#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gnd s SER 3 N 0.00 1.44 -0.16 -2.24 1.04 -1.26 -1.52 113.70 111.00 2gnd s SER 3 Ca 0.00 -0.59 -0.13 0.00 0.48 0.00 0.00 55.95 55.71 2gnd s SER 3 Cb 0.00 -0.03 0.05 0.00 0.10 0.00 0.00 66.02 66.14 2gnd s SER 3 CO 0.00 -0.11 0.42 -0.22 0.98 0.00 0.00 173.24 174.31 2gnd s LEU 4 N -1.67 0.25 -0.02 2.42 2.96 -0.33 -4.99 118.68 117.29 2gnd s LEU 4 Ca -0.04 0.87 -0.07 0.00 -0.22 0.00 0.00 54.13 54.66 2gnd s LEU 4 Cb -0.10 1.43 0.01 0.00 0.50 0.00 0.00 46.19 48.03 2gnd s LEU 4 CO 0.02 -0.16 0.16 -0.44 -1.32 0.00 0.00 176.35 174.61 2gnd s SER 5 N 0.55 -0.06 -0.12 3.68 0.01 -1.26 -0.45 113.70 116.05 2gnd s SER 5 Ca -0.03 0.00 -0.24 0.00 1.31 0.00 0.00 55.95 57.00 2gnd s SER 5 Cb -0.04 0.27 0.06 0.00 0.21 0.00 0.00 66.02 66.51 2gnd s SER 5 CO -0.03 -0.27 0.58 0.72 0.41 0.00 0.00 173.24 174.65 2gnd s PHE 6 N -0.87 -0.57 -0.03 2.43 -0.12 -0.49 -5.01 117.98 113.32 2gnd s PHE 6 Ca -0.10 1.17 0.01 0.00 -0.05 0.00 0.00 56.93 57.96 2gnd s PHE 6 Cb -0.05 0.28 0.03 0.00 -0.63 0.00 0.00 43.02 42.64 2gnd s PHE 6 CO 0.01 -0.45 -0.01 0.20 -0.05 0.00 0.00 175.22 174.93 2gnd s GLY 7 N -0.58 0.29 -0.58 1.99 0.00 -1.26 -1.11 107.32 106.07 2gnd s GLY 7 Ca -0.07 0.11 -0.01 0.00 0.00 0.00 0.00 44.72 44.76 2gnd s GLY 7 CO 0.05 0.56 0.36 -1.36 0.00 0.00 0.00 173.10 172.72 2gnd s PHE 8 N 1.00 3.36 0.35 1.90 0.40 0.21 -4.93 117.98 120.27 2gnd s PHE 8 Ca -0.10 -2.86 0.04 0.00 -0.60 0.00 0.00 56.93 53.42 2gnd s PHE 8 Cb -0.14 -3.08 0.65 0.00 0.51 0.00 0.00 43.02 40.97 2gnd s PHE 8 CO -0.01 -0.82 1.93 -1.35 0.70 0.00 0.00 175.22 175.67 2gnd h PRO 9 N 6.92 0.60 -4.29 0.24 0.11 -1.91 -0.96 132.00 132.71 2gnd h PRO 9 Ca -0.04 -0.09 -0.30 0.00 0.11 0.00 0.00 66.00 65.68 2gnd h PRO 9 Cb 0.94 -0.11 -0.10 0.00 0.11 0.00 0.00 31.00 31.85 2gnd h PRO 9 CO 0.70 0.52 -0.28 0.95 -0.21 0.00 0.00 178.00 179.69 2gnd s THR 10 N -5.21 0.00 -0.60 -1.15 -4.23 -1.26 -4.49 115.64 98.70 2gnd s THR 10 Ca -0.08 -1.70 0.04 0.00 -1.18 0.00 0.00 61.69 58.77 2gnd s THR 10 Cb 0.16 -2.58 0.16 0.00 1.34 0.00 0.00 72.50 71.58 2gnd s THR 10 CO 0.76 0.00 0.40 -0.36 -0.54 0.00 0.00 174.62 174.88 2gnd s PHE 11 N -3.25 2.98 0.71 3.99 0.08 -0.43 -4.97 117.98 117.09 2gnd s PHE 11 Ca 0.33 -3.07 -0.15 0.00 0.12 0.00 0.00 56.93 54.16 2gnd s PHE 11 Cb 0.01 -2.39 0.03 0.00 -0.57 0.00 0.00 43.02 40.10 2gnd s PHE 11 CO 0.21 -0.64 1.18 -2.14 -0.10 0.00 0.00 175.22 173.73 2gnd s PRO 12 N -0.84 2.32 0.00 0.24 0.02 -1.26 -3.35 135.00 132.13 2gnd s PRO 12 Ca 0.24 1.67 0.13 0.00 0.02 0.00 0.00 61.00 63.06 2gnd s PRO 12 Cb -0.09 -1.86 0.64 0.00 0.02 0.00 0.00 34.50 33.20 2gnd s PRO 12 CO -0.12 -1.68 1.38 -1.13 -0.33 0.00 0.00 177.00 175.12 2gnd n SER 13 N -2.62 0.00 -4.08 2.53 3.41 -1.26 -4.12 113.62 107.49 2gnd n SER 13 Ca 0.13 0.25 -0.43 0.00 -0.26 0.00 0.00 58.87 58.56 2gnd n SER 13 Cb 0.51 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 2gnd n SER 13 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2gnd n ASP 14 N -1.37 5.27 -4.73 4.04 4.64 -1.26 -4.99 116.55 118.15 2gnd n ASP 14 Ca 0.05 -3.10 -0.35 0.00 -1.38 0.00 0.00 54.79 50.01 2gnd n ASP 14 Cb 0.13 -1.48 -0.08 0.00 -1.04 0.00 0.00 41.12 38.64 2gnd n ASP 14 CO 0.00 0.00 0.00 -1.10 -0.82 0.00 0.00 177.20 175.28 2gnd s GLN 15 N 0.36 3.06 0.00 -0.67 -1.52 -1.26 -4.99 119.66 114.65 2gnd s GLN 15 Ca 0.39 -0.38 0.00 0.00 -1.95 0.00 0.00 55.36 53.43 2gnd s GLN 15 Cb 0.05 -2.87 0.00 0.00 -0.22 0.00 0.00 33.01 29.97 2gnd s GLN 15 CO 0.01 0.71 0.00 1.63 -0.25 0.00 0.00 175.29 177.39 2gnd n LYS 16 N 1.95 2.13 -0.50 2.91 4.76 -1.26 -4.81 118.16 123.34 2gnd n LYS 16 Ca -0.18 0.00 0.08 0.00 -2.87 0.00 0.00 58.31 55.34 2gnd n LYS 16 Cb 0.54 -0.92 0.29 0.00 -1.84 0.00 0.00 35.03 33.10 2gnd n LYS 16 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2gnd n ASN 17 N -1.49 4.23 -4.50 4.39 3.02 -1.26 -4.96 115.26 114.69 2gnd n ASN 17 Ca 0.00 -2.57 -0.33 0.00 -0.03 0.00 0.00 54.58 51.64 2gnd n ASN 17 Cb 0.20 -0.51 -0.12 0.00 -0.61 0.00 0.00 39.78 38.74 2gnd n ASN 17 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2gnd s LEU 18 N -2.06 3.04 -0.35 3.41 1.43 -1.26 -0.21 118.68 122.68 2gnd s LEU 18 Ca 0.43 -0.14 -0.15 0.00 -1.03 0.00 0.00 54.13 53.24 2gnd s LEU 18 Cb 0.30 -1.68 -0.01 0.00 0.03 0.00 0.00 46.19 44.83 2gnd s LEU 18 CO 0.17 0.26 0.33 -0.63 0.23 0.00 0.00 176.35 176.71 2gnd s ILE 19 N -0.19 5.20 -0.15 -0.59 1.01 0.13 -4.91 121.20 121.70 2gnd s ILE 19 Ca 0.02 -0.09 -0.14 0.00 0.00 0.00 0.00 60.65 60.44 2gnd s ILE 19 Cb -0.13 -3.81 -0.05 0.00 0.01 0.00 0.00 42.46 38.48 2gnd s ILE 19 CO 0.03 -0.10 0.29 -0.36 0.00 0.00 0.00 174.94 174.80 2gnd s PHE 20 N 1.92 3.48 0.04 3.97 0.08 -1.26 -1.16 117.98 125.05 2gnd s PHE 20 Ca 0.10 0.61 0.06 0.00 0.12 0.00 0.00 56.93 57.81 2gnd s PHE 20 Cb -0.17 -2.32 -0.02 0.00 -0.57 0.00 0.00 43.02 39.93 2gnd s PHE 20 CO 0.11 0.27 -0.16 -0.65 -0.10 0.00 0.00 175.22 174.70 2gnd s GLN 21 N 0.35 1.06 6.52 0.44 -0.21 0.40 -5.00 119.66 123.22 2gnd s GLN 21 Ca 0.17 -0.82 0.00 0.00 0.02 0.00 0.00 55.36 54.73 2gnd s GLN 21 Cb -0.13 -1.10 0.00 0.00 1.00 0.00 0.00 33.01 32.78 2gnd s GLN 21 CO 0.04 0.28 0.00 0.41 -2.12 0.00 0.00 175.29 173.90 2gnd n GLY 22 N 1.86 1.89 1.04 3.09 0.00 -1.26 -1.41 105.19 110.40 2gnd n GLY 22 Ca -0.18 -0.46 0.10 0.00 0.00 0.00 0.00 46.02 45.48 2gnd n GLY 22 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2gnd n ASP 23 N 5.14 3.03 -4.76 1.61 8.00 0.69 -4.95 116.55 125.32 2gnd n ASP 23 Ca 0.00 -1.97 -0.41 0.00 0.71 0.00 0.00 54.79 53.12 2gnd n ASP 23 Cb 0.00 -0.33 -0.02 0.00 -0.02 0.00 0.00 41.12 40.74 2gnd n ASP 23 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2gnd s ALA 24 N -1.33 3.55 0.13 2.24 0.00 -1.18 -4.42 121.76 120.75 2gnd s ALA 24 Ca 0.38 1.29 -0.24 0.00 0.00 0.00 0.00 51.96 53.39 2gnd s ALA 24 Cb 0.20 -3.51 0.07 0.00 0.00 0.00 0.00 23.12 19.88 2gnd s ALA 24 CO 0.28 -0.69 0.72 1.14 0.00 0.00 0.00 175.76 177.20 2gnd s GLN 25 N -1.15 1.22 0.05 0.00 -2.07 -0.90 -4.74 119.66 112.06 2gnd s GLN 25 Ca 0.53 -0.51 -0.24 0.00 -1.82 0.00 0.00 55.36 53.33 2gnd s GLN 25 Cb -0.40 0.52 -0.06 0.00 -1.09 0.00 0.00 33.01 31.98 2gnd s GLN 25 CO 0.49 -0.54 0.73 0.42 -1.32 0.00 0.00 175.29 175.06 2gnd s ILE 26 N -3.58 4.74 -0.23 3.63 -1.09 -1.26 -0.08 121.20 123.33 2gnd s ILE 26 Ca 0.04 1.54 -0.09 0.00 -2.23 0.00 0.00 60.65 59.92 2gnd s ILE 26 Cb -0.02 -4.07 0.10 0.00 -1.58 0.00 0.00 42.46 36.89 2gnd s ILE 26 CO -0.08 0.39 0.50 -0.54 -1.23 0.00 0.00 174.94 173.99 2gnd s LYS 27 N -0.20 0.44 -1.27 2.79 3.01 0.26 -4.91 119.74 119.85 2gnd s LYS 27 Ca 0.36 1.13 -0.04 0.00 -1.01 0.00 0.00 55.97 56.41 2gnd s LYS 27 Cb -0.20 0.41 0.00 0.00 -1.01 0.00 0.00 37.83 37.03 2gnd s LYS 27 CO 0.22 -0.21 1.09 0.09 0.51 0.00 0.00 175.35 177.04 2gnd n ASN 28 N 5.14 -4.12 -2.33 2.83 3.02 -1.26 -2.36 115.26 116.18 2gnd n ASN 28 Ca -0.13 -0.58 -0.19 0.00 -0.03 0.00 0.00 54.58 53.65 2gnd n ASN 28 Cb 0.51 -5.08 -0.02 0.00 -0.61 0.00 0.00 39.78 34.58 2gnd n ASN 28 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2gnd n ASN 29 N -3.07 -5.41 -3.93 6.41 4.13 -1.25 -4.96 115.26 107.18 2gnd n ASN 29 Ca -0.15 0.08 -0.09 0.00 1.68 0.00 0.00 54.58 56.10 2gnd n ASN 29 Cb 0.62 -4.54 -0.09 0.00 -1.54 0.00 0.00 39.78 34.23 2gnd n ASN 29 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2gnd s ALA 30 N -2.91 -0.03 -0.31 5.41 0.00 -1.00 -1.32 121.76 121.61 2gnd s ALA 30 Ca 0.00 -0.70 -0.16 0.00 0.00 0.00 0.00 51.96 51.10 2gnd s ALA 30 Cb 0.00 0.35 -0.02 0.00 0.00 0.00 0.00 23.12 23.45 2gnd s ALA 30 CO 0.00 -0.41 0.40 0.08 0.00 0.00 0.00 175.76 175.83 2gnd s VAL 31 N -3.39 5.14 -0.66 0.00 1.01 -0.35 -0.57 120.40 121.58 2gnd s VAL 31 Ca 0.02 0.36 -0.20 0.00 0.00 0.00 0.00 61.98 62.16 2gnd s VAL 31 Cb 0.03 -3.79 0.10 0.00 0.00 0.00 0.00 36.38 32.72 2gnd s VAL 31 CO -0.08 0.01 0.85 -1.10 0.00 0.00 0.00 175.10 174.77 2gnd s GLN 32 N 2.12 3.15 0.21 2.72 -1.52 0.88 -1.30 119.66 125.91 2gnd s GLN 32 Ca 0.15 -1.22 -0.08 0.00 -1.95 0.00 0.00 55.36 52.25 2gnd s GLN 32 Cb -0.16 -4.33 0.15 0.00 -0.22 0.00 0.00 33.01 28.45 2gnd s GLN 32 CO 0.11 -1.66 1.78 -0.07 -0.25 0.00 0.00 175.29 175.20 2gnd h LEU 33 N 10.47 1.06 -9.75 2.90 