#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m3d n GLY 5 N 0.00 0.78 3.78 -1.41 0.00 -1.26 -5.08 105.19 102.00 1m3d n GLY 5 Ca 0.00 -0.17 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 1m3d n GLY 5 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1m3d s PHE 6 N -1.99 3.53 0.11 1.61 0.40 -1.24 -4.96 117.98 115.44 1m3d s PHE 6 Ca 0.00 1.73 0.06 0.00 -0.60 0.00 0.00 56.93 58.11 1m3d s PHE 6 Cb 0.00 -3.01 -0.04 0.00 0.51 0.00 0.00 43.02 40.49 1m3d s PHE 6 CO 0.00 -0.12 -0.15 -0.51 0.70 0.00 0.00 175.22 175.14 1m3d s LEU 7 N -2.26 2.36 -0.06 -0.37 1.43 -1.26 -0.53 118.68 118.00 1m3d s LEU 7 Ca 0.53 -0.75 -0.04 0.00 -1.03 0.00 0.00 54.13 52.84 1m3d s LEU 7 Cb -0.20 -0.57 0.03 0.00 0.03 0.00 0.00 46.19 45.48 1m3d s LEU 7 CO 0.26 -0.11 0.15 0.54 0.23 0.00 0.00 176.35 177.41 1m3d s VAL 8 N -1.84 -0.03 -0.08 -1.59 0.11 0.18 -4.86 120.40 112.29 1m3d s VAL 8 Ca 0.06 0.11 -0.00 0.00 -2.93 0.00 0.00 61.98 59.22 1m3d s VAL 8 Cb -0.07 -0.23 -0.03 0.00 -1.53 0.00 0.00 36.38 34.52 1m3d s VAL 8 CO 0.03 0.04 -0.04 -0.89 -3.33 0.00 0.00 175.10 170.91 1m3d s THR 9 N 0.75 3.91 0.01 5.04 2.01 -1.20 -0.38 115.64 125.78 1m3d s THR 9 Ca -0.06 -0.40 0.06 0.00 0.31 0.00 0.00 61.69 61.60 1m3d s THR 9 Cb -0.07 -2.62 -0.02 0.00 0.01 0.00 0.00 72.50 69.80 1m3d s THR 9 CO -0.04 0.60 -0.17 -0.60 -0.69 0.00 0.00 174.62 173.72 1m3d s ARG 10 N -0.80 1.27 -0.14 4.92 3.52 0.22 -4.72 118.95 123.23 1m3d s ARG 10 Ca 0.12 -0.71 0.02 0.00 -0.13 0.00 0.00 55.73 55.03 1m3d s ARG 10 Cb -0.11 -1.28 0.00 0.00 -1.56 0.00 0.00 34.95 32.00 1m3d s ARG 10 CO 0.02 0.34 -0.19 -1.01 -0.81 0.00 0.00 175.30 173.65 1m3d s HIS 11 N -0.57 2.70 0.20 5.12 3.76 -1.26 -0.71 115.29 124.53 1m3d s HIS 11 Ca 0.06 -1.10 0.07 0.00 -0.15 0.00 0.00 55.06 53.94 1m3d s HIS 11 Cb -0.07 -1.82 0.11 0.00 1.11 0.00 0.00 32.58 31.90 1m3d s HIS 11 CO 0.00 -0.48 1.46 0.66 -0.85 0.00 0.00 174.74 175.54 1m3d h SER 12 N 7.12 0.07 -1.34 1.40 4.64 -1.22 -3.46 113.55 120.76 1m3d h SER 12 Ca -0.29 -0.05 -0.27 0.00 -0.47 0.00 0.00 61.79 60.71 1m3d h SER 12 Cb 1.20 -0.02 -0.05 0.00 -0.31 0.00 0.00 62.40 63.22 1m3d h SER 12 CO 0.54 0.83 -0.30 0.00 -0.87 0.00 0.00 176.83 177.03 1m3d n GLN 13 N -3.64 -1.00 -4.03 4.77 6.02 -1.26 -4.96 117.38 113.28 1m3d n GLN 13 Ca -0.01 0.78 -0.12 0.00 -0.01 0.00 0.00 57.00 57.63 1m3d n GLN 13 Cb 0.75 -4.94 -0.04 0.00 1.02 0.00 0.00 30.24 27.03 1m3d n GLN 13 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1m3d s THR 14 N -2.59 0.00 -1.57 5.09 -4.23 -1.26 -4.12 115.64 106.97 1m3d s THR 14 Ca 0.00 -1.48 0.30 0.00 -1.18 0.00 0.00 61.69 59.33 1m3d s THR 14 Cb 0.00 -2.56 0.61 0.00 1.34 0.00 0.00 72.50 71.89 1m3d s THR 14 CO 0.00 0.00 2.09 0.35 -0.54 0.00 0.00 174.62 176.52 1m3d n THR 15 N -0.51 0.01 -3.42 3.99 -2.24 -1.26 -1.81 114.28 109.04 1m3d n THR 15 Ca -0.01 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.42 1m3d n THR 15 Cb 0.61 -0.51 -0.06 0.00 -2.10 0.00 0.00 70.33 68.28 1m3d n THR 15 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1m3d s ASP 16 N -2.43 6.76 0.23 3.42 1.01 -1.26 -4.83 116.67 119.56 1m3d s ASP 16 Ca 0.33 0.99 -0.30 0.00 0.71 0.00 0.00 52.55 54.28 1m3d s ASP 16 Cb 0.21 -2.25 -0.09 0.00 1.01 0.00 0.00 42.92 41.79 1m3d s ASP 16 CO 0.44 0.10 1.31 -1.81 0.21 0.00 0.00 175.17 175.42 1m3d s ASP 17 N -1.79 6.88 0.50 0.27 1.01 -1.26 -4.54 116.67 117.74 1m3d s ASP 17 Ca 0.37 2.46 -0.17 0.00 0.71 0.00 0.00 52.55 55.92 1m3d s ASP 17 Cb -0.14 -2.62 -0.08 0.00 1.01 0.00 0.00 42.92 41.09 1m3d s ASP 17 CO 0.19 -0.52 0.98 -2.16 0.21 0.00 0.00 175.17 173.88 1m3d s PRO 18 N -0.47 3.98 0.28 8.23 0.04 -1.26 -5.00 135.00 140.79 1m3d s PRO 18 Ca 0.55 0.97 -0.23 0.00 0.04 0.00 0.00 61.00 62.33 1m3d s PRO 18 Cb -0.37 -2.14 -0.09 0.00 0.04 0.00 0.00 34.50 31.94 1m3d s PRO 18 CO 0.41 -0.24 0.85 -1.14 0.04 0.00 0.00 177.00 176.91 1m3d s GLN 19 N -3.97 4.45 0.43 4.56 0.74 -1.26 -4.73 119.66 119.88 1m3d s GLN 19 Ca 0.59 1.13 -0.25 0.00 0.05 0.00 0.00 55.36 56.89 1m3d s GLN 19 Cb -0.10 -2.85 -0.08 0.00 1.10 0.00 0.00 33.01 31.08 1m3d s GLN 19 CO 0.29 0.34 1.28 0.00 -0.55 0.00 0.00 175.29 176.65 1m3d n PRO 21 N -0.10 -0.29 -1.66 0.00 -0.02 -1.26 -4.86 135.00 126.80 1m3d n PRO 21 Ca 0.05 -0.02 -0.47 0.00 -2.02 0.00 0.00 63.50 61.05 1m3d n PRO 21 Cb 0.45 -2.36 -0.04 0.00 -0.02 0.00 0.00 33.50 31.53 1m3d n PRO 21 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1m3d n PRO 22 N -3.84 2.03 -0.53 0.52 -0.02 -1.26 -1.89 135.00 130.01 1m3d n PRO 22 Ca 0.12 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 1m3d n PRO 22 Cb 0.52 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1m3d n PRO 22 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1m3d n GLY 23 N 3.28 0.77 3.51 -1.23 0.00 -1.26 -4.93 105.19 105.32 1m3d n GLY 23 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 1m3d n GLY 23 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1m3d s THR 24 N -3.07 2.47 0.02 2.61 -4.23 -0.79 -4.34 115.64 108.31 1m3d s THR 24 Ca 0.00 -2.31 0.07 0.00 -1.18 0.00 0.00 61.69 58.28 1m3d s THR 24 Cb 0.00 -2.45 -0.02 0.00 1.34 0.00 0.00 72.50 71.37 1m3d s THR 24 CO 0.00 -0.33 -0.23 -1.59 -0.54 0.00 0.00 174.62 171.93 1m3d s LYS 25 N -3.56 1.66 0.35 3.99 -2.85 -0.68 -4.76 119.74 113.88 1m3d s LYS 25 Ca 0.31 -0.91 -0.28 0.00 -1.00 0.00 0.00 55.97 54.09 1m3d s LYS 25 Cb -0.03 -1.71 -0.11 0.00 -2.06 0.00 0.00 37.83 33.93 1m3d s LYS 25 CO 0.16 0.45 1.40 -1.50 0.10 0.00 0.00 175.35 175.96 1m3d s ILE 26 N -0.67 2.38 -0.09 3.79 1.10 -1.26 -0.52 121.20 125.93 1m3d s ILE 26 Ca 0.09 0.38 -0.07 0.00 -0.51 0.00 0.00 60.65 60.54 1m3d s ILE 26 Cb -0.09 -3.24 -0.04 0.00 0.15 0.00 0.00 42.46 39.24 1m3d s ILE 26 CO 0.01 0.09 -0.16 0.18 -2.11 0.00 0.00 174.94 172.95 1m3d n LEU 27 N 0.70 1.11 -3.56 8.50 4.32 0.02 -4.82 117.00 123.26 1m3d n LEU 27 Ca 0.01 0.18 -0.07 0.00 -0.02 0.00 0.00 56.01 56.11 1m3d n LEU 27 Cb 0.40 -0.42 -0.02 0.00 -1.62 0.00 0.00 43.42 41.76 1m3d n LEU 27 CO 0.61 -0.04 0.74 -0.72 -1.22 0.00 0.00 177.39 176.77 1m3d s TYR 28 N -2.30 -0.27 0.33 -1.77 -0.85 -1.17 -5.02 117.35 106.30 1m3d s TYR 28 Ca -0.16 0.12 0.09 0.00 -0.52 0.00 0.00 57.07 56.59 1m3d s TYR 28 Cb 0.05 0.55 -0.05 0.00 0.38 0.00 0.00 41.96 42.90 1m3d s TYR 28 CO 0.21 -0.55 0.08 -1.01 -1.52 0.00 0.00 175.55 172.76 1m3d s HIS 29 N -3.05 2.65 0.00 -3.49 3.76 -1.26 -1.27 115.29 112.63 1m3d s HIS 29 Ca 0.07 -0.38 0.00 0.00 -0.15 0.00 0.00 55.06 54.60 1m3d s HIS 29 Cb -0.01 -1.53 0.00 0.00 1.11 0.00 0.00 32.58 32.16 1m3d s HIS 29 CO -0.06 0.43 0.00 0.41 -0.85 0.00 0.00 174.74 174.66 1m3d n GLY 30 N -1.05 1.91 3.66 -2.22 0.00 -0.64 -4.52 105.19 102.33 1m3d n GLY 30 Ca -0.04 -0.65 -0.33 0.00 0.00 0.00 0.00 46.02 45.00 1m3d n GLY 30 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1m3d s TYR 31 N -2.38 3.05 -0.66 1.61 2.02 0.49 -1.11 117.35 120.36 1m3d s TYR 31 Ca 0.00 0.07 -0.27 0.00 -0.37 0.00 0.00 57.07 56.50 1m3d s TYR 31 Cb 0.00 -1.68 0.01 0.00 -0.40 0.00 0.00 41.96 39.90 1m3d s TYR 31 CO 0.00 0.44 1.46 -1.12 -1.57 0.00 0.00 175.55 174.75 1m3d s SER 32 N -1.40 5.93 -0.17 2.29 0.01 -0.42 -1.99 113.70 117.95 1m3d s SER 32 Ca 0.18 -0.07 -0.20 0.00 1.31 0.00 0.00 55.95 57.17 1m3d s SER 32 Cb -0.11 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 