLY 200 N 3.86 1.13 0.10 0.23 0.00 -1.26 -4.91 105.19 104.34 2c0h n GLY 200 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 2c0h n GLY 200 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2c0h h SER 201 N 0.00 0.00 0.00 1.61 4.64 -1.66 -3.48 113.55 114.67 2c0h h SER 201 Ca 0.00 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 2c0h h SER 201 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2c0h h SER 201 CO 0.00 0.06 0.00 0.61 -0.87 0.00 0.00 176.83 176.63 2c0h n GLY 202 N 1.26 1.93 3.55 -0.77 0.00 -1.26 -5.06 105.19 104.84 2c0h n GLY 202 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 2c0h n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c0h n ALA 203 N -1.66 -0.42 -1.05 4.61 0.00 -1.26 -2.93 120.51 117.79 2c0h n ALA 203 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2c0h n ALA 203 Cb 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 17.47 2c0h n ALA 203 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c0h n GLY 204 N 1.48 0.40 0.26 0.00 0.00 -0.05 -4.76 105.19 102.52 2c0h n GLY 204 Ca 0.12 -1.05 0.09 0.00 0.00 0.00 0.00 46.02 45.17 2c0h n GLY 204 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 2c0h h TRP 205 N 0.00 0.00 -0.00 1.61 0.09 -1.37 -1.94 115.95 114.34 2c0h h TRP 205 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.98 2c0h h TRP 205 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.32 2c0h h TRP 205 CO 0.00 0.06 -0.44 0.00 0.09 0.00 0.00 178.44 178.15 2c0h n ALA 206 N -2.48 3.44 0.00 0.11 0.00 -0.01 -5.00 120.51 116.57 2c0h n ALA 206 Ca -0.03 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.04 2c0h n ALA 206 Cb 0.14 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2c0h n ALA 206 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c0h n GLY 207 N 1.45 4.36 3.18 0.00 0.00 -0.73 -4.74 105.19 108.71 2c0h n GLY 207 Ca 0.07 -0.89 -0.43 0.00 0.00 0.00 0.00 46.02 44.77 2c0h n GLY 207 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2c0h n HIS 208 N -1.62 4.00 -0.13 1.61 8.25 -1.26 -4.07 115.22 122.00 2c0h n HIS 208 Ca 0.00 -3.07 -0.23 0.00 -0.26 0.00 0.00 57.72 54.16 2c0h n HIS 208 Cb 0.00 -2.10 -0.11 0.00 1.12 0.00 0.00 29.99 28.89 2c0h n HIS 208 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2c0h n LEU 209 N 4.94 2.54 -4.23 2.41 4.77 -0.63 -4.78 117.00 122.04 2c0h n LEU 209 Ca 0.39 0.06 -0.27 0.00 -0.03 0.00 0.00 56.01 56.17 2c0h n LEU 209 Cb 0.40 -0.87 -0.15 0.00 -2.33 0.00 0.00 43.42 40.46 2c0h n LEU 209 CO 0.73 0.79 -0.53 -0.31 -1.33 0.00 0.00 177.39 176.73 2c0h s TYR 210 N -2.51 1.85 0.72 -1.77 2.02 -0.23 -4.93 117.35 112.50 2c0h s TYR 210 Ca -0.37 -0.35 -0.11 0.00 -0.37 0.00 0.00 57.07 55.87 2c0h s TYR 210 Cb 0.12 -1.18 0.03 0.00 -0.40 0.00 0.00 41.96 40.52 2c0h s TYR 210 CO 0.55 -0.01 1.07 -1.54 -1.57 0.00 0.00 175.55 174.05 2c0h s SER 211 N -0.61 5.12 0.27 2.29 1.04 -1.26 -1.06 113.70 119.49 2c0h s SER 211 Ca 0.08 1.56 -0.01 0.00 0.48 0.00 0.00 55.95 58.07 2c0h s SER 211 Cb -0.08 -2.40 0.50 0.00 0.10 0.00 0.00 66.02 64.14 2c0h s SER 211 CO -0.00 -1.60 1.83 0.00 0.98 0.00 0.00 173.24 174.44 2c0h h ALA 212 N -0.83 1.41 -0.61 5.32 0.00 -1.87 -2.05 119.26 120.62 2c0h h ALA 212 Ca -0.44 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.44 2c0h h ALA 212 Cb 1.22 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 2c0h h ALA 212 CO 0.57 0.21 0.20 0.37 0.00 0.00 0.00 179.25 180.60 2c0h h GLN 213 N 0.96 0.92 -0.48 0.00 -0.00 -1.92 -1.40 115.11 113.19 2c0h h GLN 213 Ca 0.46 -0.17 -0.04 0.00 -0.00 0.00 0.00 58.65 58.90 2c0h h GLN 213 Cb 0.42 -0.15 -0.02 0.00 0.00 0.00 0.00 27.48 27.74 2c0h h GLN 213 CO -0.25 0.79 0.12 0.93 0.00 0.00 0.00 178.83 180.42 2c0h h GLU 214 N 0.90 0.76 -0.44 1.69 5.08 -1.75 -1.05 114.58 119.77 2c0h h GLU 214 Ca 0.20 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2c0h h GLU 214 Cb 0.25 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 2c0h h GLU 214 CO -0.01 0.73 0.17 0.82 -1.00 0.00 0.00 179.01 179.73 2c0h h ILE 215 N 0.64 1.20 -0.70 3.13 2.04 -1.33 -1.98 117.51 120.52 2c0h h ILE 215 Ca 0.15 -0.63 0.03 0.00 1.00 0.00 0.00 64.86 65.41 2c0h h ILE 215 Cb 0.31 0.80 -0.04 0.00 -0.74 0.00 0.00 36.82 37.15 2c0h h ILE 215 CO 0.00 0.23 0.44 1.23 0.00 0.00 0.00 178.15 180.05 2c0h h GLY 216 N 0.56 1.00 0.99 5.37 0.00 -1.08 -2.22 103.07 107.69 2c0h h GLY 216 Ca 0.15 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.14 2c0h h GLY 216 CO -0.01 0.28 0.29 -0.09 0.00 0.00 0.00 176.54 177.02 2c0h h ARG 217 N 0.86 0.72 -0.60 4.80 2.43 -1.03 -0.34 114.38 121.22 2c0h h ARG 217 Ca 0.28 -0.08 0.07 0.00 -0.81 0.00 0.00 59.98 59.44 2c0h h ARG 217 Cb 0.01 -0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 29.36 2c0h h ARG 217 CO -0.10 0.55 0.29 0.35 -1.51 0.00 0.00 179.97 179.54 2c0h h PHE 218 N 0.70 0.52 -0.04 2.20 3.57 -0.98 -1.36 116.94 121.55 2c0h h PHE 218 Ca 0.18 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 2c0h h PHE 218 Cb 0.03 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.63 2c0h h PHE 218 CO -0.02 0.22 -0.08 0.28 -2.23 0.00 0.00 178.31 176.48 2c0h h VAL 219 N 0.53 1.44 -0.56 1.41 2.07 -1.30 -3.01 116.25 116.83 2c0h h VAL 219 Ca 0.28 -1.43 0.09 0.00 0.82 0.00 0.00 66.70 66.47 2c0h h VAL 219 Cb 0.24 2.30 -0.07 0.00 -1.52 0.00 0.00 31.29 32.24 2c0h h VAL 219 CO -0.22 0.39 0.16 -1.13 0.02 0.00 0.00 177.57 176.79 2c0h h ASN 220 N -0.41 0.10 -0.27 0.57 -0.73 -0.86 -0.99 115.58 112.98 2c0h h ASN 220 Ca 0.00 0.09 -0.14 0.00 1.87 0.00 0.00 56.30 58.12 2c0h h ASN 220 Cb 0.67 0.10 -0.01 0.00 0.27 0.00 0.00 38.32 39.35 2c0h h ASN 220 CO 0.02 0.07 -0.33 -0.50 -0.37 0.00 0.00 177.43 176.32 2c0h h TRP 221 N 0.31 0.94 -0.03 0.67 4.06 -1.31 -1.96 115.95 118.62 2c0h h TRP 221 Ca 0.28 -0.25 -0.21 0.00 2.06 0.00 0.00 58.89 60.77 2c0h h TRP 221 Cb 0.38 -0.21 -0.00 0.00 -1.00 0.00 0.00 29.16 28.33 2c0h h TRP 221 CO -0.20 1.02 -0.86 1.96 -3.56 0.00 0.00 178.44 176.80 2c0h h GLN 222 N 0.67 0.41 -0.57 0.49 4.20 -1.36 -2.11 115.11 116.84 2c0h h GLN 222 Ca 0.07 -0.39 -0.01 0.00 0.06 0.00 0.00 58.65 58.37 2c0h h GLN 222 Cb 0.88 0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.73 2c0h h GLN 222 CO 0.08 1.05 0.31 0.00 -0.67 0.00 0.00 178.83 179.60 2c0h h ALA 223 N 0.82 0.74 -0.71 3.87 0.00 -1.16 -2.22 119.26 120.60 2c0h h ALA 223 Ca -0.06 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 2c0h h ALA 223 Cb 1.47 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 2c0h h ALA 223 CO 0.15 0.26 0.19 0.00 0.00 0.00 0.00 179.25 179.85 2c0h h ALA 224 N 1.14 1.01 -0.37 0.00 0.00 -1.30 -2.58 119.26 117.15 2c0h h ALA 224 Ca 0.20 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2c0h h ALA 224 Cb 0.05 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2c0h h ALA 224 CO -0.03 0.66 0.17 0.00 0.00 0.00 0.00 179.25 180.05 2c0h h ALA 225 N 1.14 0.48 -0.60 0.00 0.00 -1.13 -0.93 119.26 118.23 2c0h h ALA 225 Ca 0.23 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 2c0h h ALA 225 Cb 0.34 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2c0h h ALA 225 CO -0.00 0.05 0.23 0.82 0.00 0.00 0.00 179.25 180.35 2c0h h ILE 226 N 0.47 1.23 0.00 0.00 2.04 -1.35 -2.56 117.51 117.33 2c0h h ILE 226 Ca 0.13 -0.74 0.00 0.00 1.00 0.00 0.00 64.86 65.24 2c0h h ILE 226 Cb 0.13 0.60 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 2c0h h ILE 226 CO -0.02 0.29 0.00 0.11 0.00 0.00 0.00 178.15 178.53 2c0h h LYS 227 N 0.83 0.00 -0.32 2.37 1.57 -1.24 0.42 116.57 120.19 2c0h h LYS 227 Ca 0.20 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.82 2c0h h LYS 227 Cb 0.22 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 2c0h h LYS 227 CO -0.01 0.00 -0.44 1.49 -0.57 0.00 0.00 179.45 179.92 2c0h h GLU 228 N 0.00 0.84 0.00 3.15 4.81 -0.74 -2.90 114.58 119.73 2c0h h GLU 228 Ca 0.00 -0.47 -0.07 0.00 -0.13 0.00 0.00 59.36 58.69 2c0h h GLU 228 Cb 0.62 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 2c0h h GLU 228 CO 0.00 1.10 -1.95 1.33 -0.73 0.00 0.00 179.01 178.77 2c0h n VAL 229 N -4.03 0.35 -3.36 0.32 0.24 -1.11 -4.66 118.33 106.08 2c0h n VAL 229 Ca -0.03 -0.58 -0.26 0.00 -2.04 0.00 0.00 64.34 61.44 2c0h n VAL 229 Cb 0.57 -0.15 -0.09 0.00 -1.47 0.00 0.00 33.84 32.70 2c0h n VAL 229 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2c0h n ASP 230 N -2.41 0.24 0.19 -1.34 2.03 0.12 -4.76 116.55 110.62 2c0h n ASP 230 Ca -0.09 -2.61 0.18 0.00 0.52 0.00 0.00 54.79 52.79 2c0h n ASP 230 Cb 0.68 -0.60 0.82 0.00 -0.72 0.00 0.00 41.12 41.30 2c0h n ASP 230 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2c0h h PRO 231 N 4.95 0.00 -0.26 -0.67 0.11 -1.71 -0.09 132.00 134.34 2c0h h PRO 231 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 2c0h h PRO 231 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 2c0h h PRO 231 CO 0.45 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.65 2c0h n GLY 232 N -1.40 0.71 3.76 -0.55 0.00 -1.26 -4.93 105.19 101.53 2c0h n GLY 232 Ca 0.02 -0.49 -0.38 0.00 0.00 0.00 0.00 46.02 45.17 2c0h n GLY 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c0h s ALA 233 N -1.67 3.03 -0.13 4.61 0.00 -0.05 -4.93 121.76 122.64 2c0h s ALA 233 Ca 0.33 1.13 -0.21 0.00 0.00 0.00 0.00 51.96 53.21 2c0h s ALA 233 Cb 0.18 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.80 2c0h s ALA 233 CO 0.26 -0.89 0.61 -1.64 0.00 0.00 0.00 175.76 174.11 2c0h s MET 234 N -2.59 4.32 -0.03 0.00 -1.94 -1.26 -4.92 119.30 112.89 2c0h s MET 234 Ca 0.63 0.66 0.04 0.00 -1.71 0.00 0.00 55.69 55.31 2c0h s MET 234 Cb -0.35 -3.49 -0.00 0.00 2.01 0.00 0.00 34.83 32.99 2c0h s MET 234 CO 0.43 -0.03 -0.14 0.08 -0.01 0.00 0.00 175.02 175.35 2c0h s VAL 235 N 1.18 1.17 0.26 -6.03 1.01 -1.26 -1.29 120.40 115.44 2c0h s VAL 235 Ca 0.31 -0.59 0.03 0.00 0.00 0.00 0.00 61.98 61.72 2c0h s VAL 235 Cb -0.16 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.21 2c0h s VAL 235 CO 0.13 0.34 0.29 1.07 0.00 0.00 0.00 175.10 176.93 2c0h n THR 236 N 3.05 0.00 -3.81 3.92 5.66 -0.27 -0.47 114.28 122.35 2c0h n THR 236 Ca -0.17 -1.63 -0.14 0.00 -3.05 0.00 0.00 64.05 59.06 2c0h n THR 236 Cb 0.54 0.89 -0.15 0.00 -1.55 0.00 0.00 70.33 70.06 2c0h n THR 236 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2c0h s VAL 237 N -2.89 -0.03 -0.92 1.08 1.01 -1.26 -1.17 120.40 116.21 2c0h s VAL 237 Ca 0.27 0.13 -0.21 0.00 0.00 0.00 0.00 61.98 62.17 2c0h s VAL 237 Cb 0.00 -0.06 0.09 0.00 0.00 0.00 0.00 36.38 36.42 2c0h s VAL 237 CO 0.19 0.05 1.23 -0.83 0.00 0.00 0.00 175.10 175.74 2c0h s GLY 238 N 0.64 1.60 0.26 4.51 0.00 -0.85 -3.60 107.32 109.88 2c0h s GLY 238 Ca -0.05 -2.44 -0.30 0.00 0.00 0.00 0.00 44.72 41.94 2c0h s GLY 238 CO -0.02 2.27 1.10 -0.45 0.00 0.00 0.00 173.10 176.01 2c0h s SER 239 N 4.10 7.27 0.38 1.64 0.15 -0.55 0.04 113.70 126.73 2c0h s SER 239 Ca 0.36 2.24 0.17 0.00 0.70 0.00 0.00 55.95 59.43 2c0h s SER 239 Cb -0.05 -2.62 0.74 0.00 -1.71 0.00 0.00 66.02 62.38 2c0h s SER 239 CO -0.07 -0.15 1.78 -0.25 1.20 0.00 0.00 173.24 175.75 2c0h h TRP 240 N 4.02 0.00 -1.93 3.44 7.01 -1.88 -0.86 115.95 125.75 2c0h h TRP 240 Ca -0.46 0.00 -0.03 0.00 2.11 0.00 0.00 58.89 60.51 2c0h h TRP 240 Cb 1.21 0.00 -0.21 0.00 -2.10 0.00 0.00 29.16 28.06 2c0h h TRP 240 CO 0.59 0.37 0.22 1.21 -2.79 0.00 0.00 178.44 178.05 2c0h s ASN 241 N -6.56 -0.65 0.61 2.65 3.84 -1.26 -4.32 114.94 109.25 2c0h s ASN 241 Ca -0.01 0.97 0.32 0.00 0.21 0.00 0.00 52.86 54.35 2c0h s ASN 241 Cb 0.12 0.89 1.80 0.00 -0.55 0.00 0.00 41.25 43.51 2c0h s ASN 241 CO 0.69 -0.42 2.14 -0.03 -2.79 