#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yr3 s PHE 6 N 0.00 3.19 0.46 3.69 0.40 -1.26 -5.08 117.98 119.39 1yr3 s PHE 6 Ca 0.00 0.11 -0.25 0.00 -0.60 0.00 0.00 56.93 56.20 1yr3 s PHE 6 Cb 0.00 -1.66 -0.08 0.00 0.51 0.00 0.00 43.02 41.80 1yr3 s PHE 6 CO 0.00 0.52 1.39 0.45 0.70 0.00 0.00 175.22 178.28 1yr3 s SER 7 N -2.09 5.81 -0.01 1.36 0.15 -1.26 -4.93 113.70 112.73 1yr3 s SER 7 Ca 0.26 2.83 0.02 0.00 0.70 0.00 0.00 55.95 59.77 1yr3 s SER 7 Cb -0.12 -2.65 0.06 0.00 -1.71 0.00 0.00 66.02 61.60 1yr3 s SER 7 CO 0.18 -1.21 1.04 1.41 1.20 0.00 0.00 173.24 175.86 1yr3 n HIS 8 N -0.34 0.06 -0.12 3.44 8.25 -1.26 -4.77 115.22 120.48 1yr3 n HIS 8 Ca 0.06 -0.53 -0.04 0.00 -0.26 0.00 0.00 57.72 56.95 1yr3 n HIS 8 Cb 0.43 -0.05 0.03 0.00 1.12 0.00 0.00 29.99 31.51 1yr3 n HIS 8 CO 0.00 0.00 0.00 -0.91 0.64 0.00 0.00 176.34 176.07 1yr3 h ASN 9 N 0.25 -0.18 -0.72 0.41 2.35 -1.92 -1.94 115.58 113.83 1yr3 h ASN 9 Ca 0.00 0.10 0.15 0.00 -0.55 0.00 0.00 56.30 56.00 1yr3 h ASN 9 Cb 0.56 0.17 -0.13 0.00 0.05 0.00 0.00 38.32 38.97 1yr3 h ASN 9 CO 0.00 -0.05 -0.12 -0.65 -1.65 0.00 0.00 177.43 174.96 1yr3 h PRO 10 N 0.10 0.03 -0.20 0.81 0.11 -1.82 -0.06 132.00 130.97 1yr3 h PRO 10 Ca 0.20 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1yr3 h PRO 10 Cb 0.29 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.38 1yr3 h PRO 10 CO -0.34 0.02 0.13 -0.07 -0.21 0.00 0.00 178.00 177.52 1yr3 h LEU 11 N 0.03 0.21 -0.15 2.35 4.07 -1.74 -2.35 115.31 117.73 1yr3 h LEU 11 Ca 0.36 -0.00 0.05 0.00 0.08 0.00 0.00 57.88 58.36 1yr3 h LEU 11 Cb 0.58 -0.05 -0.06 0.00 1.08 0.00 0.00 40.66 42.21 1yr3 h LEU 11 CO -0.71 0.15 -0.21 -0.26 -1.08 0.00 0.00 178.44 176.34 1yr3 h PHE 12 N 0.26 -0.55 -0.47 1.13 0.05 -0.64 -2.35 116.94 114.36 1yr3 h PHE 12 Ca 0.07 0.03 0.09 0.00 3.82 0.00 0.00 57.97 61.99 1yr3 h PHE 12 Cb -0.02 0.27 -0.09 0.00 2.00 0.00 0.00 35.95 38.11 1yr3 h PHE 12 CO -0.07 -0.29 -0.10 0.00 -0.18 0.00 0.00 178.31 177.67 1yr3 h ILE 14 N 0.02 0.50 -0.12 0.00 1.08 -0.88 0.69 117.51 118.79 1yr3 h ILE 14 Ca 0.23 -0.17 -0.12 0.00 -0.39 0.00 0.00 64.86 64.41 1yr3 h ILE 14 Cb 0.35 -0.02 0.00 0.00 -3.07 0.00 0.00 36.82 34.08 1yr3 h ILE 14 CO -0.47 0.09 -0.39 0.44 -0.69 0.00 0.00 178.15 177.13 1yr3 h ASP 15 N 0.48 0.56 -0.87 1.72 3.32 -0.96 -2.53 116.42 118.13 1yr3 h ASP 15 Ca 0.60 -0.60 0.01 0.00 0.02 0.00 0.00 57.03 57.05 1yr3 h ASP 15 Cb 1.14 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 40.48 1yr3 h ASP 15 CO -0.50 1.06 0.57 0.40 -1.72 0.00 0.00 179.24 179.05 1yr3 h ILE 16 N 0.08 1.23 -0.45 0.35 2.04 1.00 -2.29 117.51 119.46 1yr3 h ILE 16 Ca -0.01 -0.43 -0.14 0.00 1.00 0.00 0.00 64.86 65.27 1yr3 h ILE 16 Cb 1.02 -0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 1yr3 h ILE 16 CO 0.08 0.22 -0.28 0.40 0.00 0.00 0.00 178.15 178.58 1yr3 h ILE 17 N 1.19 1.27 -0.74 -0.67 2.04 0.25 -2.75 117.51 118.10 1yr3 h ILE 17 Ca 0.32 -1.45 0.19 0.00 1.00 0.00 0.00 64.86 64.92 1yr3 h ILE 17 Cb -0.12 1.21 -0.04 0.00 -0.74 0.00 0.00 36.82 37.13 1yr3 h ILE 17 CO -0.07 0.50 0.52 0.11 0.00 0.00 0.00 178.15 179.21 1yr3 h LYS 18 N 0.83 0.14 -0.00 2.37 1.57 -0.96 0.58 116.57 121.09 1yr3 h LYS 18 Ca 0.09 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.76 1yr3 h LYS 18 Cb 0.87 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 1yr3 h LYS 18 CO 0.08 0.09 -0.49 1.15 -0.57 0.00 0.00 179.45 179.71 1yr3 h THR 19 N 0.15 1.35 0.00 -0.16 2.02 -1.31 -2.82 112.91 112.14 1yr3 h THR 19 Ca 0.36 -1.68 -0.36 0.00 0.77 0.00 0.00 66.41 65.50 1yr3 h THR 19 Cb 1.22 1.90 -0.07 0.00 -1.74 0.00 0.00 68.15 69.46 1yr3 h THR 19 CO -0.05 0.48 -2.32 -1.22 0.37 0.00 0.00 175.52 172.77 1yr3 n TYR 20 N -3.96 0.11 -3.42 3.16 4.02 0.48 -4.71 117.16 112.83 1yr3 n TYR 20 Ca -0.02 0.04 -0.26 0.00 -0.01 0.00 0.00 57.90 57.65 1yr3 n TYR 20 Cb 0.51 -1.02 -0.09 0.00 -0.02 0.00 0.00 39.34 38.72 1yr3 n TYR 20 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 1yr3 n LYS 21 N -2.80 0.94 -2.34 -0.72 3.00 0.17 -5.01 118.16 111.40 1yr3 n LYS 21 Ca -0.32 -3.61 -0.37 0.00 -0.00 0.00 0.00 58.31 54.01 1yr3 n LYS 21 Cb 1.14 -1.72 -0.02 0.00 0.00 0.00 0.00 35.03 34.44 1yr3 n LYS 21 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 1yr3 s PRO 22 N -0.92 3.94 -1.27 1.64 0.04 -1.07 -3.93 135.00 133.43 1yr3 s PRO 22 Ca 0.33 1.72 -0.07 0.00 0.04 0.00 0.00 61.00 63.03 1yr3 s PRO 22 Cb 0.08 -2.52 -0.01 0.00 0.04 0.00 0.00 34.50 32.10 1yr3 s PRO 22 CO -0.14 -0.38 0.65 -0.25 0.04 0.00 0.00 177.00 176.92 1yr3 n ASP 23 N -0.22 -2.44 -3.78 6.66 8.00 -1.26 -4.99 116.55 118.52 1yr3 n ASP 23 Ca 0.06 -0.93 -0.21 0.00 0.71 0.00 0.00 54.79 54.42 1yr3 n ASP 23 Cb 0.48 -3.61 -0.17 0.00 -0.02 0.00 0.00 41.12 37.80 1yr3 n ASP 23 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1yr3 s PHE 24 N -3.68 0.50 -0.31 1.24 5.36 -1.25 -5.11 117.98 114.73 1yr3 s PHE 24 Ca 0.17 -0.07 0.02 0.00 -0.96 0.00 0.00 56.93 56.09 1yr3 s PHE 24 Cb -0.06 -0.65 0.09 0.00 -0.34 0.00 0.00 43.02 42.06 1yr3 s PHE 24 CO 0.85 -0.25 0.03 0.99 -1.46 0.00 0.00 175.22 175.38 1yr3 s THR 25 N 1.69 1.78 0.50 0.12 2.01 -1.26 -5.06 115.64 115.42 1yr3 s THR 25 Ca 0.00 -1.84 -0.21 0.00 0.31 0.00 0.00 61.69 59.95 1yr3 s THR 25 Cb -0.13 -2.23 -0.07 0.00 0.01 0.00 0.00 72.50 70.08 1yr3 s THR 25 CO -0.04 -0.47 1.12 -2.16 -0.69 0.00 0.00 174.62 172.39 1yr3 s PRO 26 N 1.19 3.59 -0.24 4.92 0.04 -1.26 -4.77 135.00 138.46 1yr3 s PRO 26 Ca 0.06 1.63 -0.00 0.00 0.04 0.00 0.00 61.00 62.72 1yr3 s PRO 26 Cb -0.19 -2.17 -0.15 0.00 0.04 0.00 0.00 34.50 32.03 1yr3 s PRO 26 CO -0.12 -0.66 -0.23 0.54 0.04 0.00 0.00 177.00 176.58 1yr3 n ARG 27 N -0.93 0.59 -5.01 4.56 1.74 -0.41 -2.77 116.66 114.43 1yr3 n ARG 27 Ca 0.10 0.15 -0.32 0.00 -0.77 0.00 0.00 57.85 57.00 1yr3 n ARG 27 Cb 0.50 -1.47 -0.15 0.00 -1.02 0.00 0.00 32.46 30.33 1yr3 n ARG 27 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1yr3 s VAL 28 N -2.47 2.68 -0.08 1.55 1.01 -1.21 0.61 120.40 122.48 1yr3 s VAL 28 Ca -0.32 -0.85 -0.00 0.00 0.00 0.00 0.00 61.98 60.81 1yr3 s VAL 28 Cb 0.09 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.40 1yr3 s VAL 28 CO 0.54 0.57 -0.05 0.00 0.00 0.00 0.00 175.10 176.15 1yr3 s ALA 29 N -0.33 3.04 0.06 5.51 0.00 -0.33 -2.07 121.76 127.65 1yr3 s ALA 29 Ca 0.02 -0.86 0.09 0.00 0.00 0.00 0.00 51.96 51.21 1yr3 s ALA 29 Cb -0.13 -1.32 -0.03 0.00 0.00 0.00 0.00 23.12 21.64 1yr3 s ALA 29 CO 0.02 0.52 -0.24 -0.06 0.00 0.00 0.00 175.76 176.01 1yr3 s PHE 30 N -0.65 2.10 -0.29 0.00 0.40 0.13 -0.29 117.98 119.38 1yr3 s PHE 30 Ca 0.10 -0.40 0.02 0.00 -0.60 0.00 0.00 56.93 56.06 1yr3 s PHE 30 Cb -0.12 -1.23 0.07 0.00 0.51 0.00 0.00 43.02 42.25 1yr3 s PHE 30 CO 0.02 0.14 -0.05 0.42 0.70 0.00 0.00 175.22 176.45 1yr3 s ILE 31 N -0.85 2.36 -0.42 0.64 1.01 -1.09 0.98 121.20 123.83 1yr3 s ILE 31 Ca 0.10 -1.76 -0.16 0.00 0.00 0.00 0.00 60.65 58.82 1yr3 s ILE 31 Cb -0.10 -2.47 0.02 0.00 0.01 0.00 0.00 42.46 39.93 1yr3 s ILE 31 CO 0.03 -0.19 0.38 -0.76 0.00 0.00 0.00 174.94 174.40 1yr3 s LEU 32 N 1.08 5.01 0.00 2.97 1.43 0.11 -2.66 118.68 126.62 1yr3 s LEU 32 Ca -0.04 -0.80 0.00 0.00 -1.03 0.00 0.00 54.13 52.26 1yr3 s LEU 32 Cb -0.20 -2.28 0.00 0.00 0.03 0.00 0.00 46.19 43.74 1yr3 s LEU 32 CO -0.05 -0.53 0.00 0.61 0.23 0.00 0.00 176.35 176.61 1yr3 n GLY 33 N 5.14 -1.66 3.70 -3.19 0.00 -1.26 -0.89 105.19 107.03 1yr3 n GLY 33 Ca -0.09 -1.06 -0.42 0.00 0.00 0.00 0.00 46.02 44.45 1yr3 n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yr3 s SER 34 N -1.56 6.95 -1.12 1.61 0.01 -1.23 -3.67 113.70 114.68 1yr3 s SER 34 Ca 0.00 2.05 -0.07 0.00 1.31 0.00 0.00 55.95 59.25 1yr3 s SER 34 Cb 0.00 -2.57 0.05 0.00 0.21 0.00 0.00 66.02 63.71 1yr3 s SER 34 CO 0.00 -0.62 0.33 0.61 0.41 0.00 0.00 173.24 173.97 1yr3 n GLY 35 N 3.46 -0.49 0.02 3.44 0.00 -1.20 -4.77 105.19 105.65 1yr3 n GLY 35 Ca 0.11 0.06 0.01 0.00 0.00 0.00 0.00 46.02 46.21 1yr3 n GLY 35 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yr3 n LEU 36 N -3.40 0.29 0.00 0.99 4.77 -1.24 -4.63 117.00 113.78 1yr3 n LEU 36 Ca -0.04 -0.57 0.05 0.00 -0.03 0.00 0.00 56.01 55.41 1yr3 n LEU 36 Cb 0.55 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 41.88 1yr3 n LEU 36 CO 0.39 0.07 0.63 0.61 -1.33 0.00 0.00 177.39 177.76 1yr3 n GLY 37 N 0.93 -0.73 0.00 -0.72 0.00 -1.26 -3.01 105.19 100.40 1yr3 n GLY 37 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1yr3 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yr3 n ALA 38 N -1.38 0.83 0.02 4.61 0.00 -1.26 -0.79 120.51 122.54 1yr3 n ALA 38 Ca 0.04 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.29 1yr3 n ALA 38 Cb 0.10 -0.83 -0.13 0.00 0.00 0.00 0.00 19.45 18.59 1yr3 n ALA 38 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1yr3 h LEU 39 N 0.00 0.44 -0.30 0.00 5.85 -1.94 -3.27 115.31 116.10 1yr3 h LEU 39 Ca 0.00 -0.87 0.00 0.00 0.84 0.00 0.00 57.88 57.85 1yr3 h LEU 39 Cb 0.17 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.06 1yr3 h LEU 39 CO 0.00 1.27 0.12 0.00 -0.34 0.00 0.00 178.44 179.50 1yr3 n ALA 40 N -2.62 0.79 0.41 1.25 0.00 0.03 -0.87 120.51 119.50 1yr3 n ALA 40 Ca -0.12 0.04 0.13 0.00 0.00 