3.38 -1.70 -2.40 115.31 119.27 2gnd h LEU 33 Ca -0.23 -0.16 -0.59 0.00 0.09 0.00 0.00 57.88 56.99 2gnd h LEU 33 Cb 1.07 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 41.48 2gnd h LEU 33 CO 1.12 0.93 -0.57 0.42 0.09 0.00 0.00 178.44 180.44 2gnd s THR 34 N -5.59 4.59 0.43 0.22 -4.23 -1.26 -3.04 115.64 106.76 2gnd s THR 34 Ca -0.12 -0.94 -0.25 0.00 -1.18 0.00 0.00 61.69 59.19 2gnd s THR 34 Cb 0.15 -3.30 -0.08 0.00 1.34 0.00 0.00 72.50 70.61 2gnd s THR 34 CO 0.83 -0.03 1.31 -0.75 -0.54 0.00 0.00 174.62 175.44 2gnd s LYS 35 N -2.89 3.81 0.10 3.99 2.20 -1.26 -4.78 119.74 120.92 2gnd s LYS 35 Ca 0.31 2.16 0.04 0.00 -0.36 0.00 0.00 55.97 58.12 2gnd s LYS 35 Cb -0.11 -2.65 -0.04 0.00 -1.51 0.00 0.00 37.83 33.52 2gnd s LYS 35 CO 0.23 -0.62 -0.10 0.95 -0.36 0.00 0.00 175.35 175.45 2gnd s THR 36 N -1.29 0.97 0.39 3.43 -4.23 -1.26 -2.69 115.64 110.96 2gnd s THR 36 Ca 0.60 -1.65 -0.06 0.00 -1.18 0.00 0.00 61.69 59.40 2gnd s THR 36 Cb -0.38 -1.38 0.09 0.00 1.34 0.00 0.00 72.50 72.17 2gnd s THR 36 CO 0.48 -0.55 0.53 -0.90 -0.54 0.00 0.00 174.62 173.64 2gnd n ASP 37 N 0.55 0.12 -0.13 3.99 5.68 0.10 -4.86 116.55 122.01 2gnd n ASP 37 Ca -0.16 -1.24 -0.05 0.00 -0.50 0.00 0.00 54.79 52.84 2gnd n ASP 37 Cb 0.58 -0.40 0.02 0.00 -1.14 0.00 0.00 41.12 40.18 2gnd n ASP 37 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 2gnd h SER 38 N -0.65 -0.66 0.00 -1.12 0.02 -2.02 -0.03 113.55 109.09 2gnd h SER 38 Ca -0.17 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2gnd h SER 38 Cb 0.49 0.37 0.00 0.00 0.14 0.00 0.00 62.40 63.40 2gnd h SER 38 CO 0.13 -0.22 0.00 -0.46 -1.14 0.00 0.00 176.83 175.14 2gnd n ASN 39 N -5.38 0.00 0.00 3.07 0.23 -1.26 -4.88 115.26 107.03 2gnd n ASN 39 Ca 0.03 -1.49 0.00 0.00 -0.53 0.00 0.00 54.58 52.59 2gnd n ASN 39 Cb 0.29 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.99 2gnd n ASN 39 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2gnd n GLY 40 N 0.71 0.73 3.82 4.83 0.00 -0.03 -5.07 105.19 110.19 2gnd n GLY 40 Ca 0.11 -0.05 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 2gnd n GLY 40 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2gnd s ASN 41 N -2.05 7.01 0.62 1.61 0.02 -1.26 -4.68 114.94 116.21 2gnd s ASN 41 Ca 0.00 1.29 -0.19 0.00 -1.02 0.00 0.00 52.86 52.94 2gnd s ASN 41 Cb 0.00 -2.37 -0.02 0.00 0.02 0.00 0.00 41.25 38.88 2gnd s ASN 41 CO 0.00 0.14 1.26 -2.16 0.02 0.00 0.00 177.10 176.36 2gnd s PRO 42 N -1.66 2.76 0.25 -0.60 0.04 -1.26 0.02 135.00 134.55 2gnd s PRO 42 Ca 0.37 1.97 0.07 0.00 0.04 0.00 0.00 61.00 63.45 2gnd s PRO 42 Cb -0.17 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.41 2gnd s PRO 42 CO 0.20 -1.41 -0.09 0.14 0.04 0.00 0.00 177.00 175.89 2gnd s VAL 43 N -1.47 1.65 0.77 -0.36 -7.23 -1.10 -4.80 120.40 107.87 2gnd s VAL 43 Ca 0.80 -2.15 -0.10 0.00 -1.81 0.00 0.00 61.98 58.71 2gnd s VAL 43 Cb -0.35 -2.29 0.07 0.00 0.56 0.00 0.00 36.38 34.38 2gnd s VAL 43 CO 0.37 -0.41 1.12 0.00 -0.31 0.00 0.00 175.10 175.87 2gnd s ALA 44 N -3.02 2.83 -0.90 1.32 0.00 -1.26 -4.57 121.76 116.16 2gnd s ALA 44 Ca 0.27 -0.75 -0.07 0.00 0.00 0.00 0.00 51.96 51.40 2gnd s ALA 44 Cb 0.02 -2.83 0.00 0.00 0.00 0.00 0.00 23.12 20.31 2gnd s ALA 44 CO 0.10 -1.55 0.67 0.43 0.00 0.00 0.00 175.76 175.41 2gnd n SER 45 N -3.18 -5.67 -3.83 0.00 7.64 -0.15 -4.98 113.62 103.45 2gnd n SER 45 Ca 0.08 -0.77 -0.12 0.00 1.01 0.00 0.00 58.87 59.07 2gnd n SER 45 Cb 0.61 -2.97 -0.12 0.00 -1.01 0.00 0.00 64.21 60.72 2gnd n SER 45 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2gnd s THR 46 N -3.13 0.03 0.00 0.44 -1.32 -0.65 -5.01 115.64 106.00 2gnd s THR 46 Ca 0.14 -0.21 0.01 0.00 -1.21 0.00 0.00 61.69 60.41 2gnd s THR 46 Cb -0.06 -0.29 -0.01 0.00 -1.51 0.00 0.00 72.50 70.64 2gnd s THR 46 CO 0.86 -0.12 -0.02 -0.69 -2.21 0.00 0.00 174.62 172.44 2gnd s VAL 47 N -0.36 0.17 -0.05 5.08 1.01 -1.26 -1.19 120.40 123.80 2gnd s VAL 47 Ca -0.04 -0.24 -0.20 0.00 0.00 0.00 0.00 61.98 61.50 2gnd s VAL 47 Cb -0.03 -0.18 0.04 0.00 0.00 0.00 0.00 36.38 36.21 2gnd s VAL 47 CO 0.01 -0.05 0.44 -0.83 0.00 0.00 0.00 175.10 174.67 2gnd s GLY 48 N -0.31 -0.31 0.04 4.51 0.00 -0.67 -0.22 107.32 110.36 2gnd s GLY 48 Ca -0.02 0.77 -0.14 0.00 0.00 0.00 0.00 44.72 45.33 2gnd s GLY 48 CO -0.00 0.52 0.31 0.50 0.00 0.00 0.00 173.10 174.42 2gnd s ARG 49 N -1.05 0.82 0.04 2.90 0.52 -0.50 -1.35 118.95 120.33 2gnd s ARG 49 Ca -0.11 -0.51 0.03 0.00 -0.52 0.00 0.00 55.73 54.62 2gnd s ARG 49 Cb -0.03 0.35 -0.02 0.00 0.52 0.00 0.00 34.95 35.77 2gnd s ARG 49 CO 0.05 -0.26 -0.09 0.96 0.02 0.00 0.00 175.30 175.99 2gnd s ILE 50 N -2.57 0.62 0.01 1.52 -4.36 -0.63 -0.45 121.20 115.33 2gnd s ILE 50 Ca -0.05 -1.06 0.00 0.00 -0.26 0.00 0.00 60.65 59.28 2gnd s ILE 50 Cb -0.01 -0.66 -0.01 0.00 1.25 0.00 0.00 42.46 43.03 2gnd s ILE 50 CO -0.03 -0.33 -0.02 -0.76 0.24 0.00 0.00 174.94 174.03 2gnd s LEU 51 N -1.52 2.08 0.19 0.37 1.43 -0.31 -1.43 118.68 119.50 2gnd s LEU 51 Ca -0.08 -0.19 -0.30 0.00 -1.03 0.00 0.00 54.13 52.53 2gnd s LEU 51 Cb -0.10 -0.02 -0.08 0.00 0.03 0.00 0.00 46.19 46.03 2gnd s LEU 51 CO 0.01 -0.09 1.04 0.12 0.23 0.00 0.00 176.35 177.65 2gnd s PHE 52 N -0.51 3.72 0.14 0.29 5.36 -0.78 0.20 117.98 126.39 2gnd s PHE 52 Ca -0.05 1.72 -0.18 0.00 -0.96 0.00 0.00 56.93 57.46 2gnd s PHE 52 Cb -0.04 -3.17 -0.01 0.00 -0.34 0.00 0.00 43.02 39.47 2gnd s PHE 52 CO -0.00 -0.19 1.77 0.66 -1.46 0.00 0.00 175.22 175.99 2gnd h SER 53 N 4.88 0.22 -3.12 6.13 4.64 -0.94 -3.43 113.55 121.92 2gnd h SER 53 Ca -0.44 0.01 -0.53 0.00 -0.47 0.00 0.00 61.79 60.36 2gnd h SER 53 Cb 1.21 -0.03 0.06 0.00 -0.31 0.00 0.00 62.40 63.33 2gnd h SER 53 CO 0.71 0.16 0.85 0.00 -0.87 0.00 0.00 176.83 177.68 2gnd s ALA 54 N -6.17 3.73 0.33 5.18 0.00 -1.26 -4.97 121.76 118.60 2gnd s ALA 54 Ca -0.13 1.43 -0.26 0.00 0.00 0.00 0.00 51.96 52.99 2gnd s ALA 54 Cb 0.10 -3.61 -0.10 0.00 0.00 0.00 0.00 23.12 19.51 2gnd s ALA 54 CO 0.70 -0.83 0.98 -0.65 0.00 0.00 0.00 175.76 175.97 2gnd s GLN 55 N 0.23 4.50 -0.17 0.00 -0.21 -1.26 -4.83 119.66 117.91 2gnd s GLN 55 Ca 0.65 1.42 -0.08 0.00 0.02 0.00 0.00 55.36 57.38 2gnd s GLN 55 Cb -0.45 -2.80 -0.04 0.00 1.00 0.00 0.00 33.01 30.72 2gnd s GLN 55 CO 0.39 0.18 0.10 0.08 -2.12 0.00 0.00 175.29 173.93 2gnd s VAL 56 N -1.56 5.14 -0.85 1.09 1.01 0.48 -4.92 120.40 120.80 2gnd s VAL 56 Ca 0.51 0.09 -0.20 0.00 0.00 0.00 0.00 61.98 62.38 2gnd s VAL 56 Cb -0.21 -3.30 0.12 0.00 0.00 0.00 0.00 36.38 32.98 2gnd s VAL 56 CO 0.27 0.50 1.06 -2.28 0.00 0.00 0.00 175.10 174.65 2gnd s HIS 57 N -0.01 3.01 0.15 5.22 2.46 -1.26 -0.97 115.29 123.88 2gnd s HIS 57 Ca 0.08 -1.18 -0.10 0.00 0.47 0.00 0.00 55.06 54.34 2gnd s HIS 57 Cb -0.12 -4.27 -0.02 0.00 -0.13 0.00 0.00 32.58 28.04 2gnd s HIS 57 CO 0.00 -1.51 1.47 1.25 -2.47 0.00 0.00 174.74 173.48 2gnd h LEU 58 N 10.59 0.95 -7.15 8.88 5.85 -1.31 -3.42 115.31 129.70 2gnd h LEU 58 Ca 0.03 -0.46 -0.07 0.00 0.84 0.00 0.00 57.88 58.22 2gnd h LEU 58 Cb 1.04 -0.27 -0.18 0.00 0.37 0.00 0.00 40.66 41.62 2gnd h LEU 58 CO 1.12 1.24 0.07 -1.66 -0.34 0.00 0.00 178.44 178.87 2gnd s TRP 59 N -4.29 -0.50 -0.22 1.25 1.48 -1.13 0.25 118.94 115.77 2gnd s TRP 59 Ca -0.10 0.76 0.01 0.00 -1.06 0.00 0.00 56.10 55.71 2gnd s TRP 59 Cb 0.11 0.34 0.05 0.00 -1.16 0.00 0.00 33.47 32.81 2gnd s TRP 59 CO 0.88 -0.59 -0.10 -2.00 -4.06 0.00 0.00 176.95 171.08 2gnd s GLU 60 N -1.67 2.05 0.10 3.25 2.12 0.14 -4.53 118.70 120.15 2gnd s GLU 60 Ca -0.09 -0.99 -0.22 0.00 0.36 0.00 0.00 54.97 54.03 2gnd s GLU 60 Cb -0.01 -2.57 -0.12 0.00 0.26 0.00 0.00 34.13 31.69 2gnd s GLU 60 CO 0.05 -0.48 1.75 -0.22 -0.54 0.00 0.00 175.26 175.81 2gnd h LYS 61 N 7.92 0.06 -0.25 4.30 3.64 -1.96 -1.05 116.57 129.22 2gnd h LYS 61 Ca -0.25 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.17 2gnd h LYS 61 Cb 1.08 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.85 2gnd h LYS 61 CO 0.47 0.04 0.03 0.66 -2.27 0.00 0.00 179.45 178.38 2gnd h SER 62 N 0.06 -0.02 0.66 4.20 4.64 -1.96 -2.37 113.55 118.76 2gnd h SER 62 Ca 0.02 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2gnd h SER 62 Cb 0.01 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2gnd h SER 62 CO -0.02 0.02 -0.09 -1.54 -0.87 0.00 