0.00 0.00 177.10 176.69 2c0h h MET 242 N 3.80 0.00 0.00 0.43 1.85 -1.83 -2.40 114.93 116.78 2c0h h MET 242 Ca -0.27 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.82 2c0h h MET 242 Cb 1.15 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.18 2c0h h MET 242 CO 0.24 0.00 0.18 0.87 -0.40 0.00 0.00 176.91 177.80 2c0h h LYS 243 N 0.00 0.00 -0.31 0.39 1.57 -1.92 -0.48 116.57 115.82 2c0h h LYS 243 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2c0h h LYS 243 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 2c0h h LYS 243 CO -0.00 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.88 2c0h n ALA 244 N -1.94 2.34 -1.44 3.86 0.00 -0.90 -3.79 120.51 118.64 2c0h n ALA 244 Ca -0.02 -0.97 0.03 0.00 0.00 0.00 0.00 53.44 52.47 2c0h n ALA 244 Cb 0.24 -0.59 0.04 0.00 0.00 0.00 0.00 19.45 19.13 2c0h n ALA 244 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2c0h n ASP 245 N 0.94 0.78 -3.73 0.00 -0.08 -0.20 -1.47 116.55 112.79 2c0h n ASP 245 Ca 0.14 -2.13 -0.14 0.00 -1.51 0.00 0.00 54.79 51.15 2c0h n ASP 245 Cb 0.46 -0.21 -0.09 0.00 2.34 0.00 0.00 41.12 43.62 2c0h n ASP 245 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 2c0h s THR 246 N -0.83 0.03 -2.43 5.18 -1.32 -1.17 -4.80 115.64 110.29 2c0h s THR 246 Ca 0.08 -0.22 0.27 0.00 -1.21 0.00 0.00 61.69 60.61 2c0h s THR 246 Cb 0.07 -0.63 0.40 0.00 -1.51 0.00 0.00 72.50 70.83 2c0h s THR 246 CO 0.01 -0.12 1.58 0.47 -2.21 0.00 0.00 174.62 174.34 2c0h n ASP 247 N 1.93 1.73 -4.85 8.08 8.00 -1.26 -1.82 116.55 128.36 2c0h n ASP 247 Ca -0.18 -1.49 -0.26 0.00 0.71 0.00 0.00 54.79 53.57 2c0h n ASP 247 Cb 0.57 0.05 0.08 0.00 -0.02 0.00 0.00 41.12 41.80 2c0h n ASP 247 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2c0h s ALA 248 N -2.12 3.04 -2.12 2.24 0.00 -1.26 -4.48 121.76 117.05 2c0h s ALA 248 Ca 0.32 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 51.33 2c0h s ALA 248 Cb 0.20 -2.63 0.00 0.00 0.00 0.00 0.00 23.12 20.69 2c0h s ALA 248 CO 0.38 -1.45 0.00 -1.33 0.00 0.00 0.00 175.76 173.35 2c0h n MET 249 N -3.04 -1.51 -0.97 0.00 2.81 -1.26 -1.93 117.12 111.21 2c0h n MET 249 Ca 0.09 1.19 0.00 0.00 -1.81 0.00 0.00 57.70 57.16 2c0h n MET 249 Cb 0.60 -5.64 0.00 0.00 -0.71 0.00 0.00 33.22 27.47 2c0h n MET 249 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2c0h n GLY 250 N -0.54 0.47 3.18 3.03 0.00 -1.26 -5.05 105.19 105.01 2c0h n GLY 250 Ca -0.22 -0.40 -0.20 0.00 0.00 0.00 0.00 46.02 45.20 2c0h n GLY 250 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2c0h n PHE 251 N -2.97 -1.25 -4.33 1.61 3.72 -0.81 -4.92 117.46 108.50 2c0h n PHE 251 Ca 0.00 -1.87 -0.18 0.00 -0.05 0.00 0.00 57.45 55.34 2c0h n PHE 251 Cb 0.00 -0.40 -0.14 0.00 -0.94 0.00 0.00 39.48 38.00 2c0h n PHE 251 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 2c0h s HIS 252 N -2.18 0.87 -0.49 1.38 3.76 -0.75 -4.33 115.29 113.56 2c0h s HIS 252 Ca 0.33 -0.23 -0.20 0.00 -0.15 0.00 0.00 55.06 54.81 2c0h s HIS 252 Cb -0.03 -0.55 0.04 0.00 1.11 0.00 0.00 32.58 33.16 2c0h s HIS 252 CO 0.21 -0.01 0.68 1.21 -0.85 0.00 0.00 174.74 175.98 2c0h s ASN 253 N -0.54 6.27 0.53 1.40 3.84 -1.07 -3.55 114.94 121.82 2c0h s ASN 253 Ca 0.02 -0.65 0.35 0.00 0.21 0.00 0.00 52.86 52.79 2c0h s ASN 253 Cb -0.05 -2.32 1.68 0.00 -0.55 0.00 0.00 41.25 40.00 2c0h s ASN 253 CO 0.00 -0.91 2.05 -0.07 -2.79 0.00 0.00 177.10 175.38 2c0h h LEU 254 N 9.89 0.00 -2.99 3.21 3.38 -1.53 -3.28 115.31 124.00 2c0h h LEU 254 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2c0h h LEU 254 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 2c0h h LEU 254 CO 0.96 0.00 0.00 -1.22 0.09 0.00 0.00 178.44 178.27 2c0h n TYR 255 N -2.87 0.49 -1.37 1.13 4.01 -1.26 -4.40 117.16 112.89 2c0h n TYR 255 Ca -0.01 -0.61 -0.32 0.00 -0.16 0.00 0.00 57.90 56.81 2c0h n TYR 255 Cb 0.18 -0.10 0.08 0.00 -0.31 0.00 0.00 39.34 39.19 2c0h n TYR 255 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 2c0h s SER 256 N -1.29 4.57 0.18 7.72 1.04 -1.24 -4.71 113.70 119.98 2c0h s SER 256 Ca 0.25 1.90 -0.13 0.00 0.48 0.00 0.00 55.95 58.45 2c0h s SER 256 Cb 0.16 -2.53 0.18 0.00 0.10 0.00 0.00 66.02 63.92 2c0h s SER 256 CO 0.12 -1.99 1.72 0.44 0.98 0.00 0.00 173.24 174.50 2c0h h ASP 257 N -0.84 0.01 -0.35 7.02 3.32 -1.95 -1.51 116.42 122.12 2c0h h ASP 257 Ca -0.44 0.08 0.05 0.00 0.02 0.00 0.00 57.03 56.73 2c0h h ASP 257 Cb 1.24 0.11 -0.04 0.00 0.22 0.00 0.00 39.33 40.86 2c0h h ASP 257 CO 0.51 0.04 0.10 -0.74 -1.72 0.00 0.00 179.24 177.43 2c0h h HIS 258 N 0.24 0.18 -0.22 4.55 2.76 -1.97 -1.25 115.15 119.42 2c0h h HIS 258 Ca 0.24 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.40 2c0h h HIS 258 Cb 0.31 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.24 2c0h h HIS 258 CO -0.22 0.06 0.03 0.00 -1.30 0.00 0.00 177.93 176.50 2c0h h LEU 260 N 0.17 1.06 -0.36 0.00 3.38 -1.15 -0.11 115.31 118.31 2c0h h LEU 260 Ca 0.07 -0.26 -0.19 0.00 0.09 0.00 0.00 57.88 57.59 2c0h h LEU 260 Cb 0.35 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2c0h h LEU 260 CO 0.01 1.05 -0.68 0.58 0.09 0.00 0.00 178.44 179.49 2c0h h VAL 261 N 1.04 1.32 -0.72 1.22 2.07 -1.25 -1.32 116.25 118.61 2c0h h VAL 261 Ca 0.20 -1.96 -0.03 0.00 0.82 0.00 0.00 66.70 65.73 2c0h h VAL 261 Cb 0.45 1.94 -0.03 0.00 -1.52 0.00 0.00 31.29 32.12 2c0h h VAL 261 CO 0.01 0.61 0.32 0.50 0.02 0.00 0.00 177.57 179.03 2c0h h LYS 262 N 0.43 1.04 -0.16 1.57 1.63 -1.08 0.80 116.57 120.80 2c0h h LYS 262 Ca -0.02 -0.16 -0.08 0.00 -0.85 0.00 0.00 60.65 59.53 2c0h h LYS 262 Cb 1.26 -0.18 -0.00 0.00 -0.60 0.00 0.00 32.23 32.71 2c0h h LYS 262 CO 0.13 0.83 -0.22 0.00 -3.45 0.00 0.00 179.45 176.73 2c0h h ALA 263 N 1.31 0.24 0.00 5.00 0.00 -0.77 -3.40 119.26 121.65 2c0h h ALA 263 Ca 0.25 