0.00 0.00 53.44 53.49 1yr3 n ALA 40 Cb 0.72 -0.84 0.35 0.00 0.00 0.00 0.00 19.45 19.68 1yr3 n ALA 40 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1yr3 h ASP 41 N 0.00 0.00 -0.55 0.00 3.32 -1.66 -3.21 116.42 114.33 1yr3 h ASP 41 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1yr3 h ASP 41 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1yr3 h ASP 41 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 1yr3 n GLN 42 N -2.66 4.16 -2.77 3.56 6.02 -0.05 -4.95 117.38 120.70 1yr3 n GLN 42 Ca 0.04 -3.00 -0.42 0.00 -0.01 0.00 0.00 57.00 53.62 1yr3 n GLN 42 Cb 0.44 -2.05 -0.03 0.00 1.02 0.00 0.00 30.24 29.61 1yr3 n GLN 42 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1yr3 s ILE 43 N -2.42 4.87 0.17 5.09 1.01 -1.21 -4.86 121.20 123.85 1yr3 s ILE 43 Ca 0.51 1.94 -0.30 0.00 0.00 0.00 0.00 60.65 62.79 1yr3 s ILE 43 Cb 0.37 -4.27 -0.08 0.00 0.01 0.00 0.00 42.46 38.50 1yr3 s ILE 43 CO 0.18 0.12 1.18 -1.61 0.00 0.00 0.00 174.94 174.81 1yr3 s GLU 44 N 1.32 4.50 -1.40 2.79 2.02 0.13 -3.28 118.70 124.78 1yr3 s GLU 44 Ca 0.48 1.84 -0.03 0.00 0.02 0.00 0.00 54.97 57.28 1yr3 s GLU 44 Cb -0.19 -3.26 0.02 0.00 0.10 0.00 0.00 34.13 30.80 1yr3 s GLU 44 CO 0.23 -0.07 0.63 0.09 0.02 0.00 0.00 175.26 176.16 1yr3 n ASN 45 N 2.60 -1.42 -4.71 -0.19 4.13 -1.26 -1.52 115.26 112.88 1yr3 n ASN 45 Ca 0.04 -0.90 -0.42 0.00 1.68 0.00 0.00 54.58 54.98 1yr3 n ASN 45 Cb 0.45 -3.56 -0.03 0.00 -1.54 0.00 0.00 39.78 35.10 1yr3 n ASN 45 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1yr3 s ALA 46 N -3.71 3.39 -0.14 5.41 0.00 -1.20 -4.51 121.76 120.99 1yr3 s ALA 46 Ca 0.13 0.85 -0.01 0.00 0.00 0.00 0.00 51.96 52.94 1yr3 s ALA 46 Cb -0.07 -3.44 -0.01 0.00 0.00 0.00 0.00 23.12 19.59 1yr3 s ALA 46 CO 0.85 -0.43 -0.11 0.08 0.00 0.00 0.00 175.76 176.15 1yr3 s VAL 47 N 1.03 3.14 -0.19 0.00 1.01 -0.11 -4.95 120.40 120.33 1yr3 s VAL 47 Ca 0.59 -0.62 -0.03 0.00 0.00 0.00 0.00 61.98 61.92 1yr3 s VAL 47 Cb -0.29 -2.34 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 1yr3 s VAL 47 CO 0.29 0.51 -0.07 0.00 0.00 0.00 0.00 175.10 175.83 1yr3 s ALA 48 N 0.50 2.76 -0.19 5.51 0.00 -1.26 -1.12 121.76 127.96 1yr3 s ALA 48 Ca -0.08 -1.07 -0.03 0.00 0.00 0.00 0.00 51.96 50.79 1yr3 s ALA 48 Cb -0.15 -1.54 -0.01 0.00 0.00 0.00 0.00 23.12 21.41 1yr3 s ALA 48 CO 0.04 -0.19 -0.08 0.42 0.00 0.00 0.00 175.76 175.95 1yr3 s ILE 49 N 1.08 3.21 0.42 0.00 1.01 -0.70 -4.93 121.20 121.30 1yr3 s ILE 49 Ca 0.01 -0.56 -0.24 0.00 0.00 0.00 0.00 60.65 59.85 1yr3 s ILE 49 Cb -0.15 -2.43 -0.08 0.00 0.01 0.00 0.00 42.46 39.82 1yr3 s ILE 49 CO -0.01 0.46 1.18 -0.55 0.00 0.00 0.00 174.94 176.02 1yr3 s SER 50 N 1.14 6.37 0.58 3.58 0.15 -1.26 0.29 113.70 124.55 1yr3 s SER 50 Ca 0.01 2.36 0.27 0.00 0.70 0.00 0.00 55.95 59.30 1yr3 s SER 50 Cb -0.14 -2.61 1.68 0.00 -1.71 0.00 0.00 66.02 63.23 1yr3 s SER 50 CO -0.02 -0.78 2.19 1.88 1.20 0.00 0.00 173.24 177.71 1yr3 h TYR 51 N 2.43 0.00 -0.00 3.44 0.05 0.25 0.82 116.97 123.95 1yr3 h TYR 51 Ca -0.49 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.29 1yr3 h TYR 51 Cb 1.24 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.98 1yr3 h TYR 51 CO 0.54 0.00 0.01 0.93 -1.05 0.00 0.00 178.16 178.60 1yr3 h GLU 52 N 0.00 0.00 -0.01 4.88 5.08 -1.90 -0.04 114.58 122.59 1yr3 h GLU 52 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1yr3 h GLU 52 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1yr3 h GLU 52 CO -0.00 0.00 -0.63 1.63 -1.00 0.00 0.00 179.01 179.01 1yr3 n LYS 53 N -3.12 0.64 -3.79 2.33 5.02 0.28 -4.79 118.16 114.72 1yr3 n LYS 53 Ca -0.03 -0.50 -0.36 0.00 -2.02 0.00 0.00 58.31 55.40 1yr3 n LYS 53 Cb 0.08 -1.49 -0.12 0.00 -0.02 0.00 0.00 35.03 33.49 1yr3 n LYS 53 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1yr3 s LEU 54 N -2.71 5.22 0.16 -0.35 1.43 -0.03 -5.00 118.68 117.40 1yr3 s LEU 54 Ca 0.15 -2.09 -0.34 0.00 -1.03 0.00 0.00 54.13 50.82 1yr3 s LEU 54 Cb 0.17 -1.82 -0.14 0.00 0.03 0.00 0.00 46.19 44.44 1yr3 s LEU 54 CO 0.68 -0.52 1.51 -0.81 0.23 0.00 0.00 176.35 177.43 1yr3 n PRO 55 N 4.51 1.97 0.00 1.29 -0.04 -1.26 -1.94 135.00 139.52 1yr3 n PRO 55 Ca -0.01 0.71 0.00 0.00 -0.04 0.00 0.00 63.50 64.16 1yr3 n PRO 55 Cb 0.41 -2.43 0.00 0.00 -0.04 0.00 0.00 33.50 31.44 1yr3 n PRO 55 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1yr3 n GLY 56 N 3.04 3.03 3.76 0.55 0.00 -1.26 -4.62 105.19 109.69 1yr3 n GLY 56 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 1yr3 n GLY 56 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1yr3 s PHE 57 N -2.96 2.52 -1.14 1.61 0.40 -0.82 -4.60 117.98 112.99 1yr3 s PHE 57 Ca 0.00 1.51 -0.23 0.00 -0.60 0.00 0.00 56.93 57.61 1yr3 s PHE 57 Cb 0.00 -3.47 -0.09 0.00 0.51 0.00 0.00 43.02 39.97 1yr3 s PHE 57 CO 0.00 -2.05 1.95 -2.14 0.70 0.00 0.00 175.22 173.68 1yr3 s PRO 58 N -3.15 2.39 -0.19 0.24 0.02 -1.26 -4.94 135.00 128.11 1yr3 s PRO 58 Ca 0.73 -0.99 -0.34 0.00 0.02 0.00 0.00 61.00 60.43 1yr3 s PRO 58 Cb -0.30 -5.20 -0.11 0.00 0.02 0.00 0.00 34.50 28.91 1yr3 s PRO 58 CO 0.34 -4.03 2.00 0.28 -0.33 0.00 0.00 177.00 175.25 1yr3 n VAL 59 N 7.92 0.43 -1.22 3.83 0.31 -1.26 -4.79 118.33 123.55 1yr3 n VAL 59 Ca 0.44 -0.19 -0.35 0.00 -0.01 0.00 0.00 64.34 64.23 1yr3 n VAL 59 Cb 0.47 -1.86 0.09 0.00 -0.91 0.00 0.00 33.84 31.63 1yr3 n VAL 59 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1yr3 n SER 60 N 8.06 -0.24 0.00 4.52 2.88 -1.26 -4.93 113.62 122.64 1yr3 n SER 60 Ca 0.29 0.59 0.00 0.00 -1.33 0.00 0.00 58.87 58.42 1yr3 n SER 60 Cb 0.29 -1.34 0.00 0.00 -0.75 0.00 0.00 64.21 62.40 1yr3 n SER 60 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1yr3 n THR 61 N -2.74 0.00 -4.56 2.46 -2.24 -1.26 -5.06 114.28 100.89 1yr3 n THR 61 Ca 0.11 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.59 1yr3 n THR 61 Cb 0.50 0.71 -0.13 0.00 -2.10 0.00 0.00 70.33 69.31 1yr3 n THR 61 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1yr3 s VAL 62 N 0.00 2.63 0.21 2.28 1.01 -1.26 -5.12 120.40 120.15 1yr3 s VAL 62 Ca 0.00 -1.39 -0.30 0.00 0.00 0.00 0.00 61.98 60.30 1yr3 s VAL 62 Cb 0.00 -2.14 -0.09 0.00 0.00 0.00 0.00 36.38 34.16 1yr3 s VAL 62 CO 0.00 0.24 1.21 -1.00 0.00 0.00 0.00 175.10 175.55 1yr3 s HIS 63 N -0.99 3.38 0.00 5.22 3.76 -1.26 -3.03 115.29 122.37 1yr3 s HIS 63 Ca 0.15 1.42 0.00 0.00 -0.15 0.00 0.00 55.06 56.48 1yr3 s HIS 63 Cb -0.10 -3.46 0.00 0.00 1.11 0.00 0.00 32.58 30.12 1yr3 s HIS 63 CO 0.06 -1.30 0.00 0.41 -0.85 0.00 0.00 174.74 173.07 1yr3 n GLY 64 N 1.98 0.62 2.83 -2.22 0.00 -1.26 -4.83 105.19 102.31 1yr3 n GLY 64 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 1yr3 n GLY 64 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1yr3 s HIS 65 N -2.16 1.39 -0.03 1.61 4.02 -1.17 -3.21 115.29 115.73 1yr3 s HIS 65 Ca 0.00 -0.91 -0.06 0.00 1.02 0.00 0.00 55.06 55.12 1yr3 s HIS 65 Cb 0.00 -1.17 -0.03 0.00 -1.02 0.00 0.00 32.58 30.36 1yr3 s HIS 65 CO 0.00 -0.58 0.35 0.00 1.02 0.00 0.00 174.74 175.53 1yr3 h ALA 66 N 8.18 -0.32 0.00 -1.40 0.00 -1.85 -3.44 119.26 120.44 1yr3 h ALA 66 Ca -0.21 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1yr3 h ALA 66 Cb 1.11 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1yr3 h ALA 66 CO 0.36 -0.30 0.00 0.41 0.00 0.00 0.00 179.25 179.72 1yr3 n GLY 67 N 1.02 1.32 3.35 0.00 0.00 -1.03 -4.57 105.19 105.29 1yr3 n GLY 67 Ca -0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.78 1yr3 n GLY 67 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yr3 s GLU 68 N 0.00 1.33 -0.29 1.61 2.02 -1.18 0.23 118.70 122.43 1yr3 s GLU 68 Ca 0.00 -1.47 0.02 0.00 0.02 0.00 0.00 54.97 53.54 1yr3 s GLU 68 Cb 0.00 -1.37 0.07 0.00 0.10 0.00 0.00 34.13 32.93 1yr3 s GLU 68 CO 0.00 0.27 -0.04 -1.17 0.02 0.00 0.00 175.26 174.34 1yr3 s LEU 69 N -2.84 3.90 -0.19 1.80 2.96 0.15 -1.36 118.68 123.10 1yr3 s LEU 69 Ca 0.18 -1.58 -0.14 0.00 -0.22 0.00 0.00 54.13 52.37 1yr3 s LEU 69 Cb -0.05 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.99 1yr3 s LEU 69 CO 0.08 -0.26 0.32 -0.69 -1.32 0.00 0.00 176.35 174.47 1yr3 s VAL 70 N 1.08 5.27 -0.08 1.68 1.01 0.14 -1.72 120.40 127.79 1yr3 s VAL 70 Ca -0.03 0.56 0.04 0.00 0.00 0.00 0.00 61.98 62.55 1yr3 s VAL 70 Cb -0.20 -3.65 -0.01 0.00 0.00 0.00 0.00 36.38 32.52 1yr3 s VAL 70 CO -0.05 0.32 -0.21 -0.76 0.00 0.00 0.00 175.10 174.40 1yr3 s LEU 71 N 0.96 2.30 0.00 3.92 1.02 -0.27 0.55 118.68 127.16 1yr3 s LEU 71 Ca 0.16 -0.44 0.00 0.00 0.02 0.00 0.00 54.13 53.87 1yr3 s LEU 71 Cb -0.14 -1.45 0.00 0.00 0.02 0.00 0.00 46.19 44.62 1yr3 s LEU 71 CO 0.06 0.23 0.00 0.61 0.02 0.00 0.00 176.35 177.27 1yr3 n GLY 72 N 3.04 -0.77 3.32 -3.19 0.00 -0.46 -0.93 105.19 106.20 1yr3 n GLY 72 Ca -0.18 -0.33 -0.28 0.00 0.00 0.00 0.00 46.02 45.23 1yr3 n GLY 72 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1yr3 s HIS 73 N -4.00 2.13 -0.11 1.61 3.76 -0.58 0.62 115.29 118.73 1yr3 s HIS 73 Ca 0.00 -0.40 -0.04 0.00 -0.15 0.00 0.00 55.06 54.48 1yr3 s HIS 73 Cb 0.00 -1.25 0.05 0.00 1.11 0.00 0.00 32.58 32.50 1yr3 s HIS 73 CO 0.00 0.16 0.16 -1.17 -0.85 0.00 0.00 174.74 173.03 1yr3 s LEU 74 N -1.41 -0.02 -1.43 0.89 2.96 -0.21 0.18 118.68 119.64 1yr3 