63.54 1m3d s SER 32 CO 0.08 -1.94 0.57 -0.22 0.41 0.00 0.00 173.24 172.15 1m3d s LEU 33 N 6.64 4.18 -0.20 2.44 2.96 0.31 -1.39 118.68 133.62 1m3d s LEU 33 Ca 0.47 0.81 -0.17 0.00 -0.22 0.00 0.00 54.13 55.02 1m3d s LEU 33 Cb -0.10 -2.81 -0.13 0.00 0.50 0.00 0.00 46.19 43.65 1m3d s LEU 33 CO 0.19 -0.18 -0.03 -0.11 -1.32 0.00 0.00 176.35 174.90 1m3d n LEU 34 N 4.61 1.87 -3.68 -0.68 7.94 0.65 -4.52 117.00 123.19 1m3d n LEU 34 Ca -0.03 0.45 -0.02 0.00 -1.11 0.00 0.00 56.01 55.30 1m3d n LEU 34 Cb 0.50 -0.90 -0.01 0.00 0.53 0.00 0.00 43.42 43.54 1m3d n LEU 34 CO 0.43 0.10 0.87 -0.72 -1.11 0.00 0.00 177.39 176.96 1m3d s TYR 35 N -2.40 -0.11 0.25 1.96 1.13 -0.93 -2.26 117.35 114.98 1m3d s TYR 35 Ca -0.27 -0.09 0.07 0.00 -1.41 0.00 0.00 57.07 55.37 1m3d s TYR 35 Cb 0.06 0.59 -0.05 0.00 -1.10 0.00 0.00 41.96 41.46 1m3d s TYR 35 CO 0.47 -0.56 -0.08 0.14 -2.51 0.00 0.00 175.55 173.01 1m3d s VAL 36 N -2.89 1.62 -0.14 -3.49 -7.23 -0.50 0.75 120.40 108.52 1m3d s VAL 36 Ca 0.12 -2.14 -0.04 0.00 -1.81 0.00 0.00 61.98 58.11 1m3d s VAL 36 Cb 0.01 -2.32 0.05 0.00 0.56 0.00 0.00 36.38 34.69 1m3d s VAL 36 CO -0.01 -0.39 0.06 -1.58 -0.31 0.00 0.00 175.10 172.87 1m3d s GLN 37 N -3.71 0.23 -0.07 4.82 0.74 -0.59 -0.72 119.66 120.36 1m3d s GLN 37 Ca 0.27 -0.06 0.05 0.00 0.05 0.00 0.00 55.36 55.67 1m3d s GLN 37 Cb 0.02 -1.59 -0.00 0.00 1.10 0.00 0.00 33.01 32.54 1m3d s GLN 37 CO 0.10 -0.57 -0.22 0.20 -0.55 0.00 0.00 175.29 174.25 1m3d s GLY 38 N 2.06 1.21 -1.51 2.59 0.00 -0.15 -1.51 107.32 110.00 1m3d s GLY 38 Ca 0.02 -0.92 -0.13 0.00 0.00 0.00 0.00 44.72 43.69 1m3d s GLY 38 CO -0.07 -0.44 1.01 -2.01 0.00 0.00 0.00 173.10 171.59 1m3d n ASN 39 N 3.22 -5.01 -0.04 1.64 4.05 -1.26 -0.88 115.26 116.98 1m3d n ASN 39 Ca -0.18 -0.75 -0.01 0.00 0.45 0.00 0.00 54.58 54.09 1m3d n ASN 39 Cb 0.52 -4.04 -0.00 0.00 1.23 0.00 0.00 39.78 37.49 1m3d n ASN 39 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1m3d n GLU 40 N -4.73 -1.25 -4.18 1.20 -0.58 -1.26 -4.99 120.64 104.85 1m3d n GLU 40 Ca 0.04 0.34 -0.34 0.00 -0.42 0.00 0.00 57.16 56.77 1m3d n GLU 40 Cb 0.53 -4.29 -0.13 0.00 -0.57 0.00 0.00 31.44 26.98 1m3d n GLU 40 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1m3d s ARG 41 N -1.33 3.59 0.14 3.49 1.81 -0.06 -5.01 118.95 121.57 1m3d s ARG 41 Ca 0.00 -0.54 -0.18 0.00 -1.72 0.00 0.00 55.73 53.28 1m3d s ARG 41 Cb 0.00 -3.00 -0.07 0.00 -0.45 0.00 0.00 34.95 31.43 1m3d s ARG 41 CO 0.00 0.06 0.62 0.00 -0.68 0.00 0.00 175.30 175.30 1m3d s ALA 42 N 0.85 3.53 -0.10 2.13 0.00 -1.26 -0.98 121.76 125.93 1m3d s ALA 42 Ca -0.00 0.05 -0.04 0.00 0.00 0.00 0.00 51.96 51.97 1m3d s ALA 42 Cb -0.14 -2.67 0.05 0.00 0.00 0.00 0.00 23.12 20.36 1m3d s ALA 42 CO 0.02 0.39 0.17 -1.58 0.00 0.00 0.00 175.76 174.76 1m3d s HIS 43 N -1.31 -0.20 0.46 0.00 2.46 0.10 -4.91 115.29 111.89 1m3d s HIS 43 Ca 0.35 0.57 0.08 0.00 0.47 0.00 0.00 55.06 56.53 1m3d s HIS 43 Cb -0.18 -0.27 0.02 0.00 -0.13 0.00 0.00 32.58 32.02 1m3d s HIS 43 CO 0.20 -0.32 0.54 0.20 -2.47 0.00 0.00 174.74 172.89 1m3d s GLY 44 N 2.30 2.00 -0.13 1.59 0.00 -1.26 -1.41 107.32 110.40 1m3d s GLY 44 Ca 0.03 -1.80 0.00 0.00 0.00 0.00 0.00 44.72 42.95 1m3d s GLY 44 CO -0.07 -1.64 -0.12 1.20 0.00 0.00 0.00 173.10 172.47 1m3d s GLN 45 N -4.35 2.06 -0.02 2.90 -1.52 -0.96 -4.98 119.66 112.79 1m3d s GLN 45 Ca 0.52 -0.46 -0.35 0.00 -1.95 0.00 0.00 55.36 53.12 1m3d s GLN 45 Cb -0.06 -1.93 -0.13 0.00 -0.22 0.00 0.00 33.01 30.67 1m3d s GLN 45 CO 0.32 -0.23 1.76 -3.47 -0.25 0.00 0.00 175.29 173.41 1m3d n ASP 46 N 4.78 3.19 0.10 5.90 2.03 -1.26 -4.64 116.55 126.66 1m3d n ASP 46 Ca -0.16 1.02 0.06 0.00 0.52 0.00 0.00 54.79 56.23 1m3d n ASP 46 Cb 0.50 -1.36 0.31 0.00 -0.72 0.00 0.00 41.12 39.85 1m3d n ASP 46 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1m3d n LEU 47 N 5.41 0.29 -0.44 -2.67 4.77 -1.26 -0.62 117.00 122.48 1m3d n LEU 47 Ca 0.21 0.58 0.13 0.00 -0.03 0.00 0.00 56.01 56.90 1m3d n LEU 47 Cb 0.28 -0.60 0.35 0.00 -2.33 0.00 0.00 43.42 41.12 1m3d n LEU 47 CO 0.70 -0.68 0.69 0.61 -1.33 0.00 0.00 177.39 177.38 1m3d n GLY 48 N -1.34 -0.12 3.68 -0.72 0.00 -1.26 -4.48 105.19 100.94 1m3d n GLY 48 Ca -0.01 -0.48 -0.23 0.00 0.00 0.00 0.00 46.02 45.30 1m3d n GLY 48 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1m3d s THR 49 N -2.26 3.55 0.47 2.61 -4.23 0.21 -3.24 115.64 112.74 1m3d s THR 49 Ca 0.29 -1.82 0.40 0.00 -1.18 0.00 0.00 61.69 59.39 1m3d s THR 49 Cb 0.20 -2.94 0.41 0.00 1.34 0.00 0.00 72.50 71.50 1m3d s THR 49 CO 0.43 -0.35 2.23 0.00 -0.54 0.00 0.00 174.62 176.39 1m3d h ALA 50 N 1.79 1.00 0.00 3.99 0.00 -1.91 -2.07 119.26 122.06 1m3d h ALA 50 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1m3d h ALA 50 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1m3d h ALA 50 CO 0.61 0.00 0.00 0.78 0.00 0.00 0.00 179.25 180.64 1m3d h GLY 51 N 0.24 0.00 -1.63 0.00 0.00 -1.95 -1.62 103.07 98.10 1m3d h GLY 51 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1m3d h GLY 51 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 1m3d n SER 52 N -2.90 2.45 -3.79 0.19 3.41 -0.78 -4.69 113.62 107.52 1m3d n SER 52 Ca -0.00 -1.95 -0.30 0.00 -0.26 0.00 0.00 58.87 56.36 1m3d n SER 52 Cb 0.22 -0.28 -0.15 0.00 -0.26 0.00 0.00 64.21 63.74 1m3d n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1m3d s LEU 54 N 1.41 3.86 0.42 0.00 1.02 -0.84 -4.82 118.68 119.72 1m3d s LEU 54 Ca 0.10 0.19 0.09 0.00 0.02 0.00 0.00 54.13 54.53 1m3d s LEU 54 Cb -0.18 -1.94 0.90 0.00 0.02 0.00 0.00 46.19 44.99 1m3d s LEU 54 CO -0.21 0.29 2.04 0.03 0.02 0.00 0.00 176.35 178.53 1m3d h ARG 55 N 5.80 0.51 -5.39 1.70 3.08 -1.89 0.14 114.38 118.33 1m3d h ARG 55 Ca -0.45 -0.03 -0.62 0.00 0.07 0.00 0.00 59.98 58.95 1m3d h ARG 55 Cb 1.19 -0.11 -0.32 0.00 0.08 0.00 0.00 29.97 30.80 1m3d h ARG 55 CO 0.62 0.34 -0.86 0.15 -1.07 0.00 0.00 179.97 179.15 1m3d s LYS 56 N -5.47 2.30 0.34 0.04 1.02 -1.26 -4.69 119.74 112.02 1m3d s LYS 56 Ca -0.08 -0.73 -0.02 0.00 0.02 0.00 0.00 55.97 55.16 1m3d s LYS 56 Cb 0.18 -1.89 -0.04 0.00 -0.52 0.00 0.00 37.83 35.56 1m3d s LYS 56 CO 0.73 0.23 0.58 0.12 -0.92 0.00 0.00 175.35 176.09 1m3d s PHE 57 N 0.15 3.50 -0.26 3.18 2.19 -1.26 -4.94 117.98 120.55 1m3d s PHE 57 Ca -0.09 0.51 -0.27 0.00 0.33 0.00 0.00 56.93 57.41 1m3d s PHE 57 Cb -0.14 -2.02 0.16 0.00 -1.31 0.00 0.00 43.02 39.70 1m3d s PHE 57 CO 0.05 0.09 1.21 0.45 1.83 0.00 0.00 175.22 178.85 1m3d s SER 58 N -3.71 -0.23 0.54 6.13 0.15 -1.26 -5.00 113.70 110.33 1m3d s SER 58 Ca 0.42 0.35 0.35 0.00 0.70 0.00 0.00 55.95 57.77 1m3d s SER 58 Cb -0.10 0.33 1.56 0.00 -1.71 0.00 0.00 66.02 66.10 1m3d s SER 58 CO 0.35 -0.14 2.03 0.71 1.20 0.00 0.00 173.24 177.40 1m3d h THR 59 N 2.84 0.00 -2.66 6.45 1.35 -1.95 -3.30 112.91 115.63 1m3d h THR 59 Ca -0.21 -0.36 -0.60 0.00 -0.55 0.00 0.00 66.41 64.70 1m3d h THR 59 Cb 1.18 1.31 -0.39 0.00 -1.73 0.00 0.00 68.15 68.52 1m3d h THR 59 CO 0.20 0.00 -0.84 -0.32 -0.25 0.00 0.00 175.52 174.32 1m3d s MET 60 N -3.74 1.11 0.00 4.72 -2.45 -1.26 -4.15 119.30 113.53 1m3d s MET 60 Ca -0.00 -2.06 0.30 0.00 -1.25 0.00 0.00 55.69 52.68 1m3d s MET 60 Cb 0.10 -1.87 1.75 0.00 1.25 0.00 0.00 34.83 36.06 1m3d s MET 60 CO 0.49 -1.28 2.12 -0.35 1.05 0.00 0.00 175.02 