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2c0h h ALA 263 Cb 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2c0h h ALA 263 CO -0.03 0.20 -1.11 0.41 0.00 0.00 0.00 179.25 178.72 2c0h n GLY 264 N 0.30 -0.14 2.17 0.00 0.00 -0.52 -4.38 105.19 102.62 2c0h n GLY 264 Ca -0.06 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2c0h n GLY 264 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c0h n GLY 265 N 2.09 1.36 3.55 -0.02 0.00 0.27 -4.93 105.19 107.51 2c0h n GLY 265 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2c0h n GLY 265 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c0h s LYS 266 N -0.28 3.56 0.46 1.61 -0.14 -1.26 -4.95 119.74 118.73 2c0h s LYS 266 Ca 0.00 -0.15 0.16 0.00 -1.36 0.00 0.00 55.97 54.62 2c0h s LYS 266 Cb 0.00 -3.84 1.05 0.00 -1.68 0.00 0.00 37.83 33.37 2c0h s LYS 266 CO 0.00 -0.74 2.00 1.96 -0.76 0.00 0.00 175.35 177.81 2c0h h GLN 267 N 8.54 0.00 -0.00 1.68 1.08 -1.95 -1.89 115.11 122.57 2c0h h GLN 267 Ca -0.27 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.93 2c0h h GLN 267 Cb 1.11 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.54 2c0h h GLN 267 CO 0.81 0.18 -0.12 -1.13 -0.95 0.00 0.00 178.83 177.62 2c0h n SER 268 N -4.25 0.57 -3.49 1.46 3.41 -1.26 -4.58 113.62 105.48 2c0h n SER 268 Ca -0.02 -0.67 -0.40 0.00 -0.26 0.00 0.00 58.87 57.51 2c0h n SER 268 Cb 0.24 -0.04 -0.01 0.00 -0.26 0.00 0.00 64.21 64.14 2c0h n SER 268 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2c0h n GLY 269 N 1.27 5.02 3.45 5.00 0.00 -0.71 -4.39 105.19 114.83 2c0h n GLY 269 Ca 0.15 -1.96 -0.26 0.00 0.00 0.00 0.00 46.02 43.95 2c0h n GLY 269 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2c0h s THR 270 N -0.44 2.44 0.50 2.61 -4.23 -1.26 -4.46 115.64 110.79 2c0h s THR 270 Ca 0.55 -2.18 -0.12 0.00 -1.18 0.00 0.00 61.69 58.77 2c0h s THR 270 Cb 0.18 -2.22 -0.06 0.00 1.34 0.00 0.00 72.50 71.74 2c0h s THR 270 CO -0.08 -0.23 0.90 -0.76 -0.54 0.00 0.00 174.62 173.91 2c0h s LEU 271 N -3.03 3.61 -0.09 4.79 1.43 -1.26 -4.89 118.68 119.24 2c0h s LEU 271 Ca 0.25 1.32 -0.19 0.00 -1.03 0.00 0.00 54.13 54.48 2c0h s LEU 271 Cb -0.07 -4.27 -0.28 0.00 0.03 0.00 0.00 46.19 41.60 2c0h s LEU 271 CO 0.12 -0.59 0.68 0.28 0.23 0.00 0.00 176.35 177.08 2c0h h SER 272 N 0.68 0.37 -5.22 2.29 0.02 -1.13 -3.49 113.55 107.07 2c0h h SER 272 Ca -0.46 -0.88 -0.10 0.00 -0.84 0.00 0.00 61.79 59.51 2c0h h SER 272 Cb 1.19 -0.12 -0.13 0.00 0.14 0.00 0.00 62.40 63.48 2c0h h SER 272 CO 0.62 1.49 -0.34 0.72 -1.14 0.00 0.00 176.83 178.18 2c0h s PHE 273 N -2.44 0.29 0.20 3.45 -0.12 -1.21 -4.49 117.98 113.66 2c0h s PHE 273 Ca -0.18 -0.68 -0.00 0.00 -0.05 0.00 0.00 56.93 56.02 2c0h s PHE 273 Cb 0.03 -0.06 -0.04 0.00 -0.63 0.00 0.00 43.02 42.32 2c0h s PHE 273 CO 0.78 -0.64 0.38 0.71 -0.05 0.00 0.00 175.22 176.40 2c0h s TYR 274 N -3.92 3.48 -0.03 3.49 2.02 -0.16 -4.44 117.35 117.80 2c0h s TYR 274 Ca 0.12 0.31 -0.00 0.00 -0.37 0.00 0.00 57.07 57.12 2c0h s TYR 274 Cb 0.04 -1.83 0.03 0.00 -0.40 0.00 0.00 41.96 39.80 2c0h s TYR 274 CO -0.05 0.39 0.04 -1.14 -1.57 0.00 0.00 175.55 173.23 2c0h s GLN 275 N -3.34 -0.03 0.03 -0.62 0.74 -1.24 -1.19 119.66 114.02 2c0h s GLN 275 Ca 0.38 0.23 0.04 0.00 0.05 0.00 0.00 55.36 56.06 2c0h s GLN 275 Cb -0.11 -0.28 -0.02 0.00 1.10 0.00 0.00 33.01 33.71 2c0h s GLN 275 CO 0.29 -0.19 -0.12 0.54 -0.55 0.00 0.00 175.29 175.26 2c0h s VAL 276 N 1.23 0.96 0.09 1.34 0.11 -0.73 -1.48 120.40 121.92 2c0h s VAL 276 Ca -0.07 -0.89 0.03 0.00 -2.93 0.00 0.00 61.98 58.11 2c0h s VAL 276 Cb -0.13 -0.87 -0.04 0.00 -1.53 0.00 0.00 36.38 33.81 2c0h s VAL 276 CO -0.03 -0.01 0.12 -1.00 -3.33 0.00 0.00 175.10 170.85 2c0h s HIS 277 N -0.79 3.26 -0.18 1.54 0.09 -0.33 -1.15 115.29 117.73 2c0h s HIS 277 Ca 0.00 0.11 -0.09 0.00 -0.00 0.00 0.00 55.06 55.08 2c0h s HIS 277 Cb -0.07 -1.64 0.07 0.00 -0.00 0.00 0.00 32.58 30.94 2c0h s HIS 277 CO 0.01 0.54 0.43 -0.08 -0.00 0.00 0.00 174.74 175.64 2c0h s THR 278 N -1.46 -0.17 0.02 1.30 -1.32 -0.88 -4.21 115.64 108.91 2c0h s THR 278 Ca 0.31 0.10 0.02 0.00 -1.21 0.00 0.00 61.69 60.91 2c0h s THR 278 Cb -0.12 -0.65 -0.01 0.00 -1.51 0.00 0.00 72.50 70.20 2c0h s THR 278 CO 0.24 0.04 -0.07 -0.31 -2.21 0.00 0.00 174.62 172.31 2c0h s TYR 279 N 1.70 0.64 0.99 9.09 2.02 -1.26 -4.41 117.35 126.11 2c0h s TYR 279 Ca -0.08 -0.30 -0.14 0.00 -0.37 0.00 0.00 57.07 56.18 2c0h s TYR 279 Cb -0.09 -0.39 0.18 0.00 -0.40 0.00 0.00 41.96 41.26 2c0h s TYR 279 CO -0.13 -0.04 1.15 0.16 -1.57 0.00 0.00 175.55 175.12 2c0h s ASP 280 N -0.88 2.81 -0.03 2.29 1.47 -0.55 -4.82 116.67 116.97 2c0h s ASP 280 Ca -0.03 0.82 -0.01 0.00 1.18 0.00 0.00 52.55 54.51 2c0h s ASP 280 Cb -0.06 -1.26 0.03 0.00 -0.34 0.00 0.00 42.92 41.28 2c0h s ASP 280 CO 0.00 -2.97 0.04 0.86 0.68 0.00 0.00 175.17 173.78 2c0h s TRP 281 N -3.27 0.06 -1.50 2.11 -0.11 0.15 -4.83 118.94 111.54 2c0h s TRP 281 Ca 0.67 0.18 -0.05 0.00 1.22 0.00 0.00 56.10 58.12 2c0h s TRP 281 Cb -0.13 -0.35 0.04 0.00 -1.50 0.00 0.00 33.47 31.53 2c0h s TRP 281 CO 0.54 -0.14 0.44 1.04 -4.62 0.00 0.00 176.95 174.21 2c0h n GLN 282 N 4.67 -2.86 -1.53 5.86 6.02 -1.26 -1.84 117.38 126.44 2c0h n GLN 282 Ca -0.17 0.34 -0.16 0.00 -0.01 0.00 0.00 57.00 57.00 2c0h n GLN 282 Cb 0.50 -4.51 -0.06 0.00 1.02 0.00 0.00 30.24 27.19 2c0h n GLN 282 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2c0h n ASN 283 N -2.89 -4.91 -3.97 1.08 5.15 -1.26 -5.00 115.26 103.46 2c0h n ASN 283 Ca -0.22 0.36 -0.15 0.00 -0.60 0.00 0.00 54.58 53.97 2c0h n ASN 283 Cb 0.64 -3.83 -0.14 0.00 -0.53 0.00 0.00 39.78 35.93 2c0h n ASN 283 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 2c0h s HIS 284 N -2.61 0.47 0.27 1.20 3.76 -0.77 -4.56 115.29 113.04 2c0h s HIS 284 Ca 0.00 -0.13 -0.29 0.00 -0.15 0.00 0.00 