s LEU 74 Ca 0.10 0.13 -0.07 0.00 -0.22 0.00 0.00 54.13 54.07 1yr3 s LEU 74 Cb -0.10 0.21 0.01 0.00 0.50 0.00 0.00 46.19 46.81 1yr3 s LEU 74 CO 0.03 -0.27 0.95 0.00 -1.32 0.00 0.00 176.35 175.74 1yr3 n GLN 75 N 5.32 -6.73 -1.75 1.98 1.13 -1.26 -0.90 117.38 115.16 1yr3 n GLN 75 Ca -0.05 0.86 -0.17 0.00 -1.94 0.00 0.00 57.00 55.70 1yr3 n GLN 75 Cb 0.50 -5.81 -0.05 0.00 0.11 0.00 0.00 30.24 24.98 1yr3 n GLN 75 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1yr3 n GLY 76 N -1.82 1.05 3.30 1.08 0.00 -1.26 -4.83 105.19 102.71 1yr3 n GLY 76 Ca -0.04 -0.20 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 1yr3 n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yr3 s VAL 77 N -2.70 2.83 0.23 1.61 1.01 -0.08 -5.07 120.40 118.24 1yr3 s VAL 77 Ca 0.00 -0.72 -0.31 0.00 0.00 0.00 0.00 61.98 60.95 1yr3 s VAL 77 Cb 0.00 -2.20 -0.11 0.00 0.00 0.00 0.00 36.38 34.07 1yr3 s VAL 77 CO 0.00 0.51 1.62 -2.16 0.00 0.00 0.00 175.10 175.07 1yr3 s PRO 78 N 0.73 4.16 -0.05 2.72 0.04 -1.26 -1.04 135.00 140.30 1yr3 s PRO 78 Ca -0.06 2.51 -0.05 0.00 0.04 0.00 0.00 61.00 63.44 1yr3 s PRO 78 Cb -0.15 -3.08 0.01 0.00 0.04 0.00 0.00 34.50 31.32 1yr3 s PRO 78 CO 0.01 -0.65 0.14 0.08 0.04 0.00 0.00 177.00 176.63 1yr3 s VAL 79 N 0.66 0.01 -0.26 -0.36 1.01 0.20 -1.28 120.40 120.39 1yr3 s VAL 79 Ca 0.68 -0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.54 1yr3 s VAL 79 Cb -0.47 -0.24 0.03 0.00 0.00 0.00 0.00 36.38 35.70 1yr3 s VAL 79 CO 0.38 -0.06 -0.06 0.54 0.00 0.00 0.00 175.10 175.91 1yr3 s VAL 80 N -0.14 2.84 -0.18 2.92 0.11 -0.88 -1.36 120.40 123.72 1yr3 s VAL 80 Ca -0.02 -1.11 -0.02 0.00 -2.93 0.00 0.00 61.98 57.89 1yr3 s VAL 80 Cb -0.02 -2.48 -0.01 0.00 -1.53 0.00 0.00 36.38 32.33 1yr3 s VAL 80 CO 0.00 0.14 -0.07 0.00 -3.33 0.00 0.00 175.10 171.84 1yr3 s MET 82 N 0.86 3.14 -0.75 0.00 -1.94 0.28 0.28 119.30 121.16 1yr3 s MET 82 Ca -0.02 -0.85 -0.24 0.00 -1.71 0.00 0.00 55.69 52.87 1yr3 s MET 82 Cb -0.15 -4.11 0.06 0.00 2.01 0.00 0.00 34.83 32.64 1yr3 s MET 82 CO 0.01 -1.31 1.15 0.15 -0.01 0.00 0.00 175.02 175.01 1yr3 s LYS 83 N 2.85 3.24 0.00 2.03 1.02 -0.46 0.05 119.74 128.47 1yr3 s LYS 83 Ca 0.17 -0.72 0.00 0.00 0.02 0.00 0.00 55.97 55.43 1yr3 s LYS 83 Cb -0.19 -4.39 0.00 0.00 -0.52 0.00 0.00 37.83 32.73 1yr3 s LYS 83 CO 0.12 -1.98 0.00 0.41 -0.92 0.00 0.00 175.35 172.98 1yr3 n GLY 84 N 5.53 2.40 1.11 -3.33 0.00 -0.07 -2.46 105.19 108.37 1yr3 n GLY 84 Ca 0.05 -1.49 -0.10 0.00 0.00 0.00 0.00 46.02 44.49 1yr3 n GLY 84 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1yr3 n ARG 85 N 1.80 1.57 -4.96 1.61 1.85 -1.26 -4.82 116.66 112.45 1yr3 n ARG 85 Ca 0.00 -1.11 -0.29 0.00 -1.00 0.00 0.00 57.85 55.45 1yr3 n ARG 85 Cb 0.00 0.27 -0.15 0.00 -1.05 0.00 0.00 32.46 31.53 1yr3 n ARG 85 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1yr3 s GLY 86 N -1.92 1.29 0.38 2.89 0.00 -1.26 -4.86 107.32 103.84 1yr3 s GLY 86 Ca 0.01 -1.16 0.08 0.00 0.00 0.00 0.00 44.72 43.65 1yr3 s GLY 86 CO 0.01 -1.04 0.02 0.30 0.00 0.00 0.00 173.10 172.39 1yr3 s HIS 87 N -0.73 2.52 -0.00 1.90 0.09 -1.26 -4.74 115.29 113.07 1yr3 s HIS 87 Ca 0.10 -0.55 -0.25 0.00 -0.00 0.00 0.00 55.06 54.36 1yr3 s HIS 87 Cb -0.10 -1.64 -0.19 0.00 -0.00 0.00 0.00 32.58 30.66 1yr3 s HIS 87 CO 0.01 0.44 1.33 0.35 -0.00 0.00 0.00 174.74 176.87 1yr3 h PHE 88 N 1.77 -0.05 0.00 1.40 3.57 -1.85 -2.96 116.94 118.83 1yr3 h PHE 88 Ca -0.43 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.07 1yr3 h PHE 88 Cb 1.25 0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.00 1yr3 h PHE 88 CO 0.71 0.34 0.08 2.48 -2.23 0.00 0.00 178.31 179.69 1yr3 n TYR 89 N -4.93 0.00 0.74 0.41 0.18 -1.24 -0.57 117.16 111.75 1yr3 n TYR 89 Ca -0.08 0.00 0.13 0.00 1.88 0.00 0.00 57.90 59.82 1yr3 n TYR 89 Cb 0.22 -0.12 0.49 0.00 -0.38 0.00 0.00 39.34 39.55 1yr3 n TYR 89 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 1yr3 n GLU 90 N -1.00 0.13 -1.07 -3.48 1.02 -1.12 -4.77 120.64 110.35 1yr3 n GLU 90 Ca 0.00 0.15 0.00 0.00 -0.02 0.00 0.00 57.16 57.29 1yr3 n GLU 90 Cb 0.08 -1.66 0.00 0.00 -0.02 0.00 0.00 31.44 29.84 1yr3 n GLU 90 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1yr3 n GLY 91 N 1.12 0.68 0.21 0.62 0.00 0.26 -4.97 105.19 103.12 1yr3 n GLY 91 Ca 0.06 -0.72 0.04 0.00 0.00 0.00 0.00 46.02 45.40 1yr3 n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yr3 n ARG 92 N -1.89 2.58 0.00 1.61 1.74 -1.26 -5.11 116.66 114.33 1yr3 n ARG 92 Ca 0.00 -1.96 0.00 0.00 -0.77 0.00 0.00 57.85 55.12 1yr3 n ARG 92 Cb 0.17 -1.24 0.00 0.00 -1.02 0.00 0.00 32.46 30.38 1yr3 n ARG 92 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yr3 n GLY 93 N -0.53 -1.12 0.00 -0.13 0.00 -1.26 -4.41 105.19 97.74 1yr3 n GLY 93 Ca 0.08 -1.62 0.02 0.00 0.00 0.00 0.00 46.02 44.49 1yr3 n GLY 93 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1yr3 n MET 94 N -1.20 0.01 -0.03 1.61 2.81 -1.26 -2.37 117.12 116.69 1yr3 n MET 94 Ca 0.00 0.41 0.12 0.00 -1.81 0.00 0.00 57.70 56.42 1yr3 n MET 94 Cb 0.00 -1.50 0.52 0.00 -0.71 0.00 0.00 33.22 31.53 1yr3 n MET 94 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1yr3 n THR 95 N -1.47 0.08 -0.03 2.03 -2.24 -1.26 -4.36 114.28 107.04 1yr3 n THR 95 Ca 0.01 -0.23 0.22 0.00 -2.27 0.00 0.00 64.05 61.78 1yr3 n THR 95 Cb 0.04 0.24 0.70 0.00 -2.10 0.00 0.00 70.33 69.20 1yr3 n THR 95 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1yr3 h ILE 96 N 1.73 0.70 0.00 2.28 2.10 -1.68 -2.42 117.51 120.23 1yr3 h ILE 96 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1yr3 h ILE 96 Cb 0.37 0.71 0.00 0.00 -1.09 0.00 0.00 36.82 36.81 1yr3 h ILE 96 CO 0.00 0.00 -1.21 0.23 -1.08 0.00 0.00 178.15 176.09 1yr3 n MET 97 N -4.35 0.63 0.06 2.19 2.81 -1.26 -4.61 117.12 112.59 1yr3 n MET 97 Ca 0.11 -0.05 -0.13 0.00 -1.81 0.00 0.00 57.70 55.82 1yr3 n MET 97 Cb 0.66 -1.43 -0.08 0.00 -0.71 0.00 0.00 33.22 31.67 1yr3 n MET 97 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 1yr3 h THR 98 N 0.00 0.00 -0.96 2.03 2.02 -1.72 -0.88 112.91 113.41 1yr3 h THR 98 Ca 0.00 0.00 0.20 0.00 0.77 0.00 0.00 66.41 67.38 1yr3 h THR 98 Cb 0.59 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.92 1yr3 h THR 98 CO 0.00 0.00 0.61 0.44 0.37 0.00 0.00 175.52 176.94 1yr3 h ASP 99 N -0.55 0.59 0.61 4.18 3.32 -1.85 0.54 116.42 123.25 1yr3 h ASP 99 Ca 0.00 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 1yr3 h ASP 99 Cb 0.58 -0.04 0.01 0.00 0.22 0.00 0.00 39.33 40.09 1yr3 h ASP 99 CO -0.25 0.23 -0.29 0.00 -1.72 0.00 0.00 179.24 177.20 1yr3 h ALA 100 N 1.62 -0.82 -0.69 3.45 0.00 -1.63 0.71 119.26 121.90 1yr3 h ALA 100 Ca 0.52 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 55.29 1yr3 h ALA 100 Cb 1.04 0.32 -0.05 0.00 0.00 0.00 0.00 17.79 19.09 1yr3 h ALA 100 CO -0.27 -0.95 0.41 0.82 0.00 0.00 0.00 179.25 179.27 1yr3 h ILE 101 N -0.84 1.03 -0.05 0.00 5.03 0.27 0.25 117.51 123.20 1yr3 h ILE 101 Ca -0.08 -0.27 0.02 0.00 -0.12 0.00 0.00 64.86 64.40 1yr3 h ILE 101 Cb 0.63 0.18 -0.00 0.00 -3.03 0.00 0.00 36.82 34.60 1yr3 h ILE 101 CO 0.14 0.14 0.05 0.03 -0.68 0.00 0.00 178.15 177.83 1yr3 h ARG 102 N 0.78 0.00 -0.06 2.37 3.08 0.37 -0.46 114.38 120.47 1yr3 h ARG 102 Ca 0.29 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.31 1yr3 h ARG 102 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 1yr3 h ARG 102 CO -0.14 0.00 -0.11 1.15 -1.07 0.00 0.00 179.97 179.79 1yr3 h THR 103 N 0.00 1.42 -0.48 2.04 2.02 0.12 -2.48 112.91 115.55 1yr3 h THR 103 Ca 0.03 -1.41 0.10 0.00 0.77 0.00 0.00 66.41 65.89 1yr3 h THR 103 Cb 0.13 2.21 -0.09 0.00 -1.74 0.00 0.00 68.15 68.65 1yr3 h THR 103 CO -0.00 0.39 -0.12 -0.26 0.37 0.00 0.00 175.52 175.90 1yr3 h PHE 104 N -0.31 -0.26 -0.29 3.16 0.04 -0.51 0.16 116.94 118.92 1yr3 h PHE 104 Ca 0.00 0.04 0.07 0.00 2.80 0.00 0.00 57.97 60.88 1yr3 h PHE 104 Cb 0.68 0.19 -0.07 0.00 2.20 0.00 0.00 35.95 38.96 1yr3 h PHE 104 CO 0.11 -0.21 -0.14 -0.22 -0.60 0.00 0.00 178.31 177.25 1yr3 h LYS 105 N -0.00 -0.10 -0.66 1.51 1.63 -1.20 -2.11 116.57 115.63 1yr3 h LYS 105 Ca 0.23 0.01 -0.05 0.00 -0.85 0.00 0.00 60.65 59.99 1yr3 h LYS 105 Cb 0.35 0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.98 1yr3 h LYS 105 CO -0.50 -0.06 0.23 -0.07 -3.45 0.00 0.00 179.45 175.59 1yr3 h LEU 106 N -0.10 0.94 -1.81 5.20 3.38 -0.78 -2.04 115.31 120.11 1yr3 h LEU 106 Ca 0.15 -0.20 0.07 0.00 0.09 0.00 0.00 57.88 58.00 1yr3 h LEU 106 Cb 0.33 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1yr3 h LEU 106 CO -0.36 0.89 0.48 -0.07 0.09 0.00 0.00 178.44 179.47 1yr3 h LEU 107 N 0.95 0.00 0.00 1.67 3.38 -0.04 -3.44 115.31 117.82 1yr3 h LEU 107 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1yr3 h LEU 107 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1yr3 h LEU 107 CO -0.01 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.13 1yr3 n GLY 108 N -1.39 0.74 3.51 0.83 0.00 -0.77 -4.33 105.19 103.78 1yr3 n GLY 108 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1yr3 n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yr3 n GLU 110 N 0.26 2.18 -3.56 0.00 0.28 0.20 -4.79 120.64 115.21 1yr3 n GLU 110 Ca 0.11 -0.53 -0.14 0.00 -0.16 0.00 