#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 3.25 0.47 3.69 0.40 -1.26 -5.08 117.98 119.45 1yr3 s PHE 6 Ca 0.00 0.16 -0.24 0.00 -0.60 0.00 0.00 56.93 56.25 1yr3 s PHE 6 Cb 0.00 -1.70 -0.07 0.00 0.51 0.00 0.00 43.02 41.75 1yr3 s PHE 6 CO 0.00 0.54 1.41 0.45 0.70 0.00 0.00 175.22 178.32 1yr3 s SER 7 N -1.93 5.73 -0.02 1.36 0.15 -1.26 -4.93 113.70 112.81 1yr3 s SER 7 Ca 0.25 2.88 0.04 0.00 0.70 0.00 0.00 55.95 59.82 1yr3 s SER 7 Cb -0.12 -2.65 0.08 0.00 -1.71 0.00 0.00 66.02 61.62 1yr3 s SER 7 CO 0.16 -1.27 1.05 1.41 1.20 0.00 0.00 173.24 175.80 1yr3 n HIS 8 N -0.39 0.06 -0.11 3.44 8.25 -1.26 -4.78 115.22 120.44 1yr3 n HIS 8 Ca 0.06 -0.57 -0.05 0.00 -0.26 0.00 0.00 57.72 56.90 1yr3 n HIS 8 Cb 0.43 -0.07 0.02 0.00 1.12 0.00 0.00 29.99 31.49 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 0.23 -0.15 -0.71 0.41 2.35 -1.92 -1.96 115.58 113.83 1yr3 h ASN 9 Ca 0.00 0.09 0.15 0.00 -0.55 0.00 0.00 56.30 55.99 1yr3 h ASN 9 Cb 0.60 0.15 -0.13 0.00 0.05 0.00 0.00 38.32 39.00 1yr3 h ASN 9 CO 0.00 -0.04 -0.04 -0.65 -1.65 0.00 0.00 177.43 175.05 1yr3 h PRO 10 N 0.10 0.07 -0.18 0.81 0.11 -1.82 -0.21 132.00 130.88 1yr3 h PRO 10 Ca 0.18 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.28 1yr3 h PRO 10 Cb 0.25 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.33 1yr3 h PRO 10 CO -0.30 0.05 0.11 -0.07 -0.21 0.00 0.00 178.00 177.58 1yr3 h LEU 11 N 0.08 0.22 -0.08 2.35 4.07 -1.75 -2.39 115.31 117.81 1yr3 h LEU 11 Ca 0.37 -0.05 0.04 0.00 0.08 0.00 0.00 57.88 58.33 1yr3 h LEU 11 Cb 0.63 -0.05 -0.06 0.00 1.08 0.00 0.00 40.66 42.25 1yr3 h LEU 11 CO -0.65 0.20 -0.29 -0.26 -1.08 0.00 0.00 178.44 176.36 1yr3 h PHE 12 N 0.22 -0.80 -0.59 1.13 0.05 -0.62 -2.25 116.94 114.07 1yr3 h PHE 12 Ca 0.07 0.03 0.12 0.00 3.82 0.00 0.00 57.97 62.01 1yr3 h PHE 12 Cb 0.02 0.37 -0.11 0.00 2.00 0.00 0.00 35.95 38.23 1yr3 h PHE 12 CO -0.05 -0.38 -0.07 0.00 -0.18 0.00 0.00 178.31 177.63 1yr3 h ILE 14 N 0.05 0.56 -0.15 0.00 1.08 -0.88 0.52 117.51 118.69 1yr3 h ILE 14 Ca 0.30 -0.16 -0.09 0.00 -0.39 0.00 0.00 64.86 64.51 1yr3 h ILE 14 Cb 0.47 0.04 0.00 0.00 -3.07 0.00 0.00 36.82 34.26 1yr3 h ILE 14 CO -0.56 0.09 -0.26 0.44 -0.69 0.00 0.00 178.15 177.16 1yr3 h ASP 15 N 0.48 0.49 -0.97 1.72 3.32 -0.84 -2.44 116.42 118.17 1yr3 h ASP 15 Ca 0.53 -0.54 0.04 0.00 0.02 0.00 0.00 57.03 57.08 1yr3 h ASP 15 Cb 0.94 -0.14 -0.06 0.00 0.22 0.00 0.00 39.33 40.29 1yr3 h ASP 15 CO -0.47 0.94 0.63 0.40 -1.72 0.00 0.00 179.24 179.02 1yr3 h ILE 16 N 0.06 1.15 -0.52 0.35 2.04 0.63 -2.15 117.51 119.06 1yr3 h ILE 16 Ca 0.01 -0.41 -0.11 0.00 1.00 0.00 0.00 64.86 65.35 1yr3 h ILE 16 Cb 0.85 -0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1yr3 h ILE 16 CO 0.06 0.22 -0.10 0.40 0.00 0.00 0.00 178.15 178.73 1yr3 h ILE 17 N 1.20 1.27 -0.65 -0.67 2.04 -0.04 -2.61 117.51 118.04 1yr3 h ILE 17 Ca 0.39 -1.24 0.18 0.00 1.00 0.00 0.00 64.86 65.19 1yr3 h ILE 17 Cb 0.04 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.08 1yr3 h ILE 17 CO -0.13 0.44 0.47 0.11 0.00 0.00 0.00 178.15 179.03 1yr3 h LYS 18 N 0.86 0.05 -0.04 2.37 1.57 -0.88 0.62 116.57 121.11 1yr3 h LYS 18 Ca 0.14 -0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.80 1yr3 h LYS 18 Cb 0.66 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 1yr3 h LYS 18 CO 0.05 0.04 -0.50 1.15 -0.57 0.00 0.00 179.45 179.61 1yr3 h THR 19 N 0.06 1.36 0.00 -0.16 2.02 -1.27 -2.88 112.91 112.03 1yr3 h THR 19 Ca 0.31 -1.74 -0.31 0.00 0.77 0.00 0.00 66.41 65.44 1yr3 h THR 19 Cb 1.17 1.89 -0.06 0.00 -1.74 0.00 0.00 68.15 69.41 1yr3 h THR 19 CO -0.02 0.51 -2.21 -1.22 0.37 0.00 0.00 175.52 172.94 1yr3 n TYR 20 N -3.94 0.17 -3.41 3.16 4.02 0.36 -4.71 117.16 112.81 1yr3 n TYR 20 Ca -0.02 0.06 -0.26 0.00 -0.01 0.00 0.00 57.90 57.67 1yr3 n TYR 20 Cb 0.53 -0.97 -0.09 0.00 -0.02 0.00 0.00 39.34 38.79 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 -2.74 0.74 -2.37 -0.72 3.00 0.19 -5.00 118.16 111.26 1yr3 n LYS 21 Ca -0.27 -3.49 -0.37 0.00 -0.00 0.00 0.00 58.31 54.18 1yr3 n LYS 21 Cb 1.07 -1.68 -0.02 0.00 0.00 0.00 0.00 35.03 34.39 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 -0.69 3.99 -1.24 1.64 0.04 -1.09 -3.97 135.00 133.68 1yr3 s PRO 22 Ca 0.33 1.69 -0.11 0.00 0.04 0.00 0.00 61.00 62.95 1yr3 s PRO 22 Cb 0.07 -2.53 -0.01 0.00 0.04 0.00 0.00 34.50 32.08 1yr3 s PRO 22 CO -0.16 -0.34 0.69 -0.25 0.04 0.00 0.00 177.00 176.98 1yr3 n ASP 23 N -0.19 -3.27 -3.74 6.66 8.00 -1.26 -4.99 116.55 117.77 1yr3 n ASP 23 Ca 0.06 -0.96 -0.20 0.00 0.71 0.00 0.00 54.79 54.40 1yr3 n ASP 23 Cb 0.48 -3.52 -0.17 0.00 -0.02 0.00 0.00 41.12 37.89 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 -3.63 0.29 -0.28 1.24 5.36 -1.25 -5.11 117.98 114.59 1yr3 s PHE 24 Ca 0.26 0.07 0.02 0.00 -0.96 0.00 0.00 56.93 56.32 1yr3 s PHE 24 Cb -0.09 -0.54 0.08 0.00 -0.34 0.00 0.00 43.02 42.13 1yr3 s PHE 24 CO 0.85 -0.21 -0.01 0.99 -1.46 0.00 0.00 175.22 175.38 1yr3 s THR 25 N 1.81 1.83 0.48 0.12 2.01 -1.26 -5.06 115.64 115.57 1yr3 s THR 25 Ca 0.01 -1.71 -0.21 0.00 0.31 0.00 0.00 61.69 60.10 1yr3 s THR 25 Cb -0.12 -2.18 -0.08 0.00 0.01 0.00 0.00 72.50 70.13 1yr3 s THR 25 CO -0.03 -0.32 1.08 -2.16 -0.69 0.00 0.00 174.62 172.49 1yr3 s PRO 26 N 1.20 3.74 -0.23 4.92 0.04 -1.26 -4.77 135.00 138.63 1yr3 s PRO 26 Ca 0.01 1.50 -0.00 0.00 0.04 0.00 0.00 61.00 62.55 1yr3 s PRO 26 Cb -0.19 -2.18 -0.14 0.00 0.04 0.00 0.00 34.50 32.03 1yr3 s PRO 26 CO -0.09 -0.51 -0.22 0.54 0.04 0.00 0.00 177.00 176.76 1yr3 n ARG 27 N -0.86 0.57 -4.98 4.56 1.74 -0.39 -2.86 116.66 114.44 1yr3 n ARG 27 Ca 0.09 0.15 -0.32 0.00 -0.77 0.00 0.00 57.85 56.99 1yr3 n ARG 27 Cb 0.51 -1.45 -0.15 0.00 -1.02 0.00 0.00 32.46 30.36 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 -2.46 2.74 -0.07 1.55 1.01 -1.21 0.41 120.40 122.36 1yr3 s VAL 28 Ca -0.32 -0.82 0.00 0.00 0.00 0.00 0.00 61.98 60.85 1yr3 s VAL 28 Cb 0.09 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 1yr3 s VAL 28 CO 0.52 0.57 -0.05 0.00 0.00 0.00 0.00 175.10 176.14 1yr3 s ALA 29 N -0.26 3.07 0.06 5.51 0.00 -0.30 -2.10 121.76 127.74 1yr3 s ALA 29 Ca 0.01 -0.87 0.08 0.00 0.00 0.00 0.00 51.96 51.18 1yr3 s ALA 29 Cb -0.13 -1.30 -0.03 0.00 0.00 0.00 0.00 23.12 21.67 1yr3 s ALA 29 CO 0.03 0.58 -0.23 -0.06 0.00 0.00 0.00 175.76 176.08 1yr3 s PHE 30 N -0.84 2.00 -0.28 0.00 