177.05 1m3d n PRO 61 N 3.18 0.83 -4.32 4.11 -0.04 -1.25 -4.89 135.00 132.62 1m3d n PRO 61 Ca 0.19 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.48 1m3d n PRO 61 Cb 0.40 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.27 1m3d n PRO 61 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1m3d s PHE 62 N -2.13 1.55 0.16 0.54 -0.71 -1.26 -5.08 117.98 111.05 1m3d s PHE 62 Ca 0.42 -1.34 -0.02 0.00 -1.04 0.00 0.00 56.93 54.95 1m3d s PHE 62 Cb 0.21 -0.83 -0.04 0.00 -1.21 0.00 0.00 43.02 41.15 1m3d s PHE 62 CO 0.37 -0.51 0.10 -0.48 -1.34 0.00 0.00 175.22 173.37 1m3d s LEU 63 N -3.34 1.47 0.06 -1.99 0.05 -1.26 -4.53 118.68 109.14 1m3d s LEU 63 Ca 0.36 -1.25 0.04 0.00 0.05 0.00 0.00 54.13 53.33 1m3d s LEU 63 Cb 0.06 0.41 -0.03 0.00 -2.05 0.00 0.00 46.19 44.58 1m3d s LEU 63 CO 0.17 -0.79 -0.11 0.72 -0.55 0.00 0.00 176.35 175.79 1m3d s PHE 64 N -4.08 0.98 0.11 3.48 -0.12 -0.86 -4.99 117.98 112.50 1m3d s PHE 64 Ca 0.29 -0.50 0.06 0.00 -0.05 0.00 0.00 56.93 56.73 1m3d s PHE 64 Cb 0.07 -0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 41.87 1m3d s PHE 64 CO 0.06 -0.01 -0.16 0.00 -0.05 0.00 0.00 175.22 175.06 1m3d s ASN 66 N -2.22 4.47 0.00 0.00 2.20 -0.61 -4.99 114.94 113.79 1m3d s ASN 66 Ca 0.07 -1.26 0.15 0.00 -0.94 0.00 0.00 52.86 50.88 1m3d s ASN 66 Cb -0.07 0.10 0.75 0.00 -2.00 0.00 0.00 41.25 40.03 1m3d s ASN 66 CO 0.04 -0.85 1.40 2.30 -2.94 0.00 0.00 177.10 177.04 1m3d n ILE 67 N -1.48 0.56 0.17 0.54 -0.00 -1.26 -1.95 119.36 115.94 1m3d n ILE 67 Ca -0.05 0.14 0.07 0.00 -0.00 0.00 0.00 62.75 62.92 1m3d n ILE 67 Cb 0.65 -0.90 0.24 0.00 -0.00 0.00 0.00 39.64 39.63 1m3d n ILE 67 CO 0.00 0.00 0.00 0.59 -0.00 0.00 0.00 176.55 177.14 1m3d n ASN 68 N -1.27 3.19 -2.97 7.28 3.02 -1.26 -4.92 115.26 118.33 1m3d n ASN 68 Ca 0.07 -2.17 -0.20 0.00 -0.03 0.00 0.00 54.58 52.26 1m3d n ASN 68 Cb 0.11 -0.42 0.06 0.00 -0.61 0.00 0.00 39.78 38.92 1m3d n ASN 68 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1m3d n ASN 69 N 0.88 -5.61 -4.14 6.41 3.02 -0.82 -5.01 115.26 109.98 1m3d n ASN 69 Ca 0.18 -0.40 -0.30 0.00 -0.03 0.00 0.00 54.58 54.02 1m3d n ASN 69 Cb 0.56 -4.27 -0.17 0.00 -0.61 0.00 0.00 39.78 35.30 1m3d n ASN 69 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1m3d s VAL 70 N -3.23 1.79 0.03 2.41 1.01 -1.26 -4.98 120.40 116.18 1m3d s VAL 70 Ca 0.44 -0.84 0.05 0.00 0.00 0.00 0.00 61.98 61.64 1m3d s VAL 70 Cb -0.19 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.57 1m3d s VAL 70 CO 0.54 0.50 -0.12 0.00 0.00 0.00 0.00 175.10 176.02 1m3d s ASN 72 N -1.51 2.53 -0.14 0.00 0.01 0.96 -4.98 114.94 111.82 1m3d s ASN 72 Ca 0.16 -0.45 -0.00 0.00 -0.71 0.00 0.00 52.86 51.86 1m3d s ASN 72 Cb -0.11 -1.15 -0.01 0.00 0.41 0.00 0.00 41.25 40.38 1m3d s ASN 72 CO 0.07 0.07 -0.12 0.12 -1.51 0.00 0.00 177.10 175.73 1m3d s PHE 73 N 0.67 2.83 -1.57 2.20 5.36 -1.26 -2.03 117.98 124.17 1m3d s PHE 73 Ca -0.13 -0.66 -0.17 0.00 -0.96 0.00 0.00 56.93 55.00 1m3d s PHE 73 Cb -0.16 -1.86 0.15 0.00 -0.34 0.00 0.00 43.02 40.81 1m3d s PHE 73 CO 0.03 -0.23 0.65 0.00 -1.46 0.00 0.00 175.22 174.21 1m3d n ALA 74 N 3.62 -1.19 -1.57 11.12 0.00 -1.26 -4.85 120.51 126.38 1m3d n ALA 74 Ca -0.18 -0.03 0.06 0.00 0.00 0.00 0.00 53.44 53.28 1m3d n ALA 74 Cb 0.53 -2.98 0.21 0.00 0.00 0.00 0.00 19.45 17.20 1m3d n ALA 74 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1m3d n SER 75 N -2.47 1.78 0.00 0.00 7.64 -1.26 -4.85 113.62 114.46 1m3d n SER 75 Ca 0.07 -3.87 0.00 0.00 1.01 0.00 0.00 58.87 56.08 1m3d n SER 75 Cb 0.49 -0.53 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 1m3d n SER 75 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1m3d n ARG 76 N -1.13 0.00 -2.75 1.43 0.63 -1.26 -5.09 116.66 108.48 1m3d n ARG 76 Ca 0.20 0.00 -0.10 0.00 -0.92 0.00 0.00 57.85 57.03 1m3d n ARG 76 Cb 0.71 0.00 0.04 0.00 0.45 0.00 0.00 32.46 33.66 1m3d n ARG 76 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1m3d n ASN 77 N 0.00 0.57 -4.97 6.15 5.03 -1.26 -4.92 115.26 115.86 1m3d n ASN 77 Ca 0.00 -2.76 -0.21 0.00 0.87 0.00 0.00 54.58 52.48 1m3d n ASN 77 Cb 0.00 -0.15 0.03 0.00 -1.02 0.00 0.00 39.78 38.63 1m3d n ASN 77 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1m3d s ASP 78 N -2.58 5.49 0.27 6.41 -0.00 -1.26 -4.90 116.67 120.10 1m3d s ASP 78 Ca 0.28 0.02 0.05 0.00 -0.00 0.00 0.00 52.55 52.90 1m3d s ASP 78 Cb 0.42 -1.04 -0.06 0.00 -0.00 0.00 0.00 42.92 42.24 1m3d s ASP 78 CO -0.01 -0.96 -0.01 -0.31 -0.00 0.00 0.00 175.17 173.88 1m3d s TYR 79 N -2.64 1.83 -0.12 4.23 1.51 -0.57 -1.70 117.35 119.89 1m3d s TYR 79 Ca 0.54 -0.84 -0.10 0.00 -1.01 0.00 0.00 57.07 55.66 1m3d s TYR 79 Cb -0.10 -1.09 0.03 0.00 -0.11 0.00 0.00 41.96 40.69 1m3d s TYR 79 CO 0.37 0.11 0.31 -1.54 -1.11 0.00 0.00 175.55 173.69 1m3d s SER 80 N -3.41 -0.33 -0.05 2.29 1.04 -0.93 -1.54 113.70 110.77 1m3d s SER 80 Ca 0.31 0.63 0.05 0.00 0.48 0.00 0.00 55.95 57.42 1m3d s SER 80 Cb 0.06 0.62 -0.01 0.00 0.10 0.00 0.00 66.02 66.79 1m3d s SER 80 CO 0.12 -0.11 -0.21 -0.31 0.98 0.00 0.00 173.24 173.70 1m3d s TYR 81 N 0.28 2.08 0.07 5.02 2.02 0.23 -1.22 117.35 125.84 1m3d s TYR 81 Ca -0.01 -0.62 0.05 0.00 -0.37 0.00 0.00 57.07 56.12 1m3d s TYR 81 Cb -0.03 -1.38 -0.03 0.00 -0.40 0.00 0.00 41.96 40.12 1m3d s TYR 81 CO -0.01 -0.20 -0.15 -1.58 -1.57 0.00 0.00 175.55 172.04 1m3d s TRP 82 N -0.03 1.28 0.41 2.71 0.52 -1.05 -0.26 118.94 122.53 1m3d s TRP 82 Ca -0.05 -0.44 -0.26 0.00 0.02 0.00 0.00 56.10 55.38 1m3d s TRP 82 Cb -0.13 -0.73 -0.09 0.00 -1.15 0.00 0.00 33.47 31.38 1m3d s TRP 82 CO 0.03 0.07 1.34 -0.51 0.02 0.00 0.00 176.95 177.90 1m3d s LEU 83 N -1.65 4.21 0.51 2.99 1.43 -0.48 -1.10 118.68 124.59 1m3d s LEU 83 Ca -0.00 2.73 0.05 0.00 -1.03 0.00 0.00 54.13 55.88 1m3d s LEU 83 Cb -0.10 -3.89 0.01 0.00 0.03 0.00 0.00 46.19 42.25 1m3d s LEU 83 CO 0.02 -0.91 0.32 -0.94 0.23 0.00 0.00 176.35 175.07 1m3d s SER 84 N -0.64 4.57 0.46 2.29 1.04 -0.23 -1.18 113.70 120.01 1m3d s SER 84 Ca 0.57 -1.22 0.07 0.00 0.48 0.00 0.00 55.95 55.84 1m3d s SER 84 Cb -0.40 0.20 0.07 0.00 0.10 0.00 0.00 66.02 65.99 1m3d s SER 84 CO 0.51 -0.95 0.54 0.35 0.98 0.00 0.00 173.24 174.68 1m3d n THR 85 N -1.60 0.00 1.94 2.02 -2.24 -0.34 -4.50 114.28 109.55 1m3d n THR 85 Ca -0.03 -1.63 0.13 0.00 -2.27 0.00 0.00 64.05 60.25 1m3d n THR 85 Cb 0.64 -0.45 0.74 0.00 -2.10 0.00 0.00 70.33 69.17 1m3d n THR 85 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1m3d n PRO 86 N -1.86 0.97 -1.68 -0.78 -0.04 -1.26 -4.87 135.00 125.49 1m3d n PRO 86 Ca 0.08 0.00 -0.50 0.00 -0.04 0.00 0.00 63.50 63.04 1m3d n PRO 86 Cb 0.49 -1.40 -0.05 0.00 -0.04 0.00 0.00 33.50 32.49 1m3d n PRO 86 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1m3d n GLU 87 N -0.90 1.85 -1.70 0.54 4.07 -1.26 -4.93 120.64 118.31 1m3d n GLU 87 Ca 0.19 0.68 -0.32 0.00 -0.06 0.00 0.00 57.16 57.65 1m3d n GLU 87 Cb 0.09 -2.45 0.04 0.00 -0.06 0.00 0.00 31.44 29.06 1m3d n GLU 87 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 1m3d s PRO 88 N 3.02 2.92 0.52 5.31 0.04 -1.26 -4.99 135.00 140.56 1m3d s PRO 88 Ca 0.91 1.14 -0.21 0.00 0.04 0.00 0.00 61.00 62.87 1m3d s PRO 88 Cb -0.80 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 31.70 1m3d s PRO 88 CO 0.52 -1.13 1.23 -1.64 0.04 0.00 0.00 