55.06 54.49 2c0h s HIS 284 Cb 0.00 -0.30 -0.09 0.00 1.11 0.00 0.00 32.58 33.30 2c0h s HIS 284 CO 0.00 -0.02 0.96 -0.06 -0.85 0.00 0.00 174.74 174.78 2c0h s PHE 285 N -0.27 3.86 0.80 1.40 0.08 -1.26 -0.67 117.98 121.92 2c0h s PHE 285 Ca 0.00 1.86 -0.11 0.00 0.12 0.00 0.00 56.93 58.80 2c0h s PHE 285 Cb -0.03 -3.01 0.07 0.00 -0.57 0.00 0.00 43.02 39.48 2c0h s PHE 285 CO -0.00 0.25 1.09 0.20 -0.10 0.00 0.00 175.22 176.66 2c0h s GLY 286 N -1.24 1.66 0.64 4.36 0.00 -1.26 -4.93 107.32 106.55 2c0h s GLY 286 Ca 0.44 0.18 0.41 0.00 0.00 0.00 0.00 44.72 45.75 2c0h s GLY 286 CO 0.31 0.56 2.29 -0.57 0.00 0.00 0.00 173.10 175.70 2c0h h ASN 287 N -1.22 0.00 1.18 1.64 -1.24 -2.00 -1.69 115.58 112.25 2c0h h ASN 287 Ca -0.45 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.56 2c0h h ASN 287 Cb 1.24 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.29 2c0h h ASN 287 CO 0.52 0.00 0.00 -1.84 -1.29 0.00 0.00 177.43 174.83 2c0h n GLU 288 N -3.15 0.21 -2.00 6.67 0.00 -1.26 -4.91 120.64 116.20 2c0h n GLU 288 Ca -0.02 0.26 -0.41 0.00 0.00 0.00 0.00 57.16 56.99 2c0h n GLU 288 Cb 0.12 -1.79 -0.02 0.00 0.00 0.00 0.00 31.44 29.75 2c0h n GLU 288 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2c0h s SER 289 N -4.28 6.62 0.40 -1.84 0.15 -0.64 -4.67 113.70 109.44 2c0h s SER 289 Ca 0.09 2.76 0.27 0.00 0.70 0.00 0.00 55.95 59.77 2c0h s SER 289 Cb 0.12 -2.64 1.45 0.00 -1.71 0.00 0.00 66.02 63.24 2c0h s SER 289 CO 0.52 -0.69 1.84 1.55 1.20 0.00 0.00 173.24 177.66 2c0h h PRO 290 N 4.16 0.00 -0.00 5.44 0.13 -1.91 -1.25 132.00 138.56 2c0h h PRO 290 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2c0h h PRO 290 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2c0h h PRO 290 CO 0.72 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.68 2c0h n PHE 291 N -2.47 0.00 0.59 1.56 3.72 -1.26 -3.56 117.46 116.04 2c0h n PHE 291 Ca -0.01 -0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.45 2c0h n PHE 291 Cb 0.07 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.64 2c0h n PHE 291 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2c0h n LYS 292 N -0.74 1.30 -3.81 -1.08 4.76 -0.47 -5.03 118.16 113.09 2c0h n LYS 292 Ca 0.23 -1.10 -0.09 0.00 -2.87 0.00 0.00 58.31 54.47 2c0h n LYS 292 Cb 0.16 -1.24 -0.07 0.00 -1.84 0.00 0.00 35.03 32.05 2c0h n LYS 292 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 2c0h s HIS 293 N -1.35 0.07 0.55 2.13 3.76 -1.23 -5.06 115.29 114.16 2c0h s HIS 293 Ca 0.14 -0.46 -0.16 0.00 -0.15 0.00 0.00 55.06 54.43 2c0h s HIS 293 Cb 0.11 0.01 -0.06 0.00 1.11 0.00 0.00 32.58 33.75 2c0h s HIS 293 CO 0.23 -0.57 1.02 -1.12 -0.85 0.00 0.00 174.74 173.45 2c0h s SER 294 N -2.80 6.25 0.30 1.40 0.01 -1.26 -4.83 113.70 112.77 2c0h s SER 294 Ca 0.04 1.67 0.06 0.00 1.31 0.00 0.00 55.95 59.03 2c0h s SER 294 Cb 0.04 -2.52 0.79 0.00 0.21 0.00 0.00 66.02 64.54 2c0h s SER 294 CO -0.11 -0.84 1.70 0.15 0.41 0.00 0.00 173.24 174.55 2c0h h PHE 295 N 0.67 0.77 0.00 2.43 3.57 -1.54 -1.65 116.94 121.19 2c0h h PHE 295 Ca -0.47 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.07 2c0h h PHE 295 Cb 1.20 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 39.75 2c0h h PHE 295 CO 0.62 -0.02 -0.02 0.66 -2.23 0.00 0.00 178.31 177.32 2c0h h SER 296 N 0.45 0.00 -0.22 0.41 4.64 -1.92 -2.39 113.55 114.52 2c0h h SER 296 Ca 0.59 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.98 2c0h h SER 296 Cb 1.14 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.22 2c0h h SER 296 CO -0.52 0.02 0.16 -1.13 -0.87 0.00 0.00 176.83 174.50 2c0h h ASN 297 N 0.00 0.00 0.22 4.97 -0.73 -1.68 -3.06 115.58 115.30 2c0h h ASN 297 Ca -0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2c0h h ASN 297 Cb 0.17 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.76 2c0h h ASN 297 CO 0.00 0.00 -0.31 0.49 -0.37 0.00 0.00 177.43 177.24 2c0h n PHE 298 N -4.39 0.00 -3.63 0.67 3.72 -0.90 -4.89 117.46 108.04 2c0h n PHE 298 Ca 0.02 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.19 2c0h n PHE 298 Cb 0.31 -0.11 0.07 0.00 -0.94 0.00 0.00 39.48 38.80 2c0h n PHE 298 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2c0h n ARG 299 N -0.63 -6.82 -3.75 -1.08 5.12 -1.16 -4.39 116.66 103.96 2c0h n ARG 299 Ca 0.11 0.77 -0.29 0.00 -1.93 0.00 0.00 57.85 56.51 2c0h n ARG 299 Cb 0.36 -5.72 -0.04 0.00 -1.16 0.00 0.00 32.46 25.90 2c0h n ARG 299 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2c0h s LEU 300 N -6.99 4.27 -0.05 0.55 1.43 -1.26 -4.91 118.68 111.71 2c0h s LEU 300 Ca 0.38 0.42 0.11 0.00 -1.03 0.00 0.00 54.13 54.01 2c0h s LEU 300 Cb -0.18 -3.15 0.29 0.00 0.03 0.00 0.00 46.19 43.18 2c0h s LEU 300 CO 0.76 0.03 1.23 0.29 0.23 0.00 0.00 176.35 178.88 2c0h n LYS 301 N -0.26 2.75 -4.27 1.70 5.02 -1.26 -4.97 118.16 116.86 2c0h n LYS 301 Ca -0.04 -2.17 -0.15 0.00 -2.02 0.00 0.00 58.31 53.94 2c0h n LYS 301 Cb 0.53 -1.37 -0.10 0.00 -0.02 0.00 0.00 35.03 34.07 2c0h n LYS 301 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2c0h s LYS 302 N -1.62 1.15 0.80 1.97 1.02 -1.26 -4.53 119.74 117.27 2c0h s LYS 302 Ca 0.23 -1.54 -0.12 0.00 0.02 0.00 0.00 55.97 54.56 2c0h s LYS 302 Cb 0.16 -0.46 0.08 0.00 -0.52 0.00 0.00 37.83 37.09 2c0h s LYS 302 CO 0.09 -0.06 1.16 -2.14 -0.92 0.00 0.00 175.35 173.48 2c0h s PRO 303 N -3.85 1.80 -0.06 -1.68 0.02 -1.25 -4.76 135.00 125.22 2c0h s PRO 303 Ca 0.23 1.55 0.02 0.00 0.02 0.00 0.00 61.00 62.81 2c0h s PRO 303 Cb 0.05 -1.81 0.01 0.00 0.02 0.00 0.00 34.50 32.77 2c0h s PRO 303 CO 0.04 -2.05 -0.11 1.41 -0.33 0.00 0.00 177.00 175.95 2c0h s MET 304 N -4.38 1.54 -0.13 5.54 1.75 -1.26 -0.98 119.30 121.37 2c0h s MET 304 Ca 0.68 -0.38 -0.05 0.00 -1.25 0.00 0.00 55.69 54.69 2c0h s MET 304 Cb -0.24 -1.30 -0.04 0.00 2.84 0.00 0.00 