0.40 0.15 -0.38 117.98 119.04 1yr3 s PHE 30 Ca 0.13 -0.39 0.03 0.00 -0.60 0.00 0.00 56.93 56.10 1yr3 s PHE 30 Cb -0.11 -1.17 0.07 0.00 0.51 0.00 0.00 43.02 42.32 1yr3 s PHE 30 CO 0.02 0.14 -0.06 0.42 0.70 0.00 0.00 175.22 176.44 1yr3 s ILE 31 N -0.88 2.24 -0.42 0.64 1.01 -1.08 0.90 121.20 123.61 1yr3 s ILE 31 Ca 0.09 -1.82 -0.17 0.00 0.00 0.00 0.00 60.65 58.75 1yr3 s ILE 31 Cb -0.09 -2.41 0.02 0.00 0.01 0.00 0.00 42.46 39.99 1yr3 s ILE 31 CO 0.03 -0.19 0.41 -0.76 0.00 0.00 0.00 174.94 174.43 1yr3 s LEU 32 N 1.05 4.95 0.00 2.97 1.43 0.12 -2.58 118.68 126.62 1yr3 s LEU 32 Ca -0.04 -0.76 0.00 0.00 -1.03 0.00 0.00 54.13 52.31 1yr3 s LEU 32 Cb -0.20 -2.34 0.00 0.00 0.03 0.00 0.00 46.19 43.69 1yr3 s LEU 32 CO -0.06 -0.57 0.00 0.61 0.23 0.00 0.00 176.35 176.57 1yr3 n GLY 33 N 5.13 -1.76 3.69 -3.19 0.00 -1.26 -0.90 105.19 106.90 1yr3 n GLY 33 Ca -0.08 -1.06 -0.42 0.00 0.00 0.00 0.00 46.02 44.46 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 -1.59 6.93 -1.12 1.61 0.01 -1.24 -3.65 113.70 114.65 1yr3 s SER 34 Ca 0.00 2.04 -0.06 0.00 1.31 0.00 0.00 55.95 59.25 1yr3 s SER 34 Cb 0.00 -2.57 0.04 0.00 0.21 0.00 0.00 66.02 63.71 1yr3 s SER 34 CO 0.00 -0.64 0.30 0.61 0.41 0.00 0.00 173.24 173.92 1yr3 n GLY 35 N 3.50 -0.49 0.02 3.44 0.00 -1.19 -4.77 105.19 105.69 1yr3 n GLY 35 Ca 0.12 0.05 0.02 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 -3.34 0.33 0.00 0.99 4.77 -1.24 -4.62 117.00 113.89 1yr3 n LEU 36 Ca -0.06 -0.57 0.05 0.00 -0.03 0.00 0.00 56.01 55.40 1yr3 n LEU 36 Cb 0.56 0.00 0.22 0.00 -2.33 0.00 0.00 43.42 41.87 1yr3 n LEU 36 CO 0.37 0.08 0.64 0.61 -1.33 0.00 0.00 177.39 177.75 1yr3 n GLY 37 N 0.96 -0.76 0.00 -0.72 0.00 -1.26 -3.04 105.19 100.36 1yr3 n GLY 37 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -1.43 0.83 0.02 4.61 0.00 -1.26 -0.69 120.51 122.59 1yr3 n ALA 38 Ca 0.03 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.29 1yr3 n ALA 38 Cb 0.10 -0.81 -0.13 0.00 0.00 0.00 0.00 19.45 18.61 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 0.43 -0.21 0.00 5.85 -1.94 -3.26 115.31 116.18 1yr3 h LEU 39 Ca 0.00 -0.90 0.00 0.00 0.84 0.00 0.00 57.88 57.82 1yr3 h LEU 39 Cb 0.18 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.08 1yr3 h LEU 39 CO 0.00 1.29 0.12 0.00 -0.34 0.00 0.00 178.44 179.51 1yr3 n ALA 40 N -2.64 0.78 0.43 1.25 0.00 0.13 -0.70 120.51 119.77 1yr3 n ALA 40 Ca -0.12 0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.47 1yr3 n ALA 40 Cb 0.74 -0.82 0.36 0.00 0.00 0.00 0.00 19.45 19.73 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 -0.54 0.00 3.32 -1.65 -3.20 116.42 114.35 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 -2.62 4.05 -2.76 3.56 6.02 0.13 -4.95 117.38 120.81 1yr3 n GLN 42 Ca 0.04 -2.96 -0.42 0.00 -0.01 0.00 0.00 57.00 53.65 1yr3 n GLN 42 Cb 0.43 -2.01 -0.03 0.00 1.02 0.00 0.00 30.24 29.64 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 -2.36 4.86 0.20 5.09 1.01 -1.21 -4.86 121.20 123.93 1yr3 s ILE 43 Ca 0.50 1.95 -0.30 0.00 0.00 0.00 0.00 60.65 62.80 1yr3 s ILE 43 Cb 0.36 -4.27 -0.08 0.00 0.01 0.00 0.00 42.46 38.47 1yr3 s ILE 43 CO 0.18 0.10 1.20 -1.61 0.00 0.00 0.00 174.94 174.81 1yr3 s GLU 44 N 1.44 4.50 -1.46 2.79 2.02 0.13 -3.22 118.70 124.89 1yr3 s GLU 44 Ca 0.48 1.89 -0.06 0.00 0.02 0.00 0.00 54.97 57.30 1yr3 s GLU 44 Cb -0.19 -3.22 0.05 0.00 0.10 0.00 0.00 34.13 30.86 1yr3 s GLU 44 CO 0.22 -0.07 0.67 0.09 0.02 0.00 0.00 175.26 176.19 1yr3 n ASN 45 N 2.29 -2.00 -4.71 -0.19 4.13 -1.26 -1.70 115.26 111.82 1yr3 n ASN 45 Ca 0.04 -0.92 -0.42 0.00 1.68 0.00 0.00 54.58 54.96 1yr3 n ASN 45 Cb 0.44 -3.41 -0.03 0.00 -1.54 0.00 0.00 39.78 35.25 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 -3.63 3.47 -0.14 5.41 0.00 -1.20 -4.52 121.76 121.14 1yr3 s ALA 46 Ca 0.28 0.93 -0.01 0.00 0.00 0.00 0.00 51.96 53.15 1yr3 s ALA 46 Cb -0.14 -3.48 -0.02 0.00 0.00 0.00 0.00 23.12 19.47 1yr3 s ALA 46 CO 0.87 -0.52 -0.10 0.08 0.00 0.00 0.00 175.76 176.08 1yr3 s VAL 47 N 1.17 3.31 -0.20 0.00 1.01 0.04 -4.95 120.40 120.79 1yr3 s VAL 47 Ca 0.61 -0.56 -0.03 0.00 0.00 0.00 0.00 61.98 61.99 1yr3 s VAL 47 Cb -0.32 -2.42 -0.01 0.00 0.00 0.00 0.00 36.38 33.64 1yr3 s VAL 47 CO 0.29 0.51 -0.06 0.00 0.00 0.00 0.00 175.10 175.84 1yr3 s ALA 48 N 0.44 2.78 -0.19 5.51 0.00 -1.26 -1.00 121.76 128.03 1yr3 s ALA 48 Ca -0.08 -1.09 -0.02 0.00 0.00 0.00 0.00 51.96 50.77 1yr3 s ALA 48 Cb -0.15 -1.59 -0.01 0.00 0.00 0.00 0.00 23.12 21.37 1yr3 s ALA 48 CO 0.04 -0.25 -0.08 0.42 0.00 0.00 0.00 175.76 175.89 1yr3 s ILE 49 N 1.18 3.16 0.41 0.00 1.01 -0.61 -4.93 121.20 121.41 1yr3 s ILE 49 Ca 0.02 -0.58 -0.25 0.00 0.00 0.00 0.00 60.65 59.84 1yr3 s ILE 49 Cb -0.14 -2.40 -0.08 0.00 0.01 0.00 0.00 42.46 39.84 1yr3 s ILE 49 CO -0.02 0.46 1.21 -0.55 0.00 0.00 0.00 174.94 176.05 1yr3 s SER 50 N 1.17 6.40 0.60 3.58 0.15 -1.26 0.24 113.70 124.58 1yr3 s SER 50 Ca 0.02 2.44 0.31 0.00 0.70 0.00 0.00 55.95 59.42 1yr3 s SER 50 Cb -0.14 -2.62 1.84 0.00 -1.71 0.00 0.00 66.02 63.39 1yr3 s SER 50 CO -0.02 -0.77 2.23 1.88 1.20 0.00 0.00 173.24 177.76 1yr3 h TYR 51 N 2.58 0.00 0.00 3.44 0.05 0.28 0.16 116.97 123.48 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 0.00 178.16 178.57 1yr3 h GLU 52 N 0.00 0.00 -0.01 4.88 5.08 -1.90 -0.56 114.58 122.07 1yr3 h GLU 52 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1yr3 h GLU 52 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1yr3 h GLU 52 CO -0.00 0.01 -0.57 1.63 -1.00 0.00 0.00 179.01 179.07 1yr3 n LYS 53 N -3.45 0.54 -3.78 2.33 5.02 0.55 -4.78 118.16 114.59 1yr3 n LYS 53 Ca -0.03 -0.40 -0.36 0.00 -2.02 0.00 0.00 58.31 55.51 1yr3 n LYS 53 Cb 0.09 -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 -2.74 5.24 0.18 -0.35 1.43 -0.22 -5.00 118.68 117.23 1yr3 s LEU 54 Ca 0.15 -2.07 -0.33 0.00 -1.03 0.00 0.00 54.13 50.86 1yr3 s LEU 54 Cb 0.18 -1.82 -0.14 0.00 0.03 0.00 0.00 46.19 44.43 1yr3 s LEU 54 CO 0.67 -0.53 1.44 -0.81 0.23 0.00 0.00 176.35 177.35 1yr3 n PRO 55 N 4.54 1.90 0.00 1.29 -0.04 -1.26 -1.76 135.00 139.67 1yr3 n PRO 55 Ca -0.02 0.68 0.00 0.00 -0.04 0.00 0.00 63.50 64.12 1yr3 n PRO 55 Cb 0.41 -2.37 0.00 0.00 -0.04 0.00 0.00 33.50 31.51 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 2.68 3.09 3.76 0.55 0.00 -1.26 -4.63 105.19 109.38 1yr3 n GLY 56 