0.00 57.16 56.45 1yr3 n GLU 110 Cb 0.41 -1.14 -0.06 0.00 1.43 0.00 0.00 31.44 32.08 1yr3 n GLU 110 CO 0.00 0.00 0.00 -0.48 -0.16 0.00 0.00 177.13 176.49 1yr3 s LEU 111 N -1.99 -0.52 -0.22 -1.84 0.05 -1.06 -4.17 118.68 108.93 1yr3 s LEU 111 Ca 0.09 0.61 -0.05 0.00 0.05 0.00 0.00 54.13 54.82 1yr3 s LEU 111 Cb 0.10 2.19 -0.02 0.00 -2.05 0.00 0.00 46.19 46.41 1yr3 s LEU 111 CO 0.36 -0.45 0.01 -0.22 -0.55 0.00 0.00 176.35 175.50 1yr3 s LEU 112 N -1.02 3.19 -0.60 1.48 2.96 0.40 -1.18 118.68 123.91 1yr3 s LEU 112 Ca -0.06 -0.26 -0.12 0.00 -0.22 0.00 0.00 54.13 53.47 1yr3 s LEU 112 Cb -0.01 -1.82 0.15 0.00 0.50 0.00 0.00 46.19 45.01 1yr3 s LEU 112 CO 0.05 0.01 0.51 0.12 -1.32 0.00 0.00 176.35 175.72 1yr3 s PHE 113 N 1.32 3.46 -0.24 5.38 5.99 0.60 -0.66 117.98 133.83 1yr3 s PHE 113 Ca 0.04 -1.84 -0.19 0.00 0.00 0.00 0.00 56.93 54.94 1yr3 s PHE 113 Cb -0.15 -3.63 -0.03 0.00 0.00 0.00 0.00 43.02 39.21 1yr3 s PHE 113 CO 0.01 -0.98 0.56 0.00 -0.00 0.00 0.00 175.22 174.80 1yr3 s THR 115 N 2.14 3.27 -0.24 0.00 -4.23 -1.09 -1.22 115.64 114.28 1yr3 s THR 115 Ca 0.24 -1.91 -0.29 0.00 -1.18 0.00 0.00 61.69 58.55 1yr3 s THR 115 Cb -0.16 -2.71 0.16 0.00 1.34 0.00 0.00 72.50 71.14 1yr3 s THR 115 CO 0.09 -0.31 1.20 0.54 -0.54 0.00 0.00 174.62 175.60 1yr3 s ASN 116 N -3.45 -0.19 0.01 3.99 4.22 -1.14 -4.17 114.94 114.21 1yr3 s ASN 116 Ca 0.30 0.23 -0.23 0.00 -2.14 0.00 0.00 52.86 51.02 1yr3 s ASN 116 Cb -0.07 0.19 -0.05 0.00 1.28 0.00 0.00 41.25 42.60 1yr3 s ASN 116 CO 0.18 -0.16 0.70 0.00 -2.04 0.00 0.00 177.10 175.78 1yr3 s ALA 117 N -0.91 3.40 0.27 3.54 0.00 -1.26 -0.76 121.76 126.04 1yr3 s ALA 117 Ca 0.04 0.18 0.06 0.00 0.00 0.00 0.00 51.96 52.24 1yr3 s ALA 117 Cb -0.01 -2.91 -0.02 0.00 0.00 0.00 0.00 23.12 20.17 1yr3 s ALA 117 CO -0.05 0.07 0.24 0.00 0.00 0.00 0.00 175.76 176.03 1yr3 n ALA 118 N 2.91 0.54 -2.61 0.00 0.00 -0.82 -4.78 120.51 115.74 1yr3 n ALA 118 Ca -0.04 -1.56 -0.29 0.00 0.00 0.00 0.00 53.44 51.55 1yr3 n ALA 118 Cb 0.51 1.27 -0.09 0.00 0.00 0.00 0.00 19.45 21.13 1yr3 n ALA 118 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1yr3 s GLY 119 N -2.88 1.81 0.08 0.00 0.00 -0.31 -0.80 107.32 105.23 1yr3 s GLY 119 Ca 0.32 -1.25 -0.11 0.00 0.00 0.00 0.00 44.72 43.68 1yr3 s GLY 119 CO 0.23 -1.23 0.43 -0.45 0.00 0.00 0.00 173.10 172.07 1yr3 s SER 120 N -2.37 6.69 0.00 1.64 0.15 -0.36 -1.67 113.70 117.79 1yr3 s SER 120 Ca 0.23 0.86 0.12 0.00 0.70 0.00 0.00 55.95 57.86 1yr3 s SER 120 Cb -0.11 -2.20 0.18 0.00 -1.71 0.00 0.00 66.02 62.18 1yr3 s SER 120 CO 0.16 0.18 1.03 0.18 1.20 0.00 0.00 173.24 175.99 1yr3 n LEU 121 N 1.01 2.37 -4.17 3.45 4.77 0.14 -0.01 117.00 124.57 1yr3 n LEU 121 Ca -0.08 -1.38 -0.33 0.00 -0.03 0.00 0.00 56.01 54.19 1yr3 n LEU 121 Cb 0.52 -0.09 -0.16 0.00 -2.33 0.00 0.00 43.42 41.35 1yr3 n LEU 121 CO 0.42 0.52 -0.54 -0.13 -1.33 0.00 0.00 177.39 176.33 1yr3 s ARG 122 N -1.00 3.03 0.52 3.23 0.52 -1.25 -4.92 118.95 119.09 1yr3 s ARG 122 Ca 0.18 -0.84 0.23 0.00 -0.52 0.00 0.00 55.73 54.78 1yr3 s ARG 122 Cb 0.11 -2.48 1.42 0.00 0.52 0.00 0.00 34.95 34.52 1yr3 s ARG 122 CO 0.16 -0.05 2.12 -1.35 0.02 0.00 0.00 175.30 176.20 1yr3 h PRO 123 N 7.44 0.00 -0.96 3.54 0.11 -1.96 -2.19 132.00 137.98 1yr3 h PRO 123 Ca -0.35 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.77 1yr3 h PRO 123 Cb 1.18 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.24 1yr3 h PRO 123 CO 0.57 0.08 0.63 1.05 -0.21 0.00 0.00 178.00 180.12 1yr3 h GLU 124 N 0.00 1.25 -4.99 1.05 4.11 -2.01 -3.40 114.58 110.60 1yr3 h GLU 124 Ca -0.00 -0.08 -0.63 0.00 0.07 0.00 0.00 59.36 58.72 1yr3 h GLU 124 Cb 0.17 -0.28 -0.16 0.00 0.50 0.00 0.00 28.75 28.98 1yr3 h GLU 124 CO 0.01 0.83 -0.48 0.08 0.07 0.00 0.00 179.01 179.52 1yr3 s VAL 125 N -6.12 5.30 0.10 -1.06 1.01 -0.82 -5.08 120.40 113.73 1yr3 s VAL 125 Ca -0.13 0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.09 1yr3 s VAL 125 Cb 0.18 -3.55 0.01 0.00 0.00 0.00 0.00 36.38 33.01 1yr3 s VAL 125 CO 0.81 0.26 0.04 0.61 0.00 0.00 0.00 175.10 176.83 1yr3 n GLY 126 N 4.80 3.48 3.66 4.51 0.00 -1.26 -4.64 105.19 115.74 1yr3 n GLY 126 Ca -0.13 -2.22 -0.45 0.00 0.00 0.00 0.00 46.02 43.22 1yr3 n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yr3 n ALA 127 N -2.74 0.91 -0.10 4.61 0.00 -1.26 -2.09 120.51 119.84 1yr3 n ALA 127 Ca -0.04 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1yr3 n ALA 127 Cb 0.12 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.34 1yr3 n ALA 127 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yr3 n GLY 128 N 1.84 0.70 3.88 0.00 0.00 -0.39 -4.96 105.19 106.26 1yr3 n GLY 128 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 1yr3 n GLY 128 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yr3 s SER 129 N -2.70 6.40 -0.03 1.61 0.01 -0.89 -4.15 113.70 113.96 1yr3 s SER 129 Ca 0.00 1.22 0.03 0.00 1.31 0.00 0.00 55.95 58.51 1yr3 s SER 129 Cb 0.00 -2.37 -0.03 0.00 0.21 0.00 0.00 66.02 63.83 1yr3 s SER 129 CO 0.00 -0.59 -0.11 -0.76 0.41 0.00 0.00 173.24 172.19 1yr3 s LEU 130 N -4.44 2.94 -0.06 2.44 1.43 -1.26 -0.85 118.68 118.87 1yr3 s LEU 130 Ca 0.52 -0.17 0.01 0.00 -1.03 0.00 0.00 54.13 53.46 1yr3 s LEU 130 Cb -0.10 -1.65 0.02 0.00 0.03 0.00 0.00 46.19 44.48 1yr3 s LEU 130 CO 0.40 0.32 -0.06 -0.69 0.23 0.00 0.00 176.35 176.56 1yr3 s VAL 131 N -0.85 0.69 -0.44 -1.59 1.01 -0.35 -3.78 120.40 115.09 1yr3 s VAL 131 Ca 0.14 -0.18 -0.22 0.00 0.00 0.00 0.00 61.98 61.72 1yr3 s VAL 131 Cb -0.11 -0.71 0.02 0.00 0.00 0.00 0.00 36.38 35.59 1yr3 s VAL 131 CO 0.03 0.27 0.71 0.00 0.00 0.00 0.00 175.10 176.11 1yr3 s ALA 132 N 1.10 3.32 0.31 5.51 0.00 -0.31 -0.35 121.76 131.35 1yr3 s ALA 132 Ca -0.08 -1.12 -0.29 0.00 0.00 0.00 0.00 51.96 50.47 1yr3 s ALA 132 Cb -0.14 -3.38 -0.10 0.00 0.00 0.00 0.00 23.12 19.50 1yr3 s ALA 132 CO -0.01 -1.85 1.30 -0.51 0.00 0.00 0.00 175.76 174.69 1yr3 s LEU 133 N 3.03 4.43 0.00 0.00 1.43 -0.74 -2.30 118.68 124.54 1yr3 s LEU 133 Ca 0.26 2.63 0.05 0.00 -1.03 0.00 0.00 54.13 56.04 1yr3 s LEU 133 Cb -0.13 -3.64 0.02 0.00 0.03 0.00 0.00 46.19 42.47 1yr3 s LEU 133 CO 0.21 -0.51 0.57 2.29 0.23 0.00 0.00 176.35 179.14 1yr3 n LYS 134 N 1.06 0.64 0.00 1.70 2.85 -0.33 -4.62 118.16 119.46 1yr3 n LYS 134 Ca 0.01 -0.65 0.00 0.00 -1.05 0.00 0.00 58.31 56.61 1yr3 n LYS 134 Cb 0.42 -1.03 0.00 0.00 -0.65 0.00 0.00 35.03 33.77 1yr3 n LYS 134 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1yr3 n ASP 135 N 0.04 0.00 -3.92 -5.58 -0.08 -1.26 -4.61 116.55 101.14 1yr3 n ASP 135 Ca 0.02 0.00 -0.09 0.00 -1.51 0.00 0.00 54.79 53.21 1yr3 n ASP 135 Cb 0.11 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 43.50 1yr3 n ASP 135 CO 0.00 0.00 0.00 -1.38 0.12 0.00 0.00 177.20 175.94 1yr3 s HIS 136 N -2.00 0.30 -0.27 -0.67 -3.43 -1.26 -0.96 115.29 107.01 1yr3 s HIS 136 Ca 0.00 -0.70 0.02 0.00 -0.80 0.00 0.00 55.06 53.58 1yr3 s HIS 136 Cb 0.00 -0.08 0.07 0.00 -1.43 0.00 0.00 32.58 31.14 1yr3 s HIS 136 CO 0.00 -0.63 -0.04 0.42 -2.00 0.00 0.00 174.74 172.50 1yr3 s ILE 137 N -3.92 1.80 0.16 -5.38 1.01 0.88 -4.90 121.20 110.86 1yr3 s ILE 137 Ca 0.12 -1.57 -0.30 0.00 0.00 0.00 0.00 60.65 58.89 1yr3 s ILE 137 Cb 0.04 -2.10 -0.07 0.00 0.01 0.00 0.00 42.46 40.34 1yr3 s ILE 137 CO -0.05 -0.23 1.17 0.21 0.00 0.00 0.00 174.94 176.04 1yr3 s ASN 138 N 1.23 7.14 0.00 3.58 2.47 -1.26 -1.87 114.94 126.23 1yr3 s ASN 138 Ca -0.02 2.15 0.00 0.00 0.42 0.00 0.00 52.86 55.41 1yr3 s ASN 138 Cb -0.19 -2.60 0.00 0.00 -1.45 0.00 0.00 41.25 37.01 1yr3 s ASN 138 CO -0.08 -0.35 0.00 0.41 -3.72 0.00 0.00 177.10 173.36 1yr3 n THR 139 N 2.75 0.00 -2.12 -5.21 -1.04 -1.16 -4.89 114.28 102.62 1yr3 n THR 139 Ca 0.05 -0.31 -0.36 0.00 -2.04 0.00 0.00 64.05 61.39 1yr3 n THR 139 Cb 0.45 0.88 0.02 0.00 -1.82 0.00 0.00 70.33 69.86 1yr3 n THR 139 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 1yr3 s MET 140 N -0.95 3.13 -0.02 -2.82 -1.94 -1.26 -4.74 119.30 110.71 1yr3 s MET 140 Ca 0.00 1.74 -0.30 0.00 -1.71 0.00 0.00 55.69 55.42 1yr3 s MET 140 Cb 0.00 -1.96 -0.05 0.00 2.01 0.00 0.00 34.83 34.83 1yr3 s MET 140 CO 0.00 -1.05 1.44 -1.25 -0.01 0.00 0.00 175.02 174.14 1yr3 s PRO 141 N -3.31 4.26 1.08 2.03 0.04 -1.26 -4.82 135.00 133.01 1yr3 s PRO 141 Ca 0.75 1.98 0.00 0.00 0.04 0.00 0.00 61.00 63.78 1yr3 s PRO 141 Cb -0.28 -3.66 0.00 0.00 0.04 0.00 0.00 34.50 30.60 1yr3 s PRO 141 CO 0.30 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 177.11 1yr3 n GLY 142 N 3.73 -2.05 3.14 0.56 0.00 -1.26 -4.85 105.19 104.46 1yr3 n GLY 142 Ca 0.14 -1.41 -0.08 0.00 0.00 0.00 0.00 46.02 44.67 1yr3 n GLY 142 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1yr3 s THR 143 N 0.00 0.18 0.32 2.61 -4.23 -1.26 -5.00 115.64 108.26 1yr3 s THR 143 Ca 0.00 -1.66 0.02 0.00 -1.18 0.00 0.00 61.69 58.87 1yr3 s THR 143 Cb 0.00 -1.57 0.28 0.00 1.34 0.00 0.00 72.50 72.55 1yr3 s THR 143 CO 0.00 -0.81 1.93 -0.65 -0.54 0.00 0.00 174.62 174.55 1yr3 h PRO 144 N 2.99 0.91 -0.01 3.99 0.11 -1.90 -2.83 132.00 135.27 1yr3 h PRO 144 Ca -0.34 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1yr3 h PRO 144 Cb 1.17 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1yr3 