34.83 36.09 2c0h s MET 304 CO 0.52 0.04 0.06 0.08 -0.65 0.00 0.00 175.02 175.07 2c0h s VAL 305 N 0.60 4.81 -0.65 10.11 1.01 -0.33 -0.56 120.40 135.39 2c0h s VAL 305 Ca -0.13 -0.04 -0.23 0.00 0.00 0.00 0.00 61.98 61.58 2c0h s VAL 305 Cb -0.15 -3.10 0.07 0.00 0.00 0.00 0.00 36.38 33.20 2c0h s VAL 305 CO 0.03 0.56 0.98 -0.63 0.00 0.00 0.00 175.10 176.03 2c0h s ILE 306 N -0.48 4.30 -0.91 2.22 1.01 -0.54 -1.77 121.20 125.03 2c0h s ILE 306 Ca 0.10 -0.27 0.25 0.00 0.00 0.00 0.00 60.65 60.73 2c0h s ILE 306 Cb -0.12 -4.68 0.02 0.00 0.01 0.00 0.00 42.46 37.69 2c0h s ILE 306 CO 0.02 -1.45 1.40 0.61 0.00 0.00 0.00 174.94 175.52 2c0h n GLY 307 N 5.31 -1.29 3.33 6.18 0.00 -0.30 -1.35 105.19 117.07 2c0h n GLY 307 Ca -0.03 -0.32 -0.11 0.00 0.00 0.00 0.00 46.02 45.56 2c0h n GLY 307 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2c0h s GLU 308 N -3.04 0.46 0.02 1.61 2.02 -1.18 -4.52 118.70 114.07 2c0h s GLU 308 Ca 0.10 0.79 -0.29 0.00 0.02 0.00 0.00 54.97 55.59 2c0h s GLU 308 Cb 0.17 0.07 0.10 0.00 0.10 0.00 0.00 34.13 34.56 2c0h s GLU 308 CO 0.70 -0.13 1.07 -0.59 0.02 0.00 0.00 175.26 176.33 2c0h s PHE 309 N 1.12 -0.15 0.17 1.61 -0.12 -1.23 -2.08 117.98 117.30 2c0h s PHE 309 Ca -0.07 -0.02 -0.23 0.00 -0.05 0.00 0.00 56.93 56.55 2c0h s PHE 309 Cb -0.07 0.57 0.06 0.00 -0.63 0.00 0.00 43.02 42.96 2c0h s PHE 309 CO -0.10 -0.52 0.69 0.54 -0.05 0.00 0.00 175.22 175.79 2c0h s ASN 310 N -2.74 -0.43 0.38 1.98 2.20 -1.26 -1.12 114.94 113.95 2c0h s ASN 310 Ca 0.11 -0.20 0.08 0.00 -0.94 0.00 0.00 52.86 51.91 2c0h s ASN 310 Cb 0.01 0.60 0.76 0.00 -2.00 0.00 0.00 41.25 40.62 2c0h s ASN 310 CO -0.03 -1.03 1.92 -0.61 -2.94 0.00 0.00 177.10 174.41 2c0h h GLN 311 N 2.00 0.32 0.00 3.55 4.15 -1.93 -2.35 115.11 120.85 2c0h h GLN 311 Ca -0.28 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.07 2c0h h GLN 311 Cb 1.28 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.92 2c0h h GLN 311 CO 0.32 0.40 -0.05 0.93 -1.93 0.00 0.00 178.83 178.51 2c0h h GLU 312 N 0.31 0.00 -0.72 1.69 3.07 -1.96 -2.26 114.58 114.70 2c0h h GLU 312 Ca 0.07 0.00 -0.52 0.00 -0.50 0.00 0.00 59.36 58.41 2c0h h GLU 312 Cb 0.32 0.00 -0.43 0.00 -0.84 0.00 0.00 28.75 27.81 2c0h h GLU 312 CO 0.01 0.05 -0.85 0.72 -1.40 0.00 0.00 179.01 177.54 2c0h n HIS 313 N -4.06 2.59 -0.93 4.33 8.25 -0.93 -4.83 115.22 119.64 2c0h n HIS 313 Ca -0.03 -2.22 0.08 0.00 -0.26 0.00 0.00 57.72 55.30 2c0h n HIS 313 Cb 0.13 -0.33 0.25 0.00 1.12 0.00 0.00 29.99 31.16 2c0h n HIS 313 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2c0h n GLY 314 N -0.70 3.97 3.55 -1.41 0.00 -0.85 -1.48 105.19 108.27 2c0h n GLY 314 Ca 0.40 -0.99 -0.26 0.00 0.00 0.00 0.00 46.02 45.16 2c0h n GLY 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c0h n ALA 315 N -0.47 -1.17 -0.30 4.61 0.00 -1.26 -1.27 120.51 120.65 2c0h n ALA 315 Ca 0.20 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.88 2c0h n ALA 315 Cb 0.85 -4.21 0.00 0.00 0.00 0.00 0.00 19.45 16.09 2c0h n ALA 315 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c0h n GLY 316 N -1.61 1.43 3.75 0.00 0.00 -1.26 -4.92 105.19 102.59 2c0h n GLY 316 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2c0h n GLY 316 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2c0h s MET 317 N -0.35 4.60 0.71 1.61 -1.94 -0.39 -5.04 119.30 118.49 2c0h s MET 317 Ca 0.00 1.83 -0.12 0.00 -1.71 0.00 0.00 55.69 55.68 2c0h s MET 317 Cb 0.00 -3.20 0.02 0.00 2.01 0.00 0.00 34.83 33.66 2c0h s MET 317 CO 0.00 0.13 1.09 -1.54 -0.01 0.00 0.00 175.02 174.69 2c0h s SER 318 N -0.59 4.94 0.24 3.03 1.04 -1.26 -4.77 113.70 116.33 2c0h s SER 318 Ca 0.47 1.85 -0.04 0.00 0.48 0.00 0.00 55.95 58.70 2c0h s SER 318 Cb -0.32 -2.53 0.42 0.00 0.10 0.00 0.00 66.02 63.69 2c0h s SER 318 CO 0.40 -1.74 1.77 0.28 0.98 0.00 0.00 173.24 174.93 2c0h h SER 319 N -0.56 0.47 -0.45 7.02 0.02 -1.94 -1.51 113.55 116.60 2c0h h SER 319 Ca -0.45 0.08 0.04 0.00 -0.84 0.00 0.00 61.79 60.62 2c0h h SER 319 Cb 1.23 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.73 2c0h h SER 319 CO 0.54 0.24 0.22 -0.33 -1.14 0.00 0.00 176.83 176.35 2c0h h GLU 320 N 0.60 0.42 -0.40 3.45 3.07 -1.85 -1.58 114.58 118.29 2c0h h GLU 320 Ca 0.40 -0.03 -0.06 0.00 -0.50 0.00 0.00 59.36 59.18 2c0h h GLU 320 Cb 0.49 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.29 2c0h h GLU 320 CO -0.32 0.28 0.01 0.77 -1.40 0.00 0.00 179.01 178.36 2c0h h SER 321 N 0.43 0.59 -0.12 1.42 0.02 -1.74 0.28 113.55 114.44 2c0h h SER 321 Ca 0.20 -0.12 -0.06 0.00 -0.84 0.00 0.00 61.79 60.97 2c0h h SER 321 Cb 0.12 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 62.50 2c0h h SER 321 CO -0.15 0.66 -0.17 0.24 -1.14 0.00 0.00 176.83 176.27 2c0h h MET 322 N 0.60 0.32 -0.85 3.45 2.86 -0.97 -0.34 114.93 119.99 2c0h h MET 322 Ca 0.13 -0.19 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2c0h h MET 322 Cb 0.36 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.99 2c0h h MET 322 CO 0.01 0.76 0.55 0.74 1.06 0.00 0.00 176.91 180.03 2c0h h PHE 323 N -0.09 1.09 -0.56 -0.22 0.04 -1.19 -2.18 116.94 113.82 2c0h h PHE 323 Ca 0.01 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 2c0h h PHE 323 Cb 0.72 -0.37 -0.03 0.00 2.20 0.00 0.00 35.95 38.48 2c0h h PHE 323 CO 0.10 0.70 0.31 1.49 -0.60 0.00 0.00 178.31 180.30 2c0h h GLU 324 N 1.16 0.78 -0.01 1.51 4.57 -0.81 -0.70 114.58 121.08 2c0h h GLU 324 Ca 0.31 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.40 2c0h h GLU 324 Cb -0.11 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.33 2c0h h GLU 324 CO -0.06 0.60 0.01 2.35 -1.18 0.00 0.00 179.01 180.72 2c0h h TRP 325 N 0.75 0.01 -0.59 0.92 2.91 -0.85 -0.77 115.95 118.34 2c0h h TRP 325 Ca 0.20 0.00 0.03 0.00 1.13 0.00 0.00 58.89 60.24 2c0h h TRP 