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.71 2.54 -1.15 1.61 0.40 -0.72 -4.59 117.98 113.36 1yr3 s PHE 57 Ca 0.00 1.52 -0.23 0.00 -0.60 0.00 0.00 56.93 57.61 1yr3 s PHE 57 Cb 0.00 -3.43 -0.10 0.00 0.51 0.00 0.00 43.02 40.00 1yr3 s PHE 57 CO 0.00 -1.96 1.96 -2.14 0.70 0.00 0.00 175.22 173.78 1yr3 s PRO 58 N -3.18 2.37 -0.20 0.24 0.02 -1.26 -4.94 135.00 128.06 1yr3 s PRO 58 Ca 0.73 -1.01 -0.34 0.00 0.02 0.00 0.00 61.00 60.40 1yr3 s PRO 58 Cb -0.29 -5.20 -0.11 0.00 0.02 0.00 0.00 34.50 28.92 1yr3 s PRO 58 CO 0.32 -4.07 2.00 0.28 -0.33 0.00 0.00 177.00 175.20 1yr3 n VAL 59 N 7.93 0.42 -1.28 3.83 0.31 -1.26 -4.79 118.33 123.49 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 -1.84 0.09 0.00 -0.91 0.00 0.00 33.84 31.64 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 8.04 -0.02 0.00 4.52 2.88 -1.26 -4.93 113.62 122.84 1yr3 n SER 60 Ca 0.29 0.63 0.00 0.00 -1.33 0.00 0.00 58.87 58.46 1yr3 n SER 60 Cb 0.28 -1.36 0.00 0.00 -0.75 0.00 0.00 64.21 62.38 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 -2.59 0.00 -4.61 2.46 -2.24 -1.26 -5.06 114.28 100.98 1yr3 n THR 61 Ca 0.12 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.60 1yr3 n THR 61 Cb 0.50 0.82 -0.13 0.00 -2.10 0.00 0.00 70.33 69.42 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 0.20 2.28 1.01 -1.26 -5.12 120.40 120.14 1yr3 s VAL 62 Ca 0.00 -1.34 -0.30 0.00 0.00 0.00 0.00 61.98 60.34 1yr3 s VAL 62 Cb 0.00 -2.12 -0.08 0.00 0.00 0.00 0.00 36.38 34.17 1yr3 s VAL 62 CO 0.00 0.27 1.24 -1.00 0.00 0.00 0.00 175.10 175.61 1yr3 s HIS 63 N -0.96 3.36 0.00 5.22 3.76 -1.26 -3.00 115.29 122.41 1yr3 s HIS 63 Ca 0.15 1.37 0.00 0.00 -0.15 0.00 0.00 55.06 56.42 1yr3 s HIS 63 Cb -0.10 -3.49 0.00 0.00 1.11 0.00 0.00 32.58 30.09 1yr3 s HIS 63 CO 0.06 -1.44 0.00 0.41 -0.85 0.00 0.00 174.74 172.92 1yr3 n GLY 64 N 2.14 0.60 2.85 -2.22 0.00 -1.26 -4.84 105.19 102.46 1yr3 n GLY 64 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.08 1.48 -0.03 1.61 4.02 -1.16 -3.20 115.29 115.92 1yr3 s HIS 65 Ca 0.00 -0.95 -0.05 0.00 1.02 0.00 0.00 55.06 55.08 1yr3 s HIS 65 Cb 0.00 -1.21 -0.03 0.00 -1.02 0.00 0.00 32.58 30.32 1yr3 s HIS 65 CO 0.00 -0.58 0.32 0.00 1.02 0.00 0.00 174.74 175.49 1yr3 h ALA 66 N 8.16 -0.29 0.00 -1.40 0.00 -1.85 -3.44 119.26 120.44 1yr3 h ALA 66 Ca -0.22 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1yr3 h ALA 66 Cb 1.11 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1yr3 h ALA 66 CO 0.37 -0.28 0.00 0.41 0.00 0.00 0.00 179.25 179.76 1yr3 n GLY 67 N 1.09 1.30 3.36 0.00 0.00 -1.03 -4.59 105.19 105.33 1yr3 n GLY 67 Ca -0.02 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 1.36 -0.29 1.61 2.02 -1.18 0.24 118.70 122.46 1yr3 s GLU 68 Ca 0.00 -1.49 0.02 0.00 0.02 0.00 0.00 54.97 53.52 1yr3 s GLU 68 Cb 0.00 -1.42 0.07 0.00 0.10 0.00 0.00 34.13 32.87 1yr3 s GLU 68 CO 0.00 0.28 -0.05 -1.17 0.02 0.00 0.00 175.26 174.35 1yr3 s LEU 69 N -2.84 3.84 -0.21 1.80 2.96 0.14 -1.34 118.68 123.03 1yr3 s LEU 69 Ca 0.19 -1.53 -0.14 0.00 -0.22 0.00 0.00 54.13 52.43 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 -0.25 0.30 -0.69 -1.32 0.00 0.00 176.35 174.47 1yr3 s VAL 70 N 1.10 5.27 -0.09 1.68 1.01 0.10 -1.57 120.40 127.90 1yr3 s VAL 70 Ca -0.04 0.51 0.03 0.00 0.00 0.00 0.00 61.98 62.48 1yr3 s VAL 70 Cb -0.20 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.53 1yr3 s VAL 70 CO -0.05 0.31 -0.19 -0.76 0.00 0.00 0.00 175.10 174.42 1yr3 s LEU 71 N 1.05 2.42 0.00 3.92 1.02 -0.17 0.18 118.68 127.10 1yr3 s LEU 71 Ca 0.15 -0.39 0.00 0.00 0.02 0.00 0.00 54.13 53.90 1yr3 s LEU 71 Cb -0.14 -1.49 0.00 0.00 0.02 0.00 0.00 46.19 44.58 1yr3 s LEU 71 CO 0.06 0.23 0.00 0.61 0.02 0.00 0.00 176.35 177.26 1yr3 n GLY 72 N 3.10 -0.78 3.32 -3.19 0.00 -0.53 -0.78 105.19 106.33 1yr3 n GLY 72 Ca -0.18 -0.32 -0.28 0.00 0.00 0.00 0.00 46.02 45.24 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 2.14 -0.12 1.61 3.76 -0.69 0.43 115.29 118.42 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 -1.24 0.06 0.00 1.11 0.00 0.00 32.58 32.50 1yr3 s HIS 73 CO 0.00 0.17 0.16 -1.17 -0.85 0.00 0.00 174.74 173.05 1yr3 s LEU 74 N -1.46 -0.02 -1.40 0.89 2.96 -0.22 0.17 118.68 119.62 1yr3 s LEU 74 Ca 0.11 0.08 -0.07 0.00 -0.22 0.00 0.00 54.13 54.03 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 -0.28 0.88 0.00 -1.32 0.00 0.00 176.35 175.66 1yr3 n GLN 75 N 5.32 -6.28 -1.70 1.98 1.13 -1.26 -1.07 117.38 115.49 1yr3 n GLN 75 Ca -0.05 0.83 -0.16 0.00 -1.94 0.00 0.00 57.00 55.68 1yr3 n GLN 75 Cb 0.50 -5.71 -0.05 0.00 0.11 0.00 0.00 30.24 25.09 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 -1.74 1.11 3.30 1.08 0.00 -1.26 -4.83 105.19 102.85 1yr3 n GLY 76 Ca -0.05 -0.23 -0.33 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.66 2.86 0.25 1.61 1.01 -0.23 -5.06 120.40 118.17 1yr3 s VAL 77 Ca 0.00 -0.70 -0.31 0.00 0.00 0.00 0.00 61.98 60.97 1yr3 s VAL 77 Cb 0.00 -2.22 -0.11 0.00 0.00 0.00 0.00 36.38 34.05 1yr3 s VAL 77 CO 0.00 0.50 1.60 -2.16 0.00 0.00 0.00 175.10 175.05 1yr3 s PRO 78 N 0.80 4.15 -0.07 2.72 0.04 -1.26 -1.06 135.00 140.32 1yr3 s PRO 78 Ca -0.05 2.52 -0.08 0.00 0.04 0.00 0.00 61.00 63.44 1yr3 s PRO 78 Cb -0.15 -3.06 0.02 0.00 0.04 0.00 0.00 34.50 31.35 1yr3 s PRO 78 CO 0.01 -0.63 0.21 0.08 0.04 0.00 0.00 177.00 176.71 1yr3 s VAL 79 N 0.42 0.01 -0.26 -0.36 1.01 0.17 -1.26 120.40 120.12 1yr3 s VAL 79 Ca 0.66 -0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.55 1yr3 s VAL 79 Cb -0.47 -0.33 0.03 0.00 0.00 0.00 0.00 36.38 35.61 1yr3 s VAL 79 CO 0.41 -0.04 -0.05 0.54 0.00 0.00 0.00 175.10 175.96 1yr3 s VAL 80 N -0.06 2.85 -0.18 2.92 0.11 -0.89 -1.45 120.40 123.71 1yr3 s VAL 80 Ca -0.02 -1.12 -0.03 0.00 -2.93 0.00 0.00 61.98 57.88 1yr3 s VAL 80 Cb -0.02 -2.50 -0.01 0.00 -1.53 0.00 0.00 36.38 32.32 1yr3 s VAL 80 CO 0.01 0.13 -0.07 0.00 -3.33 0.00 0.00 175.10 171.84 1yr3 s MET 82 N 0.88 3.13 -0.76 0.00 -1.94 0.26 0.02 119.30 120.89 1yr3 s MET 82 Ca -0.02 -0.91 -0.24 0.00 -1.71 0.00 0.00 55.69 52.81 1yr3 s MET 82 Cb -0.15 -4.13 0.05 0.00 2.01 0.00 0.00 34.83 32.61 1yr3 s MET 82 CO 0.01 -1.34 1.18 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 -0.45 0.13 119.74 128.56 1yr3 s LYS 83 Ca 0.16 -0.65 0.00 0.00 0.02 0.00 0.00 55.97 55.50 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 0.11 -2.02 0.00 