h PRO 144 CO 0.62 0.60 -0.08 -1.33 -0.21 0.00 0.00 178.00 177.61 1yr3 n MET 145 N -4.48 1.26 -1.67 1.05 2.81 -1.26 -4.61 117.12 110.22 1yr3 n MET 145 Ca 0.12 -0.65 -0.47 0.00 -1.81 0.00 0.00 57.70 54.90 1yr3 n MET 145 Cb 0.20 -1.49 -0.04 0.00 -0.71 0.00 0.00 33.22 31.18 1yr3 n MET 145 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1yr3 n VAL 146 N -0.30 0.29 0.00 2.03 0.31 -1.07 -4.66 118.33 114.93 1yr3 n VAL 146 Ca 0.17 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 1yr3 n VAL 146 Cb 0.32 -1.72 0.00 0.00 -0.91 0.00 0.00 33.84 31.53 1yr3 n VAL 146 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1yr3 n GLY 147 N 3.91 0.55 3.78 2.92 0.00 -1.26 -5.02 105.19 110.06 1yr3 n GLY 147 Ca 0.20 -2.15 -0.41 0.00 0.00 0.00 0.00 46.02 43.66 1yr3 n GLY 147 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yr3 s LEU 148 N 0.00 4.33 0.14 0.99 1.43 -1.26 -4.96 118.68 119.35 1yr3 s LEU 148 Ca 0.00 3.02 -0.21 0.00 -1.03 0.00 0.00 54.13 55.91 1yr3 s LEU 148 Cb 0.00 -3.67 -0.07 0.00 0.03 0.00 0.00 46.19 42.48 1yr3 s LEU 148 CO 0.00 -0.85 0.67 0.21 0.23 0.00 0.00 176.35 176.61 1yr3 s ASN 149 N -0.16 7.16 -0.99 2.29 2.47 -1.26 -5.01 114.94 119.43 1yr3 s ASN 149 Ca 0.53 1.41 -0.15 0.00 0.42 0.00 0.00 52.86 55.07 1yr3 s ASN 149 Cb -0.46 -2.41 0.19 0.00 -1.45 0.00 0.00 41.25 37.12 1yr3 s ASN 149 CO 0.62 0.19 1.08 -0.62 -3.72 0.00 0.00 177.10 174.66 1yr3 s ASP 150 N -1.27 6.89 0.55 -4.21 -1.08 -1.26 -4.88 116.67 111.41 1yr3 s ASP 150 Ca 0.35 -2.73 0.46 0.00 -0.52 0.00 0.00 52.55 50.11 1yr3 s ASP 150 Cb -0.20 -2.31 1.56 0.00 -1.46 0.00 0.00 42.92 40.52 1yr3 s ASP 150 CO 0.22 -0.71 1.47 0.47 0.52 0.00 0.00 175.17 177.14 1yr3 n ASP 151 N 4.88 0.00 -0.13 -0.34 8.00 -1.26 -0.31 116.55 127.40 1yr3 n ASP 151 Ca 0.24 0.93 0.02 0.00 0.71 0.00 0.00 54.79 56.68 1yr3 n ASP 151 Cb 0.45 -0.45 0.31 0.00 -0.02 0.00 0.00 41.12 41.42 1yr3 n ASP 151 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1yr3 h ARG 152 N 0.00 0.80 0.00 -1.24 3.08 -2.03 -3.32 114.38 111.67 1yr3 h ARG 152 Ca 0.85 -0.06 -0.33 0.00 0.07 0.00 0.00 59.98 60.52 1yr3 h ARG 152 Cb 3.55 -0.18 -0.06 0.00 0.08 0.00 0.00 29.97 33.37 1yr3 h ARG 152 CO -0.01 0.54 -2.23 1.19 -1.07 0.00 0.00 179.97 178.39 1yr3 n PHE 153 N -4.43 0.00 -3.12 3.04 3.72 0.58 -5.10 117.46 112.15 1yr3 n PHE 153 Ca 0.06 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.46 1yr3 n PHE 153 Cb 0.05 -0.85 0.00 0.00 -0.94 0.00 0.00 39.48 37.74 1yr3 n PHE 153 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1yr3 n GLY 154 N 2.26 2.16 3.99 1.37 0.00 -1.11 -4.08 105.19 109.79 1yr3 n GLY 154 Ca -0.35 -1.08 -0.19 0.00 0.00 0.00 0.00 46.02 44.40 1yr3 n GLY 154 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yr3 s GLU 155 N -2.01 3.12 0.16 1.61 2.02 -1.26 -4.06 118.70 118.29 1yr3 s GLU 155 Ca 0.01 -1.01 -0.16 0.00 0.02 0.00 0.00 54.97 53.82 1yr3 s GLU 155 Cb -0.00 -2.82 0.07 0.00 0.10 0.00 0.00 34.13 31.48 1yr3 s GLU 155 CO 0.00 0.07 1.72 -0.09 0.02 0.00 0.00 175.26 176.99 1yr3 h ARG 156 N 0.90 0.17 -6.44 1.61 9.65 -1.97 -3.42 114.38 114.87 1yr3 h ARG 156 Ca -0.46 -0.01 -0.69 0.00 -1.10 0.00 0.00 59.98 57.72 1yr3 h ARG 156 Cb 1.26 -0.04 -0.26 0.00 -1.39 0.00 0.00 29.97 29.54 1yr3 h ARG 156 CO 0.53 0.11 -0.82 -0.06 2.80 0.00 0.00 179.97 182.53 1yr3 s PHE 157 N -6.17 2.55 -0.02 2.20 0.08 -1.26 -5.05 117.98 110.31 1yr3 s PHE 157 Ca -0.13 -0.28 -0.10 0.00 0.12 0.00 0.00 56.93 56.54 1yr3 s PHE 157 Cb 0.13 -1.57 0.01 0.00 -0.57 0.00 0.00 43.02 41.01 1yr3 s PHE 157 CO 0.71 0.09 0.21 -0.59 -0.10 0.00 0.00 175.22 175.54 1yr3 s PHE 158 N -0.68 -0.08 0.10 0.36 -0.12 -1.26 -5.15 117.98 111.15 1yr3 s PHE 158 Ca 0.11 0.12 -0.24 0.00 -0.05 0.00 0.00 56.93 56.87 1yr3 s PHE 158 Cb -0.10 0.02 -0.07 0.00 -0.63 0.00 0.00 43.02 42.24 1yr3 s PHE 158 CO -0.00 -0.30 0.73 0.45 -0.05 0.00 0.00 175.22 176.05 1yr3 s SER 159 N -1.12 7.25 -0.09 1.98 0.15 -1.26 -4.96 113.70 115.66 1yr3 s SER 159 Ca -0.12 1.49 0.19 0.00 0.70 0.00 0.00 55.95 58.21 1yr3 s SER 159 Cb -0.06 -2.46 0.71 0.00 -1.71 0.00 0.00 66.02 62.50 1yr3 s SER 159 CO 0.02 0.15 1.61 0.18 1.20 0.00 0.00 173.24 176.41 1yr3 n LEU 160 N 2.06 4.58 -4.73 3.45 4.77 -1.26 -4.90 117.00 120.97 1yr3 n LEU 160 Ca -0.06 -2.31 -0.42 0.00 -0.03 0.00 0.00 56.01 53.20 1yr3 n LEU 160 Cb 0.50 -0.56 -0.03 0.00 -2.33 0.00 0.00 43.42 41.00 1yr3 n LEU 160 CO 0.45 0.85 1.15 0.00 -1.33 0.00 0.00 177.39 178.51 1yr3 s ALA 161 N -1.66 3.69 -1.46 -1.18 0.00 -1.26 -1.99 121.76 117.89 1yr3 s ALA 161 Ca 0.51 1.32 -0.08 0.00 0.00 0.00 0.00 51.96 53.71 1yr3 s ALA 161 Cb 0.31 -3.58 0.03 0.00 0.00 0.00 0.00 23.12 19.88 1yr3 s ALA 161 CO 0.27 -0.75 0.81 -1.71 0.00 0.00 0.00 175.76 174.38 1yr3 n ASN 162 N 3.18 -5.58 -0.08 0.00 5.15 -1.26 -4.88 115.26 111.79 1yr3 n ASN 162 Ca 0.10 -0.46 -0.07 0.00 -0.60 0.00 0.00 54.58 53.54 1yr3 n ASN 162 Cb 0.40 -4.47 -0.00 0.00 -0.53 0.00 0.00 39.78 35.17 1yr3 n ASN 162 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1yr3 h ALA 163 N 1.00 0.33 -2.12 5.20 0.00 -1.74 -3.17 119.26 118.75 1yr3 h ALA 163 Ca -0.54 0.03 -0.73 0.00 0.00 0.00 0.00 54.91 53.68 1yr3 h ALA 163 Cb 1.36 0.02 -0.20 0.00 0.00 0.00 0.00 17.79 18.96 1yr3 h ALA 163 CO 0.58 -0.31 0.74 0.71 0.00 0.00 0.00 179.25 180.98 1yr3 s TYR 164 N -6.17 3.40 -0.22 0.00 1.51 -1.26 -3.65 117.35 110.95 1yr3 s TYR 164 Ca -0.13 -1.73 -0.21 0.00 -1.01 0.00 0.00 57.07 53.99 1yr3 s TYR 164 Cb 0.11 -4.16 -0.09 0.00 -0.11 0.00 0.00 41.96 37.71 1yr3 s TYR 164 CO 0.70 -1.33 0.81 -3.47 -1.11 0.00 0.00 175.55 171.15 1yr3 n ASP 165 N 5.60 0.46 0.09 2.29 2.03 -0.60 -4.81 116.55 121.61 1yr3 n ASP 165 Ca 0.24 0.45 -0.01 0.00 0.52 0.00 0.00 54.79 55.98 1yr3 n ASP 165 Cb 0.47 -0.40 0.25 0.00 -0.72 0.00 0.00 41.12 40.72 1yr3 n ASP 165 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1yr3 h ALA 166 N 2.92 1.18 -0.10 -1.67 0.00 -1.90 -2.09 119.26 117.59 1yr3 h ALA 166 Ca -0.14 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.35 1yr3 h ALA 166 Cb 0.62 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1yr3 h ALA 166 CO 0.46 0.54 -0.13 1.49 0.00 0.00 0.00 179.25 181.61 1yr3 h GLU 167 N 0.22 0.28 -0.40 0.00 4.81 -1.98 -2.36 114.58 115.14 1yr3 h GLU 167 Ca 0.03 -0.16 -0.05 0.00 -0.13 0.00 0.00 59.36 59.05 1yr3 h GLU 167 Cb 0.72 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.10 1yr3 h GLU 167 CO 0.05 0.72 0.03 1.88 -0.73 0.00 0.00 179.01 180.96 1yr3 h TYR 168 N -0.15 0.64 -0.51 0.92 0.99 -1.92 -1.78 116.97 115.16 1yr3 h TYR 168 Ca 0.01 -0.07 -0.01 0.00 2.00 0.00 0.00 58.73 60.67 1yr3 h TYR 168 Cb 0.68 -0.19 -0.03 0.00 1.00 0.00 0.00 36.73 38.20 1yr3 h TYR 168 CO 0.10 0.60 0.27 0.00 -0.00 0.00 0.00 178.16 179.12 1yr3 h ARG 169 N 0.59 0.70 -0.54 4.88 3.08 -1.28 -1.48 114.38 120.33 1yr3 h ARG 169 Ca 0.13 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 1yr3 h ARG 169 Cb 0.33 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 1yr3 h ARG 169 CO 0.01 0.52 0.11 0.00 -1.07 0.00 0.00 179.97 179.55 1yr3 h ALA 170 N 1.59 1.19 -0.17 0.04 0.00 -0.77 -1.58 119.26 119.55 1yr3 h ALA 170 Ca 0.18 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1yr3 h ALA 170 Cb 0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1yr3 h ALA 170 CO -0.03 0.55 -0.41 -0.07 0.00 0.00 0.00 179.25 179.29 1yr3 h LEU 171 N 0.80 0.42 -0.93 0.00 4.07 -1.15 -2.28 115.31 116.24 1yr3 h LEU 171 Ca 0.17 -0.18 -0.02 0.00 0.08 0.00 0.00 57.88 57.93 1yr3 h LEU 171 Cb 0.32 -0.12 -0.04 0.00 1.08 0.00 0.00 40.66 41.90 1yr3 h LEU 171 CO 0.00 0.79 0.46 -0.07 -1.08 0.00 0.00 178.44 178.54 1yr3 h LEU 172 N 0.33 1.10 -0.07 1.67 4.07 -0.46 -1.67 115.31 120.27 1yr3 h LEU 172 Ca 0.03 -0.10 -0.00 0.00 0.08 0.00 0.00 57.88 57.88 1yr3 h LEU 172 Cb 0.87 -0.28 -0.00 0.00 1.08 0.00 0.00 40.66 42.32 1yr3 h LEU 172 CO 0.07 0.89 0.04 1.56 -1.08 0.00 0.00 178.44 179.92 1yr3 h GLN 173 N 1.22 0.10 0.35 1.13 1.08 -0.76 -1.70 115.11 116.52 1yr3 h GLN 173 Ca 0.30 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.49 1yr3 h GLN 173 Cb 0.05 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.43 1yr3 h GLN 173 CO -0.05 0.15 -0.44 0.87 -0.95 0.00 0.00 178.83 178.41 1yr3 h LYS 174 N 0.02 -0.80 -1.08 1.46 1.57 -1.17 -0.69 116.57 115.88 1yr3 h LYS 174 Ca 0.03 0.05 0.31 0.00 -1.87 0.00 0.00 60.65 59.17 1yr3 h LYS 174 Cb 0.08 0.18 -0.12 0.00 0.08 0.00 0.00 32.23 32.46 1yr3 h LYS 174 CO -0.00 -0.53 0.67 0.28 -0.57 0.00 0.00 179.45 179.29 1yr3 h VAL 175 N -0.83 0.40 -0.35 0.50 2.07 -1.21 0.21 116.25 117.04 1yr3 h VAL 175 Ca -0.03 -0.12 -0.14 0.00 0.82 0.00 0.00 66.70 67.23 1yr3 h VAL 175 Cb 0.76 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1yr3 h VAL 175 CO -0.12 0.06 -0.33 0.00 0.02 0.00 0.00 177.57 177.20 1yr3 h ALA 176 N 1.68 0.52 0.42 1.67 0.00 -0.26 -2.15 119.26 121.15 1yr3 h ALA 176 Ca 0.67 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1yr3 h ALA 176 Cb 1.69 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.37 1yr3 h ALA 176 CO -0.41 0.58 -0.20 0.87 0.00 0.00 0.00 179.25 180.08 1yr3 h LYS 177 N 0.65 -0.55 -0.92 0.00 1.57 0.73 -2.50 116.57 115.56 1yr3 h LYS 177 Ca 0.06 0.04 0.25 0.00 -1.87 