0.00 176.83 174.33 2gnd n SER 63 N -5.11 0.18 -2.77 4.97 3.41 -1.21 -4.91 113.62 108.17 2gnd n SER 63 Ca -0.01 -0.03 -0.21 0.00 -0.26 0.00 0.00 58.87 58.36 2gnd n SER 63 Cb 0.12 -0.24 0.03 0.00 -0.26 0.00 0.00 64.21 63.86 2gnd n SER 63 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2gnd n SER 64 N -1.31 -5.78 -4.70 4.04 3.41 -0.46 -5.00 113.62 103.82 2gnd n SER 64 Ca 0.11 -0.26 -0.31 0.00 -0.26 0.00 0.00 58.87 58.15 2gnd n SER 64 Cb 0.30 -4.61 -0.08 0.00 -0.26 0.00 0.00 64.21 59.56 2gnd n SER 64 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2gnd s ARG 65 N -5.59 2.64 -0.02 4.33 0.52 -0.85 -4.70 118.95 115.28 2gnd s ARG 65 Ca 0.27 -0.78 0.04 0.00 -0.52 0.00 0.00 55.73 54.75 2gnd s ARG 65 Cb -0.12 -2.59 -0.01 0.00 0.52 0.00 0.00 34.95 32.75 2gnd s ARG 65 CO 0.34 0.56 -0.14 0.08 0.02 0.00 0.00 175.30 176.15 2gnd s VAL 66 N -1.29 1.16 0.41 3.52 1.01 -0.72 -0.69 120.40 123.81 2gnd s VAL 66 Ca 0.25 -0.61 -0.23 0.00 0.00 0.00 0.00 61.98 61.40 2gnd s VAL 66 Cb -0.12 -0.99 -0.10 0.00 0.00 0.00 0.00 36.38 35.18 2gnd s VAL 66 CO 0.18 0.33 0.99 0.00 0.00 0.00 0.00 175.10 176.60 2gnd s ALA 67 N -0.17 3.05 -0.08 5.51 0.00 0.14 -1.21 121.76 129.00 2gnd s ALA 67 Ca 0.02 0.54 -0.02 0.00 0.00 0.00 0.00 51.96 52.50 2gnd s ALA 67 Cb -0.07 -3.21 -0.03 0.00 0.00 0.00 0.00 23.12 19.80 2gnd s ALA 67 CO 0.00 -0.03 0.03 0.54 0.00 0.00 0.00 175.76 176.30 2gnd s ASN 68 N -1.88 5.45 0.06 0.00 4.22 -0.33 -4.44 114.94 118.02 2gnd s ASN 68 Ca 0.60 0.19 -0.03 0.00 -2.14 0.00 0.00 52.86 51.47 2gnd s ASN 68 Cb -0.16 -1.57 -0.03 0.00 1.28 0.00 0.00 41.25 40.78 2gnd s ASN 68 CO 0.20 0.37 0.04 0.72 -2.04 0.00 0.00 177.10 176.39 2gnd s PHE 69 N -0.94 0.40 -0.09 1.54 -0.12 -0.96 -1.86 117.98 115.94 2gnd s PHE 69 Ca 0.15 -0.89 -0.04 0.00 -0.05 0.00 0.00 56.93 56.10 2gnd s PHE 69 Cb -0.11 -0.28 0.05 0.00 -0.63 0.00 0.00 43.02 42.04 2gnd s PHE 69 CO 0.04 -0.42 0.18 -1.14 -0.05 0.00 0.00 175.22 173.82 2gnd s GLN 70 N -3.79 0.08 -0.18 1.99 0.74 -0.75 -0.51 119.66 117.24 2gnd s GLN 70 Ca 0.05 0.52 0.01 0.00 0.05 0.00 0.00 55.36 55.99 2gnd s GLN 70 Cb 0.06 -0.20 0.02 0.00 1.10 0.00 0.00 33.01 34.00 2gnd s GLN 70 CO -0.10 -0.24 -0.19 0.45 -0.55 0.00 0.00 175.29 174.66 2gnd s SER 71 N 1.84 3.09 -0.12 6.67 0.15 0.10 -2.08 113.70 123.35 2gnd s SER 71 Ca -0.02 -0.64 0.00 0.00 0.70 0.00 0.00 55.95 55.99 2gnd s SER 71 Cb -0.12 -1.44 -0.01 0.00 -1.71 0.00 0.00 66.02 62.73 2gnd s SER 71 CO -0.06 -0.01 -0.14 -1.58 1.20 0.00 0.00 173.24 172.65 2gnd s GLN 72 N 1.31 3.32 0.22 5.44 0.74 -0.38 -0.53 119.66 129.79 2gnd s GLN 72 Ca 0.05 -0.70 -0.22 0.00 0.05 0.00 0.00 55.36 54.54 2gnd s GLN 72 Cb -0.13 -2.59 0.04 0.00 1.10 0.00 0.00 33.01 31.43 2gnd s GLN 72 CO -0.13 0.23 0.67 -0.59 -0.55 0.00 0.00 175.29 174.93 2gnd s PHE 73 N 0.30 -0.34 0.01 1.67 -0.12 -0.64 -0.32 117.98 118.54 2gnd s PHE 73 Ca -0.11 -0.01 0.00 0.00 -0.05 0.00 0.00 56.93 56.77 2gnd s PHE 73 Cb -0.16 0.64 -0.01 0.00 -0.63 0.00 0.00 43.02 42.86 2gnd s PHE 73 CO 0.06 -1.06 -0.03 -1.54 -0.05 0.00 0.00 175.22 172.60 2gnd s SER 74 N -2.84 0.28 0.19 1.98 1.04 -1.05 -0.30 113.70 112.99 2gnd s SER 74 Ca 0.07 -0.31 -0.06 0.00 0.48 0.00 0.00 55.95 56.12 2gnd s SER 74 Cb -0.04 0.04 -0.02 0.00 0.10 0.00 0.00 66.02 66.11 2gnd s SER 74 CO -0.02 -0.16 0.24 0.72 0.98 0.00 0.00 173.24 175.01 2gnd s PHE 75 N -0.86 0.69 0.01 5.02 -0.71 -0.91 -1.27 117.98 119.94 2gnd s PHE 75 Ca -0.08 -1.01 -0.03 0.00 -1.04 0.00 0.00 56.93 54.77 2gnd s PHE 75 Cb -0.06 -0.22 -0.01 0.00 -1.21 0.00 0.00 43.02 41.52 2gnd s PHE 75 CO -0.00 -0.72 0.04 -1.54 -1.34 0.00 0.00 175.22 171.65 2gnd s SER 76 N -3.05 0.14 -0.05 1.98 1.04 -0.81 0.30 113.70 113.25 2gnd s SER 76 Ca 0.26 -0.36 0.06 0.00 0.48 0.00 0.00 55.95 56.39 2gnd s SER 76 Cb 0.04 0.14 -0.01 0.00 0.10 0.00 0.00 66.02 66.30 2gnd s SER 76 CO 0.06 -0.32 -0.22 -0.76 0.98 0.00 0.00 173.24 172.98 2gnd s LEU 77 N -1.37 2.02 -0.00 2.42 1.43 -1.26 -2.03 118.68 119.88 2gnd s LEU 77 Ca -0.15 -0.45 0.01 0.00 -1.03 0.00 0.00 54.13 52.51 2gnd s LEU 77 Cb -0.09 -1.22 -0.00 0.00 0.03 0.00 0.00 46.19 44.92 2gnd s LEU 77 CO 0.00 0.22 -0.02 -0.54 0.23 0.00 0.00 176.35 176.24 2gnd s LYS 78 N -0.17 0.17 -0.24 1.70 -0.14 -1.18 0.65 119.74 120.53 2gnd s LYS 78 Ca -0.01 -0.07 -0.21 0.00 -1.36 0.00 0.00 55.97 54.31 2gnd s LYS 78 Cb -0.12 -0.17 0.06 0.00 -1.68 0.00 0.00 37.83 35.92 2gnd s LYS 78 CO 0.02 0.04 0.63 0.45 -0.76 0.00 0.00 175.35 175.74 2gnd s SER 79 N -0.04 -0.68 0.46 2.83 0.15 -1.26 -0.60 113.70 114.55 2gnd s SER 79 Ca 0.01 1.29 0.17 0.00 0.70 0.00 0.00 55.95 58.11 2gnd s SER 79 Cb -0.01 1.29 1.07 0.00 -1.71 0.00 0.00 66.02 66.65 2gnd s SER 79 CO -0.00 -0.22 2.00 -0.65 1.20 0.00 0.00 173.24 175.56 2gnd h PRO 80 N 5.36 0.00 0.00 5.44 0.11 -1.97 -3.42 132.00 137.52 2gnd h PRO 80 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2gnd h PRO 80 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2gnd h PRO 80 CO 0.12 0.19 0.00 1.28 -0.21 0.00 0.00 178.00 179.37 2gnd n LEU 81 N -4.18 0.00 0.00 2.35 4.77 -1.26 -5.05 117.00 113.64 2gnd n LEU 81 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 2gnd n LEU 81 Cb 0.26 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 2gnd n LEU 81 CO 0.35 -0.02 -0.23 -0.24 -1.33 0.00 0.00 177.39 175.92 2gnd n SER 82 N 0.00 0.95 -4.13 -1.43 2.88 -1.26 -4.90 113.62 105.72 2gnd n SER 82 Ca 0.00 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.12 2gnd n SER 82 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 2gnd n SER 82 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2gnd n ASN 83 N -2.34 5.68 -4.79 -3.46 6.94 -1.26 -5.05 115.26 110.98 2gnd n ASN 83 Ca 0.00 -3.22 -0.33 0.00 -0.02 0.00 0.00 54.58 51.00 2gnd n ASN 83 Cb 0.23 -1.27 0.01 0.00 -2.36 0.00 0.00 39.78 36.39 2gnd n ASN 83 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 2gnd s GLY 84 N -0.30 2.27 0.13 4.83 0.00 -1.26 -4.70 107.32 108.29 2gnd s GLY 84 Ca 0.31 0.52 -0.00 0.00 0.00 0.00 0.00 44.72 45.55 2gnd s GLY 84 CO -0.00 0.85 0.03 0.00 0.00 0.00 0.00 173.10 173.97 2gnd s ALA 85 N -2.26 0.97 -0.15 3.20 0.00 -1.24 -4.28 121.76 118.00 2gnd s ALA 85 Ca 0.66 -1.47 0.08 0.00 0.00 0.00 0.00 51.96 51.23 2gnd s ALA 85 Cb -0.18 0.67 -0.12 0.00 0.00 0.00 0.00 23.12 23.50 2gnd s ALA 85 CO 0.33 -0.41 0.24 -0.25 0.00 0.00 0.00 175.76 175.67 2gnd n ASP 86 N -0.11 2.11 0.00 0.00 8.00 0.14 -2.75 116.55 123.94 2gnd n ASP 86 Ca -0.07 -0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.18 2gnd n ASP 86 Cb 0.63 1.24 0.00 0.00 -0.02 0.00 0.00 41.12 42.98 2gnd n ASP 86 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gnd n GLY 87 N 1.72 2.72 3.28 0.44 0.00 -1.23 -2.75 105.19 109.38 2gnd n GLY 87 Ca -0.00 -1.83 -0.24 0.00 0.00 0.00 0.00 46.02 43.94 2gnd n GLY 87 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2gnd s ILE 88 N -1.81 1.72 -0.03 -0.61 2.07 -1.05 -3.04 121.20 118.45 2gnd s ILE 88 Ca 0.00 -1.47 -0.03 0.00 -1.41 0.00 0.00 60.65 57.74 2gnd s ILE 88 Cb 0.00 -1.55 0.01 0.00 0.13 0.00 0.00 42.46 41.05 2gnd s ILE 88 CO 0.00 0.01 0.08 0.00 -1.91 0.00 0.00 174.94 173.12 2gnd s ALA 89 N -1.07 -0.20 -0.14 1.50 0.00 0.69 -0.80 121.76 121.73 2gnd s ALA 89 Ca 0.07 0.16 -0.15 0.00 0.00 0.00 0.00 51.96 52.03 2gnd s ALA 89 Cb -0.10 -0.10 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 2gnd s ALA 89 CO 0.04 -0.06 0.36 0.12 0.00 0.00 0.00 175.76 176.22 2gnd s PHE 90 N -0.17 3.48 0.10 0.00 5.36 -0.33 -0.85 117.98 125.57 2gnd s PHE 90 Ca -0.02 0.71 -0.01 0.00 -0.96 0.00 0.00 56.93 56.64 2gnd s PHE 90 Cb -0.02 -2.42 -0.04 0.00 -0.34 0.00 0.00 43.02 40.20 2gnd s PHE 90 CO 0.00 0.21 0.04 -0.59 -1.46 0.00 0.00 175.22 173.42 2gnd s PHE 91 N 0.51 0.71 -0.05 10.12 -0.71 -0.40 -0.04 117.98 128.12 2gnd s PHE 91 Ca 0.20 -1.15 0.03 0.00 -1.04 0.00 0.00 56.93 54.97 2gnd s PHE 91 Cb -0.14 -0.42 0.01 0.00 -1.21 0.00 0.00 43.02 41.25 2gnd s PHE 91 CO 0.06 -0.48 -0.12 0.42 -1.34 0.00 0.00 175.22 173.76 2gnd s ILE 92 N -4.00 1.10 0.30 -4.49 1.01 -0.00 -1.92 121.20 113.21 2gnd s ILE 92 Ca 0.17 -0.50 -0.17 0.00 0.00 0.00 0.00 60.65 60.15 2gnd s ILE 92 Cb 0.07 -0.99 0.02 0.00 0.01 0.00 0.00 42.46 41.58 2gnd s ILE 92 CO -0.03 0.34 0.67 0.00 0.00 0.00 