177.00 176.02 1m3d s MET 89 N -4.57 3.38 0.72 4.56 -1.94 -1.26 -4.96 119.30 115.23 1m3d s MET 89 Ca 0.62 1.91 -0.15 0.00 -1.71 0.00 0.00 55.69 56.36 1m3d s MET 89 Cb -0.16 -2.23 0.03 0.00 2.01 0.00 0.00 34.83 34.48 1m3d s MET 89 CO 0.47 -0.90 1.19 -2.14 -0.01 0.00 0.00 175.02 173.63 1m3d s PRO 90 N -2.93 2.27 0.50 2.03 0.02 -1.26 -4.86 135.00 130.76 1m3d s PRO 90 Ca 0.70 1.68 0.20 0.00 0.02 0.00 0.00 61.00 63.60 1m3d s PRO 90 Cb -0.32 -1.86 1.26 0.00 0.02 0.00 0.00 34.50 33.60 1m3d s PRO 90 CO 0.38 -1.72 2.01 0.52 -0.33 0.00 0.00 177.00 177.85 1m3d h MET 91 N -0.23 0.14 0.00 5.54 2.86 -1.97 -0.50 114.93 120.76 1m3d h MET 91 Ca -0.47 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.12 1m3d h MET 91 Cb 1.29 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.91 1m3d h MET 91 CO 0.50 0.09 -0.17 0.66 1.06 0.00 0.00 176.91 179.06 1m3d h SER 92 N 0.14 0.00 -0.09 1.22 4.64 -2.03 -3.46 113.55 113.98 1m3d h SER 92 Ca 0.23 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.52 1m3d h SER 92 Cb 0.74 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.82 1m3d h SER 92 CO -0.03 0.17 -0.03 0.23 -0.87 0.00 0.00 176.83 176.29 1m3d n MET 93 N -3.51 -1.26 -2.63 4.77 0.00 -0.20 -4.98 117.12 109.32 1m3d n MET 93 Ca -0.01 0.41 -0.29 0.00 0.00 0.00 0.00 57.70 57.82 1m3d n MET 93 Cb 0.32 -4.40 -0.01 0.00 0.00 0.00 0.00 33.22 29.13 1m3d n MET 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1m3d s ALA 94 N -1.50 3.36 0.45 3.04 0.00 -1.26 -4.99 121.76 120.86 1m3d s ALA 94 Ca 0.00 -0.38 -0.23 0.00 0.00 0.00 0.00 51.96 51.35 1m3d s ALA 94 Cb 0.00 -2.67 -0.09 0.00 0.00 0.00 0.00 23.12 20.36 1m3d s ALA 94 CO 0.00 -0.28 1.05 -2.30 0.00 0.00 0.00 175.76 174.23 1m3d n PRO 95 N -2.03 1.39 -3.54 0.00 -0.02 -1.26 -4.81 135.00 124.72 1m3d n PRO 95 Ca 0.02 0.50 -0.37 0.00 -2.02 0.00 0.00 63.50 61.63 1m3d n PRO 95 Cb 0.55 -2.14 -0.06 0.00 -0.02 0.00 0.00 33.50 31.83 1m3d n PRO 95 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1m3d s ILE 96 N -1.31 5.07 0.15 4.25 1.01 0.12 -4.87 121.20 125.62 1m3d s ILE 96 Ca 0.65 0.66 0.01 0.00 0.00 0.00 0.00 60.65 61.96 1m3d s ILE 96 Cb -0.52 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.24 1m3d s ILE 96 CO 0.55 0.46 0.01 0.42 0.00 0.00 0.00 174.94 176.38 1m3d s THR 97 N -1.22 0.50 0.00 2.92 -4.23 -1.26 -1.24 115.64 111.11 1m3d s THR 97 Ca 0.27 -1.95 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 1m3d s THR 97 Cb -0.15 -2.03 0.00 0.00 1.34 0.00 0.00 72.50 71.66 1m3d s THR 97 CO 0.15 -0.54 0.00 0.61 -0.54 0.00 0.00 174.62 174.30 1m3d n GLY 98 N -0.16 2.19 0.33 3.99 0.00 -1.26 -2.13 105.19 108.15 1m3d n GLY 98 Ca -0.07 -0.29 0.19 0.00 0.00 0.00 0.00 46.02 45.84 1m3d n GLY 98 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1m3d h GLU 99 N 0.00 0.00 0.00 1.61 4.39 -1.99 -1.27 114.58 117.32 1m3d h GLU 99 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1m3d h GLU 99 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1m3d h GLU 99 CO 0.00 0.00 0.00 0.09 -1.16 0.00 0.00 179.01 177.94 1m3d n ASN 100 N -3.41 0.60 0.05 1.42 3.02 -0.90 -2.47 115.26 113.57 1m3d n ASN 100 Ca -0.02 0.69 -0.17 0.00 -0.03 0.00 0.00 54.58 55.05 1m3d n ASN 100 Cb 0.17 -0.80 -0.08 0.00 -0.61 0.00 0.00 39.78 38.46 1m3d n ASN 100 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1m3d h ILE 101 N 0.00 1.33 -0.85 2.41 1.08 -1.32 -3.37 117.51 116.78 1m3d h ILE 101 Ca 0.00 -2.30 0.13 0.00 -0.39 0.00 0.00 64.86 62.30 1m3d h ILE 101 Cb 0.24 2.36 -0.14 0.00 -3.07 0.00 0.00 36.82 36.22 1m3d h ILE 101 CO 0.00 0.70 -0.32 -1.14 -0.69 0.00 0.00 178.15 176.70 1m3d n ARG 102 N -3.82 -0.19 0.14 2.37 3.00 -1.03 -0.44 116.66 116.70 1m3d n ARG 102 Ca -0.09 1.31 0.10 0.00 -0.00 0.00 0.00 57.85 59.17 1m3d n ARG 102 Cb 0.85 -1.94 0.51 0.00 0.00 0.00 0.00 32.46 31.88 1m3d n ARG 102 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 1m3d n PRO 103 N -5.26 0.12 0.04 -0.14 -0.02 -1.26 -2.69 135.00 125.80 1m3d n PRO 103 Ca 0.09 0.61 0.11 0.00 -2.02 0.00 0.00 63.50 62.29 1m3d n PRO 103 Cb 0.35 -1.90 -0.01 0.00 -0.02 0.00 0.00 33.50 31.92 1m3d n PRO 103 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1m3d n PHE 104 N -2.16 0.43 -3.14 6.00 3.01 0.42 -4.58 117.46 117.44 1m3d n PHE 104 Ca -0.01 0.13 -0.40 0.00 1.01 0.00 0.00 57.45 58.18 1m3d n PHE 104 Cb 0.04 -0.60 -0.06 0.00 -0.01 0.00 0.00 39.48 38.85 1m3d n PHE 104 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1m3d s ILE 105 N -3.30 5.05 0.64 4.37 -1.09 -1.09 -1.20 121.20 124.57 1m3d s ILE 105 Ca 0.01 1.16 -0.17 0.00 -2.23 0.00 0.00 60.65 59.42 1m3d s ILE 105 Cb 0.13 -3.93 -0.01 0.00 -1.58 0.00 0.00 42.46 37.07 1m3d s ILE 105 CO 0.81 0.15 1.15 -0.55 -1.23 0.00 0.00 174.94 175.28 1m3d s SER 106 N 1.09 5.06 0.27 3.58 0.15 -0.32 -4.43 113.70 119.09 1m3d s SER 106 Ca 0.29 2.17 0.08 0.00 0.70 0.00 0.00 55.95 59.19 1m3d s SER 106 Cb -0.16 -2.57 -0.04 0.00 -1.71 0.00 0.00 66.02 61.54 1m3d s SER 106 CO 0.11 -1.67 0.12 -0.13 1.20 0.00 0.00 173.24 172.87 1m3d s ARG 107 N -3.76 2.64 0.18 5.44 1.81 -0.75 -1.30 118.95 123.21 1m3d s ARG 107 Ca 0.71 -1.23 -0.04 0.00 -1.72 0.00 0.00 55.73 53.45 1m3d s ARG 107 Cb -0.25 -2.38 -0.03 0.00 -0.45 0.00 0.00 34.95 31.84 1m3d s ARG 107 CO 0.38 0.35 0.19 0.00 -0.68 0.00 0.00 175.30 175.54 1m3d s ALA 109 N -4.07 0.05 -0.24 0.00 0.00 0.11 -1.63 121.76 115.98 1m3d s ALA 109 Ca 0.28 0.19 -0.08 0.00 0.00 0.00 0.00 51.96 52.35 1m3d s ALA 109 Cb 0.05 -0.15 -0.03 0.00 0.00 0.00 0.00 23.12 22.99 1m3d s ALA 109 CO 0.06 -0.07 0.08 0.08 0.00 0.00 0.00 175.76 175.92 1m3d s VAL 110 N 0.66 4.45 0.10 0.00 1.01 -0.40 -0.61 120.40 125.62 1m3d s VAL 110 Ca -0.06 -0.13 0.09 0.00 0.00 0.00 0.00 61.98 61.89 1m3d s VAL 110 Cb -0.08 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 1m3d s VAL 110 CO -0.02 0.34 -0.24 0.00 0.00 0.00 0.00 175.10 175.18 1m3d s GLU 112 N -1.83 4.14 0.11 0.00 2.12 0.32 -0.64 118.70 122.91 1m3d s GLU 112 Ca 0.10 0.36 0.07 0.00 0.36 0.00 0.00 54.97 55.87 1m3d s GLU 112 Cb -0.10 -3.34 -0.04 0.00 0.26 0.00 0.00 34.13 30.91 1m3d s GLU 112 CO 0.05 0.40 -0.10 0.00 -0.54 0.00 0.00 175.26 175.07 1m3d s ALA 113 N -0.14 2.94 -0.93 6.30 0.00 0.31 -1.69 121.76 128.54 1m3d s ALA 113 Ca 0.23 -1.27 0.23 0.00 0.00 0.00 0.00 51.96 51.15 1m3d s ALA 113 Cb -0.15 -0.87 0.94 0.00 0.00 0.00 0.00 23.12 23.04 1m3d s ALA 113 CO 0.10 0.62 1.72 -0.35 0.00 0.00 0.00 175.76 177.86 1m3d n PRO 114 N 0.64 0.04 -3.85 0.00 -0.04 -1.26 -3.63 135.00 126.90 1m3d n PRO 114 Ca -0.13 0.15 -0.10 0.00 -0.04 0.00 0.00 63.50 63.38 1m3d n PRO 114 Cb 0.53 -1.56 0.02 0.00 -0.04 0.00 0.00 33.50 32.44 1m3d n PRO 114 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1m3d n ALA 115 N -1.55 -1.49 -1.71 0.55 0.00 -1.26 -4.72 120.51 110.33 1m3d n ALA 115 Ca 0.05 -1.36 -0.42 0.00 0.00 0.00 0.00 53.44 51.71 1m3d n ALA 115 Cb 0.27 1.09 -0.00 0.00 0.00 0.00 0.00 19.45 20.81 1m3d n ALA 115 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1m3d n MET 116 N -0.55 2.14 -5.17 0.00 2.81 -1.26 -4.76 117.12 110.33 1m3d n MET 116 Ca -0.07 0.75 -0.30 0.00 -1.81 0.00 0.00 57.70 56.28 1m3d n MET 116 Cb 0.60 -2.38 -0.16 0.00 -0.71 0.00 0.00 33.22 30.57 1m3d n MET 116 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1m3d