325 Cb 0.05 -0.00 -0.04 0.00 -0.51 0.00 0.00 29.16 28.66 2c0h h TRP 325 CO -0.01 0.01 0.36 0.00 -1.03 0.00 0.00 178.44 177.77 2c0h h ALA 326 N 1.00 0.76 -0.40 2.65 0.00 -1.21 -0.87 119.26 121.19 2c0h h ALA 326 Ca 0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 2c0h h ALA 326 Cb 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2c0h h ALA 326 CO -0.00 0.09 -0.34 -0.92 0.00 0.00 0.00 179.25 178.08 2c0h h TYR 327 N 0.71 1.09 0.00 0.00 3.20 -0.89 -2.96 116.97 118.12 2c0h h TYR 327 Ca 0.24 -0.31 0.00 0.00 3.14 0.00 0.00 58.73 61.80 2c0h h TYR 327 Cb 0.02 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.05 2c0h h TYR 327 CO -0.06 1.13 -1.21 0.25 -1.64 0.00 0.00 178.16 176.63 2c0h n THR 328 N -4.07 0.10 -0.88 1.81 -2.24 -0.32 -4.39 114.28 104.29 2c0h n THR 328 Ca -0.02 -0.24 0.08 0.00 -2.27 0.00 0.00 64.05 61.60 2c0h n THR 328 Cb 0.52 0.34 0.34 0.00 -2.10 0.00 0.00 70.33 69.43 2c0h n THR 328 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2c0h n LYS 329 N -1.92 3.99 0.00 -0.78 4.76 -0.35 -4.94 118.16 118.92 2c0h n LYS 329 Ca 0.01 -2.98 0.00 0.00 -2.87 0.00 0.00 58.31 52.47 2c0h n LYS 329 Cb 0.44 -2.04 0.00 0.00 -1.84 0.00 0.00 35.03 31.59 2c0h n LYS 329 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2c0h n GLY 330 N 0.26 0.70 3.89 0.72 0.00 -1.26 -1.39 105.19 108.10 2c0h n GLY 330 Ca 0.25 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.97 2c0h n GLY 330 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2c0h s TYR 331 N -2.00 3.38 -1.04 1.61 2.02 -1.12 -4.80 117.35 115.41 2c0h s TYR 331 Ca 0.00 1.02 0.09 0.00 -0.37 0.00 0.00 57.07 57.80 2c0h s TYR 331 Cb 0.00 -2.92 0.08 0.00 -0.40 0.00 0.00 41.96 38.73 2c0h s TYR 331 CO 0.00 -0.99 0.81 0.43 -1.57 0.00 0.00 175.55 174.23 2c0h n SER 332 N -2.86 1.82 -3.61 2.29 7.64 0.28 -4.73 113.62 114.44 2c0h n SER 332 Ca 0.06 -1.42 -0.02 0.00 1.01 0.00 0.00 58.87 58.50 2c0h n SER 332 Cb 0.57 -0.02 -0.01 0.00 -1.01 0.00 0.00 64.21 63.73 2c0h n SER 332 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2c0h s GLY 333 N -0.75 -0.35 -0.20 0.23 0.00 -1.25 -1.44 107.32 103.57 2c0h s GLY 333 Ca 0.11 1.13 -0.06 0.00 0.00 0.00 0.00 44.72 45.90 2c0h s GLY 333 CO 0.11 0.33 0.41 0.00 0.00 0.00 0.00 173.10 173.94 2c0h s ALA 334 N -2.48 -1.12 -0.19 3.20 0.00 0.10 -1.47 121.76 119.80 2c0h s ALA 334 Ca 0.11 1.42 0.01 0.00 0.00 0.00 0.00 51.96 53.50 2c0h s ALA 334 Cb 0.01 -1.34 0.02 0.00 0.00 0.00 0.00 23.12 21.82 2c0h s ALA 334 CO -0.04 -0.80 -0.19 -1.58 0.00 0.00 0.00 175.76 173.15 2c0h s TRP 335 N 2.60 2.79 0.66 0.00 0.51 -0.46 -1.82 118.94 123.21 2c0h s TRP 335 Ca -0.00 -1.70 -0.12 0.00 -2.12 0.00 0.00 56.10 52.16 2c0h s TRP 335 Cb -0.12 -1.90 -0.01 0.00 -0.81 0.00 0.00 33.47 30.62 2c0h s TRP 335 CO -0.13 -0.81 1.06 0.95 -0.51 0.00 0.00 176.95 177.51 2c0h s THR 336 N 1.28 4.00 -0.23 2.01 -4.23 -0.85 -3.10 115.64 114.52 2c0h s THR 336 Ca 0.04 0.75 -0.03 0.00 -1.18 0.00 0.00 61.69 61.26 2c0h s THR 336 Cb -0.14 -3.42 0.00 0.00 1.34 0.00 0.00 72.50 70.28 2c0h s THR 336 CO -0.12 -0.75 -0.05 0.86 -0.54 0.00 0.00 174.62 174.02 2c0h s TRP 337 N -2.85 2.97 0.36 3.99 -0.11 -0.28 -1.06 118.94 121.97 2c0h s TRP 337 Ca 0.60 -1.10 -0.08 0.00 1.22 0.00 0.00 56.10 56.74 2c0h s TRP 337 Cb -0.14 -2.09 0.03 0.00 -1.50 0.00 0.00 33.47 29.76 2c0h s TRP 337 CO 0.49 -0.60 0.61 -1.54 -4.62 0.00 0.00 176.95 171.29 2c0h s SER 338 N 1.44 0.54 0.33 5.86 1.04 -1.25 -4.65 113.70 117.00 2c0h s SER 338 Ca 0.05 -1.34 0.03 0.00 0.48 0.00 0.00 55.95 55.16 2c0h s SER 338 Cb -0.15 0.75 0.63 0.00 0.10 0.00 0.00 66.02 67.35 2c0h s SER 338 CO -0.04 -1.47 1.93 -0.09 0.98 0.00 0.00 173.24 174.54 2c0h h ARG 339 N 2.06 0.88 0.00 4.02 9.65 -0.72 -2.53 114.38 127.73 2c0h h ARG 339 Ca -0.30 -0.05 -0.10 0.00 -1.10 0.00 0.00 59.98 58.43 2c0h h ARG 339 Cb 1.24 -0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 29.61 2c0h h ARG 339 CO 0.39 0.58 -0.45 1.79 2.80 0.00 0.00 179.97 185.08 2c0h h THR 340 N 0.91 0.80 -2.42 0.20 1.35 -1.78 -3.46 112.91 108.51 2c0h h THR 340 Ca 0.36 -2.07 -0.58 0.00 -0.55 0.00 0.00 66.41 63.58 2c0h h THR 340 Cb 0.25 2.35 -0.11 0.00 -1.73 0.00 0.00 68.15 68.92 2c0h h THR 340 CO -0.13 0.44 -0.67 -1.81 -0.25 0.00 0.00 175.52 173.10 2c0h s ASP 341 N -6.43 4.45 0.31 5.36 1.11 -0.95 -5.06 116.67 115.46 2c0h s ASP 341 Ca 0.04 -0.63 0.00 0.00 0.18 0.00 0.00 52.55 52.14 2c0h s ASP 341 Cb 0.08 -0.80 0.00 0.00 1.07 0.00 0.00 42.92 43.26 2c0h s ASP 341 CO 0.73 0.03 0.00 1.33 1.18 0.00 0.00 175.17 178.44 2c0h n VAL 342 N -0.63 0.00 -3.17 -1.27 0.24 -1.26 -3.93 118.33 108.32 2c0h n VAL 342 Ca -0.07 0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 61.82 2c0h n VAL 342 Cb 0.58 0.00 -0.07 0.00 -1.47 0.00 0.00 33.84 32.88 2c0h n VAL 342 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2c0h s SER 343 N -4.00 6.48 0.15 -1.34 0.15 -1.26 -4.95 113.70 108.93 2c0h s SER 343 Ca 0.00 0.51 -0.11 0.00 0.70 0.00 0.00 55.95 57.05 2c0h s SER 343 Cb 0.00 -2.31 -0.02 0.00 -1.71 0.00 0.00 66.02 61.98 2c0h s SER 343 CO 0.00 -0.38 1.51 -0.25 1.20 0.00 0.00 173.24 175.32 2c0h h TRP 344 N 8.06 1.12 -0.84 3.44 -0.00 -1.86 -3.12 115.95 122.76 2c0h h TRP 344 Ca -0.28 -0.30 0.04 0.00 -0.00 0.00 0.00 58.89 58.36 2c0h h TRP 344 Cb 1.13 -0.25 -0.05 0.00 -0.00 0.00 0.00 29.16 29.99 2c0h h TRP 344 CO 0.75 1.13 0.55 -0.91 -0.00 0.00 0.00 178.44 179.96 2c0h h ASN 345 N 0.79 0.87 -0.91 2.65 2.35 -1.98 -1.25 115.58 118.10 2c0h h ASN 345 Ca 0.09 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2c0h h ASN 345 Cb 0.88 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 39.01 2c0h h ASN 345 CO 0.08 0.59 0.57 0.78 -1.65 0.00 0.00 177.43 177.80 2c0h h ASN 346 N 1.00 1.07 -0.23 5.81 2.35 -1.97 -0.78 115.58 122.84 