0.41 -0.92 0.00 0.00 175.35 172.94 1yr3 n GLY 84 N 5.55 2.36 0.95 -3.33 0.00 -0.08 -2.47 105.19 108.17 1yr3 n GLY 84 Ca 0.06 -1.48 -0.08 0.00 0.00 0.00 0.00 46.02 44.51 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 1.86 1.63 -4.98 1.61 1.85 -1.26 -4.81 116.66 112.56 1yr3 n ARG 85 Ca 0.00 -0.95 -0.29 0.00 -1.00 0.00 0.00 57.85 55.61 1yr3 n ARG 85 Cb 0.00 0.24 -0.15 0.00 -1.05 0.00 0.00 32.46 31.50 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 -1.78 1.20 0.37 2.89 0.00 -1.26 -4.86 107.32 103.88 1yr3 s GLY 86 Ca 0.01 -1.08 0.08 0.00 0.00 0.00 0.00 44.72 43.73 1yr3 s GLY 86 CO 0.01 -0.95 0.05 0.30 0.00 0.00 0.00 173.10 172.51 1yr3 s HIS 87 N -0.66 2.55 0.01 1.90 0.09 -1.26 -4.71 115.29 113.20 1yr3 s HIS 87 Ca 0.09 -0.52 -0.25 0.00 -0.00 0.00 0.00 55.06 54.38 1yr3 s HIS 87 Cb -0.09 -1.66 -0.18 0.00 -0.00 0.00 0.00 32.58 30.65 1yr3 s HIS 87 CO 0.00 0.40 1.36 0.35 -0.00 0.00 0.00 174.74 176.85 1yr3 h PHE 88 N 1.71 -0.10 0.00 1.40 3.57 -1.85 -3.00 116.94 118.68 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 0.03 0.00 0.00 2.79 0.00 0.00 35.95 40.02 1yr3 h PHE 88 CO 0.69 0.25 0.12 2.48 -2.23 0.00 0.00 178.31 179.63 1yr3 n TYR 89 N -4.97 0.00 0.64 0.41 0.18 -1.24 -0.36 117.16 111.81 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 0.21 -0.16 0.46 0.00 -0.38 0.00 0.00 39.34 39.47 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 -1.06 0.18 -1.11 -3.48 1.02 -1.13 -4.77 120.64 110.28 1yr3 n GLU 90 Ca 0.00 0.22 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 1yr3 n GLU 90 Cb 0.12 -1.74 0.00 0.00 -0.02 0.00 0.00 31.44 29.80 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 1.00 0.79 0.22 0.62 0.00 0.51 -4.97 105.19 103.35 1yr3 n GLY 91 Ca 0.05 -0.65 0.04 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.59 2.64 0.00 1.61 1.74 -1.26 -5.11 116.66 114.69 1yr3 n ARG 92 Ca 0.00 -1.94 0.00 0.00 -0.77 0.00 0.00 57.85 55.14 1yr3 n ARG 92 Cb 0.22 -1.22 0.00 0.00 -1.02 0.00 0.00 32.46 30.44 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 -0.46 -0.76 0.00 -0.13 0.00 -1.26 -4.42 105.19 98.16 1yr3 n GLY 93 Ca 0.07 -1.66 0.02 0.00 0.00 0.00 0.00 46.02 44.46 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 -0.71 0.02 -0.03 1.61 2.81 -1.26 -2.24 117.12 117.31 1yr3 n MET 94 Ca 0.00 0.37 0.12 0.00 -1.81 0.00 0.00 57.70 56.39 1yr3 n MET 94 Cb 0.00 -1.50 0.53 0.00 -0.71 0.00 0.00 33.22 31.54 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 -1.45 0.08 -0.17 2.03 -2.24 -1.26 -4.36 114.28 106.91 1yr3 n THR 95 Ca 0.02 -0.23 0.21 0.00 -2.27 0.00 0.00 64.05 61.78 1yr3 n THR 95 Cb 0.06 0.24 0.60 0.00 -2.10 0.00 0.00 70.33 69.13 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 1.75 0.67 0.00 2.28 2.10 -1.66 -2.47 117.51 120.19 1yr3 h ILE 96 Ca 0.00 -0.08 0.00 0.00 1.08 0.00 0.00 64.86 65.86 1yr3 h ILE 96 Cb 0.38 0.43 0.00 0.00 -1.09 0.00 0.00 36.82 36.53 1yr3 h ILE 96 CO 0.00 0.04 -1.36 0.23 -1.08 0.00 0.00 178.15 175.98 1yr3 n MET 97 N -4.42 0.26 0.01 2.19 2.81 -1.26 -4.62 117.12 112.08 1yr3 n MET 97 Ca 0.17 -0.07 -0.09 0.00 -1.81 0.00 0.00 57.70 55.89 1yr3 n MET 97 Cb 0.73 -1.51 -0.06 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 -0.99 2.03 2.02 -1.72 -0.69 112.91 113.55 1yr3 h THR 98 Ca 0.00 0.00 0.23 0.00 0.77 0.00 0.00 66.41 67.41 1yr3 h THR 98 Cb 0.69 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 67.02 1yr3 h THR 98 CO 0.00 0.00 0.63 0.44 0.37 0.00 0.00 175.52 176.96 1yr3 h ASP 99 N -0.36 0.51 0.67 4.18 3.32 -1.85 0.48 116.42 123.38 1yr3 h ASP 99 Ca 0.01 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 1yr3 h ASP 99 Cb 0.41 -0.02 0.01 0.00 0.22 0.00 0.00 39.33 39.95 1yr3 h ASP 99 CO -0.24 0.16 -0.32 0.00 -1.72 0.00 0.00 179.24 177.12 1yr3 h ALA 100 N 1.62 -0.90 -0.66 3.45 0.00 -1.58 0.11 119.26 121.31 1yr3 h ALA 100 Ca 0.55 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.31 1yr3 h ALA 100 Cb 1.25 0.35 -0.05 0.00 0.00 0.00 0.00 17.79 19.34 1yr3 h ALA 100 CO -0.28 -0.99 0.37 0.82 0.00 0.00 0.00 179.25 179.18 1yr3 h ILE 101 N -0.94 0.98 -0.17 0.00 5.03 0.40 1.00 117.51 123.80 1yr3 h ILE 101 Ca -0.09 -0.24 0.05 0.00 -0.12 0.00 0.00 64.86 64.46 1yr3 h ILE 101 Cb 0.70 0.23 -0.01 0.00 -3.03 0.00 0.00 36.82 34.72 1yr3 h ILE 101 CO 0.15 0.13 0.14 0.03 -0.68 0.00 0.00 178.15 177.92 1yr3 h ARG 102 N 0.69 0.00 -0.06 2.37 3.08 0.20 -0.76 114.38 119.90 1yr3 h ARG 102 Ca 0.29 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.32 1yr3 h ARG 102 Cb 0.16 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.21 1yr3 h ARG 102 CO -0.17 0.00 -0.05 1.15 -1.07 0.00 0.00 179.97 179.83 1yr3 h THR 103 N 0.00 1.36 -0.48 2.04 2.02 0.18 -2.43 112.91 115.60 1yr3 h THR 103 Ca 0.08 -1.17 0.10 0.00 0.77 0.00 0.00 66.41 66.19 1yr3 h THR 103 Cb 0.36 2.01 -0.10 0.00 -1.74 0.00 0.00 68.15 68.68 1yr3 h THR 103 CO -0.00 0.32 -0.18 -0.26 0.37 0.00 0.00 175.52 175.77 1yr3 h PHE 104 N -0.28 -0.43 -0.29 3.16 0.04 -0.51 0.95 116.94 119.58 1yr3 h PHE 104 Ca 0.01 0.05 0.07 0.00 2.80 0.00 0.00 57.97 60.90 1yr3 h PHE 104 Cb 0.54 0.26 -0.07 0.00 2.20 0.00 0.00 35.95 38.88 1yr3 h PHE 104 CO 0.09 -0.27 -0.18 -0.22 -0.60 0.00 0.00 178.31 177.13 1yr3 h LYS 105 N -0.07 -0.15 -0.72 1.51 1.63 -1.21 -2.18 116.57 115.37 1yr3 h LYS 105 Ca 0.23 0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 60.00 1yr3 h LYS 105 Cb 0.42 0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.05 1yr3 h LYS 105 CO -0.53 -0.10 0.32 -0.07 -3.45 0.00 0.00 179.45 175.62 1yr3 h LEU 106 N -0.15 0.97 -1.97 5.20 3.38 -0.76 -1.98 115.31 119.99 1yr3 h LEU 106 Ca 0.15 -0.15 0.05 0.00 0.09 0.00 0.00 57.88 58.02 1yr3 h LEU 106 Cb 0.39 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1yr3 h LEU 106 CO -0.38 0.86 0.39 -0.07 0.09 0.00 0.00 178.44 179.32 1yr3 h LEU 107 N 1.02 0.00 0.00 1.67 3.38 -0.21 -3.44 115.31 117.73 1yr3 h LEU 107 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1yr3 h LEU 107 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1yr3 h LEU 107 CO -0.03 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.11 1yr3 n GLY 108 N -1.34 0.74 3.54 0.83 0.00 -0.74 -4.31 105.19 103.90 1yr3 n GLY 108 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.03 2.19 -3.55 0.00 0.28 0.17 -4.79 120.64 114.90 1yr3 n GLU 110 Ca 0.11 -0.50 -0.14 0.00 -0.16 0.00 0.00 57.16 