0.00 0.00 60.65 59.13 1yr3 h LYS 177 Cb 0.92 0.12 -0.05 0.00 0.08 0.00 0.00 32.23 33.31 1yr3 h LYS 177 CO 0.08 -0.34 0.64 0.93 -0.57 0.00 0.00 179.45 180.19 1yr3 h GLU 178 N -0.61 0.12 -0.22 3.15 5.08 -1.04 -1.42 114.58 119.64 1yr3 h GLU 178 Ca -0.06 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1yr3 h GLU 178 Cb 0.46 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1yr3 h GLU 178 CO 0.10 0.08 0.00 0.39 -1.00 0.00 0.00 179.01 178.58 1yr3 n GLU 179 N -4.35 2.38 -2.59 2.33 -0.58 -0.81 -4.99 120.64 112.02 1yr3 n GLU 179 Ca 0.19 -2.05 -0.08 0.00 -0.42 0.00 0.00 57.16 54.81 1yr3 n GLU 179 Cb 0.90 -1.49 0.04 0.00 -0.57 0.00 0.00 31.44 30.32 1yr3 n GLU 179 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1yr3 n GLY 180 N 1.42 -0.51 3.60 0.62 0.00 -0.54 -5.06 105.19 104.72 1yr3 n GLY 180 Ca 0.17 0.27 -0.12 0.00 0.00 0.00 0.00 46.02 46.34 1yr3 n GLY 180 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1yr3 s PHE 181 N -3.20 -0.51 0.37 1.61 -0.12 -1.11 -5.08 117.98 109.94 1yr3 s PHE 181 Ca 0.23 1.07 -0.25 0.00 -0.05 0.00 0.00 56.93 57.93 1yr3 s PHE 181 Cb -0.03 0.39 -0.09 0.00 -0.63 0.00 0.00 43.02 42.66 1yr3 s PHE 181 CO 0.47 -0.35 1.04 -2.14 -0.05 0.00 0.00 175.22 174.19 1yr3 s PRO 182 N -0.45 4.32 -0.51 1.99 0.02 -1.26 -4.41 135.00 134.69 1yr3 s PRO 182 Ca -0.01 1.53 0.04 0.00 0.02 0.00 0.00 61.00 62.58 1yr3 s PRO 182 Cb -0.03 -2.70 0.17 0.00 0.02 0.00 0.00 34.50 31.96 1yr3 s PRO 182 CO 0.00 -0.01 0.39 -1.17 -0.33 0.00 0.00 177.00 175.88 1yr3 s LEU 183 N -2.34 2.66 0.47 -5.54 2.96 -1.26 -4.54 118.68 111.10 1yr3 s LEU 183 Ca 0.54 -3.31 -0.22 0.00 -0.22 0.00 0.00 54.13 50.92 1yr3 s LEU 183 Cb -0.23 -0.88 -0.07 0.00 0.50 0.00 0.00 46.19 45.50 1yr3 s LEU 183 CO 0.29 -0.15 1.16 0.28 -1.32 0.00 0.00 176.35 176.61 1yr3 s THR 184 N -0.44 3.13 -0.09 3.68 -1.32 -1.25 -4.74 115.64 114.62 1yr3 s THR 184 Ca 0.29 0.82 -0.00 0.00 -1.21 0.00 0.00 61.69 61.59 1yr3 s THR 184 Cb -0.01 -3.40 -0.03 0.00 -1.51 0.00 0.00 72.50 67.55 1yr3 s THR 184 CO -0.17 -0.04 -0.06 -1.61 -2.21 0.00 0.00 174.62 170.53 1yr3 s GLU 185 N -2.80 2.98 0.18 7.08 2.02 -1.26 -1.16 118.70 125.74 1yr3 s GLU 185 Ca 0.65 -0.53 -0.10 0.00 0.02 0.00 0.00 54.97 55.01 1yr3 s GLU 185 Cb -0.28 -2.68 -0.00 0.00 0.10 0.00 0.00 34.13 31.27 1yr3 s GLU 185 CO 0.33 0.57 0.33 0.20 0.02 0.00 0.00 175.26 176.71 1yr3 s GLY 186 N -0.55 0.43 -0.11 -1.39 0.00 -0.97 -4.92 107.32 99.81 1yr3 s GLY 186 Ca 0.08 -0.82 -0.26 0.00 0.00 0.00 0.00 44.72 43.73 1yr3 s GLY 186 CO 0.02 -0.76 0.82 0.14 0.00 0.00 0.00 173.10 173.32 1yr3 s VAL 187 N -3.96 4.92 -0.19 1.40 1.01 -1.26 -1.19 120.40 121.13 1yr3 s VAL 187 Ca 0.17 1.65 -0.13 0.00 0.00 0.00 0.00 61.98 63.67 1yr3 s VAL 187 Cb 0.02 -4.14 -0.05 0.00 0.00 0.00 0.00 36.38 32.22 1yr3 s VAL 187 CO 0.01 0.11 0.28 0.12 0.00 0.00 0.00 175.10 175.61 1yr3 s PHE 188 N 1.60 3.41 -0.08 5.22 5.36 -0.13 -0.88 117.98 132.48 1yr3 s PHE 188 Ca 0.40 0.51 0.02 0.00 -0.96 0.00 0.00 56.93 56.91 1yr3 s PHE 188 Cb -0.18 -2.35 -0.02 0.00 -0.34 0.00 0.00 43.02 40.13 1yr3 s PHE 188 CO 0.16 0.16 -0.14 0.14 -1.46 0.00 0.00 175.22 174.09 1yr3 s VAL 189 N 0.73 3.04 0.08 3.12 -7.23 0.95 -0.08 120.40 121.01 1yr3 s VAL 189 Ca 0.15 -0.71 -0.14 0.00 -1.81 0.00 0.00 61.98 59.47 1yr3 s VAL 189 Cb -0.13 -2.22 -0.06 0.00 0.56 0.00 0.00 36.38 34.53 1yr3 s VAL 189 CO 0.04 0.57 0.48 -0.94 -0.31 0.00 0.00 175.10 174.94 1yr3 s SER 190 N -0.32 6.80 0.02 4.85 1.04 -0.78 -2.38 113.70 122.92 1yr3 s SER 190 Ca 0.03 1.00 0.09 0.00 0.48 0.00 0.00 55.95 57.54 1yr3 s SER 190 Cb -0.13 -2.26 -0.03 0.00 0.10 0.00 0.00 66.02 63.71 1yr3 s SER 190 CO 0.02 0.20 -0.26 -0.47 0.98 0.00 0.00 173.24 173.71 1yr3 s TYR 191 N -1.31 2.33 0.16 5.02 5.04 0.30 -2.96 117.35 125.93 1yr3 s TYR 191 Ca 0.32 -0.42 -0.12 0.00 -2.44 0.00 0.00 57.07 54.42 1yr3 s TYR 191 Cb -0.16 -1.43 0.03 0.00 0.35 0.00 0.00 41.96 40.75 1yr3 s TYR 191 CO 0.17 0.07 1.63 -1.00 -1.34 0.00 0.00 175.55 175.08 1yr3 h PRO 192 N 5.03 0.91 0.00 4.97 0.13 -1.87 -3.38 132.00 137.78 1yr3 h PRO 192 Ca -0.45 -0.27 0.00 0.00 -0.87 0.00 0.00 66.00 64.41 1yr3 h PRO 192 Cb 1.13 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1yr3 h PRO 192 CO 0.45 0.91 0.00 0.41 -0.23 0.00 0.00 178.00 179.53 1yr3 n GLY 193 N -0.46 -1.37 0.00 1.56 0.00 -1.26 -3.73 105.19 99.93 1yr3 n GLY 193 Ca 0.02 -1.27 0.15 0.00 0.00 0.00 0.00 46.02 44.91 1yr3 n GLY 193 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1yr3 n PRO 194 N -0.14 0.49 -1.86 1.61 -0.04 -1.26 -4.86 135.00 128.94 1yr3 n PRO 194 Ca 0.00 0.01 -0.31 0.00 -0.04 0.00 0.00 63.50 63.15 1yr3 n PRO 194 Cb 0.00 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 31.98 1yr3 n PRO 194 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1yr3 s ASN 195 N -2.50 6.03 0.75 3.54 4.22 -1.26 -5.05 114.94 120.68 1yr3 s ASN 195 Ca 0.31 1.51 -0.10 0.00 -2.14 0.00 0.00 52.86 52.43 1yr3 s ASN 195 Cb 0.20 -2.48 0.06 0.00 1.28 0.00 0.00 41.25 40.31 1yr3 s ASN 195 CO 0.44 -1.00 1.11 -0.36 -2.04 0.00 0.00 177.10 175.25 1yr3 s PHE 196 N -3.04 3.03 0.64 1.54 0.08 -1.26 -4.98 117.98 113.97 1yr3 s PHE 196 Ca 0.57 0.72 -0.15 0.00 0.12 0.00 0.00 56.93 58.19 1yr3 s PHE 196 Cb -0.12 -3.31 -0.01 0.00 -0.57 0.00 0.00 43.02 39.01 1yr3 s PHE 196 CO 0.51 -1.53 1.08 -1.21 -0.10 0.00 0.00 175.22 173.97 1yr3 s GLU 197 N -5.43 3.02 0.35 0.44 8.01 -1.26 -5.02 118.70 118.81 1yr3 s GLU 197 Ca 0.60 1.28 -0.14 0.00 0.01 0.00 0.00 54.97 56.73 1yr3 s GLU 197 Cb -0.11 -1.99 -0.08 0.00 -4.31 0.00 0.00 34.13 27.64 1yr3 s GLU 197 CO 0.48 -1.06 0.75 0.95 0.01 0.00 0.00 175.26 176.39 1yr3 s THR 198 N -2.44 4.71 0.22 3.63 -4.23 -1.26 -4.73 115.64 111.54 1yr3 s THR 198 Ca 0.65 0.85 -0.09 0.00 -1.18 0.00 0.00 61.69 61.92 1yr3 s THR 198 Cb -0.18 -3.65 0.20 0.00 1.34 0.00 0.00 72.50 70.21 1yr3 s THR 198 CO 0.41 -0.30 1.68 0.00 -0.54 0.00 0.00 174.62 175.86 1yr3 h ALA 199 N 1.92 0.72 -0.64 3.99 0.00 -1.97 0.51 119.26 123.80 1yr3 h ALA 199 Ca -0.48 0.17 0.11 0.00 0.00 0.00 0.00 54.91 54.72 1yr3 h ALA 199 Cb 1.18 0.27 -0.08 0.00 0.00 0.00 0.00 17.79 19.15 1yr3 h ALA 199 CO 0.65 -0.36 0.20 0.00 0.00 0.00 0.00 179.25 179.74 1yr3 h ALA 200 N 1.56 0.82 -0.49 0.00 0.00 -1.93 -1.18 119.26 118.04 1yr3 h ALA 200 Ca 0.35 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.27 1yr3 h ALA 200 Cb 0.56 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1yr3 h ALA 200 CO -0.50 -0.24 -0.07 0.93 0.00 0.00 0.00 179.25 179.37 1yr3 h GLU 201 N 0.36 0.87 -0.39 0.00 5.08 -1.35 -2.33 114.58 116.82 1yr3 h GLU 201 Ca 0.34 -0.28 0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1yr3 h GLU 201 Cb 0.47 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1yr3 h GLU 201 CO -0.37 0.92 0.25 0.82 -1.00 0.00 0.00 179.01 179.63 1yr3 h ILE 202 N 0.79 1.08 -0.99 3.13 1.08 0.08 0.22 117.51 122.90 1yr3 h ILE 202 Ca 0.14 -0.17 0.04 0.00 -0.39 0.00 0.00 64.86 64.47 1yr3 h ILE 202 Cb 0.58 0.53 -0.06 0.00 -3.07 0.00 0.00 36.82 34.80 1yr3 h ILE 202 CO 0.04 0.09 0.65 0.03 -0.69 0.00 0.00 178.15 178.27 1yr3 h ARG 203 N 0.51 1.22 -0.34 2.37 3.08 -1.20 0.17 114.38 120.18 1yr3 h ARG 203 Ca 0.15 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.09 1yr3 h ARG 203 Cb -0.04 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 29.71 1yr3 h ARG 203 CO -0.04 0.81 0.09 1.98 -1.07 0.00 0.00 179.97 181.74 1yr3 h MET 204 N 1.26 0.50 -0.06 0.04 4.05 -0.64 0.25 114.93 120.32 1yr3 h MET 204 Ca 0.39 -0.07 -0.15 0.00 -0.28 0.00 0.00 59.70 59.59 1yr3 h MET 204 Cb -0.00 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 30.70 1yr3 h MET 204 CO -0.12 0.45 -0.62 0.52 0.23 0.00 0.00 176.91 177.37 1yr3 h MET 205 N 0.49 0.22 -0.37 0.39 2.86 0.21 -1.05 114.93 117.68 1yr3 h MET 205 Ca 0.12 -0.15 -0.10 0.00 -2.06 0.00 0.00 59.70 57.50 1yr3 h MET 205 Cb 0.17 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.85 1yr3 h MET 205 CO -0.01 0.77 -0.17 1.96 1.06 0.00 0.00 176.91 180.52 1yr3 h GLN 206 N 0.16 0.76 -0.71 1.72 4.20 0.29 -0.37 115.11 121.15 1yr3 h GLN 206 Ca -0.01 -0.33 -0.07 0.00 0.06 0.00 0.00 58.65 58.30 1yr3 h GLN 206 Cb 1.13 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.85 1yr3 h GLN 206 CO 0.09 0.94 0.17 0.82 -0.67 0.00 0.00 178.83 180.19 1yr3 h ILE 207 N 0.56 1.26 0.00 2.54 2.04 -0.86 -1.63 117.51 121.42 1yr3 h ILE 207 Ca 0.08 -0.98 0.00 0.00 1.00 0.00 0.00 64.86 64.96 1yr3 h ILE 207 Cb 0.71 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1yr3 h ILE 207 CO 0.05 0.38 0.00 0.40 0.00 0.00 0.00 178.15 178.98 1yr3 h ILE 208 N 1.08 0.00 -0.01 -0.67 5.03 -1.10 -3.46 117.51 118.38 1yr3 h ILE 208 Ca 0.22 -0.12 0.00 0.00 -0.12 0.00 0.00 64.86 64.84 1yr3 h ILE 208 Cb 0.38 0.79 0.00 0.00 -3.03 0.00 0.00 36.82 34.96 1yr3 h ILE 208 CO 0.00 0.00 0.00 0.61 -0.68 0.00 0.00 178.15 178.08 1yr3 n GLY 209 N -0.72 1.74 3.95 5.37 0.00 -0.61 -5.09 105.19 109.83 1yr3 n GLY 209 Ca -0.00 -0.04 -0.25 0.00 0.00 0.00 0.00 46.02 45.73 1yr3 n GLY 209 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1yr3 s GLY 210 N -2.04 1.56 -0.02 -0.02 0.00 -0.18 -4.79 107.32 101.83 1yr3 s GLY 210 Ca 0.00 -1.02 0.02 0.00 0.00 0.00 0.00 44.72 43.72 