s VAL 117 N -1.12 1.87 0.21 2.03 1.01 -1.26 -1.83 120.40 121.30 1m3d s VAL 117 Ca 0.56 -0.99 -0.12 0.00 0.00 0.00 0.00 61.98 61.44 1m3d s VAL 117 Cb -0.54 -1.57 -0.00 0.00 0.00 0.00 0.00 36.38 34.27 1m3d s VAL 117 CO 0.61 0.53 0.40 0.00 0.00 0.00 0.00 175.10 176.64 1m3d s MET 118 N -0.38 1.36 0.11 2.72 0.23 -0.00 -4.85 119.30 118.50 1m3d s MET 118 Ca 0.04 -1.18 0.11 0.00 -1.03 0.00 0.00 55.69 53.63 1m3d s MET 118 Cb -0.11 0.43 -0.04 0.00 -1.53 0.00 0.00 34.83 33.59 1m3d s MET 118 CO 0.01 -0.54 -0.27 0.00 -2.03 0.00 0.00 175.02 172.19 1m3d s ALA 119 N -3.98 2.36 0.05 3.16 0.00 -0.42 0.42 121.76 123.35 1m3d s ALA 119 Ca 0.19 -1.42 0.05 0.00 0.00 0.00 0.00 51.96 50.78 1m3d s ALA 119 Cb 0.01 -0.41 -0.02 0.00 0.00 0.00 0.00 23.12 22.70 1m3d s ALA 119 CO 0.04 0.54 -0.14 0.14 0.00 0.00 0.00 175.76 176.34 1m3d s VAL 120 N -1.01 1.10 0.01 0.00 -7.23 -0.68 -4.49 120.40 108.09 1m3d s VAL 120 Ca 0.14 -1.13 0.08 0.00 -1.81 0.00 0.00 61.98 59.25 1m3d s VAL 120 Cb -0.10 -1.02 -0.02 0.00 0.56 0.00 0.00 36.38 35.79 1m3d s VAL 120 CO 0.05 -0.10 -0.24 -1.00 -0.31 0.00 0.00 175.10 173.49 1m3d s HIS 121 N -1.04 2.16 -0.04 2.82 3.76 -1.26 -1.92 115.29 119.77 1m3d s HIS 121 Ca -0.00 -0.40 0.13 0.00 -0.15 0.00 0.00 55.06 54.63 1m3d s HIS 121 Cb -0.09 -1.35 -0.22 0.00 1.11 0.00 0.00 32.58 32.03 1m3d s HIS 121 CO 0.02 0.02 0.74 0.66 -0.85 0.00 0.00 174.74 175.33 1m3d h SER 122 N 5.25 0.00 -2.47 1.40 4.64 -1.60 -3.48 113.55 117.30 1m3d h SER 122 Ca -0.43 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 60.57 1m3d h SER 122 Cb 1.13 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.22 1m3d h SER 122 CO 0.46 0.96 -0.42 0.00 -0.87 0.00 0.00 176.83 176.95 1m3d n GLN 123 N -3.06 -1.60 -4.08 4.77 6.02 -1.26 -4.93 117.38 113.24 1m3d n GLN 123 Ca -0.14 0.78 -0.14 0.00 -0.01 0.00 0.00 57.00 57.49 1m3d n GLN 123 Cb 1.02 -5.19 -0.05 0.00 1.02 0.00 0.00 30.24 27.05 1m3d n GLN 123 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1m3d s THR 124 N -2.84 0.00 -1.40 5.09 -4.23 -1.26 -0.46 115.64 110.54 1m3d s THR 124 Ca 0.03 -1.60 0.30 0.00 -1.18 0.00 0.00 61.69 59.24 1m3d s THR 124 Cb -0.01 -2.58 0.47 0.00 1.34 0.00 0.00 72.50 71.72 1m3d s THR 124 CO 0.03 0.00 2.00 2.30 -0.54 0.00 0.00 174.62 178.42 1m3d n ILE 125 N -0.53 0.00 -3.29 2.99 -5.35 -1.26 -2.26 119.36 109.66 1m3d n ILE 125 Ca 0.01 -0.01 -0.30 0.00 -0.27 0.00 0.00 62.75 62.18 1m3d n ILE 125 Cb 0.62 -0.43 -0.04 0.00 -1.74 0.00 0.00 39.64 38.05 1m3d n ILE 125 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1m3d s GLN 126 N -2.62 3.73 0.00 6.28 1.11 -1.26 -4.82 119.66 122.09 1m3d s GLN 126 Ca 0.27 0.20 -0.30 0.00 0.01 0.00 0.00 55.36 55.54 1m3d s GLN 126 Cb 0.20 -2.60 -0.04 0.00 -1.01 0.00 0.00 33.01 29.56 1m3d s GLN 126 CO 0.48 0.22 1.11 0.42 0.01 0.00 0.00 175.29 177.53 1m3d s ILE 127 N -2.01 4.41 0.27 1.08 1.01 -1.26 -4.44 121.20 120.26 1m3d s ILE 127 Ca 0.47 1.73 -0.29 0.00 0.00 0.00 0.00 60.65 62.55 1m3d s ILE 127 Cb -0.11 -4.11 -0.09 0.00 0.01 0.00 0.00 42.46 38.16 1m3d s ILE 127 CO 0.26 0.09 1.06 -2.16 0.00 0.00 0.00 174.94 174.20 1m3d s PRO 128 N 1.39 4.68 0.49 2.79 0.04 -1.26 -5.01 135.00 138.11 1m3d s PRO 128 Ca 0.55 1.73 -0.19 0.00 0.04 0.00 0.00 61.00 63.13 1m3d s PRO 128 Cb -0.25 -3.19 -0.08 0.00 0.04 0.00 0.00 34.50 31.02 1m3d s PRO 128 CO 0.26 0.27 0.99 1.14 0.04 0.00 0.00 177.00 179.71 1m3d s GLN 129 N -1.42 3.92 0.64 4.56 -2.07 -1.26 -4.59 119.66 119.45 1m3d s GLN 129 Ca 0.44 1.13 -0.16 0.00 -1.82 0.00 0.00 55.36 54.94 1m3d s GLN 129 Cb -0.30 -2.13 -0.01 0.00 -1.09 0.00 0.00 33.01 29.48 1m3d s GLN 129 CO 0.39 -0.30 1.13 0.00 -1.32 0.00 0.00 175.29 175.19 1m3d s PRO 131 N -3.86 2.21 0.07 0.00 0.02 -1.26 -4.84 135.00 127.35 1m3d s PRO 131 Ca 0.70 1.91 -0.35 0.00 0.02 0.00 0.00 61.00 63.28 1m3d s PRO 131 Cb -0.23 -1.82 -0.14 0.00 0.02 0.00 0.00 34.50 32.33 1m3d s PRO 131 CO 0.38 -1.81 1.63 2.41 -0.33 0.00 0.00 177.00 179.28 1m3d n THR 132 N -2.46 0.15 -0.30 0.99 -1.04 -1.26 -1.26 114.28 109.09 1m3d n THR 132 Ca 0.15 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.13 1m3d n THR 132 Cb 0.49 -1.51 0.00 0.00 -1.82 0.00 0.00 70.33 67.49 1m3d n THR 132 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1m3d n GLY 133 N 3.57 0.71 3.65 3.41 0.00 -1.26 -5.05 105.19 110.22 1m3d n GLY 133 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1m3d n GLY 133 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1m3d s TRP 134 N -2.65 3.00 0.15 1.61 0.52 -0.39 -1.92 118.94 119.25 1m3d s TRP 134 Ca 0.00 0.03 0.04 0.00 0.02 0.00 0.00 56.10 56.18 1m3d s TRP 134 Cb 0.00 -1.63 -0.04 0.00 -1.15 0.00 0.00 33.47 30.65 1m3d s TRP 134 CO 0.00 0.43 0.19 -1.54 0.02 0.00 0.00 176.95 176.05 1m3d s SER 135 N -1.59 5.84 0.11 2.95 1.04 0.11 -4.72 113.70 117.43 1m3d s SER 135 Ca 0.19 0.00 -0.30 0.00 0.48 0.00 0.00 55.95 56.32 1m3d s SER 135 Cb -0.11 -1.63 -0.06 0.00 0.10 0.00 0.00 66.02 64.32 1m3d s SER 135 CO 0.10 0.07 1.00 -0.55 0.98 0.00 0.00 173.24 174.84 1m3d s SER 136 N -3.07 7.43 -0.21 7.02 0.15 -1.26 -0.44 113.70 123.33 1m3d s SER 136 Ca 0.32 1.83 -0.01 0.00 0.70 0.00 0.00 55.95 58.79 1m3d s SER 136 Cb -0.11 -2.59 -0.12 0.00 -1.71 0.00 0.00 66.02 61.49 1m3d s SER 136 CO 0.25 -0.13 -0.20 0.18 1.20 0.00 0.00 173.24 174.54 1m3d n LEU 137 N 2.91 2.67 -3.62 3.45 4.77 0.81 -4.78 117.00 123.21 1m3d n LEU 137 Ca 0.03 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1m3d n LEU 137 Cb 0.49 -0.69 -0.01 0.00 -2.33 0.00 0.00 43.42 40.88 1m3d n LEU 137 CO 0.52 0.76 1.04 -1.66 -1.33 0.00 0.00 177.39 176.72 1m3d s TRP 138 N -2.40 -0.06 0.35 -1.77 -2.14 -1.15 -4.60 118.94 107.17 1m3d s TRP 138 Ca -0.28 -0.04 0.05 0.00 2.66 0.00 0.00 56.10 58.49 1m3d s TRP 138 Cb 0.08 0.54 -0.07 0.00 -3.10 0.00 0.00 33.47 30.93 1m3d s TRP 138 CO 0.45 -0.28 0.03 0.96 -2.66 0.00 0.00 176.95 175.45 1m3d s ILE 139 N -2.45 1.51 -0.66 0.66 -4.36 -1.26 0.18 121.20 114.81 1m3d s ILE 139 Ca 0.13 -2.01 0.00 0.00 -0.26 0.00 0.00 60.65 58.51 1m3d s ILE 139 Cb 0.04 -2.83 0.00 0.00 1.25 0.00 0.00 42.46 40.92 1m3d s ILE 139 CO -0.04 -0.03 0.00 0.61 0.24 0.00 0.00 174.94 175.72 1m3d n GLY 140 N -0.77 -0.75 3.45 6.27 0.00 -0.34 -4.35 105.19 108.70 1m3d n GLY 140 Ca -0.03 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 1m3d n GLY 140 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1m3d s TYR 141 N -3.88 2.55 -0.80 1.61 1.51 0.25 -1.22 117.35 117.37 1m3d s TYR 141 Ca 0.00 -0.26 -0.25 0.00 -1.01 0.00 0.00 57.07 55.55 1m3d s TYR 141 Cb 0.00 -1.47 -0.01 0.00 -0.11 0.00 0.00 41.96 40.37 1m3d s TYR 141 CO 0.00 0.24 1.72 -1.12 -1.11 0.00 0.00 175.55 175.28 1m3d s SER 142 N -1.37 5.59 -0.36 2.29 0.01 -0.43 -1.48 113.70 117.95 1m3d s SER 142 Ca 0.14 -0.45 -0.16 0.00 1.31 0.00 0.00 55.95 56.79 1m3d s SER 142 Cb -0.10 -2.55 -0.00 0.00 0.21 0.00 0.00 66.02 63.57 1m3d s SER 142 CO 0.05 -2.26 0.39 0.12 0.41 0.00 0.00 173.24 171.95 1m3d s PHE 143 N 8.15 3.20 -0.18 2.43 5.36 0.10 -1.61 117.98 135.44 1m3d s PHE 143 Ca 0.59 -0.07 0.00 0.00 -0.96 0.00 0.00 56.93 56.50 1m3d s PHE 143 Cb -0.08 -2.74 -0.11 0.00 -0.34 0.00 0.00 43.02 39.75 1m3d s PHE 143 CO 0.07 -0.50 -0.17 1.55 -1.46 0.00 0.00 175.22 174.72 1m3d n VAL 144 N 5.30 1.03 -3.85 3.12 3.14 -0.61 -4.30 118.33 