0.00 174.94 175.92 2gnd s ALA 93 N 0.38 -0.79 0.57 9.38 0.00 -0.56 -2.34 121.76 128.41 2gnd s ALA 93 Ca -0.09 -0.60 -0.19 0.00 0.00 0.00 0.00 51.96 51.07 2gnd s ALA 93 Cb -0.13 0.87 -0.06 0.00 0.00 0.00 0.00 23.12 23.81 2gnd s ALA 93 CO 0.02 -0.98 0.98 -2.30 0.00 0.00 0.00 175.76 173.48 2gnd n PRO 94 N -0.47 1.00 -0.24 0.00 -0.02 -1.26 -0.76 135.00 133.25 2gnd n PRO 94 Ca -0.04 0.38 0.18 0.00 -2.02 0.00 0.00 63.50 62.00 2gnd n PRO 94 Cb 0.60 -2.16 0.49 0.00 -0.02 0.00 0.00 33.50 32.42 2gnd n PRO 94 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2gnd h PRO 95 N 0.70 0.43 -0.59 0.52 0.11 -1.85 -1.99 132.00 129.32 2gnd h PRO 95 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2gnd h PRO 95 Cb 1.36 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2gnd h PRO 95 CO 0.52 0.28 0.00 -0.40 -0.21 0.00 0.00 178.00 178.19 2gnd n ASP 96 N -4.52 2.47 -4.73 -2.05 3.85 -1.26 -4.90 116.55 105.40 2gnd n ASP 96 Ca 0.19 -2.22 -0.40 0.00 -0.71 0.00 0.00 54.79 51.65 2gnd n ASP 96 Cb 0.66 -0.41 0.02 0.00 -1.35 0.00 0.00 41.12 40.04 2gnd n ASP 96 CO 0.00 0.00 0.00 1.07 -1.01 0.00 0.00 177.20 177.26 2gnd n THR 97 N 0.36 2.74 -4.12 2.12 5.66 -0.75 -5.02 114.28 115.26 2gnd n THR 97 Ca 0.12 -0.50 -0.10 0.00 -3.05 0.00 0.00 64.05 60.52 2gnd n THR 97 Cb 0.49 -1.72 -0.10 0.00 -1.55 0.00 0.00 70.33 67.45 2gnd n THR 97 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2gnd s THR 98 N -1.20 0.10 -0.07 1.09 -4.23 -1.26 -5.10 115.64 104.97 2gnd s THR 98 Ca 0.61 -1.83 -0.30 0.00 -1.18 0.00 0.00 61.69 59.00 2gnd s THR 98 Cb -0.47 -1.99 -0.06 0.00 1.34 0.00 0.00 72.50 71.32 2gnd s THR 98 CO 0.57 -0.47 1.71 -0.63 -0.54 0.00 0.00 174.62 175.27 2gnd s ILE 99 N -4.03 3.50 0.57 2.99 1.01 -1.26 -4.97 121.20 119.01 2gnd s ILE 99 Ca 0.22 0.60 -0.19 0.00 0.00 0.00 0.00 60.65 61.28 2gnd s ILE 99 Cb 0.07 -3.42 -0.05 0.00 0.01 0.00 0.00 42.46 39.08 2gnd s ILE 99 CO 0.01 -0.09 1.16 -2.84 0.00 0.00 0.00 174.94 173.18 2gnd s PRO 100 N 4.28 3.17 0.21 2.79 0.02 -1.26 -4.96 135.00 139.25 2gnd s PRO 100 Ca 0.76 1.67 -0.30 0.00 0.02 0.00 0.00 61.00 63.15 2gnd s PRO 100 Cb -0.33 -1.97 -0.10 0.00 0.02 0.00 0.00 34.50 32.12 2gnd s PRO 100 CO 0.31 -1.01 1.45 -1.12 -0.33 0.00 0.00 177.00 176.30 2gnd s SER 101 N -1.76 6.68 -1.13 2.53 0.01 -1.26 -2.52 113.70 116.24 2gnd s SER 101 Ca 0.74 2.60 0.00 0.00 1.31 0.00 0.00 55.95 60.60 2gnd s SER 101 Cb -0.26 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.36 2gnd s SER 101 CO 0.30 -0.70 0.00 0.61 0.41 0.00 0.00 173.24 173.86 2gnd n GLY 102 N 2.65 1.20 0.52 3.44 0.00 -1.26 -4.36 105.19 107.38 2gnd n GLY 102 Ca 0.09 -0.52 0.03 0.00 0.00 0.00 0.00 46.02 45.61 2gnd n GLY 102 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gnd n SER 103 N 0.22 1.41 -3.30 1.61 3.41 -1.05 -4.33 113.62 111.59 2gnd n SER 103 Ca -0.11 -2.08 -0.23 0.00 -0.26 0.00 0.00 58.87 56.19 2gnd n SER 103 Cb 0.36 -0.28 0.19 0.00 -0.26 0.00 0.00 64.21 64.22 2gnd n SER 103 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gnd n GLY 104 N 0.56 -2.72 7.00 5.00 0.00 -1.26 0.84 105.19 114.62 2gnd n GLY 104 Ca 0.06 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.60 2gnd n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gnd n GLY 105 N -3.07 3.15 0.00 -0.02 0.00 -1.26 -2.30 105.19 101.68 2gnd n GLY 105 Ca 0.12 -0.18 0.02 0.00 0.00 0.00 0.00 46.02 45.98 2gnd n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gnd n GLY 106 N 0.00 -0.60 0.26 -0.02 0.00 -1.26 -1.28 105.19 102.29 2gnd n GLY 106 Ca 0.00 -0.02 0.15 0.00 0.00 0.00 0.00 46.02 46.15 2gnd n GLY 106 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2gnd n LEU 107 N -1.45 0.85 -0.77 0.99 4.77 -0.97 -4.92 117.00 115.49 2gnd n LEU 107 Ca 0.01 -0.25 -0.07 0.00 -0.03 0.00 0.00 56.01 55.67 2gnd n LEU 107 Cb 0.05 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 2gnd n LEU 107 CO 0.04 0.14 -0.07 0.18 -1.33 0.00 0.00 177.39 176.35 2gnd n LEU 108 N -0.42 -0.26 -0.12 2.23 4.77 -0.41 -1.30 117.00 121.50 2gnd n LEU 108 Ca 0.19 0.18 -0.02 0.00 -0.03 0.00 0.00 56.01 56.34 2gnd n LEU 108 Cb 0.27 -1.89 -0.01 0.00 -2.33 0.00 0.00 43.42 39.47 2gnd n LEU 108 CO 0.19 -0.66 -0.01 0.61 -1.33 0.00 0.00 177.39 176.18 2gnd n GLY 109 N 0.14 0.52 0.05 -0.72 0.00 0.25 -3.90 105.19 101.53 2gnd n GLY 109 Ca -0.07 -0.58 -0.05 0.00 0.00 0.00 0.00 46.02 45.32 2gnd n GLY 109 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2gnd n LEU 110 N -0.18 0.10 -4.36 0.99 4.77 -0.42 -4.47 117.00 113.44 2gnd n LEU 110 Ca -0.02 -0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.75 2gnd n LEU 110 Cb 0.08 0.21 -0.11 0.00 -2.33 0.00 0.00 43.42 41.27 2gnd n LEU 110 CO 0.02 0.25 -0.47 -0.36 -1.33 0.00 0.00 177.39 175.50 2gnd s PHE 111 N -2.23 1.85 0.12 -1.77 0.40 -1.20 -4.83 117.98 110.32 2gnd s PHE 111 Ca -0.05 -0.49 -0.18 0.00 -0.60 0.00 0.00 56.93 55.62 2gnd s PHE 111 Cb 0.03 -0.88 -0.07 0.00 0.51 0.00 0.00 43.02 42.61 2gnd s PHE 111 CO 0.38 0.40 0.58 0.00 0.70 0.00 0.00 175.22 177.28 2gnd s ALA 112 N -2.43 3.56 0.18 5.36 0.00 -1.26 -4.04 121.76 123.13 2gnd s ALA 112 Ca 0.20 0.00 -0.18 0.00 0.00 0.00 0.00 51.96 51.98 2gnd s ALA 112 Cb -0.04 -2.63 0.14 0.00 0.00 0.00 0.00 23.12 20.59 2gnd s ALA 112 CO 0.08 0.41 1.63 -1.35 0.00 0.00 0.00 175.76 176.52 2gnd h PRO 113 N 4.07 -0.10 0.00 0.00 0.11 -1.76 0.35 132.00 134.67 2gnd h PRO 113 Ca -0.49 0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 2gnd h PRO 113 Cb 1.20 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 2gnd h PRO 113 CO 0.64 -0.06 -0.02 0.78 -0.21 0.00 0.00 178.00 179.13 2gnd h GLY 114 N -0.10 0.00 -0.07 -0.55 0.00 -1.94 -3.14 103.07 97.27 2gnd h GLY 114 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 2gnd h GLY 114 CO -0.55 0.00 -0.04 -1.30 0.00 0.00 0.00 176.54 174.66 2gnd n THR 115 N -3.22 0.81 -0.07 4.70 -2.24 -0.64 -4.82 114.28 108.80 2gnd n THR 115 Ca -0.02 -0.87 0.25 0.00 -2.27 0.00 0.00 64.05 61.15 2gnd n THR 115 Cb 0.17 0.51 0.72 0.00 -2.10 0.00 0.00 70.33 69.64 2gnd n THR 115 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gnd h ALA 116 N 0.00 2.57 -0.14 6.98 0.00 -0.30 -1.27 119.26 127.10 2gnd h ALA 116 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2gnd h ALA 116 Cb 0.77 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2gnd h ALA 116 CO 0.00 -0.93 0.00 1.04 0.00 0.00 0.00 179.25 179.36 2gnd n GLN 117 N -4.05 2.63 -3.24 0.00 6.02 -1.26 -1.23 117.38 116.25 2gnd n GLN 117 Ca 0.14 -2.07 -0.46 0.00 -0.01 0.00 0.00 57.00 54.60 2gnd n GLN 117 Cb 0.83 -1.30 -0.04 0.00 1.02 0.00 0.00 30.24 30.74 2gnd n GLN 117 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2gnd s ASN 118 N -1.50 6.29 0.39 1.08 3.04 -0.48 -4.94 114.94 118.82 2gnd s ASN 118 Ca 0.19 -1.84 0.09 0.00 0.04 0.00 0.00 52.86 51.35 2gnd s ASN 118 Cb 0.14 -2.24 0.86 0.00 -1.54 0.00 0.00 41.25 38.47 2gnd s ASN 118 CO 0.07 -0.90 1.96 0.71 -3.04 0.00 0.00 177.10 175.90 2gnd h THR 119 N 5.73 0.95 0.00 -5.21 1.35 -1.85 -0.96 112.91 112.92 2gnd h THR 119 Ca -0.22 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 2gnd h THR 119 Cb 1.08 0.28 0.00 0.00 -1.73 0.00 0.00 68.15 67.79 2gnd h THR 119 CO 1.02 0.11 0.00 -1.54 -0.25 0.00 0.00 175.52 174.86 2gnd n SER 120 N -4.49 0.00 -0.65 5.36 3.41 -1.26 -3.14 113.62 112.86 2gnd n SER 120 Ca 0.11 -0.55 0.07 0.00 -0.26 0.00 0.00 58.87 58.24 2gnd n SER 120 Cb 0.31 -0.13 0.11 0.00 -0.26 0.00 0.00 64.21 64.24 2gnd n SER 120 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gnd n ALA 121 N -1.13 2.39 -2.29 7.33 0.00 -0.37 -5.01 120.51 121.43 2gnd n ALA 121 Ca 0.18 -0.81 -0.14 0.00 0.00 0.00 0.00 53.44 52.66 2gnd n ALA 121 Cb 0.15 -0.50 -0.10 0.00 0.00 0.00 0.00 19.45 19.01 2gnd n ALA 121 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2gnd s ASN 122 N -1.10 1.77 -0.44 0.00 0.01 -1.19 -5.06 114.94 108.93 2gnd s ASN 122 Ca 0.21 -0.98 0.03 0.00 -0.71 0.00 0.00 52.86 51.41 2gnd s ASN 122 Cb 0.13 -0.01 0.16 0.00 0.41 0.00 0.00 41.25 41.94 2gnd s ASN 122 CO 0.18 -0.31 0.32 -1.10 -1.51 0.00 0.00 177.10 174.68 2gnd s GLN 123 N -3.58 1.06 -0.20 -0.60 -0.21 -1.26 -4.83 119.66 110.04 2gnd s GLN 123 Ca 0.15 -2.09 -0.27 0.00 0.02 0.00 0.00 55.36 53.17 2gnd s GLN 123 Cb 