2c0h h ASN 346 Ca 0.34 -0.05 -0.05 0.00 -0.55 0.00 0.00 56.30 55.99 2c0h h ASN 346 Cb 0.09 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.18 2c0h h ASN 346 CO -0.11 0.81 -0.06 1.56 -1.65 0.00 0.00 177.43 177.98 2c0h h GLN 347 N 1.25 0.44 -0.74 0.81 4.20 -1.32 -2.28 115.11 117.47 2c0h h GLN 347 Ca 0.33 -0.17 -0.03 0.00 0.06 0.00 0.00 58.65 58.83 2c0h h GLN 347 Cb -0.09 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.63 2c0h h GLN 347 CO -0.07 0.68 0.33 -0.07 -0.67 0.00 0.00 178.83 179.03 2c0h h LEU 348 N 0.18 0.98 -1.01 1.46 3.38 -1.11 -1.62 115.31 117.57 2c0h h LEU 348 Ca 0.06 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 2c0h h LEU 348 Cb 0.52 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2c0h h LEU 348 CO 0.02 0.85 0.10 -0.09 0.09 0.00 0.00 178.44 179.41 2c0h h ARG 349 N 1.06 0.81 0.01 1.13 2.43 -1.07 -1.01 114.38 117.74 2c0h h ARG 349 Ca 0.25 -0.18 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2c0h h ARG 349 Cb 0.15 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 2c0h h ARG 349 CO -0.03 0.75 -0.00 0.78 -1.51 0.00 0.00 179.97 179.96 2c0h h GLY 350 N 0.97 -0.01 0.63 2.80 0.00 -0.96 -2.93 103.07 103.56 2c0h h GLY 350 Ca 0.17 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.57 2c0h h GLY 350 CO 0.00 -0.00 0.32 -0.33 0.00 0.00 0.00 176.54 176.53 2c0h h MET 351 N -0.18 0.58 -0.12 4.80 2.86 -1.10 -2.41 114.93 119.36 2c0h h MET 351 Ca -0.00 -0.03 0.03 0.00 -2.06 0.00 0.00 59.70 57.64 2c0h h MET 351 Cb 0.18 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 31.70 2c0h h MET 351 CO 0.00 0.38 0.09 0.37 1.06 0.00 0.00 176.91 178.81 2c0h h GLN 352 N 0.60 0.00 -0.20 1.72 4.15 -0.85 -1.79 115.11 118.74 2c0h h GLN 352 Ca 0.29 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.71 2c0h h GLN 352 Cb 0.22 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 2c0h h GLN 352 CO -0.20 0.00 0.11 1.25 -1.93 0.00 0.00 178.83 178.05 2c0h h HIS 353 N 0.00 0.26 -0.01 3.99 2.76 -1.24 -2.37 115.15 118.53 2c0h h HIS 353 Ca 0.06 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 2c0h h HIS 353 Cb 0.23 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.10 2c0h h HIS 353 CO 0.00 0.18 -0.25 1.28 -1.30 0.00 0.00 177.93 177.84 2c0h n LEU 354 N -4.48 1.68 -0.20 0.26 4.77 -0.68 -4.69 117.00 113.66 2c0h n LEU 354 Ca -0.00 -0.55 -0.01 0.00 -0.03 0.00 0.00 56.01 55.42 2c0h n LEU 354 Cb 0.10 -0.05 0.06 0.00 -2.33 0.00 0.00 43.42 41.20 2c0h n LEU 354 CO 0.35 0.30 0.75 0.50 -1.33 0.00 0.00 177.39 177.96 2c0h h LYS 355 N 2.24 0.01 -0.55 3.23 3.64 -1.38 -1.12 116.57 122.63 2c0h h LYS 355 Ca 0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2c0h h LYS 355 Cb 0.65 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 2c0h h LYS 355 CO 0.00 0.01 0.00 0.43 -2.27 0.00 0.00 179.45 177.62 2c0h n SER 356 N -5.41 3.01 -4.79 4.20 7.64 -1.26 -4.18 113.62 112.83 2c0h n SER 356 Ca 0.07 -2.05 -0.39 0.00 1.01 0.00 0.00 58.87 57.51 2c0h n SER 356 Cb 0.32 -0.38 -0.06 0.00 -1.01 0.00 0.00 64.21 63.08 2c0h n SER 356 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2c0h s ARG 357 N -1.35 4.47 0.00 1.43 1.81 -0.43 -4.96 118.95 119.92 2c0h s ARG 357 Ca 0.36 1.04 0.00 0.00 -1.72 0.00 0.00 55.73 55.42 2c0h s ARG 357 Cb 0.20 -3.24 0.00 0.00 -0.45 0.00 0.00 34.95 31.45 2c0h s ARG 357 CO 0.24 0.58 0.13 0.25 -0.68 0.00 0.00 175.30 175.82 2c0h n THR 358 N 1.60 0.00 0.30 0.02 -2.24 -1.26 -3.49 114.28 109.21 2c0h n THR 358 Ca -0.07 -0.19 0.17 0.00 -2.27 0.00 0.00 64.05 61.69 2c0h n THR 358 Cb 0.49 1.43 0.93 0.00 -2.10 0.00 0.00 70.33 71.08 2c0h n THR 358 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 2c0h h ASP 359 N 0.00 0.00 -0.63 3.42 2.03 -2.00 -2.97 116.42 116.27 2c0h h ASP 359 Ca 0.00 0.00 -0.34 0.00 -0.73 0.00 0.00 57.03 55.96 2c0h h ASP 359 Cb 0.22 0.00 -0.41 0.00 -0.83 0.00 0.00 39.33 38.31 2c0h h ASP 359 CO 0.00 0.04 -1.05 1.41 -1.03 0.00 0.00 179.24 178.61 2c0h n HIS 360 N -3.46 1.65 0.00 4.15 8.25 -1.26 -5.10 115.22 119.45 2c0h n HIS 360 Ca -0.02 -2.29 0.00 0.00 -0.26 0.00 0.00 57.72 55.15 2c0h n HIS 360 Cb 0.15 -0.27 0.00 0.00 1.12 0.00 0.00 29.99 31.00 2c0h n HIS 360 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2c0h n GLY 361 N -0.54 2.59 3.74 -1.41 0.00 -1.12 -4.63 105.19 103.82 2c0h n GLY 361 Ca 0.16 -1.76 -0.41 0.00 0.00 0.00 0.00 46.02 44.02 2c0h n GLY 361 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c0h s GLN 362 N -3.93 4.49 -0.24 1.61 -0.21 0.02 -4.18 119.66 117.23 2c0h s GLN 362 Ca 0.00 1.92 0.03 0.00 0.02 0.00 0.00 55.36 57.33 2c0h s GLN 362 Cb 0.00 -3.21 -0.16 0.00 1.00 0.00 0.00 33.01 30.64 2c0h s GLN 362 CO 0.00 -0.07 -0.20 0.28 -2.12 0.00 0.00 175.29 173.19 2c0h n VAL 363 N 2.13 1.37 -3.31 1.09 0.31 -1.23 -1.93 118.33 116.76 2c0h n VAL 363 Ca 0.03 -0.54 -0.44 0.00 -0.01 0.00 0.00 64.34 63.38 2c0h n VAL 363 Cb 0.44 -1.30 -0.07 0.00 -0.91 0.00 0.00 33.84 32.00 2c0h n VAL 363 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2c0h s GLN 364 N -2.48 3.04 0.03 5.55 1.11 -1.26 -4.73 119.66 120.92 2c0h s GLN 364 Ca -0.31 -1.12 0.01 0.00 0.01 0.00 0.00 55.36 53.96 2c0h s GLN 364 Cb 0.08 -4.09 -0.02 0.00 -1.01 0.00 0.00 33.01 27.96 2c0h s GLN 364 CO 0.57 -1.05 -0.06 -0.59 0.01 0.00 0.00 175.29 174.16 2c0h s PHE 365 N 2.02 0.53 0.30 0.91 -0.12 -1.26 -5.12 117.98 115.23 2c0h s PHE 365 Ca 0.09 -0.51 -0.21 0.00 -0.05 0.00 0.00 56.93 56.25 2c0h s PHE 365 Cb -0.22 -0.33 -0.09 0.00 -0.63 0.00 0.00 43.02 41.75 2c0h s PHE 365 CO 0.09 -0.12 0.81 0.20 -0.05 0.00 0.00 175.22 176.16 2c0h s GLY 366 N -1.54 2.58 0.00 1.99 0.00 -1.26 -5.00 107.32 104.09 2c0h s GLY 366 Ca -0.12 0.26 0.31 0.00 0.00 0.00 0.00 44.72 45.17 2c0h s GLY 366 CO -0.00 0.60 2.10 1.04 0.00 0.00 0.00 173.10 176.84