56.47 1yr3 n GLU 110 Cb 0.43 -1.15 -0.06 0.00 1.43 0.00 0.00 31.44 32.09 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 -2.04 -0.52 -0.22 -1.84 0.05 -1.07 -4.18 118.68 108.86 1yr3 s LEU 111 Ca 0.09 0.59 -0.05 0.00 0.05 0.00 0.00 54.13 54.81 1yr3 s LEU 111 Cb 0.10 2.21 -0.02 0.00 -2.05 0.00 0.00 46.19 46.44 1yr3 s LEU 111 CO 0.38 -0.47 -0.00 -0.22 -0.55 0.00 0.00 176.35 175.49 1yr3 s LEU 112 N -1.09 3.13 -0.59 1.48 2.96 0.38 -1.15 118.68 123.79 1yr3 s LEU 112 Ca -0.06 -0.29 -0.12 0.00 -0.22 0.00 0.00 54.13 53.43 1yr3 s LEU 112 Cb -0.00 -1.81 0.15 0.00 0.50 0.00 0.00 46.19 45.03 1yr3 s LEU 112 CO 0.06 0.00 0.51 0.12 -1.32 0.00 0.00 176.35 175.72 1yr3 s PHE 113 N 1.37 3.44 -0.24 5.38 5.99 0.49 -0.72 117.98 133.69 1yr3 s PHE 113 Ca 0.05 -1.74 -0.19 0.00 0.00 0.00 0.00 56.93 55.04 1yr3 s PHE 113 Cb -0.15 -3.67 -0.02 0.00 0.00 0.00 0.00 43.02 39.18 1yr3 s PHE 113 CO 0.00 -0.99 0.57 0.00 -0.00 0.00 0.00 175.22 174.80 1yr3 s THR 115 N 2.24 3.35 -0.23 0.00 -4.23 -1.07 -1.18 115.64 114.52 1yr3 s THR 115 Ca 0.24 -1.89 -0.29 0.00 -1.18 0.00 0.00 61.69 58.58 1yr3 s THR 115 Cb -0.16 -2.77 0.16 0.00 1.34 0.00 0.00 72.50 71.08 1yr3 s THR 115 CO 0.09 -0.32 1.20 0.54 -0.54 0.00 0.00 174.62 175.58 1yr3 s ASN 116 N -3.50 -0.20 0.04 3.99 4.22 -1.14 -4.14 114.94 114.21 1yr3 s ASN 116 Ca 0.30 0.24 -0.24 0.00 -2.14 0.00 0.00 52.86 51.03 1yr3 s ASN 116 Cb -0.07 0.19 -0.06 0.00 1.28 0.00 0.00 41.25 42.60 1yr3 s ASN 116 CO 0.19 -0.17 0.72 0.00 -2.04 0.00 0.00 177.10 175.80 1yr3 s ALA 117 N -0.92 3.41 0.29 3.54 0.00 -1.26 -0.52 121.76 126.30 1yr3 s ALA 117 Ca 0.04 0.21 0.05 0.00 0.00 0.00 0.00 51.96 52.26 1yr3 s ALA 117 Cb -0.01 -2.92 -0.02 0.00 0.00 0.00 0.00 23.12 20.17 1yr3 s ALA 117 CO -0.04 0.11 0.29 0.00 0.00 0.00 0.00 175.76 176.11 1yr3 n ALA 118 N 2.69 0.39 -2.58 0.00 0.00 -0.80 -4.78 120.51 115.43 1yr3 n ALA 118 Ca -0.04 -1.59 -0.29 0.00 0.00 0.00 0.00 53.44 51.52 1yr3 n ALA 118 Cb 0.50 1.29 -0.10 0.00 0.00 0.00 0.00 19.45 21.14 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 -2.95 1.77 0.06 0.00 0.00 -0.43 -0.86 107.32 104.90 1yr3 s GLY 119 Ca 0.32 -1.32 -0.11 0.00 0.00 0.00 0.00 44.72 43.61 1yr3 s GLY 119 CO 0.22 -1.31 0.40 -0.45 0.00 0.00 0.00 173.10 171.96 1yr3 s SER 120 N -2.42 6.68 0.00 1.64 0.15 -0.36 -1.62 113.70 117.76 1yr3 s SER 120 Ca 0.22 0.83 0.13 0.00 0.70 0.00 0.00 55.95 57.83 1yr3 s SER 120 Cb -0.10 -2.19 0.18 0.00 -1.71 0.00 0.00 66.02 62.19 1yr3 s SER 120 CO 0.14 0.21 1.02 0.18 1.20 0.00 0.00 173.24 176.00 1yr3 n LEU 121 N 1.13 2.37 -4.19 3.45 4.77 0.35 -0.12 117.00 124.76 1yr3 n LEU 121 Ca -0.10 -1.31 -0.33 0.00 -0.03 0.00 0.00 56.01 54.25 1yr3 n LEU 121 Cb 0.52 -0.08 -0.16 0.00 -2.33 0.00 0.00 43.42 41.37 1yr3 n LEU 121 CO 0.41 0.50 -0.51 -0.13 -1.33 0.00 0.00 177.39 176.33 1yr3 s ARG 122 N -1.04 3.09 0.52 3.23 0.52 -1.25 -4.93 118.95 119.09 1yr3 s ARG 122 Ca 0.18 -0.80 0.18 0.00 -0.52 0.00 0.00 55.73 54.77 1yr3 s ARG 122 Cb 0.12 -2.57 1.31 0.00 0.52 0.00 0.00 34.95 34.33 1yr3 s ARG 122 CO 0.17 -0.08 2.14 -1.35 0.02 0.00 0.00 175.30 176.20 1yr3 h PRO 123 N 7.57 0.00 -0.79 3.54 0.11 -1.96 -2.12 132.00 138.35 1yr3 h PRO 123 Ca -0.37 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.79 1yr3 h PRO 123 Cb 1.17 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.23 1yr3 h PRO 123 CO 0.59 0.03 0.48 1.05 -0.21 0.00 0.00 178.00 179.94 1yr3 h GLU 124 N 0.00 0.87 -5.08 1.05 4.11 -2.01 -3.39 114.58 110.14 1yr3 h GLU 124 Ca -0.00 -0.05 -0.63 0.00 0.07 0.00 0.00 59.36 58.75 1yr3 h GLU 124 Cb 0.05 -0.20 -0.15 0.00 0.50 0.00 0.00 28.75 28.95 1yr3 h GLU 124 CO 0.00 0.58 -0.34 0.08 0.07 0.00 0.00 179.01 179.40 1yr3 s VAL 125 N -6.08 5.23 0.14 -1.06 1.01 -0.80 -5.07 120.40 113.76 1yr3 s VAL 125 Ca -0.13 0.43 0.01 0.00 0.00 0.00 0.00 61.98 62.29 1yr3 s VAL 125 Cb 0.17 -3.64 0.01 0.00 0.00 0.00 0.00 36.38 32.92 1yr3 s VAL 125 CO 0.78 0.20 0.07 0.61 0.00 0.00 0.00 175.10 176.76 1yr3 n GLY 126 N 4.76 3.34 3.65 4.51 0.00 -1.26 -4.65 105.19 115.53 1yr3 n GLY 126 Ca -0.11 -2.22 -0.46 0.00 0.00 0.00 0.00 46.02 43.24 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 -2.66 0.68 -0.09 4.61 0.00 -1.26 -2.15 120.51 119.64 1yr3 n ALA 127 Ca -0.05 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1yr3 n ALA 127 Cb 0.16 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.40 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 2.10 0.64 3.88 0.00 0.00 -0.44 -4.96 105.19 106.40 1yr3 n GLY 128 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.66 6.34 -0.03 1.61 0.01 -0.92 -4.17 113.70 113.89 1yr3 s SER 129 Ca 0.00 1.24 0.04 0.00 1.31 0.00 0.00 55.95 58.54 1yr3 s SER 129 Cb 0.00 -2.38 -0.03 0.00 0.21 0.00 0.00 66.02 63.82 1yr3 s SER 129 CO 0.00 -0.66 -0.13 -0.76 0.41 0.00 0.00 173.24 172.10 1yr3 s LEU 130 N -4.67 2.82 -0.07 2.44 1.43 -1.26 -1.00 118.68 118.37 1yr3 s LEU 130 Ca 0.53 -0.21 0.01 0.00 -1.03 0.00 0.00 54.13 53.42 1yr3 s LEU 130 Cb -0.11 -1.61 0.02 0.00 0.03 0.00 0.00 46.19 44.53 1yr3 s LEU 130 CO 0.44 0.32 -0.08 -0.69 0.23 0.00 0.00 176.35 176.58 1yr3 s VAL 131 N -0.82 0.85 -0.44 -1.59 1.01 -0.39 -3.78 120.40 115.24 1yr3 s VAL 131 Ca 0.13 -0.27 -0.22 0.00 0.00 0.00 0.00 61.98 61.63 1yr3 s VAL 131 Cb -0.11 -0.84 0.02 0.00 0.00 0.00 0.00 36.38 35.46 1yr3 s VAL 131 CO 0.03 0.31 0.72 0.00 0.00 0.00 0.00 175.10 176.15 1yr3 s ALA 132 N 1.09 3.32 0.26 5.51 0.00 -0.44 -0.29 121.76 131.21 1yr3 s ALA 132 Ca -0.08 -1.09 -0.30 0.00 0.00 0.00 0.00 51.96 50.49 1yr3 s ALA 132 Cb -0.14 -3.39 -0.10 0.00 0.00 0.00 0.00 23.12 19.49 1yr3 s ALA 132 CO -0.01 -1.85 1.35 -0.51 0.00 0.00 0.00 175.76 174.74 1yr3 s LEU 133 N 3.06 4.41 0.00 0.00 1.43 -0.76 -2.28 118.68 124.54 1yr3 s LEU 133 Ca 0.26 2.58 0.07 0.00 -1.03 0.00 0.00 54.13 56.02 1yr3 s LEU 133 Cb -0.13 -3.63 0.03 0.00 0.03 0.00 0.00 46.19 42.49 1yr3 s LEU 133 CO 0.21 -0.58 0.63 2.29 0.23 0.00 0.00 176.35 179.13 1yr3 n LYS 134 N 1.92 0.98 0.00 1.70 2.85 -0.32 -4.61 118.16 120.67 1yr3 n LYS 134 Ca 0.04 -0.74 0.00 0.00 -1.05 0.00 0.00 58.31 56.57 1yr3 n LYS 134 Cb 0.42 -1.07 0.00 0.00 -0.65 0.00 0.00 35.03 33.73 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 0.09 0.00 -3.93 -5.58 -0.08 -1.26 -4.62 116.55 101.17 1yr3 n ASP 135 Ca 0.04 0.00 -0.09 0.00 -1.51 0.00 0.00 54.79 53.22 1yr3 n ASP 135 Cb 0.16 