122.16 1m3d n VAL 144 Ca -0.08 -0.38 -0.09 0.00 -2.96 0.00 0.00 64.34 60.82 1m3d n VAL 144 Cb 0.49 -1.18 0.01 0.00 -1.06 0.00 0.00 33.84 32.10 1m3d n VAL 144 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1m3d s MET 145 N -2.36 2.18 0.16 1.45 0.23 -1.17 0.14 119.30 119.93 1m3d s MET 145 Ca -0.24 -1.46 -0.21 0.00 -1.03 0.00 0.00 55.69 52.74 1m3d s MET 145 Cb 0.07 0.60 0.06 0.00 -1.53 0.00 0.00 34.83 34.03 1m3d s MET 145 CO 0.41 -1.01 0.55 -3.38 -2.03 0.00 0.00 175.02 169.56 1m3d s HIS 146 N -2.47 -0.43 0.05 3.16 -3.43 -0.58 -0.44 115.29 111.16 1m3d s HIS 146 Ca 0.17 0.18 -0.11 0.00 -0.80 0.00 0.00 55.06 54.50 1m3d s HIS 146 Cb -0.05 0.49 0.01 0.00 -1.43 0.00 0.00 32.58 31.60 1m3d s HIS 146 CO 0.12 -0.83 0.24 0.95 -2.00 0.00 0.00 174.74 173.22 1m3d s THR 147 N -3.77 0.10 0.00 -5.38 -4.23 -0.80 -2.83 115.64 98.73 1m3d s THR 147 Ca 0.02 -0.86 0.00 0.00 -1.18 0.00 0.00 61.69 59.67 1m3d s THR 147 Cb -0.00 -1.01 0.00 0.00 1.34 0.00 0.00 72.50 72.83 1m3d s THR 147 CO -0.12 -0.48 0.00 -0.24 -0.54 0.00 0.00 174.62 173.25 1m3d n SER 148 N 0.48 0.00 -4.61 3.99 2.88 -0.34 -0.89 113.62 115.13 1m3d n SER 148 Ca -0.18 0.00 -0.50 0.00 -1.33 0.00 0.00 58.87 56.86 1m3d n SER 148 Cb 0.60 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 64.01 1m3d n SER 148 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1m3d n ALA 149 N -3.00 -0.43 -1.15 -1.46 0.00 -1.26 -0.70 120.51 112.51 1m3d n ALA 149 Ca 0.00 0.49 -0.05 0.00 0.00 0.00 0.00 53.44 53.88 1m3d n ALA 149 Cb 0.00 -2.13 -0.02 0.00 0.00 0.00 0.00 19.45 17.30 1m3d n ALA 149 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1m3d n GLY 150 N 2.59 0.54 2.43 0.00 0.00 -1.26 -1.85 105.19 107.65 1m3d n GLY 150 Ca 0.17 -0.04 -0.16 0.00 0.00 0.00 0.00 46.02 46.00 1m3d n GLY 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m3d n ALA 151 N 1.10 -0.29 -2.19 4.61 0.00 0.12 -4.99 120.51 118.86 1m3d n ALA 151 Ca -0.05 0.23 -0.27 0.00 0.00 0.00 0.00 53.44 53.35 1m3d n ALA 151 Cb 0.49 -1.73 0.01 0.00 0.00 0.00 0.00 19.45 18.22 1m3d n ALA 151 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1m3d s GLU 152 N -3.67 3.26 0.00 0.00 0.41 -0.77 -4.74 118.70 113.19 1m3d s GLU 152 Ca 0.00 0.08 0.00 0.00 -0.41 0.00 0.00 54.97 54.64 1m3d s GLU 152 Cb 0.00 -2.34 0.00 0.00 -1.78 0.00 0.00 34.13 30.01 1m3d s GLU 152 CO 0.00 -0.42 0.00 0.41 -0.49 0.00 0.00 175.26 174.76 1m3d n GLY 153 N -2.39 -0.62 1.64 -1.39 0.00 -1.26 -1.20 105.19 99.97 1m3d n GLY 153 Ca 0.02 -0.82 -0.04 0.00 0.00 0.00 0.00 46.02 45.19 1m3d n GLY 153 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1m3d n SER 154 N 0.13 -1.01 -1.00 1.61 3.41 -1.13 -4.69 113.62 110.95 1m3d n SER 154 Ca 0.00 -1.70 0.00 0.00 -0.26 0.00 0.00 58.87 56.91 1m3d n SER 154 Cb 0.00 1.68 0.00 0.00 -0.26 0.00 0.00 64.21 65.63 1m3d n SER 154 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1m3d n GLY 155 N -0.23 2.53 3.48 5.00 0.00 -1.26 -1.53 105.19 113.18 1m3d n GLY 155 Ca -0.04 -1.18 -0.29 0.00 0.00 0.00 0.00 46.02 44.51 1m3d n GLY 155 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1m3d s GLN 156 N -1.99 1.75 0.08 1.61 -1.52 0.12 -4.73 119.66 114.98 1m3d s GLN 156 Ca 0.00 -1.20 -0.30 0.00 -1.95 0.00 0.00 55.36 51.91 1m3d s GLN 156 Cb 0.00 -2.09 -0.05 0.00 -0.22 0.00 0.00 33.01 30.64 1m3d s GLN 156 CO 0.00 0.48 1.08 0.00 -0.25 0.00 0.00 175.29 176.60 1m3d s ALA 157 N -1.15 3.30 -0.63 6.09 0.00 -1.26 -4.87 121.76 123.24 1m3d s ALA 157 Ca 0.18 0.72 0.15 0.00 0.00 0.00 0.00 51.96 53.00 1m3d s ALA 157 Cb -0.10 -3.37 0.71 0.00 0.00 0.00 0.00 23.12 20.35 1m3d s ALA 157 CO 0.10 -0.26 1.46 1.28 0.00 0.00 0.00 175.76 178.33 1m3d n LEU 158 N 3.34 0.33 -0.68 0.00 4.77 -1.26 -1.38 117.00 122.12 1m3d n LEU 158 Ca 0.06 0.62 0.09 0.00 -0.03 0.00 0.00 56.01 56.74 1m3d n LEU 158 Cb 0.48 -0.62 0.07 0.00 -2.33 0.00 0.00 43.42 41.02 1m3d n LEU 158 CO 0.53 -0.61 0.51 0.00 -1.33 0.00 0.00 177.39 176.50 1m3d n ALA 159 N -1.65 2.51 -2.27 -1.18 0.00 -1.26 -4.64 120.51 112.02 1m3d n ALA 159 Ca 0.01 -0.63 -0.35 0.00 0.00 0.00 0.00 53.44 52.46 1m3d n ALA 159 Cb 0.09 -0.59 -0.06 0.00 0.00 0.00 0.00 19.45 18.90 1m3d n ALA 159 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1m3d s SER 160 N -1.48 6.89 0.66 0.00 0.15 -0.48 -1.30 113.70 118.16 1m3d s SER 160 Ca 0.20 1.19 0.39 0.00 0.70 0.00 0.00 55.95 58.42 1m3d s SER 160 Cb 0.14 -2.33 2.11 0.00 -1.71 0.00 0.00 66.02 64.23 1m3d s SER 160 CO 0.23 0.07 2.20 -0.65 1.20 0.00 0.00 173.24 176.29 1m3d h PRO 161 N 3.46 0.00 0.00 5.44 0.11 -1.87 -1.29 132.00 137.85 1m3d h PRO 161 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1m3d h PRO 161 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1m3d h PRO 161 CO 0.66 0.00 0.00 0.78 -0.21 0.00 0.00 178.00 179.23 1m3d h GLY 162 N 0.00 0.00 -0.38 -0.55 0.00 -1.86 -1.76 103.07 98.52 1m3d h GLY 162 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1m3d h GLY 162 CO -0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 1m3d n SER 163 N -2.95 1.17 -3.91 0.19 3.41 -0.49 -4.51 113.62 106.54 1m3d n SER 163 Ca -0.00 -1.60 -0.29 0.00 -0.26 0.00 0.00 58.87 56.72 1m3d n SER 163 Cb 0.23 -0.07 -0.13 0.00 -0.26 0.00 0.00 64.21 63.98 1m3d n SER 163 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1m3d s LEU 165 N -0.72 4.43 0.30 0.00 1.43 -0.55 -4.73 118.68 118.84 1m3d s LEU 165 Ca 0.20 1.73 0.09 0.00 -1.03 0.00 0.00 54.13 55.12 1m3d s LEU 165 Cb -0.17 -3.58 0.47 0.00 0.03 0.00 0.00 46.19 42.94 1m3d s LEU 165 CO -0.07 -0.18 1.69 -0.33 0.23 0.00 0.00 176.35 177.69 1m3d h GLU 166 N 6.26 0.10 -4.83 1.70 5.08 -1.87 0.72 114.58 121.74 1m3d h GLU 166 Ca -0.42 -0.06 -0.61 0.00 -1.00 0.00 0.00 59.36 57.28 1m3d h GLU 166 Cb 1.22 0.00 -0.35 0.00 0.50 0.00 0.00 28.75 30.12 1m3d h GLU 166 CO 0.74 0.57 -0.84 -1.21 -1.00 0.00 0.00 179.01 177.27 1m3d s GLU 167 N -3.94 2.43 0.23 2.33 2.02 -1.26 -4.66 118.70 115.85 1m3d s GLU 167 Ca -0.03 -0.63 -0.30 0.00 0.02 0.00 0.00 54.97 54.03 1m3d s GLU 167 Cb 0.13 -2.08 -0.09 0.00 0.10 0.00 0.00 34.13 32.19 1m3d s GLU 167 CO 0.76 -0.10 1.26 0.12 0.02 0.00 0.00 175.26 177.32 1m3d s PHE 168 N 1.09 3.30 -0.06 1.61 2.19 -1.26 -4.97 117.98 119.88 1m3d s PHE 168 Ca -0.03 1.36 -0.02 0.00 0.33 0.00 0.00 56.93 58.56 1m3d s PHE 168 Cb -0.14 -3.54 0.04 0.00 -1.31 0.00 0.00 43.02 38.07 1m3d s PHE 168 CO -0.04 -1.55 0.13 1.03 1.83 0.00 0.00 175.22 176.61 1m3d s ARG 169 N -0.61 0.08 0.45 10.12 1.81 -1.26 -5.02 118.95 124.51 1m3d s ARG 169 Ca 0.53 0.35 0.18 0.00 -1.72 0.00 0.00 55.73 55.07 1m3d s ARG 169 Cb -0.36 -0.19 1.04 0.00 -0.45 0.00 0.00 34.95 35.00 1m3d s ARG 169 CO 0.41 -0.17 1.95 0.66 -0.68 0.00 0.00 175.30 177.47 1m3d h SER 170 N 7.27 0.00 -2.93 0.23 4.64 -2.00 -3.26 113.55 117.50 1m3d h SER 170 Ca -0.43 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.28 1m3d h SER 170 Cb 1.14 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.82 1m3d h SER 170 CO 0.43 0.23 -0.73 0.00 -0.87 0.00 0.00 176.83 175.88 1m3d s ALA 171 N -4.31 2.77 -1.19 5.18 0.00 -1.26 -4.45 121.76 118.51 1m3d s ALA 171 Ca -0.03 -3.20 0.25 0.00 0.00 0.00 0.00 51.96 48.98 1m3d s ALA 171 Cb 0.14 -1.94 1.16 0.00 0.00 0.00 0.00 23.12 22.48 1m3d s ALA 171 CO 0.67 -2.05 1.82 -0.35 0.00 0.00 0.00 175.76 175.85 1m3d n PRO 