1yr3 s GLY 210 CO 0.00 -1.01 0.01 1.22 0.00 0.00 0.00 173.10 173.32 1yr3 n ASP 211 N -0.91 4.34 -3.93 1.64 8.00 -0.06 -4.60 116.55 121.03 1yr3 n ASP 211 Ca -0.07 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.29 1yr3 n ASP 211 Cb 0.55 0.61 -0.14 0.00 -0.02 0.00 0.00 41.12 42.12 1yr3 n ASP 211 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1yr3 s VAL 212 N -2.08 0.28 -0.04 2.53 1.01 -0.62 -0.69 120.40 120.79 1yr3 s VAL 212 Ca -0.01 -0.21 0.06 0.00 0.00 0.00 0.00 61.98 61.81 1yr3 s VAL 212 Cb 0.01 -0.25 -0.01 0.00 0.00 0.00 0.00 36.38 36.13 1yr3 s VAL 212 CO 0.11 0.04 -0.21 0.54 0.00 0.00 0.00 175.10 175.58 1yr3 s VAL 213 N -0.18 1.71 0.31 2.92 0.11 -0.67 -0.04 120.40 124.57 1yr3 s VAL 213 Ca 0.00 -0.89 -0.13 0.00 -2.93 0.00 0.00 61.98 58.03 1yr3 s VAL 213 Cb -0.02 -1.45 0.02 0.00 -1.53 0.00 0.00 36.38 33.40 1yr3 s VAL 213 CO -0.00 0.48 0.60 -0.83 -3.33 0.00 0.00 175.10 172.03 1yr3 s GLY 214 N -0.19 0.58 -0.10 6.54 0.00 -1.00 -1.16 107.32 111.98 1yr3 s GLY 214 Ca -0.00 -0.88 0.17 0.00 0.00 0.00 0.00 44.72 44.01 1yr3 s GLY 214 CO 0.02 -0.52 1.53 1.03 0.00 0.00 0.00 173.10 175.15 1yr3 n MET 215 N -0.48 3.46 0.00 2.90 2.81 -1.26 -0.54 117.12 124.01 1yr3 n MET 215 Ca -0.03 -2.74 0.00 0.00 -1.81 0.00 0.00 57.70 53.12 1yr3 n MET 215 Cb 0.61 -1.77 0.00 0.00 -0.71 0.00 0.00 33.22 31.34 1yr3 n MET 215 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1yr3 n SER 216 N 0.74 0.04 0.00 7.83 3.41 -1.26 -4.48 113.62 119.90 1yr3 n SER 216 Ca 0.23 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.84 1yr3 n SER 216 Cb 0.81 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.76 1yr3 n SER 216 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1yr3 n VAL 217 N 0.00 0.00 -0.35 -3.33 0.31 -1.26 -4.41 118.33 109.29 1yr3 n VAL 217 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.29 1yr3 n VAL 217 Cb 0.00 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 32.92 1yr3 n VAL 217 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1yr3 n VAL 218 N 0.00 -0.52 -0.01 2.52 0.31 -1.26 -1.43 118.33 117.93 1yr3 n VAL 218 Ca 0.00 2.11 -0.10 0.00 -0.01 0.00 0.00 64.34 66.34 1yr3 n VAL 218 Cb 0.00 -2.71 -0.03 0.00 -0.91 0.00 0.00 33.84 30.19 1yr3 n VAL 218 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1yr3 h PRO 219 N 0.00 -0.31 0.52 5.55 0.11 -1.88 -1.47 132.00 134.52 1yr3 h PRO 219 Ca 0.25 0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.36 1yr3 h PRO 219 Cb 0.47 0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.63 1yr3 h PRO 219 CO -0.86 -0.21 -0.42 0.93 -0.21 0.00 0.00 178.00 177.23 1yr3 h GLU 220 N -0.32 -0.89 -0.34 1.05 3.07 -1.59 -2.43 114.58 113.13 1yr3 h GLU 220 Ca 0.11 0.06 0.07 0.00 -0.50 0.00 0.00 59.36 59.10 1yr3 h GLU 220 Cb 0.49 0.20 -0.07 0.00 -0.84 0.00 0.00 28.75 28.54 1yr3 h GLU 220 CO -0.35 -0.59 -0.09 0.28 -1.40 0.00 0.00 179.01 176.86 1yr3 h VAL 221 N -0.92 0.65 -0.61 3.13 2.07 -1.13 0.13 116.25 119.56 1yr3 h VAL 221 Ca -0.06 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.44 1yr3 h VAL 221 Cb 0.78 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 1yr3 h VAL 221 CO -0.00 0.00 0.27 0.40 0.02 0.00 0.00 177.57 178.26 1yr3 h ILE 222 N -0.01 1.20 -0.48 4.57 2.04 -1.26 0.37 117.51 123.94 1yr3 h ILE 222 Ca 0.16 -0.60 -0.05 0.00 1.00 0.00 0.00 64.86 65.37 1yr3 h ILE 222 Cb 0.26 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 1yr3 h ILE 222 CO -0.35 0.25 0.09 0.28 0.00 0.00 0.00 178.15 178.42 1yr3 h SER 223 N 0.86 0.75 -0.03 1.72 0.02 -0.85 -1.40 113.55 114.62 1yr3 h SER 223 Ca 0.21 -0.25 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1yr3 h SER 223 Cb 0.12 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.46 1yr3 h SER 223 CO -0.02 0.81 0.01 0.00 -1.14 0.00 0.00 176.83 176.48 1yr3 h ALA 224 N 0.97 0.04 -0.73 3.77 0.00 0.15 -2.45 119.26 121.00 1yr3 h ALA 224 Ca 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1yr3 h ALA 224 Cb 0.36 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1yr3 h ALA 224 CO 0.01 -0.47 0.44 0.00 0.00 0.00 0.00 179.25 179.23 1yr3 h ARG 225 N 0.03 0.99 -0.70 0.00 2.47 -0.81 -0.08 114.38 116.28 1yr3 h ARG 225 Ca 0.01 -0.08 0.03 0.00 -1.26 0.00 0.00 59.98 58.67 1yr3 h ARG 225 Cb 0.00 -0.21 -0.04 0.00 -1.65 0.00 0.00 29.97 28.07 1yr3 h ARG 225 CO -0.01 0.69 0.44 1.25 0.56 0.00 0.00 179.97 182.91 1yr3 h HIS 226 N 1.01 0.83 -0.43 3.04 2.76 -0.80 -1.08 115.15 120.49 1yr3 h HIS 226 Ca 0.26 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.46 1yr3 h HIS 226 Cb -0.04 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 28.64 1yr3 h HIS 226 CO 0.00 0.49 0.00 0.00 -1.30 0.00 0.00 177.93 177.12 1yr3 n ASP 228 N 0.53 -6.90 -3.94 0.00 2.03 -0.41 -4.93 116.55 102.93 1yr3 n ASP 228 Ca 0.19 -0.50 -0.30 0.00 0.52 0.00 0.00 54.79 54.71 1yr3 n ASP 228 Cb 0.86 -4.91 -0.16 0.00 -0.72 0.00 0.00 41.12 36.19 1yr3 n ASP 228 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1yr3 s LEU 229 N -4.93 2.16 0.32 -2.67 0.20 -0.11 -5.00 118.68 108.64 1yr3 s LEU 229 Ca 0.26 -0.91 -0.28 0.00 0.69 0.00 0.00 54.13 53.88 1yr3 s LEU 229 Cb -0.05 -1.11 -0.13 0.00 -0.43 0.00 0.00 46.19 44.48 1yr3 s LEU 229 CO 0.76 -0.19 1.24 0.29 -0.29 0.00 0.00 176.35 178.17 1yr3 n LYS 230 N 4.74 1.94 -4.52 1.98 5.02 -1.26 -4.14 118.16 121.93 1yr3 n LYS 230 Ca -0.13 0.68 -0.30 0.00 -2.02 0.00 0.00 58.31 56.54 1yr3 n LYS 230 Cb 0.46 -2.23 -0.13 0.00 -0.02 0.00 0.00 35.03 33.12 1yr3 n LYS 230 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1yr3 s VAL 231 N -0.97 2.63 -0.06 -0.18 1.01 -1.24 -0.45 120.40 121.14 1yr3 s VAL 231 Ca 0.58 -1.43 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 1yr3 s VAL 231 Cb -0.61 -2.14 0.04 0.00 0.00 0.00 0.00 36.38 33.67 1yr3 s VAL 231 CO 0.60 0.21 0.11 -0.69 0.00 0.00 0.00 175.10 175.34 1yr3 s VAL 232 N -1.01 -0.13 0.00 2.92 1.01 0.16 -1.56 120.40 121.79 1yr3 s VAL 232 Ca 0.15 0.30 0.03 0.00 0.00 0.00 0.00 61.98 62.46 1yr3 s VAL 232 Cb -0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 36.38 36.06 1yr3 s VAL 232 CO 0.07 0.12 -0.10 0.00 0.00 0.00 0.00 175.10 175.19 1yr3 s ALA 233 N 1.73 0.82 -0.06 5.51 0.00 -1.26 0.80 121.76 129.30 1yr3 s ALA 233 Ca -0.02 -0.47 -0.01 0.00 0.00 0.00 0.00 51.96 51.46 1yr3 s ALA 233 Cb -0.12 -0.19 0.03 0.00 0.00 0.00 0.00 23.12 22.84 1yr3 s ALA 233 CO -0.05 0.18 -0.01 0.08 0.00 0.00 0.00 175.76 175.97 1yr3 s VAL 234 N -0.35 0.37 0.04 0.00 1.01 -0.36 -1.79 120.40 119.33 1yr3 s VAL 234 Ca 0.03 0.08 -0.03 0.00 0.00 0.00 0.00 61.98 62.05 1yr3 s VAL 234 Cb -0.04 -0.50 -0.04 0.00 0.00 0.00 0.00 36.38 35.79 1yr3 s VAL 234 CO -0.00 0.24 0.25 -0.44 0.00 0.00 0.00 175.10 175.15 1yr3 s SER 235 N 1.68 6.42 -0.38 3.32 0.01 0.53 -2.90 113.70 122.38 1yr3 s SER 235 Ca 0.00 0.43 -0.08 0.00 1.31 0.00 0.00 55.95 57.62 1yr3 s SER 235 Cb -0.13 -2.03 0.06 0.00 0.21 0.00 0.00 66.02 64.14 1yr3 s SER 235 CO -0.04 0.20 0.19 0.00 0.41 0.00 0.00 173.24 174.00 1yr3 s ALA 236 N -1.43 3.18 0.23 1.44 0.00 0.06 -1.21 121.76 124.02 1yr3 s ALA 236 Ca 0.32 -2.01 -0.31 0.00 0.00 0.00 0.00 51.96 49.96 1yr3 s ALA 236 Cb -0.13 -2.48 -0.10 0.00 0.00 0.00 0.00 23.12 20.41 1yr3 s ALA 236 CO 0.22 -1.53 1.53 0.42 0.00 0.00 0.00 175.76 176.39 1yr3 s ILE 237 N 1.40 2.50 -0.07 0.00 -1.09 -0.03 -1.95 121.20 121.95 1yr3 s ILE 237 Ca 0.02 0.39 0.01 0.00 -2.23 0.00 0.00 60.65 58.84 1yr3 s ILE 237 Cb -0.21 -3.25 0.01 0.00 -1.58 0.00 0.00 42.46 37.42 1yr3 s ILE 237 CO 0.02 0.05 0.70 0.35 -1.23 0.00 0.00 174.94 174.83 1yr3 n THR 238 N 2.94 0.36 0.00 2.92 -2.24 0.02 -1.26 114.28 117.02 1yr3 n THR 238 Ca 0.10 -0.68 0.00 0.00 -2.27 0.00 0.00 64.05 61.20 1yr3 n THR 238 Cb 0.39 0.83 0.00 0.00 -2.10 0.00 0.00 70.33 69.45 1yr3 n THR 238 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1yr3 n ASN 239 N -0.13 0.00 -4.84 3.42 6.94 -1.26 -4.77 115.26 114.62 1yr3 n ASN 239 Ca 0.01 0.00 -0.33 0.00 -0.02 0.00 0.00 54.58 54.24 1yr3 n ASN 239 Cb 0.10 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.47 1yr3 n ASN 239 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 1yr3 s MET 240 N -2.00 4.09 0.95 -3.83 -1.94 -1.26 -1.22 119.30 114.09 1yr3 s MET 240 Ca 0.00 0.93 -0.10 0.00 -1.71 0.00 0.00 55.69 54.81 1yr3 s MET 240 Cb 0.00 -2.25 0.17 0.00 2.01 0.00 0.00 34.83 34.75 1yr3 s MET 240 CO 0.00 -0.02 1.13 0.00 -0.01 0.00 0.00 175.02 176.11 1yr3 s ALA 241 N -2.22 1.19 0.05 3.03 0.00 0.99 -4.68 121.76 120.12 1yr3 s ALA 241 Ca 0.59 0.48 -0.35 0.00 0.00 0.00 0.00 51.96 52.68 1yr3 s ALA 241 Cb -0.10 -3.42 -0.14 0.00 0.00 0.00 0.00 23.12 19.47 1yr3 s ALA 241 CO 0.19 -2.91 1.63 -1.91 0.00 0.00 0.00 175.76 172.75 1yr3 n GLU 242 N -4.33 1.90 -0.38 0.00 4.07 -1.26 -2.34 120.64 118.31 1yr3 n GLU 242 Ca 0.10 0.69 0.00 0.00 -0.06 0.00 0.00 57.16 57.89 1yr3 n GLU 242 Cb 0.52 -2.45 0.00 0.00 -0.06 0.00 0.00 31.44 29.45 1yr3 n GLU 242 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1yr3 n GLY 243 N 3.57 0.69 0.87 8.31 0.00 -1.26 -4.22 105.19 113.16 1yr3 n GLY 243 Ca 0.19 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.31 1yr3 n GLY 243 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yr3 n LEU 244 