0.02 -1.74 0.07 0.00 1.00 0.00 0.00 33.01 32.36 2gnd s GLN 123 CO 0.01 -1.32 0.71 0.54 -2.12 0.00 0.00 175.29 173.11 2gnd s VAL 124 N 0.11 0.00 -0.12 1.09 0.11 -1.26 -4.29 120.40 116.04 2gnd s VAL 124 Ca 0.27 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 59.34 2gnd s VAL 124 Cb -0.06 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.81 2gnd s VAL 124 CO -0.13 0.00 -0.15 -0.63 -3.33 0.00 0.00 175.10 170.86 2gnd s ILE 125 N -0.13 1.52 0.05 7.04 1.01 -0.99 -0.75 121.20 128.95 2gnd s ILE 125 Ca -0.03 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 59.98 2gnd s ILE 125 Cb -0.03 -1.40 -0.03 0.00 0.01 0.00 0.00 42.46 41.00 2gnd s ILE 125 CO 0.04 0.45 -0.06 0.00 0.00 0.00 0.00 174.94 175.37 2gnd s ALA 126 N 1.12 0.53 -0.31 9.38 0.00 -0.12 -0.82 121.76 131.54 2gnd s ALA 126 Ca -0.03 -0.88 0.02 0.00 0.00 0.00 0.00 51.96 51.06 2gnd s ALA 126 Cb -0.14 0.12 0.08 0.00 0.00 0.00 0.00 23.12 23.17 2gnd s ALA 126 CO -0.04 -0.13 -0.00 0.08 0.00 0.00 0.00 175.76 175.66 2gnd s VAL 127 N -2.10 2.49 0.09 0.00 1.01 0.94 -0.26 120.40 122.57 2gnd s VAL 127 Ca -0.06 -1.86 -0.03 0.00 0.00 0.00 0.00 61.98 60.03 2gnd s VAL 127 Cb -0.05 -2.60 -0.05 0.00 0.00 0.00 0.00 36.38 33.68 2gnd s VAL 127 CO -0.02 -0.30 0.30 -1.83 0.00 0.00 0.00 175.10 173.25 2gnd s GLU 128 N 1.07 3.55 -0.47 2.72 -1.05 -0.15 -1.18 118.70 123.19 2gnd s GLU 128 Ca -0.00 -0.21 0.03 0.00 -0.15 0.00 0.00 54.97 54.64 2gnd s GLU 128 Cb -0.20 -2.96 0.13 0.00 -0.44 0.00 0.00 34.13 30.66 2gnd s GLU 128 CO -0.05 0.55 0.23 -0.06 0.95 0.00 0.00 175.26 176.88 2gnd s PHE 129 N -1.54 2.62 -0.26 4.83 0.40 0.02 -1.13 117.98 122.92 2gnd s PHE 129 Ca 0.36 -2.78 -0.19 0.00 -0.60 0.00 0.00 56.93 53.73 2gnd s PHE 129 Cb -0.13 -2.37 -0.02 0.00 0.51 0.00 0.00 43.02 41.01 2gnd s PHE 129 CO 0.24 -0.78 0.55 0.34 0.70 0.00 0.00 175.22 176.28 2gnd s ASP 130 N 0.13 6.48 -0.00 1.36 -1.08 -0.38 -2.52 116.67 120.66 2gnd s ASP 130 Ca 0.17 0.58 0.16 0.00 -0.52 0.00 0.00 52.55 52.94 2gnd s ASP 130 Cb -0.25 -2.30 -0.18 0.00 -1.46 0.00 0.00 42.92 38.73 2gnd s ASP 130 CO -0.01 -0.31 0.66 0.35 0.52 0.00 0.00 175.17 176.38 2gnd n THR 131 N 5.16 0.00 -4.92 1.71 -2.24 -1.11 -1.92 114.28 110.95 2gnd n THR 131 Ca -0.03 -0.14 -0.32 0.00 -2.27 0.00 0.00 64.05 61.29 2gnd n THR 131 Cb 0.49 0.92 -0.17 0.00 -2.10 0.00 0.00 70.33 69.47 2gnd n THR 131 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2gnd s PHE 132 N -2.59 2.57 -0.03 4.78 5.36 -1.25 -4.77 117.98 122.04 2gnd s PHE 132 Ca 0.05 -1.18 0.05 0.00 -0.96 0.00 0.00 56.93 54.90 2gnd s PHE 132 Cb 0.12 -1.74 0.09 0.00 -0.34 0.00 0.00 43.02 41.15 2gnd s PHE 132 CO 0.67 -0.51 1.04 2.48 -1.46 0.00 0.00 175.22 177.44 2gnd n TYR 133 N 3.81 0.00 -1.70 10.12 4.11 -1.26 -4.96 117.16 127.27 2gnd n TYR 133 Ca -0.20 -0.27 -0.55 0.00 -0.00 0.00 0.00 57.90 56.89 2gnd n TYR 133 Cb 0.52 -0.08 -0.06 0.00 -0.00 0.00 0.00 39.34 39.72 2gnd n TYR 133 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2gnd n ALA 134 N -0.33 0.14 0.17 -3.48 0.00 -1.26 -4.75 120.51 111.00 2gnd n ALA 134 Ca 0.04 0.36 0.09 0.00 0.00 0.00 0.00 53.44 53.93 2gnd n ALA 134 Cb 0.70 -2.31 0.44 0.00 0.00 0.00 0.00 19.45 18.28 2gnd n ALA 134 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2gnd n GLN 135 N 5.71 0.11 0.10 0.00 1.13 -1.26 -0.25 117.38 122.92 2gnd n GLN 135 Ca 0.25 0.57 -0.20 0.00 -1.94 0.00 0.00 57.00 55.67 2gnd n GLN 135 Cb 0.18 -1.83 -0.12 0.00 0.11 0.00 0.00 30.24 28.57 2gnd n GLN 135 CO 0.00 0.00 0.00 0.38 -1.44 0.00 0.00 177.06 176.00 2gnd h ASP 136 N 0.00 0.75 0.00 1.08 2.03 -1.97 -3.30 116.42 115.00 2gnd h ASP 136 Ca 0.00 -0.71 -0.35 0.00 -0.73 0.00 0.00 57.03 55.24 2gnd h ASP 136 Cb 0.06 -0.24 -0.06 0.00 -0.83 0.00 0.00 39.33 38.26 2gnd h ASP 136 CO 0.00 1.53 -2.33 -1.54 -1.03 0.00 0.00 179.24 175.87 2gnd n SER 137 N -3.73 1.98 -3.38 4.15 3.41 -0.99 -4.65 113.62 110.41 2gnd n SER 137 Ca -0.12 -0.11 -0.35 0.00 -0.26 0.00 0.00 58.87 58.02 2gnd n SER 137 Cb 0.99 -0.23 -0.01 0.00 -0.26 0.00 0.00 64.21 64.70 2gnd n SER 137 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2gnd n ASN 138 N -3.14 6.05 -0.20 4.04 5.03 0.66 -4.87 115.26 122.83 2gnd n ASN 138 Ca -0.40 -3.66 0.25 0.00 0.87 0.00 0.00 54.58 51.63 2gnd n ASN 138 Cb 0.96 -0.92 0.64 0.00 -1.02 0.00 0.00 39.78 39.44 2gnd n ASN 138 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.26 176.14 2gnd h THR 139 N 2.62 0.60 0.00 3.41 1.35 -1.74 -1.57 112.91 117.58 2gnd h THR 139 Ca 0.35 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 66.15 2gnd h THR 139 Cb 0.42 0.42 0.00 0.00 -1.73 0.00 0.00 68.15 67.26 2gnd h THR 139 CO 1.04 0.03 0.00 4.11 -0.25 0.00 0.00 175.52 180.45 2gnd h TRP 140 N 0.16 0.00 -3.72 4.73 0.09 -1.90 -3.46 115.95 111.85 2gnd h TRP 140 Ca 0.45 0.00 -0.49 0.00 0.09 0.00 0.00 58.89 58.93 2gnd h TRP 140 Cb 1.49 0.00 -0.02 0.00 0.08 0.00 0.00 29.16 30.72 2gnd h TRP 140 CO -0.00 0.00 0.10 -0.51 0.09 0.00 0.00 178.44 178.12 2gnd s ASP 141 N -4.60 6.69 0.81 0.11 1.01 -0.59 -4.79 116.67 115.31 2gnd s ASP 141 Ca 0.05 1.23 -0.11 0.00 0.71 0.00 0.00 52.55 54.43 2gnd s ASP 141 Cb 0.10 -2.36 0.08 0.00 1.01 0.00 0.00 42.92 41.75 2gnd s ASP 141 CO 0.48 -0.27 1.09 -2.16 0.21 0.00 0.00 175.17 174.52 2gnd s PRO 142 N -3.26 1.98 -1.21 8.23 0.04 -1.26 -4.91 135.00 134.61 2gnd s PRO 142 Ca 0.53 0.80 -0.09 0.00 0.04 0.00 0.00 61.00 62.28 2gnd s PRO 142 Cb -0.10 -1.89 0.21 0.00 0.04 0.00 0.00 34.50 32.75 2gnd s PRO 142 CO 0.22 -1.74 1.62 0.27 0.04 0.00 0.00 177.00 177.41 2gnd n ASN 143 N -3.54 5.44 0.00 6.66 2.04 -1.26 -4.85 115.26 119.76 2gnd n ASN 143 Ca 0.07 -3.14 0.00 0.00 -0.44 0.00 0.00 54.58 51.08 2gnd n ASN 143 Cb 0.55 -1.45 0.00 0.00 -2.53 0.00 0.00 39.78 36.35 2gnd n ASN 143 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2gnd n TYR 144 N 3.63 0.00 -1.39 -2.53 0.18 -1.26 -5.11 117.16 110.68 2gnd n TYR 144 Ca 0.35 0.00 -0.36 0.00 1.88 0.00 0.00 57.90 59.77 2gnd n TYR 144 Cb 0.37 0.00 0.09 0.00 -0.38 0.00 0.00 39.34 39.42 2gnd n TYR 144 CO 0.00 0.00 0.00 -0.35 -2.08 0.00 0.00 176.86 174.43 2gnd n PRO 145 N -0.16 0.57 -3.66 -3.48 -0.04 -1.26 -4.90 135.00 122.08 2gnd n PRO 145 Ca 0.00 0.25 -0.05 0.00 -0.04 0.00 0.00 63.50 63.66 2gnd n PRO 145 Cb 0.00 -2.29 -0.02 0.00 -0.04 0.00 0.00 33.50 31.16 2gnd n PRO 145 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 2gnd s HIS 146 N -1.78 -0.21 -0.10 0.54 -3.43 -0.81 -2.02 115.29 107.49 2gnd s HIS 146 Ca 0.75 -0.04 -0.01 0.00 -0.80 0.00 0.00 55.06 54.97 2gnd s HIS 146 Cb -0.35 0.60 -0.03 0.00 -1.43 0.00 0.00 32.58 31.38 2gnd s HIS 146 CO 0.49 -0.72 -0.07 0.42 -2.00 0.00 0.00 174.74 172.86 2gnd s ILE 147 N -3.22 3.69 0.06 -5.38 1.01 -0.63 -1.25 121.20 115.48 2gnd s ILE 147 Ca 0.10 -0.46 0.01 0.00 0.00 0.00 0.00 60.65 60.29 2gnd s ILE 147 Cb -0.01 -2.54 -0.03 0.00 0.01 0.00 0.00 42.46 39.88 2gnd s ILE 147 CO -0.02 0.56 -0.05 -0.83 0.00 0.00 0.00 174.94 174.60 2gnd s GLY 148 N -0.37 0.53 -0.25 6.18 0.00 -0.29 -1.52 107.32 111.59 2gnd s GLY 148 Ca 0.05 -1.07 -0.07 0.00 0.00 0.00 0.00 44.72 43.63 2gnd s GLY 148 CO 0.02 -1.17 0.05 -0.42 0.00 0.00 0.00 173.10 171.59 2gnd s ILE 149 N -2.99 4.06 -0.22 0.90 1.01 -0.34 -0.98 121.20 122.63 2gnd s ILE 149 Ca 0.02 -0.34 -0.06 0.00 0.00 0.00 0.00 60.65 60.28 2gnd s ILE 149 Cb 0.01 -2.93 -0.02 0.00 0.01 0.00 0.00 42.46 39.53 2gnd s ILE 149 CO -0.05 0.31 0.02 -1.81 0.00 0.00 0.00 174.94 173.40 2gnd s ASP 150 N 1.57 4.83 -0.38 3.58 -0.00 0.64 -1.23 116.67 125.68 2gnd s ASP 150 Ca 0.06 -0.24 0.04 0.00 -0.00 0.00 0.00 52.55 52.40 2gnd s ASP 150 Cb -0.15 -1.84 0.11 0.00 -0.00 0.00 0.00 42.92 41.03 2gnd s ASP 150 CO 0.02 0.01 0.10 -0.69 -0.00 0.00 0.00 175.17 174.61 2gnd s VAL 151 N 1.33 2.35 -1.75 -1.27 1.01 -1.26 -0.94 120.40 119.86 2gnd s VAL 151 Ca 0.04 -2.57 0.00 0.00 0.00 0.00 0.00 61.98 59.46 2gnd s VAL 151 Cb -0.15 -2.71 0.00 0.00 0.00 0.00 0.00 36.38 33.52 2gnd s VAL 151 CO 0.01 -0.64 0.00 0.59 0.00 0.00 0.00 175.10 175.06 2gnd n ASN 152 N 4.00 -5.16 -3.55 3.32 3.02 0.07 -4.94 115.26 112.01 2gnd n ASN 152 Ca 0.04 0.41 -0.17 0.00 -0.03 0.00 0.00 54.58 54.83 2gnd n ASN 152 Cb 0.40 -4.12 -0.06 0.00 -0.61 0.00 0.00 39.78 35.39 2gnd n ASN 152 