172 N 2.49 0.16 -4.11 0.00 -0.04 -1.23 -4.86 135.00 127.41 1m3d n PRO 172 Ca 0.21 0.06 -0.08 0.00 -0.04 0.00 0.00 63.50 63.66 1m3d n PRO 172 Cb 0.39 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.25 1m3d n PRO 172 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1m3d s PHE 173 N -2.81 0.61 0.10 0.54 -0.71 -1.26 -1.06 117.98 113.38 1m3d s PHE 173 Ca 0.17 -1.04 0.09 0.00 -1.04 0.00 0.00 56.93 55.12 1m3d s PHE 173 Cb 0.17 -0.42 -0.04 0.00 -1.21 0.00 0.00 43.02 41.52 1m3d s PHE 173 CO 0.42 -0.33 -0.24 -1.50 -1.34 0.00 0.00 175.22 172.23 1m3d s ILE 174 N -3.85 2.01 -0.21 -4.49 2.07 -0.26 -4.81 121.20 111.67 1m3d s ILE 174 Ca 0.08 -1.58 -0.12 0.00 -1.41 0.00 0.00 60.65 57.63 1m3d s ILE 174 Cb 0.07 -1.78 -0.05 0.00 0.13 0.00 0.00 42.46 40.84 1m3d s ILE 174 CO -0.09 0.10 0.22 -0.70 -1.91 0.00 0.00 174.94 172.56 1m3d s GLU 175 N -1.79 4.16 0.26 3.50 2.12 -0.85 -2.51 118.70 123.58 1m3d s GLU 175 Ca 0.11 -0.11 0.12 0.00 0.36 0.00 0.00 54.97 55.45 1m3d s GLU 175 Cb -0.10 -3.49 -0.05 0.00 0.26 0.00 0.00 34.13 30.76 1m3d s GLU 175 CO 0.04 0.14 -0.20 0.00 -0.54 0.00 0.00 175.26 174.70 1m3d s HIS 177 N -2.42 1.45 0.56 0.00 0.09 0.14 -2.20 115.29 112.91 1m3d s HIS 177 Ca 0.28 -0.61 0.26 0.00 -0.00 0.00 0.00 55.06 54.98 1m3d s HIS 177 Cb -0.05 -0.73 1.54 0.00 -0.00 0.00 0.00 32.58 33.34 1m3d s HIS 177 CO 0.14 0.18 2.10 0.78 -0.00 0.00 0.00 174.74 177.94 1m3d h GLY 178 N 3.09 0.00 1.65 -2.22 0.00 -1.49 0.99 103.07 105.08 1m3d h GLY 178 Ca -0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.94 1m3d h GLY 178 CO 0.57 0.00 0.00 -0.96 0.00 0.00 0.00 176.54 176.15 1m3d n ARG 179 N -4.08 0.18 -0.14 4.80 1.85 -1.26 -4.80 116.66 113.21 1m3d n ARG 179 Ca 0.02 0.16 0.00 0.00 -1.00 0.00 0.00 57.85 57.03 1m3d n ARG 179 Cb 0.31 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.22 1m3d n ARG 179 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1m3d n GLY 180 N 0.04 0.91 3.81 2.89 0.00 0.34 -5.09 105.19 108.10 1m3d n GLY 180 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 1m3d n GLY 180 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1m3d s THR 181 N -2.02 4.53 0.03 2.61 -4.23 -1.24 -4.09 115.64 111.23 1m3d s THR 181 Ca 0.00 -1.10 -0.04 0.00 -1.18 0.00 0.00 61.69 59.38 1m3d s THR 181 Cb 0.00 -3.33 -0.02 0.00 1.34 0.00 0.00 72.50 70.50 1m3d s THR 181 CO 0.00 -0.14 0.05 0.00 -0.54 0.00 0.00 174.62 173.99 1m3d s ASN 183 N -1.91 -0.06 -0.08 0.00 2.47 0.54 0.11 114.94 116.01 1m3d s ASN 183 Ca -0.08 -0.11 -0.06 0.00 0.42 0.00 0.00 52.86 53.03 1m3d s ASN 183 Cb -0.04 0.14 -0.04 0.00 -1.45 0.00 0.00 41.25 39.87 1m3d s ASN 183 CO -0.03 -0.26 0.17 -0.31 -3.72 0.00 0.00 177.10 172.94 1m3d s TYR 184 N -2.38 3.59 0.08 0.43 1.51 -1.26 -2.01 117.35 117.31 1m3d s TYR 184 Ca 0.14 0.50 0.08 0.00 -1.01 0.00 0.00 57.07 56.77 1m3d s TYR 184 Cb 0.05 -1.92 -0.03 0.00 -0.11 0.00 0.00 41.96 39.94 1m3d s TYR 184 CO -0.04 0.70 -0.21 0.71 -1.11 0.00 0.00 175.55 175.60 1m3d s TYR 185 N -1.14 1.81 0.59 2.71 1.51 -1.26 -5.03 117.35 116.55 1m3d s TYR 185 Ca 0.20 -0.40 0.29 0.00 -1.01 0.00 0.00 57.07 56.14 1m3d s TYR 185 Cb -0.12 -1.02 1.59 0.00 -0.11 0.00 0.00 41.96 42.30 1m3d s TYR 185 CO 0.09 0.17 2.03 0.00 -1.11 0.00 0.00 175.55 176.74 1m3d h ALA 186 N 4.35 1.93 -0.50 3.71 0.00 -2.03 -1.11 119.26 125.60 1m3d h ALA 186 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1m3d h ALA 186 Cb 1.17 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1m3d h ALA 186 CO 0.41 -0.43 0.00 0.27 0.00 0.00 0.00 179.25 179.50 1m3d n ASN 187 N -3.78 3.01 -4.56 0.00 6.94 -1.26 -4.79 115.26 110.83 1m3d n ASN 187 Ca 0.04 -2.10 -0.41 0.00 -0.02 0.00 0.00 54.58 52.08 1m3d n ASN 187 Cb 0.44 -0.39 -0.03 0.00 -2.36 0.00 0.00 39.78 37.44 1m3d n ASN 187 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1m3d s ALA 188 N -1.45 2.83 -0.12 -2.53 0.00 -0.42 -4.21 121.76 115.85 1m3d s ALA 188 Ca 0.35 -1.22 -0.06 0.00 0.00 0.00 0.00 51.96 51.03 1m3d s ALA 188 Cb 0.20 -4.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.09 1m3d s ALA 188 CO 0.22 -3.10 0.09 0.71 0.00 0.00 0.00 175.76 173.68 1m3d s TYR 189 N 5.49 3.42 -0.13 0.00 4.12 -0.06 -4.93 117.35 125.26 1m3d s TYR 189 Ca 0.37 0.37 0.01 0.00 0.02 0.00 0.00 57.07 57.84 1m3d s TYR 189 Cb -0.08 -1.92 -0.01 0.00 -1.52 0.00 0.00 41.96 38.43 1m3d s TYR 189 CO 0.18 0.57 -0.16 -1.54 0.02 0.00 0.00 175.55 174.62 1m3d s SER 190 N -0.76 3.70 -0.12 2.29 1.04 -1.26 -1.91 113.70 116.68 1m3d s SER 190 Ca 0.13 -0.42 -0.03 0.00 0.48 0.00 0.00 55.95 56.11 1m3d s SER 190 Cb -0.12 -1.55 -0.03 0.00 0.10 0.00 0.00 66.02 64.42 1m3d s SER 190 CO 0.03 0.14 -0.01 -0.36 0.98 0.00 0.00 173.24 174.03 1m3d s PHE 191 N 0.46 3.12 0.10 5.02 0.40 0.41 -5.00 117.98 122.50 1m3d s PHE 191 Ca -0.11 0.03 0.05 0.00 -0.60 0.00 0.00 56.93 56.29 1m3d s PHE 191 Cb -0.16 -1.87 -0.03 0.00 0.51 0.00 0.00 43.02 41.46 1m3d s PHE 191 CO 0.05 0.28 -0.12 -1.58 0.70 0.00 0.00 175.22 174.55 1m3d s TRP 192 N -0.37 1.20 0.24 0.36 0.52 -1.26 -1.57 118.94 118.06 1m3d s TRP 192 Ca 0.07 -0.57 -0.30 0.00 0.02 0.00 0.00 56.10 55.32 1m3d s TRP 192 Cb -0.12 -0.65 -0.09 0.00 -1.15 0.00 0.00 33.47 31.45 1m3d s TRP 192 CO 0.02 0.06 1.32 -1.17 0.02 0.00 0.00 176.95 177.20 1m3d s LEU 193 N -2.25 4.42 0.55 2.99 2.96 -0.63 -4.91 118.68 121.81 1m3d s LEU 193 Ca 0.04 2.50 -0.01 0.00 -0.22 0.00 0.00 54.13 56.45 1m3d s LEU 193 Cb -0.06 -3.62 0.03 0.00 0.50 0.00 0.00 46.19 43.04 1m3d s LEU 193 CO 0.02 -0.54 0.79 0.00 -1.32 0.00 0.00 176.35 175.30 1m3d s ALA 194 N -0.23 3.72 -0.07 5.97 0.00 -1.26 -1.41 121.76 128.47 1m3d s ALA 194 Ca 0.55 -1.16 -0.25 0.00 0.00 0.00 0.00 51.96 51.11 1m3d s ALA 194 Cb -0.38 -2.20 -0.03 0.00 0.00 0.00 0.00 23.12 20.51 1m3d s ALA 194 CO 0.42 -0.73 0.76 0.95 0.00 0.00 0.00 175.76 177.16 1m3d s THR 195 N -2.79 5.00 -0.12 0.00 -4.23 -1.25 -4.47 115.64 107.77 1m3d s THR 195 Ca 0.55 1.56 0.00 0.00 -1.18 0.00 0.00 61.69 62.62 1m3d s THR 195 Cb -0.10 -4.09 0.02 0.00 1.34 0.00 0.00 72.50 69.67 1m3d s THR 195 CO 0.40 0.20 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.94 1m3d s ILE 196 N 1.05 1.26 0.11 2.99 -1.09 0.39 -4.95 121.20 120.96 1m3d s ILE 196 Ca 0.40 -0.45 -0.30 0.00 -2.23 0.00 0.00 60.65 58.07 1m3d s ILE 196 Cb -0.18 -1.23 -0.06 0.00 -1.58 0.00 0.00 42.46 39.41 1m3d s ILE 196 CO 0.19 0.41 1.12 -1.61 -1.23 0.00 0.00 174.94 173.81 1m3d s GLU 197 N 1.54 4.53 0.41 2.79 0.41 -1.26 -4.81 118.70 122.32 1m3d s GLU 197 Ca 0.04 1.70 0.19 0.00 -0.41 0.00 0.00 54.97 56.48 1m3d s GLU 197 Cb -0.13 -3.33 1.11 0.00 -1.78 0.00 0.00 34.13 30.00 1m3d s GLU 197 CO -0.08 -0.06 1.81 0.00 -0.49 0.00 0.00 175.26 176.44 1m3d h ARG 198 N 5.97 0.38 0.00 1.61 3.08 -1.99 0.26 114.38 123.69 1m3d h ARG 198 Ca -0.43 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.60 1m3d h ARG 198 Cb 1.21 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.18 1m3d h ARG 198 CO 0.76 0.25 0.00 0.66 -1.07 0.00 0.00 179.97 180.57 1m3d h SER 199 N 0.39 0.00 -0.24 7.04 4.64 -2.05 -3.02 113.55 120.31 1m3d h SER 199 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 1m3d h SER 199 Cb 1.