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 43.55 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 0.32 -0.28 -0.67 -3.43 -1.26 -1.14 115.29 106.84 1yr3 s HIS 136 Ca 0.00 -0.72 0.02 0.00 -0.80 0.00 0.00 55.06 53.56 1yr3 s HIS 136 Cb 0.00 -0.10 0.07 0.00 -1.43 0.00 0.00 32.58 31.13 1yr3 s HIS 136 CO 0.00 -0.61 -0.03 0.42 -2.00 0.00 0.00 174.74 172.52 1yr3 s ILE 137 N -3.92 1.81 0.12 -5.38 1.01 0.90 -4.90 121.20 110.83 1yr3 s ILE 137 Ca 0.12 -1.63 -0.30 0.00 0.00 0.00 0.00 60.65 58.84 1yr3 s ILE 137 Cb 0.04 -2.13 -0.07 0.00 0.01 0.00 0.00 42.46 40.32 1yr3 s ILE 137 CO -0.05 -0.27 1.17 0.21 0.00 0.00 0.00 174.94 176.00 1yr3 s ASN 138 N 1.22 7.13 0.00 3.58 2.47 -1.26 -1.84 114.94 126.23 1yr3 s ASN 138 Ca -0.01 2.08 0.00 0.00 0.42 0.00 0.00 52.86 55.35 1yr3 s ASN 138 Cb -0.19 -2.59 0.00 0.00 -1.45 0.00 0.00 41.25 37.02 1yr3 s ASN 138 CO -0.08 -0.39 0.00 0.41 -3.72 0.00 0.00 177.10 173.32 1yr3 n THR 139 N 3.25 0.00 -2.02 -5.21 -1.04 -1.13 -4.89 114.28 103.24 1yr3 n THR 139 Ca 0.06 -0.38 -0.35 0.00 -2.04 0.00 0.00 64.05 61.35 1yr3 n THR 139 Cb 0.46 0.92 0.03 0.00 -1.82 0.00 0.00 70.33 69.91 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 -1.02 3.01 -0.04 -2.82 -1.94 -1.25 -4.72 119.30 110.51 1yr3 s MET 140 Ca 0.00 1.71 -0.30 0.00 -1.71 0.00 0.00 55.69 55.39 1yr3 s MET 140 Cb 0.00 -1.95 -0.05 0.00 2.01 0.00 0.00 34.83 34.85 1yr3 s MET 140 CO 0.00 -1.14 1.39 -1.25 -0.01 0.00 0.00 175.02 174.01 1yr3 s PRO 141 N -3.44 4.27 0.87 2.03 0.04 -1.26 -4.83 135.00 132.68 1yr3 s PRO 141 Ca 0.75 1.91 0.00 0.00 0.04 0.00 0.00 61.00 63.70 1yr3 s PRO 141 Cb -0.27 -3.66 0.00 0.00 0.04 0.00 0.00 34.50 30.61 1yr3 s PRO 141 CO 0.33 -0.62 0.00 0.41 0.04 0.00 0.00 177.00 177.16 1yr3 n GLY 142 N 3.67 -2.13 3.13 0.56 0.00 -1.26 -4.85 105.19 104.31 1yr3 n GLY 142 Ca 0.14 -1.45 -0.09 0.00 0.00 0.00 0.00 46.02 44.62 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 -0.13 0.23 0.36 2.61 -4.23 -1.26 -5.00 115.64 108.22 1yr3 s THR 143 Ca 0.00 -1.87 0.04 0.00 -1.18 0.00 0.00 61.69 58.68 1yr3 s THR 143 Cb 0.00 -1.76 0.27 0.00 1.34 0.00 0.00 72.50 72.36 1yr3 s THR 143 CO 0.00 -0.77 2.00 -0.65 -0.54 0.00 0.00 174.62 174.66 1yr3 h PRO 144 N 3.01 0.79 -0.01 3.99 0.11 -1.89 -2.92 132.00 135.08 1yr3 h PRO 144 Ca -0.35 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1yr3 h PRO 144 Cb 1.17 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1yr3 h PRO 144 CO 0.63 0.52 -0.05 -1.33 -0.21 0.00 0.00 178.00 177.56 1yr3 n MET 145 N -4.45 1.42 -1.68 1.05 2.81 -1.26 -4.61 117.12 110.39 1yr3 n MET 145 Ca 0.08 -0.78 -0.45 0.00 -1.81 0.00 0.00 57.70 54.73 1yr3 n MET 145 Cb 0.10 -1.48 -0.04 0.00 -0.71 0.00 0.00 33.22 31.09 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 -0.11 0.35 0.00 2.03 0.31 -1.10 -4.66 118.33 115.14 1yr3 n VAL 146 Ca 0.18 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 1yr3 n VAL 146 Cb 0.33 -1.88 0.00 0.00 -0.91 0.00 0.00 33.84 31.39 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 4.06 0.64 3.77 2.92 0.00 -1.26 -5.02 105.19 110.30 1yr3 n GLY 147 Ca 0.19 -2.11 -0.40 0.00 0.00 0.00 0.00 46.02 43.70 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 4.27 0.12 0.99 1.43 -1.26 -4.96 118.68 119.26 1yr3 s LEU 148 Ca 0.00 2.91 -0.19 0.00 -1.03 0.00 0.00 54.13 55.82 1yr3 s LEU 148 Cb 0.00 -3.76 -0.07 0.00 0.03 0.00 0.00 46.19 42.39 1yr3 s LEU 148 CO 0.00 -0.90 0.61 0.21 0.23 0.00 0.00 176.35 176.51 1yr3 s ASN 149 N -0.37 7.07 -1.02 2.29 2.47 -1.26 -5.02 114.94 119.11 1yr3 s ASN 149 Ca 0.55 1.31 -0.14 0.00 0.42 0.00 0.00 52.86 55.00 1yr3 s ASN 149 Cb -0.44 -2.38 0.20 0.00 -1.45 0.00 0.00 41.25 37.19 1yr3 s ASN 149 CO 0.58 0.21 1.11 -0.62 -3.72 0.00 0.00 177.10 174.66 1yr3 s ASP 150 N -1.28 6.94 0.54 -4.21 -1.08 -1.26 -4.88 116.67 111.44 1yr3 s ASP 150 Ca 0.33 -2.81 0.48 0.00 -0.52 0.00 0.00 52.55 50.03 1yr3 s ASP 150 Cb -0.19 -2.31 1.65 0.00 -1.46 0.00 0.00 42.92 40.62 1yr3 s ASP 150 CO 0.20 -0.68 1.49 0.47 0.52 0.00 0.00 175.17 177.18 1yr3 n ASP 151 N 4.77 0.00 -0.20 -0.34 8.00 -1.26 -0.19 116.55 127.34 1yr3 n ASP 151 Ca 0.25 0.95 0.02 0.00 0.71 0.00 0.00 54.79 56.72 1yr3 n ASP 151 Cb 0.45 -0.47 0.28 0.00 -0.02 0.00 0.00 41.12 41.35 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 0.90 0.00 -1.24 3.08 -2.03 -3.31 114.38 111.79 1yr3 h ARG 152 Ca 0.90 -0.05 -0.32 0.00 0.07 0.00 0.00 59.98 60.57 1yr3 h ARG 152 Cb 3.63 -0.20 -0.06 0.00 0.08 0.00 0.00 29.97 33.42 1yr3 h ARG 152 CO -0.01 0.60 -2.21 1.19 -1.07 0.00 0.00 179.97 178.47 1yr3 n PHE 153 N -4.44 0.00 -3.21 3.04 3.72 0.73 -5.10 117.46 112.20 1yr3 n PHE 153 Ca 0.09 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.47 1yr3 n PHE 153 Cb 0.08 -0.84 0.01 0.00 -0.94 0.00 0.00 39.48 37.79 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 2.22 1.87 3.99 1.37 0.00 -1.10 -4.09 105.19 109.44 1yr3 n GLY 154 Ca -0.33 -1.09 -0.20 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 -2.03 2.98 0.15 1.61 2.02 -1.26 -4.03 118.70 118.14 1yr3 s GLU 155 Ca 0.04 -0.93 -0.17 0.00 0.02 0.00 0.00 54.97 53.93 1yr3 s GLU 155 Cb -0.01 -2.72 0.05 0.00 0.10 0.00 0.00 34.13 31.55 1yr3 s GLU 155 CO 0.03 -0.16 1.75 -0.09 0.02 0.00 0.00 175.26 176.80 1yr3 h ARG 156 N 0.65 0.24 -6.43 1.61 9.65 -1.97 -3.42 114.38 114.70 1yr3 h ARG 156 Ca -0.44 -0.01 -0.69 0.00 -1.10 0.00 0.00 59.98 57.73 1yr3 h ARG 156 Cb 1.27 -0.05 -0.27 0.00 -1.39 0.00 0.00 29.97 29.52 1yr3 h ARG 156 CO 0.52 0.16 -0.84 -0.06 2.80 0.00 0.00 179.97 182.55 1yr3 s PHE 157 N -6.16 2.50 -0.03 2.20 0.08 -1.26 -5.05 117.98 110.26 1yr3 s PHE 157 Ca -0.13 -0.33 -0.08 0.00 0.12 0.00 0.00 56.93 56.50 1yr3 s PHE 157 Cb 0.12 -1.57 0.01 0.00 -0.57 0.00 0.00 43.02 41.01 1yr3 s PHE 157 CO 0.71 0.05 0.19 -0.59 -0.10 0.00 0.00 175.22 175.47 1yr3 s PHE 158 N -0.62 -0.09 0.17 0.36 -0.12 -1.26 -5.15 117.98 111.26 1yr3 s PHE 158 Ca 0.10 0.18 -0.26 0.00 -0.05 0.00 0.00 56.93 56.89 1yr3 s PHE 158 Cb -0.11 0.02 -0.08 0.00 -0.63 0.00 0.00 43.02 42.23 1yr3 s PHE 158 CO -0.00 -0.24 0.82 0.45 -0.05 0.00 0.00 175.22 176.20 1yr3 s SER 159 N -0.83 7.43 -0.09 1.98 0.15 -1.26 -4.95 113.70 116.13 1yr3 s SER 159 Ca -0.09 1.70 0.20 0.00 0.70 0.00 0.00 55.95 58.45 1yr3 s SER 159 Cb -0.05 -2.52 0.71 0.00 -1.71 0.00 0.00 66.02 62.45 1yr3 s SER 159 CO 0.02 0.17 1.62 0.18 1.20 0.00 0.00 