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2gnd s SER 153 N -2.76 -0.67 0.34 6.41 0.15 -1.26 -3.74 113.70 112.17 2gnd s SER 153 Ca 0.00 0.87 0.27 0.00 0.70 0.00 0.00 55.95 57.79 2gnd s SER 153 Cb 0.00 0.75 0.98 0.00 -1.71 0.00 0.00 66.02 66.03 2gnd s SER 153 CO 0.00 -0.52 1.79 -0.29 1.20 0.00 0.00 173.24 175.41 2gnd h ILE 154 N 3.25 0.00 -2.98 6.45 6.09 -1.54 -3.39 117.51 125.40 2gnd h ILE 154 Ca -0.28 -0.44 -0.65 0.00 -1.37 0.00 0.00 64.86 62.13 2gnd h ILE 154 Cb 1.15 1.32 -0.16 0.00 0.47 0.00 0.00 36.82 39.60 2gnd h ILE 154 CO 0.31 0.00 0.35 -0.60 -3.07 0.00 0.00 178.15 175.14 2gnd s ARG 155 N -3.35 3.16 0.33 2.19 3.52 -1.26 -4.93 118.95 118.61 2gnd s ARG 155 Ca 0.05 -0.79 -0.27 0.00 -0.13 0.00 0.00 55.73 54.59 2gnd s ARG 155 Cb 0.09 -4.16 -0.13 0.00 -1.56 0.00 0.00 34.95 29.19 2gnd s ARG 155 CO 0.50 -1.54 0.97 0.43 -0.81 0.00 0.00 175.30 174.86 2gnd n SER 156 N 7.03 1.13 0.16 -2.12 7.64 -1.26 -4.81 113.62 121.38 2gnd n SER 156 Ca -0.04 1.13 0.12 0.00 1.01 0.00 0.00 58.87 61.09 2gnd n SER 156 Cb 0.45 -1.29 0.25 0.00 -1.01 0.00 0.00 64.21 62.61 2gnd n SER 156 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 2gnd h VAL 157 N 1.80 0.00 -2.24 0.44 -1.51 -1.52 -3.45 116.25 109.77 2gnd h VAL 157 Ca -0.41 -0.77 -0.06 0.00 -1.23 0.00 0.00 66.70 64.24 2gnd h VAL 157 Cb 1.34 1.70 -0.22 0.00 -2.13 0.00 0.00 31.29 31.98 2gnd h VAL 157 CO 0.59 0.00 -0.02 -0.75 -1.23 0.00 0.00 177.57 176.16 2gnd s LYS 158 N -3.18 0.69 0.13 5.19 2.47 -1.24 -5.02 119.74 118.77 2gnd s LYS 158 Ca 0.08 0.91 -0.01 0.00 -1.56 0.00 0.00 55.97 55.38 2gnd s LYS 158 Cb 0.09 0.28 -0.04 0.00 -1.46 0.00 0.00 37.83 36.70 2gnd s LYS 158 CO 0.66 -0.10 0.06 0.95 0.16 0.00 0.00 175.35 177.07 2gnd s THR 159 N 0.64 0.11 -0.05 3.43 -4.23 -1.26 -1.20 115.64 113.08 2gnd s THR 159 Ca -0.02 -1.87 -0.04 0.00 -1.18 0.00 0.00 61.69 58.57 2gnd s THR 159 Cb -0.05 -1.99 0.01 0.00 1.34 0.00 0.00 72.50 71.82 2gnd s THR 159 CO -0.04 -0.50 0.12 0.54 -0.54 0.00 0.00 174.62 174.21 2gnd s VAL 160 N -4.03 -0.01 0.38 2.29 0.11 -0.58 -4.98 120.40 113.58 2gnd s VAL 160 Ca 0.22 0.02 -0.27 0.00 -2.93 0.00 0.00 61.98 59.02 2gnd s VAL 160 Cb 0.07 -0.18 -0.11 0.00 -1.53 0.00 0.00 36.38 34.63 2gnd s VAL 160 CO 0.01 0.01 1.44 1.17 -3.33 0.00 0.00 175.10 174.39 2gnd n LYS 161 N 3.16 2.49 -4.10 1.54 4.81 -1.26 -1.60 118.16 123.20 2gnd n LYS 161 Ca -0.14 0.87 -0.12 0.00 -0.87 0.00 0.00 58.31 58.06 2gnd n LYS 161 Cb 0.58 -2.59 -0.11 0.00 0.02 0.00 0.00 35.03 32.93 2gnd n LYS 161 CO 0.00 0.00 0.00 -0.46 1.17 0.00 0.00 177.40 178.11 2gnd s TRP 162 N -1.13 0.72 -0.17 5.64 -0.00 -0.86 -4.76 118.94 118.39 2gnd s TRP 162 Ca 0.55 -0.66 -0.03 0.00 -0.00 0.00 0.00 56.10 55.96 2gnd s TRP 162 Cb -0.49 -0.43 -0.02 0.00 -0.00 0.00 0.00 33.47 32.53 2gnd s TRP 162 CO 0.62 -0.12 -0.05 -0.51 -0.00 0.00 0.00 176.95 176.90 2gnd s ASP 163 N -2.11 4.58 -0.10 5.86 1.01 -1.26 -4.32 116.67 120.33 2gnd s ASP 163 Ca -0.02 -0.22 -0.21 0.00 0.71 0.00 0.00 52.55 52.80 2gnd s ASP 163 Cb -0.04 -1.75 -0.04 0.00 1.01 0.00 0.00 42.92 42.10 2gnd s ASP 163 CO -0.02 0.12 0.61 -0.60 0.21 0.00 0.00 175.17 175.49 2gnd s ARG 164 N 0.66 4.38 -0.24 8.23 3.52 -1.26 -5.04 118.95 129.21 2gnd s ARG 164 Ca -0.03 0.70 0.01 0.00 -0.13 0.00 0.00 55.73 56.29 2gnd s ARG 164 Cb -0.15 -3.45 0.06 0.00 -1.56 0.00 0.00 34.95 29.85 2gnd s ARG 164 CO 0.02 0.07 -0.08 1.03 -0.81 0.00 0.00 175.30 175.54 2gnd s ARG 165 N 0.82 1.85 0.12 5.12 0.52 -1.26 -5.10 118.95 121.02 2gnd s ARG 165 Ca 0.33 -1.06 -0.33 0.00 -0.52 0.00 0.00 55.73 54.15 2gnd s ARG 165 Cb -0.17 -2.64 -0.12 0.00 0.52 0.00 0.00 34.95 32.54 2gnd s ARG 165 CO 0.15 -0.56 1.72 -3.47 0.02 0.00 0.00 175.30 173.16 2gnd n ASP 166 N 4.61 3.56 0.00 0.23 -0.08 -1.26 -2.28 116.55 121.33 2gnd n ASP 166 Ca -0.13 1.03 0.00 0.00 -1.51 0.00 0.00 54.79 54.18 2gnd n ASP 166 Cb 0.44 -1.47 0.00 0.00 2.34 0.00 0.00 41.12 42.43 2gnd n ASP 166 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2gnd n GLY 167 N 3.89 0.29 3.63 0.27 0.00 0.21 -4.99 105.19 108.49 2gnd n GLY 167 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 2gnd n GLY 167 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2gnd s GLN 168 N -0.86 3.80 0.26 1.61 -1.52 -0.97 -4.92 119.66 117.06 2gnd s GLN 168 Ca 0.00 -0.37 -0.29 0.00 -1.95 0.00 0.00 55.36 52.74 2gnd s GLN 168 Cb 0.00 -3.12 -0.09 0.00 -0.22 0.00 0.00 33.01 29.58 2gnd s GLN 168 CO 0.00 0.34 1.17 -1.12 -0.25 0.00 0.00 175.29 175.42 2gnd s SER 169 N 0.18 7.12 -0.17 5.90 0.01 -1.26 -4.39 113.70 121.09 2gnd s SER 169 Ca 0.03 2.33 -0.02 0.00 1.31 0.00 0.00 55.95 59.60 2gnd s SER 169 Cb -0.13 -2.62 -0.01 0.00 0.21 0.00 0.00 66.02 63.47 2gnd s SER 169 CO 0.01 -0.28 -0.09 -0.22 0.41 0.00 0.00 173.24 173.07 2gnd s LEU 170 N -1.10 2.81 -0.19 2.44 2.96 0.15 -4.39 118.68 121.36 2gnd s LEU 170 Ca 0.48 -0.35 -0.17 0.00 -0.22 0.00 0.00 54.13 53.87 2gnd s LEU 170 Cb -0.34 -1.67 -0.04 0.00 0.50 0.00 0.00 46.19 44.64 2gnd s LEU 170 CO 0.42 0.08 0.45 0.20 -1.32 0.00 0.00 176.35 176.18 2gnd s ASN 171 N 0.85 6.50 -0.00 3.68 0.02 -0.59 -2.14 114.94 123.26 2gnd s ASN 171 Ca -0.03 0.60 0.06 0.00 -1.02 0.00 0.00 52.86 52.48 2gnd s ASN 171 Cb -0.15 -2.26 -0.02 0.00 0.02 0.00 0.00 41.25 38.84 2gnd s ASN 171 CO 0.01 -0.11 -0.20 -0.69 0.02 0.00 0.00 177.10 176.13 2gnd s VAL 172 N 1.38 1.59 -0.16 1.60 1.01 0.59 -0.90 120.40 125.51 2gnd s VAL 172 Ca 0.21 -0.93 -0.00 0.00 0.00 0.00 0.00 61.98 61.26 2gnd s VAL 172 Cb -0.15 -1.33 0.04 0.00 0.00 0.00 0.00 36.38 34.93 2gnd s VAL 172 CO 0.09 0.39 -0.07 -0.22 0.00 0.00 0.00 175.10 175.29 2gnd s LEU 173 N -0.64 1.59 -0.15 3.92 2.96 0.26 -1.63 118.68 124.99 2gnd s LEU 173 Ca 0.08 -0.60 0.00 0.00 -0.22 0.00 0.00 54.13 53.39 2gnd s LEU 173 Cb -0.08 -0.94 -0.00 0.00 0.50 0.00 0.00 46.19 45.67 2gnd s LEU 173 CO -0.00 -0.16 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.03 2gnd s VAL 174 N 1.62 2.71 -0.00 1.68 1.01 0.31 -1.13 120.40 126.60 2gnd s VAL 174 Ca 0.02 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.26 2gnd s VAL 174 Cb -0.15 -2.15 -0.01 0.00 0.00 0.00 0.00 36.38 34.08 2gnd s VAL 174 CO -0.08 0.51 -0.07 0.42 0.00 0.00 0.00 175.10 175.88 2gnd s THR 175 N 0.80 0.58 -0.16 3.92 -4.23 -0.42 0.02 115.64 116.15 2gnd s THR 175 Ca -0.05 -0.36 0.01 0.00 -1.18 0.00 0.00 61.69 60.11 2gnd s THR 175 Cb -0.15 -0.50 0.02 0.00 1.34 0.00 0.00 72.50 73.21 2gnd s THR 175 CO 0.00 0.13 -0.19 0.12 -0.54 0.00 0.00 174.62 174.14 2gnd s PHE 176 N -0.25 2.63 -0.38 3.99 5.36 0.33 -0.41 117.98 129.25 2gnd s PHE 176 Ca 0.02 -1.47 -0.12 0.00 -0.96 0.00 0.00 56.93 54.39 2gnd s PHE 176 Cb -0.03 -1.82 0.02 0.00 -0.34 0.00 0.00 43.02 40.84 2gnd s PHE 176 CO -0.00 -0.72 0.23 1.21 -1.46 0.00 0.00 175.22 174.48 2gnd s ASN 177 N 1.17 5.86 0.54 6.13 3.84 -0.51 -2.28 114.94 129.70 2gnd s ASN 177 Ca 0.01 -0.88 0.30 0.00 0.21 0.00 0.00 52.86 52.51 2gnd s ASN 177 Cb -0.14 -2.07 1.56 0.00 -0.55 0.00 0.00 41.25 40.05 2gnd s ASN 177 CO -0.09 -0.38 2.10 1.55 -2.79 0.00 0.00 177.10 177.49 2gnd h PRO 178 N 8.49 0.00 -0.14 0.43 0.13 -1.88 0.76 132.00 139.78 2gnd h PRO 178 Ca -0.27 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.68 2gnd h PRO 178 Cb 1.12 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 2gnd h PRO 178 CO 0.68 0.09 -0.64 1.03 -0.23 0.00 0.00 178.00 178.92 2gnd h SER 179 N 0.00 0.60 0.00 1.44 0.87 -1.94 -3.30 113.55 111.22 2gnd h SER 179 Ca -0.00 -0.36 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 2gnd h SER 179 Cb 0.32 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.10 2gnd h SER 179 CO 0.01 1.09 -0.79 0.35 -0.53 0.00 0.00 176.83 176.96 2gnd n THR 180 N -3.91 0.00 -1.21 2.23 -2.24 -1.11 -4.97 114.28 103.07 2gnd n THR 180 Ca -0.04 -0.24 -0.07 0.00 -2.27 0.00 0.00 64.05 61.43 2gnd n THR 180 Cb 0.66 0.81 -0.03 0.00 -2.10 0.00 0.00 70.33 69.67 2gnd n THR 180 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2gnd n ARG 181 N -1.43 -1.00 -3.09 -0.78 1.74 0.26 -4.89 116.66 107.47 2gnd n ARG 181 Ca 0.01 0.67 -0.39 0.00 -0.77 0.00 0.00 57.85 57.37 2gnd n ARG 181 Cb 0.21 -4.64 -0.05 0.00 -1.02 0.00 0.00 32.46 26.96 2gnd n ARG 181 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2gnd s ASN 182 N -2.50 7.13 -0.37 