N 0.00 2.90 0.00 0.99 4.77 -0.99 -5.01 117.00 119.66 1yr3 n LEU 244 Ca 0.00 -1.29 0.00 0.00 -0.03 0.00 0.00 56.01 54.69 1yr3 n LEU 244 Cb 0.00 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1yr3 n LEU 244 CO 0.00 0.58 0.00 -1.54 -1.33 0.00 0.00 177.39 175.10 1yr3 n SER 245 N 1.14 0.00 -0.07 -1.43 3.41 -1.26 -5.00 113.62 110.40 1yr3 n SER 245 Ca 0.14 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.77 1yr3 n SER 245 Cb 0.50 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.45 1yr3 n SER 245 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1yr3 n ASP 246 N 0.00 0.68 -4.75 4.04 5.75 -1.26 -5.04 116.55 115.96 1yr3 n ASP 246 Ca 0.00 -0.84 -0.41 0.00 -0.01 0.00 0.00 54.79 53.54 1yr3 n ASP 246 Cb 0.00 0.59 -0.04 0.00 -1.03 0.00 0.00 41.12 40.64 1yr3 n ASP 246 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1yr3 s VAL 247 N -0.96 3.47 0.15 2.12 1.01 -1.26 -5.04 120.40 119.90 1yr3 s VAL 247 Ca 0.03 1.40 -0.22 0.00 0.00 0.00 0.00 61.98 63.18 1yr3 s VAL 247 Cb 0.03 -3.89 -0.08 0.00 0.00 0.00 0.00 36.38 32.45 1yr3 s VAL 247 CO 0.12 0.30 0.70 -0.75 0.00 0.00 0.00 175.10 175.47 1yr3 s LYS 248 N -1.07 4.39 -0.14 2.72 2.20 -1.26 -4.94 119.74 121.65 1yr3 s LYS 248 Ca 0.47 0.97 -0.15 0.00 -0.36 0.00 0.00 55.97 56.90 1yr3 s LYS 248 Cb -0.33 -3.19 -0.05 0.00 -1.51 0.00 0.00 37.83 32.76 1yr3 s LYS 248 CO 0.40 0.56 0.36 -0.51 -0.36 0.00 0.00 175.35 175.81 1yr3 s LEU 249 N -1.28 4.27 0.15 5.43 1.43 -1.26 -4.94 118.68 122.48 1yr3 s LEU 249 Ca 0.35 0.64 -0.17 0.00 -1.03 0.00 0.00 54.13 53.92 1yr3 s LEU 249 Cb -0.21 -2.49 0.03 0.00 0.03 0.00 0.00 46.19 43.55 1yr3 s LEU 249 CO 0.23 0.08 0.45 -0.94 0.23 0.00 0.00 176.35 176.40 1yr3 s SER 250 N 0.40 -0.25 0.30 2.29 1.04 -1.26 -5.01 113.70 111.21 1yr3 s SER 250 Ca 0.20 -0.38 0.09 0.00 0.48 0.00 0.00 55.95 56.34 1yr3 s SER 250 Cb -0.14 0.51 0.45 0.00 0.10 0.00 0.00 66.02 66.94 1yr3 s SER 250 CO 0.07 -0.93 1.67 -0.74 0.98 0.00 0.00 173.24 174.29 1yr3 h HIS 251 N 2.29 0.11 -0.56 5.02 2.76 -1.99 -2.43 115.15 120.35 1yr3 h HIS 251 Ca -0.32 -0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 57.77 1yr3 h HIS 251 Cb 1.26 -0.02 -0.03 0.00 1.55 0.00 0.00 27.41 30.17 1yr3 h HIS 251 CO 0.33 0.58 0.17 0.00 -1.30 0.00 0.00 177.93 177.72 1yr3 h ALA 252 N 1.41 1.25 -0.49 5.26 0.00 -2.00 -1.06 119.26 123.63 1yr3 h ALA 252 Ca -0.00 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.61 1yr3 h ALA 252 Cb 0.93 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1yr3 h ALA 252 CO 0.07 0.53 -0.15 0.37 0.00 0.00 0.00 179.25 180.07 1yr3 h GLN 253 N 0.81 0.97 0.73 0.00 5.75 -1.83 -2.42 115.11 119.11 1yr3 h GLN 253 Ca 0.19 -0.38 -0.04 0.00 -0.15 0.00 0.00 58.65 58.27 1yr3 h GLN 253 Cb 0.24 -0.05 0.01 0.00 1.07 0.00 0.00 27.48 28.75 1yr3 h GLN 253 CO -0.01 1.05 -0.35 1.15 -2.65 0.00 0.00 178.83 178.03 1yr3 h THR 254 N 0.82 0.27 -0.76 2.39 2.02 -0.94 0.57 112.91 117.28 1yr3 h THR 254 Ca 0.12 -0.06 0.09 0.00 0.77 0.00 0.00 66.41 67.34 1yr3 h THR 254 Cb 0.71 0.28 -0.07 0.00 -1.74 0.00 0.00 68.15 67.33 1yr3 h THR 254 CO 0.05 0.01 0.41 -0.07 0.37 0.00 0.00 175.52 176.29 1yr3 h LEU 255 N -1.02 0.56 0.06 2.58 3.38 -1.25 -2.41 115.31 117.20 1yr3 h LEU 255 Ca -0.10 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1yr3 h LEU 255 Cb 0.76 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1yr3 h LEU 255 CO 0.16 0.32 -0.03 0.00 0.09 0.00 0.00 178.44 178.98 1yr3 h ALA 256 N 1.44 -0.08 0.00 1.53 0.00 -1.36 -3.19 119.26 117.60 1yr3 h ALA 256 Ca 0.37 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1yr3 h ALA 256 Cb 0.37 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1yr3 h ALA 256 CO -0.26 -0.38 0.00 0.00 0.00 0.00 0.00 179.25 178.61 1yr3 n ALA 257 N -2.30 1.91 1.15 0.00 0.00 0.18 -2.32 120.51 119.14 1yr3 n ALA 257 Ca -0.08 -0.08 0.10 0.00 0.00 0.00 0.00 53.44 53.38 1yr3 n ALA 257 Cb 0.20 -1.24 0.35 0.00 0.00 0.00 0.00 19.45 18.76 1yr3 n ALA 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yr3 n ALA 258 N -1.17 2.51 0.41 0.00 0.00 -0.93 -3.78 120.51 117.54 1yr3 n ALA 258 Ca 0.09 -0.55 0.11 0.00 0.00 0.00 0.00 53.44 53.08 1yr3 n ALA 258 Cb 0.09 -1.07 -0.03 0.00 0.00 0.00 0.00 19.45 18.44 1yr3 n ALA 258 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1yr3 n GLU 259 N 0.40 0.39 0.03 0.00 4.07 -0.98 -3.19 120.64 121.36 1yr3 n GLU 259 Ca 0.16 -0.03 -0.15 0.00 -0.06 0.00 0.00 57.16 57.08 1yr3 n GLU 259 Cb 0.34 -1.60 -0.04 0.00 -0.06 0.00 0.00 31.44 30.07 1yr3 n GLU 259 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 1yr3 h LEU 260 N 0.00 0.71 -0.95 4.31 3.38 -1.78 -3.28 115.31 117.70 1yr3 h LEU 260 Ca 0.00 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.46 1yr3 h LEU 260 Cb 0.81 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1yr3 h LEU 260 CO 0.00 1.30 -0.41 -1.54 0.09 0.00 0.00 178.44 177.87 1yr3 n SER 261 N -3.85 1.89 -0.26 -0.43 3.41 -1.26 -4.54 113.62 108.58 1yr3 n SER 261 Ca -0.07 -1.43 0.05 0.00 -0.26 0.00 0.00 58.87 57.16 1yr3 n SER 261 Cb 0.78 0.39 0.18 0.00 -0.26 0.00 0.00 64.21 65.31 1yr3 n SER 261 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1yr3 h LYS 262 N 2.32 0.52 -0.20 4.33 3.64 -1.61 0.53 116.57 126.11 1yr3 h LYS 262 Ca 0.00 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.30 1yr3 h LYS 262 Cb 0.72 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 1yr3 h LYS 262 CO 0.00 0.34 -0.06 0.37 -2.27 0.00 0.00 179.45 177.83 1yr3 h GLN 263 N 0.53 0.39 -0.61 1.90 5.75 -1.81 -2.04 115.11 119.23 1yr3 h GLN 263 Ca 0.41 -0.16 -0.03 0.00 -0.15 0.00 0.00 58.65 58.73 1yr3 h GLN 263 Cb 0.56 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 29.06 1yr3 h GLN 263 CO -0.35 0.66 0.27 -0.91 -2.65 0.00 0.00 178.83 175.85 1yr3 h ASN 264 N 0.10 0.79 0.07 -0.69 2.35 -1.74 -1.81 115.58 114.65 1yr3 h ASN 264 Ca 0.05 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1yr3 h ASN 264 Cb 0.52 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.69 1yr3 h ASN 264 CO 0.02 0.68 -0.03 0.15 -1.65 0.00 0.00 177.43 176.60 1yr3 h PHE 265 N 0.86 -0.09 -0.66 1.19 3.04 -0.72 0.19 116.94 120.75 1yr3 h PHE 265 Ca 0.21 -0.00 0.01 0.00 3.98 0.00 0.00 57.97 62.17 1yr3 h PHE 265 Cb 0.12 0.03 -0.03 0.00 2.56 0.00 0.00 35.95 38.63 1yr3 h PHE 265 CO 0.01 -0.04 0.44 0.82 -2.02 0.00 0.00 178.31 177.52 1yr3 h ILE 266 N -0.11 1.17 -0.29 1.41 2.04 -1.05 0.10 117.51 120.78 1yr3 h ILE 266 Ca -0.01 -0.31 -0.18 0.00 1.00 0.00 0.00 64.86 65.36 1yr3 h ILE 266 Cb 0.09 0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 36.36 1yr3 h ILE 266 CO 0.02 0.16 -0.53 0.78 0.00 0.00 0.00 178.15 178.58 1yr3 h ASN 267 N 0.89 0.95 -0.15 1.72 -0.26 -0.97 0.75 115.58 118.51 1yr3 h ASN 267 Ca 0.24 -0.50 -0.00 0.00 -0.56 0.00 0.00 56.30 55.48 1yr3 h ASN 267 Cb -0.10 -0.27 -0.01 0.00 -1.06 0.00 0.00 38.32 36.88 1yr3 h ASN 267 CO -0.05 1.29 0.08 0.25 -1.06 0.00 0.00 177.43 177.94 1yr3 h LEU 268 N 0.66 0.20 0.77 1.61 5.85 0.20 0.18 115.31 124.77 1yr3 h LEU 268 Ca 0.02 -0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.60 1yr3 h LEU 268 Cb 1.13 -0.05 0.01 0.00 0.37 0.00 0.00 40.66 42.12 1yr3 h LEU 268 CO 0.12 0.24 -0.37 0.40 -0.34 0.00 0.00 178.44 178.49 1yr3 h ILE 269 N 0.13 0.00 -0.25 4.05 2.04 -0.78 0.49 117.51 123.19 1yr3 h ILE 269 Ca 0.05 -0.24 0.07 0.00 1.00 0.00 0.00 64.86 65.74 1yr3 h ILE 269 Cb 0.10 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.17 1yr3 h ILE 269 CO -0.01 0.00 0.34 0.00 0.00 0.00 0.00 178.15 178.48 1yr3 h GLY 271 N 0.00 0.34 0.79 0.00 0.00 -0.40 -2.90 103.07 100.90 1yr3 h GLY 271 Ca 0.12 -0.85 0.02 0.00 0.00 0.00 0.00 47.33 46.62 1yr3 h GLY 271 CO -0.00 0.74 -0.04 -2.75 0.00 0.00 0.00 176.54 174.50 1yr3 h PHE 272 N -0.38 -0.08 -0.82 5.60 3.57 0.13 -2.31 116.94 122.65 1yr3 h PHE 272 Ca -0.13 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.48 1yr3 h PHE 272 Cb 1.61 0.05 -0.08 0.00 2.79 0.00 0.00 35.95 40.32 1yr3 h PHE 272 CO 0.20 -0.06 0.46 -0.07 -2.23 0.00 0.00 178.31 176.61 1yr3 h LEU 273 N -0.02 0.64 -1.40 0.59 4.07 -1.01 -1.57 115.31 116.60 1yr3 h LEU 273 Ca 0.05 0.06 -0.04 0.00 0.08 0.00 0.00 57.88 58.02 1yr3 h LEU 273 Cb 0.09 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 41.76 1yr3 h LEU 273 CO -0.11 0.35 -0.08 -0.09 -1.08 0.00 0.00 178.44 177.44 1yr3 h ARG 274 N 0.75 0.30 0.00 1.13 2.43 -1.21 0.53 114.38 118.32 1yr3 h ARG 274 Ca 0.40 -0.06 -0.14 0.00 -0.81 0.00 0.00 59.98 59.37 1yr3 h ARG 274 Cb 0.41 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.90 1yr3 h ARG 274 CO -0.27 0.39 -0.66 0.87 -1.51 0.00 0.00 179.97 178.80 1yr3 h LYS 275 N 0.29 0.00 0.00 0.20 1.57 -0.88 -3.26 116.57 114.48 1yr3 h LYS 275 Ca 0.06 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.74 1yr3 h LYS 275 Cb 0.33 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 1yr3 h LYS 275 CO 0.02 0.66 -1.17 0.97 -0.57 0.00 0.00 179.45 179.35 1yr3 h ILE 276 N 0.00 0.36 0.00 1.86 2.10 -1.08 -3.52 117.51 117.23 1yr3 h ILE 276 Ca -0.01 -1.67 0.00 0.00 1.08 0.00 0.00 64.86 64.26 1yr3 h ILE 276 Cb 1.45 1.90 0.00 0.00 -1.09 0.00 0.00 36.82 39.07 1yr3 h ILE 276 CO 0.09 0.20 0.00 0.00 -1.08 0.00 0.00 178.15 177.36