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 1m3d h SER 199 CO -0.22 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.12 1m3d n GLU 200 N -2.82 2.12 -0.33 4.77 -0.58 0.91 -4.59 120.64 120.11 1m3d n GLU 200 Ca 0.01 -1.97 0.13 0.00 -0.42 0.00 0.00 57.16 54.91 1m3d n GLU 200 Cb 0.28 -1.42 0.32 0.00 -0.57 0.00 0.00 31.44 30.05 1m3d n GLU 200 CO 0.00 0.00 0.00 0.52 -0.48 0.00 0.00 177.13 177.17 1m3d h MET 201 N 3.78 0.62 -1.02 3.49 2.86 -1.39 -1.69 114.93 121.58 1m3d h MET 201 Ca 0.00 -0.04 -0.62 0.00 -2.06 0.00 0.00 59.70 56.99 1m3d h MET 201 Cb 0.86 -0.14 -0.37 0.00 0.06 0.00 0.00 31.60 32.01 1m3d h MET 201 CO 0.00 0.41 -0.07 1.19 1.06 0.00 0.00 176.91 179.50 1m3d n PHE 202 N -4.86 3.01 -4.46 -0.22 3.01 -1.26 -4.96 117.46 107.73 1m3d n PHE 202 Ca 0.23 -2.61 -0.22 0.00 1.01 0.00 0.00 57.45 55.86 1m3d n PHE 202 Cb 0.61 -0.77 -0.14 0.00 -0.01 0.00 0.00 39.48 39.17 1m3d n PHE 202 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1m3d s LYS 203 N -3.71 1.13 0.14 -1.08 -0.14 -0.64 -5.10 119.74 110.34 1m3d s LYS 203 Ca 0.56 -0.87 -0.34 0.00 -1.36 0.00 0.00 55.97 53.96 1m3d s LYS 203 Cb 0.45 -1.20 -0.14 0.00 -1.68 0.00 0.00 37.83 35.26 1m3d s LYS 203 CO -0.04 0.30 1.55 1.17 -0.76 0.00 0.00 175.35 177.57 1m3d n LYS 204 N 1.80 1.99 -1.68 1.68 4.81 -1.26 -4.88 118.16 120.62 1m3d n LYS 204 Ca -0.18 0.72 -0.39 0.00 -0.87 0.00 0.00 58.31 57.59 1m3d n LYS 204 Cb 0.54 -2.47 0.03 0.00 0.02 0.00 0.00 35.03 33.15 1m3d n LYS 204 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1m3d n PRO 205 N 3.37 1.49 -3.43 1.64 -0.02 -1.26 -4.96 135.00 131.84 1m3d n PRO 205 Ca 0.17 0.54 -0.40 0.00 -2.02 0.00 0.00 63.50 61.79 1m3d n PRO 205 Cb 0.27 -2.34 -0.10 0.00 -0.02 0.00 0.00 33.50 31.32 1m3d n PRO 205 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1m3d s THR 206 N -1.32 5.19 0.59 3.45 2.01 -1.26 -5.05 115.64 119.25 1m3d s THR 206 Ca 0.69 0.05 -0.20 0.00 0.31 0.00 0.00 61.69 62.54 1m3d s THR 206 Cb -0.46 -3.79 -0.04 0.00 0.01 0.00 0.00 72.50 68.22 1m3d s THR 206 CO 0.52 -0.05 1.19 -2.65 -0.69 0.00 0.00 174.62 172.94 1m3d n PRO 207 N 5.33 1.22 -3.73 4.92 -0.02 -1.26 -5.03 135.00 136.43 1m3d n PRO 207 Ca -0.10 0.46 -0.12 0.00 -2.02 0.00 0.00 63.50 61.73 1m3d n PRO 207 Cb 0.50 -2.40 -0.11 0.00 -0.02 0.00 0.00 33.50 31.46 1m3d n PRO 207 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1m3d s SER 208 N -1.17 -0.41 -0.21 2.55 0.15 -1.26 -5.13 113.70 108.21 1m3d s SER 208 Ca 0.76 0.77 -0.02 0.00 0.70 0.00 0.00 55.95 58.16 1m3d s SER 208 Cb -0.41 0.73 0.01 0.00 -1.71 0.00 0.00 66.02 64.63 1m3d s SER 208 CO 0.46 -0.15 -0.09 -0.89 1.20 0.00 0.00 173.24 173.76 1m3d s THR 209 N 0.65 2.89 -0.05 6.45 2.01 -1.26 -5.11 115.64 121.22 1m3d s THR 209 Ca -0.04 -0.72 0.01 0.00 0.31 0.00 0.00 61.69 61.25 1m3d s THR 209 Cb -0.05 -2.32 -0.03 0.00 0.01 0.00 0.00 72.50 70.11 1m3d s THR 209 CO -0.04 0.42 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.50 1m3d s LEU 210 N 1.40 3.29 0.43 4.42 1.02 -1.26 -5.13 118.68 122.84 1m3d s LEU 210 Ca 0.05 -0.01 0.06 0.00 0.02 0.00 0.00 54.13 54.25 1m3d s LEU 210 Cb -0.14 -1.78 -0.06 0.00 0.02 0.00 0.00 46.19 44.23 1m3d s LEU 210 CO -0.06 0.34 0.06 -0.54 0.02 0.00 0.00 176.35 176.17 1m3d s LYS 211 N -1.03 2.06 0.17 1.70 1.02 -1.26 -4.93 119.74 117.47 1m3d s LYS 211 Ca 0.14 -2.07 -0.32 0.00 0.02 0.00 0.00 55.97 53.74 1m3d s LYS 211 Cb -0.11 -1.73 -0.17 0.00 -0.52 0.00 0.00 37.83 35.31 1m3d s LYS 211 CO 0.04 -0.12 0.93 0.00 -0.92 0.00 0.00 175.35 175.28 1m3d n ALA 212 N -1.09 -1.80 0.00 5.17 0.00 -1.26 -1.17 120.51 120.36 1m3d n ALA 212 Ca -0.06 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1m3d n ALA 212 Cb 0.66 -1.86 0.00 0.00 0.00 0.00 0.00 19.45 18.26 1m3d n ALA 212 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1m3d n GLY 213 N 1.80 3.15 0.09 0.00 0.00 -1.26 -4.78 105.19 104.19 1m3d n GLY 213 Ca 0.16 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.24 1m3d n GLY 213 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1m3d n GLU 214 N -1.04 1.58 0.01 1.61 0.28 -0.32 -4.84 120.64 117.92 1m3d n GLU 214 Ca 0.00 -2.07 -0.01 0.00 -0.16 0.00 0.00 57.16 54.93 1m3d n GLU 214 Cb 0.00 -1.24 -0.00 0.00 1.43 0.00 0.00 31.44 31.63 1m3d n GLU 214 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 1m3d h LEU 215 N 0.00 -0.04 -0.22 -1.84 3.38 -1.86 -3.36 115.31 111.37 1m3d h LEU 215 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1m3d h LEU 215 Cb 0.90 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1m3d h LEU 215 CO 0.00 0.11 0.00 -2.11 0.09 0.00 0.00 178.44 176.53 1m3d n ARG 216 N -2.91 0.03 -0.03 1.13 1.85 -1.26 -1.62 116.66 113.84 1m3d n ARG 216 Ca -0.01 0.48 0.12 0.00 -1.00 0.00 0.00 57.85 57.44 1m3d n ARG 216 Cb 0.02 -1.58 0.53 0.00 -1.05 0.00 0.00 32.46 30.39 1m3d n ARG 216 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1m3d n THR 217 N -1.63 0.08 -1.25 8.89 -2.24 -1.26 -3.65 114.28 113.23 1m3d n THR 217 Ca 0.00 -0.19 0.03 0.00 -2.27 0.00 0.00 64.05 61.63 1m3d n THR 217 Cb 0.04 0.12 0.05 0.00 -2.10 0.00 0.00 70.33 68.43 1m3d n THR 217 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1m3d n HIS 218 N -0.17 0.00 -4.37 4.78 8.25 -0.64 -4.92 115.22 118.15 1m3d n HIS 218 Ca 0.17 -0.41 -0.34 0.00 -0.26 0.00 0.00 57.72 56.89 1m3d n HIS 218 Cb 0.24 -0.08 -0.09 0.00 1.12 0.00 0.00 29.99 31.18 1m3d n HIS 218 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1m3d s VAL 219 N -1.11 4.16 0.48 1.59 1.01 -1.24 -3.83 120.40 121.46 1m3d s VAL 219 Ca 0.11 -0.42 -0.24 0.00 0.00 0.00 0.00 61.98 61.42 1m3d s VAL 219 Cb 0.09 -2.79 -0.07 0.00 0.00 0.00 0.00 36.38 33.62 1m3d s VAL 219 CO 0.01 0.51 1.39 -0.55 0.00 0.00 0.00 175.10 176.46 1m3d s SER 220 N -1.14 5.73 0.31 3.32 0.15 -0.50 -4.57 113.70 117.00 1m3d s SER 220 Ca 0.16 2.83 0.07 0.00 0.70 0.00 0.00 55.95 59.70 1m3d s SER 220 Cb -0.11 -2.65 -0.02 0.00 -1.71 0.00 0.00 66.02 61.53 1m3d s SER 220 CO 0.05 -1.26 0.35 -0.13 1.20 0.00 0.00 173.24 173.45 1m3d s ARG 221 N -2.58 2.98 0.19 5.44 1.81 -0.96 -1.32 118.95 124.52 1m3d s ARG 221 Ca 0.64 -1.09 -0.09 0.00 -1.72 0.00 0.00 55.73 53.46 1m3d s ARG 221 Cb -0.42 -2.66 -0.01 0.00 -0.45 0.00 0.00 34.95 31.41 1m3d s ARG 221 CO 0.52 0.17 0.33 0.00 -0.68 0.00 0.00 175.30 175.64 1m3d s GLN 223 N -4.00 0.12 -0.19 0.00 0.74 -0.81 -1.20 119.66 114.32 1m3d s GLN 223 Ca 0.21 0.25 -0.13 0.00 0.05 0.00 0.00 55.36 55.75 1m3d s GLN 223 Cb 0.03 -0.04 -0.05 0.00 1.10 0.00 0.00 33.01 34.05 1m3d s GLN 223 CO 0.04 -0.08 0.25 0.08 -0.55 0.00 0.00 175.29 175.03 1m3d s VAL 224 N 0.52 5.32 0.22 1.34 1.01 0.13 -1.68 120.40 127.26 1m3d s VAL 224 Ca -0.04 0.43 0.09 0.00 0.00 0.00 0.00 61.98 62.45 1m3d s VAL 224 Cb -0.05 -3.59 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 1m3d s VAL 224 CO -0.02 0.37 -0.16 0.00 0.00 0.00 0.00 175.10 175.29 1m3d s MET 226 N -3.61 0.61 0.40 0.00 -2.45 0.42 -0.82 119.30 113.85 1m3d s MET 226 Ca 0.24 -0.19 -0.27 0.00 -1.25 0.00 0.00 55.69 54.22 1m3d s MET 226 Cb -0.02 -0.61 -0.10 0.00 1.25 0.00 0.00 34.83 35.36 1m3d s MET 226 CO 0.08 0.07 1.44 0.50 1.05 0.00 0.00 175.02 178.16 1m3d s ARG 227 N 0.19 4.00 0.00 4.11 3.00 -0.76 0.05 118.95 129.53 1m3d s ARG 227 Ca -0.02 2.46 0.27 0.00 -1.00 0.00 0.00 55.73 57.44 1m3d s ARG 227 Cb -0.06 -2.87 0.81 0.00 0.00 0.00 0.00 34.95 32.83 1m3d s ARG 227 CO -0.00 -0.58 1.61 2.89 0.00 0.00 0.00 175.30 179.22