0.55 0.01 -1.16 -0.84 114.94 117.75 2gnd s ASN 182 Ca 0.00 1.34 -0.07 0.00 -0.71 0.00 0.00 52.86 53.43 2gnd s ASN 182 Cb 0.00 -2.42 0.06 0.00 0.41 0.00 0.00 41.25 39.29 2gnd s ASN 182 CO 0.00 0.08 0.16 -0.22 -1.51 0.00 0.00 177.10 175.61 2gnd s LEU 183 N -0.27 4.64 -0.09 0.60 2.96 0.21 -1.43 118.68 125.30 2gnd s LEU 183 Ca 0.35 -1.32 -0.03 0.00 -0.22 0.00 0.00 54.13 52.90 2gnd s LEU 183 Cb -0.20 -1.90 -0.04 0.00 0.50 0.00 0.00 46.19 44.56 2gnd s LEU 183 CO 0.21 -0.41 0.06 -1.81 -1.32 0.00 0.00 176.35 173.08 2gnd s ASP 184 N 1.64 5.69 -0.13 3.68 1.01 0.45 -1.86 116.67 127.16 2gnd s ASP 184 Ca 0.01 0.26 0.01 0.00 0.71 0.00 0.00 52.55 53.54 2gnd s ASP 184 Cb -0.21 -1.70 0.02 0.00 1.01 0.00 0.00 42.92 42.04 2gnd s ASP 184 CO 0.02 0.38 -0.15 -0.69 0.21 0.00 0.00 175.17 174.93 2gnd s VAL 185 N -0.97 1.57 -0.15 -1.27 1.01 0.03 -1.30 120.40 119.32 2gnd s VAL 185 Ca 0.15 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.47 2gnd s VAL 185 Cb -0.12 -1.45 0.03 0.00 0.00 0.00 0.00 36.38 34.84 2gnd s VAL 185 CO 0.04 0.46 -0.13 -0.69 0.00 0.00 0.00 175.10 174.78 2gnd s VAL 186 N 1.19 1.51 -0.05 2.92 1.01 -0.28 -2.08 120.40 124.61 2gnd s VAL 186 Ca -0.02 -0.65 0.05 0.00 0.00 0.00 0.00 61.98 61.36 2gnd s VAL 186 Cb -0.14 -1.46 -0.00 0.00 0.00 0.00 0.00 36.38 34.78 2gnd s VAL 186 CO -0.05 0.40 -0.19 0.00 0.00 0.00 0.00 175.10 175.25 2gnd s ALA 187 N 1.50 1.69 -0.04 5.51 0.00 -0.25 -0.57 121.76 129.59 2gnd s ALA 187 Ca 0.04 -0.77 -0.04 0.00 0.00 0.00 0.00 51.96 51.19 2gnd s ALA 187 Cb -0.13 -0.57 0.01 0.00 0.00 0.00 0.00 23.12 22.43 2gnd s ALA 187 CO -0.10 0.30 0.12 0.95 0.00 0.00 0.00 175.76 177.02 2gnd s THR 188 N 0.06 0.01 0.49 0.00 -4.23 -0.08 -0.04 115.64 111.84 2gnd s THR 188 Ca -0.05 -0.06 -0.04 0.00 -1.18 0.00 0.00 61.69 60.36 2gnd s THR 188 Cb -0.13 -0.19 -0.02 0.00 1.34 0.00 0.00 72.50 73.50 2gnd s THR 188 CO 0.03 -0.03 0.77 -0.31 -0.54 0.00 0.00 174.62 174.54 2gnd s TYR 189 N -0.05 3.44 0.53 3.99 1.51 -0.42 -1.54 117.35 124.80 2gnd s TYR 189 Ca -0.01 0.64 0.27 0.00 -1.01 0.00 0.00 57.07 56.96 2gnd s TYR 189 Cb -0.01 -2.35 1.41 0.00 -0.11 0.00 0.00 41.96 40.89 2gnd s TYR 189 CO 0.00 -0.37 1.95 0.66 -1.11 0.00 0.00 175.55 176.68 2gnd h SER 190 N 0.22 0.03 0.00 2.29 4.64 -1.90 0.12 113.55 118.94 2gnd h SER 190 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2gnd h SER 190 Cb 1.22 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2gnd h SER 190 CO 0.61 0.01 0.00 -0.90 -0.87 0.00 0.00 176.83 175.68 2gnd n ASP 191 N -4.34 0.00 0.00 4.97 5.75 -1.26 -4.87 116.55 116.80 2gnd n ASP 191 Ca 0.14 -1.05 0.00 0.00 -0.01 0.00 0.00 54.79 53.86 2gnd n ASP 191 Cb 0.75 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.84 2gnd n ASP 191 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2gnd n GLY 192 N 0.71 0.64 3.69 6.12 0.00 0.03 -5.04 105.19 111.34 2gnd n GLY 192 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2gnd n GLY 192 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gnd s THR 193 N -2.51 3.19 0.00 2.61 2.01 -1.25 -4.82 115.64 114.87 2gnd s THR 193 Ca 0.00 0.66 0.08 0.00 0.31 0.00 0.00 61.69 62.74 2gnd s THR 193 Cb 0.00 -3.42 -0.02 0.00 0.01 0.00 0.00 72.50 69.06 2gnd s THR 193 CO 0.00 0.00 -0.25 -0.60 -0.69 0.00 0.00 174.62 173.08 2gnd s ARG 194 N 2.42 2.05 -0.03 4.92 3.52 -1.26 -1.30 118.95 129.27 2gnd s ARG 194 Ca 0.71 -0.97 0.03 0.00 -0.13 0.00 0.00 55.73 55.37 2gnd s ARG 194 Cb -0.38 -2.06 0.00 0.00 -1.56 0.00 0.00 34.95 30.96 2gnd s ARG 194 CO 0.31 0.55 -0.11 0.71 -0.81 0.00 0.00 175.30 175.94 2gnd s TYR 195 N -0.69 1.17 0.01 5.12 1.51 0.94 -4.99 117.35 120.41 2gnd s TYR 195 Ca 0.11 -0.31 0.02 0.00 -1.01 0.00 0.00 57.07 55.88 2gnd s TYR 195 Cb -0.10 -0.82 -0.01 0.00 -0.11 0.00 0.00 41.96 40.92 2gnd s TYR 195 CO 0.00 -0.12 -0.06 -1.21 -1.11 0.00 0.00 175.55 173.05 2gnd s GLU 196 N 0.16 0.48 -0.22 -0.62 2.02 -1.26 -1.09 118.70 118.17 2gnd s GLU 196 Ca -0.04 -0.32 -0.19 0.00 0.02 0.00 0.00 54.97 54.44 2gnd s GLU 196 Cb -0.10 -0.42 0.06 0.00 0.10 0.00 0.00 34.13 33.77 2gnd s GLU 196 CO 0.01 0.11 0.58 0.54 0.02 0.00 0.00 175.26 176.52 2gnd s VAL 197 N -0.39 -0.00 0.09 2.63 0.11 -0.89 -4.90 120.40 117.05 2gnd s VAL 197 Ca -0.00 0.01 -0.01 0.00 -2.93 0.00 0.00 61.98 59.04 2gnd s VAL 197 Cb -0.04 -0.82 -0.04 0.00 -1.53 0.00 0.00 36.38 33.95 2gnd s VAL 197 CO -0.00 0.00 0.02 -0.94 -3.33 0.00 0.00 175.10 170.86 2gnd s SER 198 N 0.60 0.38 -0.19 3.54 1.04 -1.26 -0.79 113.70 117.03 2gnd s SER 198 Ca -0.02 -1.09 -0.24 0.00 0.48 0.00 0.00 55.95 55.08 2gnd s SER 198 Cb -0.05 0.26 0.06 0.00 0.10 0.00 0.00 66.02 66.39 2gnd s SER 198 CO -0.03 -0.67 0.63 -0.47 0.98 0.00 0.00 173.24 173.68 2gnd s TYR 199 N -3.98 -0.67 -0.22 5.02 6.14 -0.78 -4.97 117.35 117.88 2gnd s TYR 199 Ca 0.16 1.53 -0.21 0.00 0.64 0.00 0.00 57.07 59.19 2gnd s TYR 199 Cb 0.08 0.27 -0.02 0.00 0.42 0.00 0.00 41.96 42.70 2gnd s TYR 199 CO -0.04 -0.40 0.63 -2.00 0.64 0.00 0.00 175.55 174.38 2gnd s GLU 200 N -0.06 4.17 -0.09 4.97 2.12 -1.26 -0.62 118.70 127.92 2gnd s GLU 200 Ca -0.03 0.59 -0.07 0.00 0.36 0.00 0.00 54.97 55.81 2gnd s GLU 200 Cb -0.04 -3.61 0.02 0.00 0.26 0.00 0.00 34.13 30.77 2gnd s GLU 200 CO 0.03 -0.32 0.22 0.54 -0.54 0.00 0.00 175.26 175.19 2gnd s VAL 201 N 2.19 -0.00 -0.59 3.70 0.11 -0.02 -5.00 120.40 120.78 2gnd s VAL 201 Ca 0.28 0.02 -0.19 0.00 -2.93 0.00 0.00 61.98 59.15 2gnd s VAL 201 Cb -0.16 -0.32 0.10 0.00 -1.53 0.00 0.00 36.38 34.47 2gnd s VAL 201 CO 0.09 0.01 0.71 -0.62 -3.33 0.00 0.00 175.10 171.96 2gnd s ASP 202 N 0.25 6.19 0.54 3.54 -1.08 -1.26 -4.74 116.67 120.11 2gnd s ASP 202 Ca -0.01 -1.35 0.22 0.00 -0.52 0.00 0.00 52.55 50.89 2gnd s ASP 202 Cb -0.03 -2.31 1.45 0.00 -1.46 0.00 0.00 42.92 40.58 2gnd s ASP 202 CO -0.01 -1.11 2.14 -0.37 0.52 0.00 0.00 175.17 176.34 2gnd h VAL 203 N 5.92 0.79 -0.25 1.11 -1.51 -1.96 -2.48 116.25 117.87 2gnd h VAL 203 Ca -0.29 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.17 2gnd h VAL 203 Cb 1.09 0.94 -0.01 0.00 -2.13 0.00 0.00 31.29 31.17 2gnd h VAL 203 CO 1.09 0.00 0.11 0.03 -1.23 0.00 0.00 177.57 177.57 2gnd h ARG 204 N 0.00 0.34 -0.03 5.19 3.08 -1.91 0.96 114.38 122.01 2gnd h ARG 204 Ca 0.05 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2gnd h ARG 204 Cb 0.23 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.21 2gnd h ARG 204 CO -0.00 0.28 0.00 -1.13 -1.07 0.00 0.00 179.97 178.05 2gnd n SER 205 N -4.44 1.51 -0.04 7.04 3.41 -0.93 -4.26 113.62 115.91 2gnd n SER 205 Ca 0.01 -1.52 -0.06 0.00 -0.26 0.00 0.00 58.87 57.04 2gnd n SER 205 Cb 0.12 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.02 2gnd n SER 205 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2gnd n VAL 206 N 0.19 0.44 -4.39 -3.33 0.31 -0.63 -5.08 118.33 105.85 2gnd n VAL 206 Ca 0.19 -0.16 -0.25 0.00 -0.01 0.00 0.00 64.34 64.11 2gnd n VAL 206 Cb 0.35 -0.90 -0.11 0.00 -0.91 0.00 0.00 33.84 32.26 2gnd n VAL 206 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2gnd s LEU 207 N -5.60 2.44 1.19 7.52 1.43 0.24 -4.64 118.68 121.25 2gnd s LEU 207 Ca -0.11 -0.87 -0.17 0.00 -1.03 0.00 0.00 54.13 51.96 2gnd s LEU 207 Cb 0.03 -1.03 0.28 0.00 0.03 0.00 0.00 46.19 45.50 2gnd s LEU 207 CO 0.17 0.06 1.05 -2.16 0.23 0.00 0.00 176.35 175.70 2gnd s PRO 208 N -2.75 -1.09 0.24 1.29 0.04 -1.26 -4.60 135.00 126.86 2gnd s PRO 208 Ca 0.19 0.31 -0.05 0.00 0.04 0.00 0.00 61.00 61.49 2gnd s PRO 208 Cb -0.07 -1.58 0.25 0.00 0.04 0.00 0.00 34.50 33.14 2gnd s PRO 208 CO 0.09 -3.70 1.75 0.93 0.04 0.00 0.00 177.00 176.10 2gnd h GLU 209 N -2.58 0.95 -5.44 4.56 5.08 -1.95 -3.42 114.58 111.78 2gnd h GLU 209 Ca -0.51 -0.24 -0.65 0.00 -1.00 0.00 0.00 59.36 56.96 2gnd h GLU 209 Cb 1.32 -0.12 -0.23 0.00 0.50 0.00 0.00 28.75 30.22 2gnd h GLU 209 CO 0.43 0.88 -0.71 -1.58 -1.00 0.00 0.00 179.01 177.04 2gnd s TRP 210 N -5.14 2.93 0.31 4.33 0.52 -1.26 -0.86 118.94 119.76 2gnd s TRP 210 Ca -0.11 -0.38 0.05 0.00 0.02 0.00 0.00 56.10 55.69 2gnd s TRP 210 Cb 0.15 -1.88 -0.02 0.00 -1.15 0.00 0.00 33.47 30.57 2gnd s TRP 210 CO 0.83 -0.05 0.19 1.33 0.02 0.00 0.00 176.95 179.27 2gnd n VAL 211 N 3.33 0.00 -4.26 4.03 0.24 -0.14 -4.27 118.33 117.26 2gnd n VAL 211 Ca -0.18 -2.04 -0.18 