173.24 176.42 1yr3 n LEU 160 N 1.73 4.62 -4.73 3.45 4.77 -1.26 -4.91 117.00 120.68 1yr3 n LEU 160 Ca -0.04 -2.34 -0.42 0.00 -0.03 0.00 0.00 56.01 53.18 1yr3 n LEU 160 Cb 0.48 -0.56 -0.03 0.00 -2.33 0.00 0.00 43.42 40.98 1yr3 n LEU 160 CO 0.47 0.86 1.17 0.00 -1.33 0.00 0.00 177.39 178.57 1yr3 s ALA 161 N -1.65 3.71 -1.47 -1.18 0.00 -1.26 -1.98 121.76 117.93 1yr3 s ALA 161 Ca 0.51 1.34 -0.08 0.00 0.00 0.00 0.00 51.96 53.74 1yr3 s ALA 161 Cb 0.32 -3.59 0.03 0.00 0.00 0.00 0.00 23.12 19.87 1yr3 s ALA 161 CO 0.27 -0.76 0.79 -1.71 0.00 0.00 0.00 175.76 174.36 1yr3 n ASN 162 N 3.40 -5.72 -0.13 0.00 5.15 -1.26 -4.88 115.26 111.82 1yr3 n ASN 162 Ca 0.11 -0.43 -0.06 0.00 -0.60 0.00 0.00 54.58 53.60 1yr3 n ASN 162 Cb 0.39 -4.59 0.03 0.00 -0.53 0.00 0.00 39.78 35.08 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 0.50 -2.19 5.20 0.00 -1.74 -3.15 119.26 118.88 1yr3 h ALA 163 Ca -0.53 0.03 -0.74 0.00 0.00 0.00 0.00 54.91 53.66 1yr3 h ALA 163 Cb 1.36 -0.02 -0.21 0.00 0.00 0.00 0.00 17.79 18.92 1yr3 h ALA 163 CO 0.58 -0.20 0.71 0.71 0.00 0.00 0.00 179.25 181.05 1yr3 s TYR 164 N -6.15 3.54 -0.21 0.00 1.51 -1.26 -3.65 117.35 111.12 1yr3 s TYR 164 Ca -0.13 -1.90 -0.19 0.00 -1.01 0.00 0.00 57.07 53.84 1yr3 s TYR 164 Cb 0.12 -4.11 -0.08 0.00 -0.11 0.00 0.00 41.96 37.78 1yr3 s TYR 164 CO 0.72 -1.26 0.74 -3.47 -1.11 0.00 0.00 175.55 171.17 1yr3 n ASP 165 N 5.14 0.43 0.13 2.29 2.03 -0.53 -4.81 116.55 121.24 1yr3 n ASP 165 Ca 0.24 0.42 -0.00 0.00 0.52 0.00 0.00 54.79 55.97 1yr3 n ASP 165 Cb 0.46 -0.37 0.26 0.00 -0.72 0.00 0.00 41.12 40.75 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 2.66 1.19 -0.05 -1.67 0.00 -1.90 -2.04 119.26 117.45 1yr3 h ALA 166 Ca -0.13 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.35 1yr3 h ALA 166 Cb 0.58 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1yr3 h ALA 166 CO 0.42 0.57 -0.08 1.49 0.00 0.00 0.00 179.25 181.65 1yr3 h GLU 167 N 0.12 0.14 -0.28 0.00 4.81 -1.98 -2.45 114.58 114.93 1yr3 h GLU 167 Ca 0.01 -0.08 -0.04 0.00 -0.13 0.00 0.00 59.36 59.12 1yr3 h GLU 167 Cb 0.79 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.16 1yr3 h GLU 167 CO 0.06 0.65 0.01 1.88 -0.73 0.00 0.00 179.01 180.87 1yr3 h TYR 168 N -0.36 0.43 -0.45 0.92 0.99 -1.92 -1.55 116.97 115.03 1yr3 h TYR 168 Ca 0.00 -0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.68 1yr3 h TYR 168 Cb 0.64 -0.13 -0.02 0.00 1.00 0.00 0.00 36.73 38.21 1yr3 h TYR 168 CO 0.11 0.43 0.19 0.00 -0.00 0.00 0.00 178.16 178.89 1yr3 h ARG 169 N 0.41 0.64 -0.57 4.88 3.08 -1.26 -1.63 114.38 119.92 1yr3 h ARG 169 Ca 0.09 -0.08 -0.06 0.00 0.07 0.00 0.00 59.98 60.00 1yr3 h ARG 169 Cb 0.26 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 1yr3 h ARG 169 CO 0.01 0.52 0.12 0.00 -1.07 0.00 0.00 179.97 179.54 1yr3 h ALA 170 N 1.57 1.13 -0.26 0.04 0.00 -0.79 -1.84 119.26 119.11 1yr3 h ALA 170 Ca 0.16 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 1yr3 h ALA 170 Cb 0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1yr3 h ALA 170 CO -0.02 0.58 -0.34 -0.07 0.00 0.00 0.00 179.25 179.40 1yr3 h LEU 171 N 0.86 0.59 -0.89 0.00 4.07 -1.20 -2.32 115.31 116.42 1yr3 h LEU 171 Ca 0.18 -0.24 0.01 0.00 0.08 0.00 0.00 57.88 57.92 1yr3 h LEU 171 Cb 0.34 -0.16 -0.05 0.00 1.08 0.00 0.00 40.66 41.87 1yr3 h LEU 171 CO 0.00 0.89 0.59 -0.07 -1.08 0.00 0.00 178.44 178.77 1yr3 h LEU 172 N 0.48 1.01 -0.17 1.67 4.07 -0.63 -1.39 115.31 120.36 1yr3 h LEU 172 Ca 0.05 -0.02 -0.00 0.00 0.08 0.00 0.00 57.88 57.99 1yr3 h LEU 172 Cb 0.82 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 42.30 1yr3 h LEU 172 CO 0.07 0.73 0.10 1.56 -1.08 0.00 0.00 178.44 179.82 1yr3 h GLN 173 N 1.20 0.23 0.41 1.13 1.08 -0.83 -1.25 115.11 117.07 1yr3 h GLN 173 Ca 0.33 -0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.51 1yr3 h GLN 173 Cb -0.12 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.24 1yr3 h GLN 173 CO -0.08 0.19 -0.43 0.87 -0.95 0.00 0.00 178.83 178.44 1yr3 h LYS 174 N 0.20 -0.83 -1.03 1.46 1.57 -1.03 -1.02 116.57 115.88 1yr3 h LYS 174 Ca 0.06 0.06 0.29 0.00 -1.87 0.00 0.00 60.65 59.19 1yr3 h LYS 174 Cb 0.02 0.19 -0.13 0.00 0.08 0.00 0.00 32.23 32.39 1yr3 h LYS 174 CO -0.01 -0.55 0.62 0.28 -0.57 0.00 0.00 179.45 179.22 1yr3 h VAL 175 N -0.86 0.41 -0.41 0.50 2.07 -1.10 0.17 116.25 117.03 1yr3 h VAL 175 Ca -0.04 -0.14 -0.12 0.00 0.82 0.00 0.00 66.70 67.22 1yr3 h VAL 175 Cb 0.77 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1yr3 h VAL 175 CO -0.07 0.08 -0.22 0.00 0.02 0.00 0.00 177.57 177.37 1yr3 h ALA 176 N 1.74 0.57 0.43 1.67 0.00 -0.21 -2.13 119.26 121.34 1yr3 h ALA 176 Ca 0.68 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1yr3 h ALA 176 Cb 1.55 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1yr3 h ALA 176 CO -0.49 0.55 -0.21 0.87 0.00 0.00 0.00 179.25 179.97 1yr3 h LYS 177 N 0.68 -0.56 -0.92 0.00 1.57 0.49 -2.38 116.57 115.44 1yr3 h LYS 177 Ca 0.09 0.04 0.26 0.00 -1.87 0.00 0.00 60.65 59.16 1yr3 h LYS 177 Cb 0.78 0.13 -0.04 0.00 0.08 0.00 0.00 32.23 33.18 1yr3 h LYS 177 CO 0.06 -0.36 0.65 0.93 -0.57 0.00 0.00 179.45 180.16 1yr3 h GLU 178 N -0.59 0.08 -0.28 3.15 5.08 -1.03 -1.10 114.58 119.88 1yr3 h GLU 178 Ca -0.06 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1yr3 h GLU 178 Cb 0.45 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1yr3 h GLU 178 CO 0.10 0.05 0.00 0.39 -1.00 0.00 0.00 179.01 178.55 1yr3 n GLU 179 N -4.32 2.45 -2.63 2.33 -0.58 -0.81 -4.99 120.64 112.09 1yr3 n GLU 179 Ca 0.19 -2.17 -0.08 0.00 -0.42 0.00 0.00 57.16 54.69 1yr3 n GLU 179 Cb 0.93 -1.50 0.04 0.00 -0.57 0.00 0.00 31.44 30.34 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 1.46 -0.58 3.61 0.62 0.00 -0.42 -5.05 105.19 104.83 1yr3 n GLY 180 Ca 0.18 0.29 -0.11 0.00 0.00 0.00 0.00 46.02 46.38 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 -0.49 0.35 1.61 -0.12 -1.12 -5.07 117.98 109.95 1yr3 s PHE 181 Ca 0.23 1.08 -0.26 0.00 -0.05 0.00 0.00 56.93 57.93 1yr3 s PHE 181 Cb -0.03 0.38 -0.09 0.00 -0.63 0.00 0.00 43.02 42.65 1yr3 s PHE 181 CO 0.49 -0.30 1.09 -2.14 -0.05 0.00 0.00 175.22 174.31 1yr3 s PRO 182 N -0.24 4.33 -0.53 1.99 0.02 -1.26 -4.40 135.00 134.90 1yr3 s PRO 182 Ca 0.00 1.69 0.04 0.00 0.02 0.00 0.00 61.00 62.76 1yr3 s PRO 182 Cb -0.03 -2.82 0.17 0.00 0.02 0.00 0.00 34.50 31.83 