0.00 -2.04 0.00 0.00 64.34 59.90 2gnd n VAL 211 Cb 0.53 0.90 -0.13 0.00 -1.47 0.00 0.00 33.84 33.67 2gnd n VAL 211 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2gnd s ARG 212 N -3.22 0.74 0.11 7.34 0.52 0.06 -0.38 118.95 124.12 2gnd s ARG 212 Ca 0.27 -0.62 0.09 0.00 -0.52 0.00 0.00 55.73 54.95 2gnd s ARG 212 Cb 0.01 -0.69 -0.04 0.00 0.52 0.00 0.00 34.95 34.76 2gnd s ARG 212 CO 0.19 0.17 -0.19 0.14 0.02 0.00 0.00 175.30 175.63 2gnd s VAL 213 N -0.79 2.78 0.00 3.52 -7.23 -1.26 -1.50 120.40 115.92 2gnd s VAL 213 Ca -0.01 -1.51 0.00 0.00 -1.81 0.00 0.00 61.98 58.66 2gnd s VAL 213 Cb -0.07 -2.26 0.00 0.00 0.56 0.00 0.00 36.38 34.61 2gnd s VAL 213 CO 0.01 0.12 0.00 0.61 -0.31 0.00 0.00 175.10 175.52 2gnd n GLY 214 N 0.87 0.66 3.26 2.32 0.00 -0.81 -1.87 105.19 109.61 2gnd n GLY 214 Ca -0.16 -0.67 -0.17 0.00 0.00 0.00 0.00 46.02 45.03 2gnd n GLY 214 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gnd s PHE 215 N -2.10 1.38 0.01 1.61 0.40 -0.51 -1.28 117.98 117.49 2gnd s PHE 215 Ca 0.00 -0.63 -0.03 0.00 -0.60 0.00 0.00 56.93 55.67 2gnd s PHE 215 Cb 0.00 -0.70 -0.01 0.00 0.51 0.00 0.00 43.02 42.82 2gnd s PHE 215 CO 0.00 0.15 0.05 0.45 0.70 0.00 0.00 175.22 176.57 2gnd s SER 216 N -2.83 0.11 0.06 1.36 0.15 -0.03 -1.61 113.70 110.90 2gnd s SER 216 Ca 0.13 -0.29 -0.18 0.00 0.70 0.00 0.00 55.95 56.32 2gnd s SER 216 Cb -0.02 0.14 0.04 0.00 -1.71 0.00 0.00 66.02 64.47 2gnd s SER 216 CO 0.03 -0.28 0.41 0.00 1.20 0.00 0.00 173.24 174.60 2gnd s ALA 217 N -1.18 -0.99 0.09 5.45 0.00 -0.46 -0.23 121.76 124.45 2gnd s ALA 217 Ca -0.13 0.25 -0.20 0.00 0.00 0.00 0.00 51.96 51.88 2gnd s ALA 217 Cb -0.08 0.40 0.05 0.00 0.00 0.00 0.00 23.12 23.49 2gnd s ALA 217 CO 0.00 -0.48 0.49 0.00 0.00 0.00 0.00 175.76 175.77 2gnd s ALA 218 N -2.67 -1.23 -0.04 0.00 0.00 -1.17 -1.67 121.76 114.97 2gnd s ALA 218 Ca -0.04 0.35 -0.02 0.00 0.00 0.00 0.00 51.96 52.26 2gnd s ALA 218 Cb -0.00 0.57 0.03 0.00 0.00 0.00 0.00 23.12 23.72 2gnd s ALA 218 CO -0.04 -0.60 0.05 -1.12 0.00 0.00 0.00 175.76 174.05 2gnd s SER 219 N -2.38 1.02 0.00 0.00 0.01 -0.33 0.28 113.70 112.29 2gnd s SER 219 Ca -0.01 0.05 0.00 0.00 1.31 0.00 0.00 55.95 57.29 2gnd s SER 219 Cb 0.00 -0.17 0.00 0.00 0.21 0.00 0.00 66.02 66.06 2gnd s SER 219 CO -0.07 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 173.97 2gnd n GLY 220 N 5.07 0.69 0.16 3.44 0.00 -1.26 -1.63 105.19 111.66 2gnd n GLY 220 Ca -0.08 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.98 2gnd n GLY 220 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2gnd h GLU 221 N 0.00 0.00 -6.02 1.61 5.08 -1.97 -0.36 114.58 112.92 2gnd h GLU 221 Ca 0.00 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.78 2gnd h GLU 221 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 2gnd h GLU 221 CO 0.00 0.46 -0.45 -0.65 -1.00 0.00 0.00 179.01 177.37 2gnd s GLN 222 N -3.33 3.47 0.14 2.33 -1.52 -1.26 -4.85 119.66 114.63 2gnd s GLN 222 Ca 0.01 -0.44 -0.06 0.00 -1.95 0.00 0.00 55.36 52.93 2gnd s GLN 222 Cb 0.10 -2.97 -0.02 0.00 -0.22 0.00 0.00 33.01 29.90 2gnd s GLN 222 CO 0.71 0.54 0.17 1.52 -0.25 0.00 0.00 175.29 177.99 2gnd s TYR 223 N -1.64 0.55 -0.16 0.91 1.13 -1.25 -4.22 117.35 112.66 2gnd s TYR 223 Ca 0.36 -0.93 -0.32 0.00 -1.41 0.00 0.00 57.07 54.77 2gnd s TYR 223 Cb -0.12 -0.23 0.14 0.00 -1.10 0.00 0.00 41.96 40.65 2gnd s TYR 223 CO 0.28 -0.61 1.11 1.14 -2.51 0.00 0.00 175.55 174.96 2gnd s GLN 224 N -3.98 0.45 0.27 -3.49 -2.07 -1.11 -3.71 119.66 106.02 2gnd s GLN 224 Ca 0.18 -0.06 -0.25 0.00 -1.82 0.00 0.00 55.36 53.41 2gnd s GLN 224 Cb 0.05 0.21 -0.09 0.00 -1.09 0.00 0.00 33.01 32.09 2gnd s GLN 224 CO -0.01 -0.17 0.87 0.95 -1.32 0.00 0.00 175.29 175.60 2gnd s THR 225 N -2.00 4.31 -0.54 3.63 -4.23 0.23 -4.86 115.64 112.18 2gnd s THR 225 Ca 0.05 1.69 0.03 0.00 -1.18 0.00 0.00 61.69 62.29 2gnd s THR 225 Cb -0.01 -4.01 0.14 0.00 1.34 0.00 0.00 72.50 69.96 2gnd s THR 225 CO -0.04 0.23 0.29 -1.00 -0.54 0.00 0.00 174.62 173.56 2gnd s HIS 226 N -1.51 3.22 -0.44 3.99 0.09 -1.26 -3.13 115.29 116.25 2gnd s HIS 226 Ca 0.46 -3.11 -0.19 0.00 -0.00 0.00 0.00 55.06 52.22 2gnd s HIS 226 Cb -0.19 -2.88 0.03 0.00 -0.00 0.00 0.00 32.58 29.54 2gnd s HIS 226 CO 0.24 -0.75 0.54 0.99 -0.00 0.00 0.00 174.74 175.75 2gnd s THR 227 N -0.28 4.96 -0.27 1.30 2.01 -0.86 -2.18 115.64 120.32 2gnd s THR 227 Ca 0.17 -0.23 -0.24 0.00 0.31 0.00 0.00 61.69 61.70 2gnd s THR 227 Cb -0.25 -4.14 -0.00 0.00 0.01 0.00 0.00 72.50 68.11 2gnd s THR 227 CO -0.01 -0.55 0.80 -0.22 -0.69 0.00 0.00 174.62 173.95 2gnd s LEU 228 N 2.45 4.08 -0.18 4.42 2.96 -0.42 -1.93 118.68 130.06 2gnd s LEU 228 Ca 0.16 0.87 0.03 0.00 -0.22 0.00 0.00 54.13 54.97 2gnd s LEU 228 Cb -0.17 -3.12 -0.22 0.00 0.50 0.00 0.00 46.19 43.19 2gnd s LEU 228 CO 0.15 -0.54 0.13 -0.62 -1.32 0.00 0.00 176.35 174.15 2gnd n GLU 229 N 6.06 0.69 -3.62 1.98 1.02 -0.40 -1.21 120.64 125.16 2gnd n GLU 229 Ca 0.04 0.18 -0.11 0.00 -0.02 0.00 0.00 57.16 57.26 2gnd n GLU 229 Cb 0.48 -1.62 -0.04 0.00 -0.02 0.00 0.00 31.44 30.24 2gnd n GLU 229 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2gnd s SER 230 N -6.49 -0.26 -0.29 1.62 1.04 -1.21 -4.30 113.70 103.80 2gnd s SER 230 Ca -0.23 -0.30 -0.15 0.00 0.48 0.00 0.00 55.95 55.75 2gnd s SER 230 Cb 0.08 0.49 0.13 0.00 0.10 0.00 0.00 66.02 66.82 2gnd s SER 230 CO 0.72 -0.87 0.87 0.86 0.98 0.00 0.00 173.24 175.80 2gnd s TRP 231 N -3.80 -0.81 0.05 5.02 -0.00 -0.37 -2.54 118.94 116.49 2gnd s TRP 231 Ca 0.03 1.54 0.06 0.00 -0.00 0.00 0.00 56.10 57.73 2gnd s TRP 231 Cb 0.01 0.49 -0.02 0.00 -0.00 0.00 0.00 33.47 33.95 2gnd s TRP 231 CO -0.12 -0.40 -0.16 -1.54 -0.00 0.00 0.00 176.95 174.73 2gnd s SER 232 N 1.84 1.95 -0.07 5.86 1.04 0.56 0.63 113.70 125.52 2gnd s SER 232 Ca -0.08 -0.51 -0.09 0.00 0.48 0.00 0.00 55.95 55.75 2gnd s SER 232 Cb -0.06 -0.13 0.02 0.00 0.10 0.00 0.00 66.02 65.96 2gnd s SER 232 CO -0.17 0.06 0.24 0.12 0.98 0.00 0.00 173.24 174.47 2gnd s PHE 233 N -0.91 -0.21 -0.11 5.02 2.19 -0.27 -1.25 117.98 122.45 2gnd s PHE 233 Ca 0.03 0.47 -0.09 0.00 0.33 0.00 0.00 56.93 57.67 2gnd s PHE 233 Cb -0.08 0.07 0.03 0.00 -1.31 0.00 0.00 43.02 41.73 2gnd s PHE 233 CO 0.02 -0.20 0.28 -0.08 1.83 0.00 0.00 175.22 177.07 2gnd s THR 234 N -0.35 -0.01 -0.00 0.12 -1.32 -0.88 -1.40 115.64 111.80 2gnd s THR 234 Ca -0.05 0.02 0.00 0.00 -1.21 0.00 0.00 61.69 60.46 2gnd s THR 234 Cb -0.03 -0.40 0.00 0.00 -1.51 0.00 0.00 72.50 70.55 2gnd s THR 234 CO 0.01 0.01 -0.01 -0.55 -2.21 0.00 0.00 174.62 171.88 2gnd s SER 235 N 0.34 0.08 -0.06 8.08 0.15 0.41 -1.81 113.70 120.89 2gnd s SER 235 Ca -0.02 -0.01 -0.02 0.00 0.70 0.00 0.00 55.95 56.60 2gnd s SER 235 Cb -0.03 -0.01 0.04 0.00 -1.71 0.00 0.00 66.02 64.30 2gnd s SER 235 CO -0.01 0.00 0.10 -0.89 1.20 0.00 0.00 173.24 173.64 2gnd s THR 236 N 0.03 -0.15 0.10 6.45 2.01 -0.78 -1.19 115.64 122.11 2gnd s THR 236 Ca -0.00 0.35 -0.31 0.00 0.31 0.00 0.00 61.69 62.04 2gnd s THR 236 Cb -0.01 -0.20 -0.08 0.00 0.01 0.00 0.00 72.50 72.22 2gnd s THR 236 CO -0.00 0.15 1.40 -0.76 -0.69 0.00 0.00 174.62 174.72 2gnd s LEU 237 N 1.98 4.36 0.10 4.42 1.43 -0.57 -1.19 118.68 129.21 2gnd s LEU 237 Ca 0.01 2.31 0.04 0.00 -1.03 0.00 0.00 54.13 55.47 2gnd s LEU 237 Cb -0.12 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.48 2gnd s LEU 237 CO -0.04 -0.67 -0.11 -0.76 0.23 0.00 0.00 176.35 174.99 2gnd s LEU 238 N 1.30 2.38 -0.26 1.79 1.43 -0.35 -4.92 118.68 120.05 2gnd s LEU 238 Ca 0.65 -0.77 -0.15 0.00 -1.03 0.00 0.00 54.13 52.83 2gnd s LEU 238 Cb -0.36 -0.38 -0.04 0.00 0.03 0.00 0.00 46.19 45.44 2gnd s LEU 238 CO 0.30 -0.21 0.37 -0.72 0.23 0.00 0.00 176.35 176.32 2gnd s TYR 239 N -2.14 3.27 -0.01 0.29 -0.85 -1.26 -1.75 117.35 114.89 2gnd s TYR 239 Ca 0.04 0.44 -0.17 0.00 -0.52 0.00 0.00 57.07 56.86 2gnd s TYR 239 Cb -0.05 -2.55 -0.06 0.00 0.38 0.00 0.00 41.96 39.69 2gnd s TYR 239 CO 0.01 -0.18 0.47 0.99 -1.52 0.00 0.00 175.55 175.32 2gnd s THR 240 N 1.90 5.00 0.00 -3.49 2.01 -1.26 -5.06 115.64 114.74 2gnd s THR 240 Ca 0.15 0.97 0.00 0.00 0.31 0.00 0.00 61.69 63.12 2gnd s THR 240 Cb -0.16 -3.79 0.00 0.00 0.01 0.00 0.00 72.50 68.56 2gnd s THR 240 CO 0.09 0.50 0.00 0.00 -0.69 0.00 0.00 174.62 174.53