1yr3 s PRO 182 CO -0.02 -0.04 0.39 -1.17 -0.33 0.00 0.00 177.00 175.83 1yr3 s LEU 183 N -2.14 2.93 0.46 -5.54 2.96 -1.26 -4.54 118.68 111.55 1yr3 s LEU 183 Ca 0.52 -3.32 -0.23 0.00 -0.22 0.00 0.00 54.13 50.88 1yr3 s LEU 183 Cb -0.28 -0.99 -0.07 0.00 0.50 0.00 0.00 46.19 45.35 1yr3 s LEU 183 CO 0.35 -0.15 1.14 0.28 -1.32 0.00 0.00 176.35 176.66 1yr3 s THR 184 N -0.51 3.21 -0.10 3.68 -1.32 -1.25 -4.75 115.64 114.60 1yr3 s THR 184 Ca 0.28 0.89 -0.02 0.00 -1.21 0.00 0.00 61.69 61.63 1yr3 s THR 184 Cb -0.03 -3.44 -0.03 0.00 -1.51 0.00 0.00 72.50 67.48 1yr3 s THR 184 CO -0.16 -0.03 -0.04 -1.61 -2.21 0.00 0.00 174.62 170.57 1yr3 s GLU 185 N -2.74 3.15 0.16 7.08 2.02 -1.26 -1.33 118.70 125.79 1yr3 s GLU 185 Ca 0.64 -0.50 -0.08 0.00 0.02 0.00 0.00 54.97 55.04 1yr3 s GLU 185 Cb -0.27 -2.76 -0.01 0.00 0.10 0.00 0.00 34.13 31.19 1yr3 s GLU 185 CO 0.33 0.52 0.27 0.20 0.02 0.00 0.00 175.26 176.59 1yr3 s GLY 186 N -0.39 0.52 -0.15 -1.39 0.00 -0.97 -4.92 107.32 100.02 1yr3 s GLY 186 Ca 0.06 -0.93 -0.25 0.00 0.00 0.00 0.00 44.72 43.61 1yr3 s GLY 186 CO 0.02 -0.87 0.79 0.14 0.00 0.00 0.00 173.10 173.18 1yr3 s VAL 187 N -3.97 4.93 -0.16 1.40 1.01 -1.26 -1.18 120.40 121.16 1yr3 s VAL 187 Ca 0.18 1.55 -0.14 0.00 0.00 0.00 0.00 61.98 63.57 1yr3 s VAL 187 Cb 0.04 -4.10 -0.05 0.00 0.00 0.00 0.00 36.38 32.27 1yr3 s VAL 187 CO 0.00 0.09 0.32 0.12 0.00 0.00 0.00 175.10 175.62 1yr3 s PHE 188 N 1.82 3.45 -0.07 5.22 5.36 -0.29 -0.75 117.98 132.71 1yr3 s PHE 188 Ca 0.37 0.61 0.03 0.00 -0.96 0.00 0.00 56.93 56.98 1yr3 s PHE 188 Cb -0.17 -2.38 -0.02 0.00 -0.34 0.00 0.00 43.02 40.11 1yr3 s PHE 188 CO 0.14 0.20 -0.15 0.14 -1.46 0.00 0.00 175.22 174.08 1yr3 s VAL 189 N 0.60 2.93 0.05 3.12 -7.23 0.10 -0.07 120.40 119.91 1yr3 s VAL 189 Ca 0.17 -0.75 -0.14 0.00 -1.81 0.00 0.00 61.98 59.46 1yr3 s VAL 189 Cb -0.13 -2.16 -0.06 0.00 0.56 0.00 0.00 36.38 34.58 1yr3 s VAL 189 CO 0.05 0.57 0.44 -0.94 -0.31 0.00 0.00 175.10 174.91 1yr3 s SER 190 N -0.35 6.80 -0.00 4.85 1.04 -0.77 -2.35 113.70 122.92 1yr3 s SER 190 Ca 0.03 0.97 0.08 0.00 0.48 0.00 0.00 55.95 57.51 1yr3 s SER 190 Cb -0.13 -2.25 -0.02 0.00 0.10 0.00 0.00 66.02 63.72 1yr3 s SER 190 CO 0.02 0.25 -0.23 -0.47 0.98 0.00 0.00 173.24 173.79 1yr3 s TYR 191 N -1.22 2.42 0.15 5.02 5.04 0.17 -2.83 117.35 126.09 1yr3 s TYR 191 Ca 0.29 -0.37 -0.13 0.00 -2.44 0.00 0.00 57.07 54.42 1yr3 s TYR 191 Cb -0.16 -1.49 0.02 0.00 0.35 0.00 0.00 41.96 40.68 1yr3 s TYR 191 CO 0.16 0.07 1.63 -1.00 -1.34 0.00 0.00 175.55 175.08 1yr3 h PRO 192 N 5.17 0.81 0.00 4.97 0.13 -1.87 -3.38 132.00 137.83 1yr3 h PRO 192 Ca -0.45 -0.22 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 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 0.47 0.81 0.00 0.41 -0.23 0.00 0.00 178.00 179.46 1yr3 n GLY 193 N -0.52 -1.48 0.00 1.56 0.00 -1.26 -3.73 105.19 99.76 1yr3 n GLY 193 Ca 0.01 -1.30 0.14 0.00 0.00 0.00 0.00 46.02 44.88 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 -0.09 0.34 -1.74 1.61 -0.04 -1.26 -4.86 135.00 128.96 1yr3 n PRO 194 Ca 0.00 0.01 -0.31 0.00 -0.04 0.00 0.00 63.50 63.16 1yr3 n PRO 194 Cb 0.00 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 31.99 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 -2.64 5.82 0.73 3.54 4.22 -1.26 -5.04 114.94 120.31 1yr3 s ASN 195 Ca 0.25 1.52 -0.09 0.00 -2.14 0.00 0.00 52.86 52.41 1yr3 s ASN 195 Cb 0.19 -2.48 0.06 0.00 1.28 0.00 0.00 41.25 40.30 1yr3 s ASN 195 CO 0.46 -1.14 1.08 -0.36 -2.04 0.00 0.00 177.10 175.09 1yr3 s PHE 196 N -3.09 3.00 0.67 1.54 0.08 -1.26 -4.98 117.98 113.94 1yr3 s PHE 196 Ca 0.57 0.64 -0.14 0.00 0.12 0.00 0.00 56.93 58.12 1yr3 s PHE 196 Cb -0.12 -3.26 0.00 0.00 -0.57 0.00 0.00 43.02 39.07 1yr3 s PHE 196 CO 0.54 -1.47 1.09 -1.21 -0.10 0.00 0.00 175.22 174.06 1yr3 s GLU 197 N -5.36 2.86 0.31 0.44 8.01 -1.26 -5.03 118.70 118.67 1yr3 s GLU 197 Ca 0.60 1.24 -0.14 0.00 0.01 0.00 0.00 54.97 56.69 1yr3 s GLU 197 Cb -0.11 -1.97 -0.08 0.00 -4.31 0.00 0.00 34.13 27.66 1yr3 s GLU 197 CO 0.47 -1.18 0.70 0.95 0.01 0.00 0.00 175.26 176.21 1yr3 s THR 198 N -2.56 4.74 0.22 3.63 -4.23 -1.26 -4.74 115.64 111.44 1yr3 s THR 198 Ca 0.64 0.82 -0.09 0.00 -1.18 0.00 0.00 61.69 61.88 1yr3 s THR 198 Cb -0.18 -3.62 0.21 0.00 1.34 0.00 0.00 72.50 70.26 1yr3 s THR 198 CO 0.45 -0.18 1.66 0.00 -0.54 0.00 0.00 174.62 176.00 1yr3 h ALA 199 N 2.25 0.68 -0.69 3.99 0.00 -1.97 0.99 119.26 124.51 1yr3 h ALA 199 Ca -0.48 0.19 0.13 0.00 0.00 0.00 0.00 54.91 54.76 1yr3 h ALA 199 Cb 1.17 0.33 -0.09 0.00 0.00 0.00 0.00 17.79 19.20 1yr3 h ALA 199 CO 0.66 -0.39 0.23 0.00 0.00 0.00 0.00 179.25 179.75 1yr3 h ALA 200 N 1.59 0.91 -0.48 0.00 0.00 -1.93 -1.21 119.26 118.14 1yr3 h ALA 200 Ca 0.35 0.12 -0.10 0.00 0.00 0.00 0.00 54.91 55.27 1yr3 h ALA 200 Cb 0.57 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1yr3 h ALA 200 CO -0.55 -0.24 -0.11 0.93 0.00 0.00 0.00 179.25 179.28 1yr3 h GLU 201 N 0.37 0.88 -0.41 0.00 5.08 -1.25 -2.36 114.58 116.90 1yr3 h GLU 201 Ca 0.37 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1yr3 h GLU 201 Cb 0.55 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 1yr3 h GLU 201 CO -0.40 0.95 0.26 0.82 -1.00 0.00 0.00 179.01 179.64 1yr3 h ILE 202 N 0.79 1.12 -0.97 3.13 1.08 0.01 0.20 117.51 122.87 1yr3 h ILE 202 Ca 0.13 -0.24 0.04 0.00 -0.39 0.00 0.00 64.86 64.40 1yr3 h ILE 202 Cb 0.63 0.55 -0.06 0.00 -3.07 0.00 0.00 36.82 34.87 1yr3 h ILE 202 CO 0.04 0.12 0.63 0.03 -0.69 0.00 0.00 178.15 178.28 1yr3 h ARG 203 N 0.54 1.16 -0.45 2.37 3.08 -1.22 0.68 114.38 120.54 1yr3 h ARG 203 Ca 0.15 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 1yr3 h ARG 203 Cb -0.03 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 29.73 1yr3 h ARG 203 CO -0.03 0.77 0.20 1.98 -1.07 0.00 0.00 179.97 181.81 1yr3 h MET 204 N 1.19 0.63 -0.05 0.04 4.05 -0.66 0.45 114.93 120.58 1yr3 h MET 204 Ca 0.40 -0.08 -0.13 0.00 -0.28 0.00 0.00 59.70 59.60 1yr3 h MET 204 Cb 0.05 -0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 30.72 1yr3 h MET 204 CO -0.14 0.51 -0.58 0.52 0.23 0.00 0.00 176.91 177.45 1yr3 h MET 205 N 0.63 0.15 -0.35 0.39 2.86 0.15 -0.87 114.93 117.89 1yr3 h MET 205 Ca 0.16 -0.10 -0.10 0.00 -2.06 0.00 0.00 59.70 57.59 1yr3 h MET 205 Cb 0.10 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 1yr3 h MET 205 CO -0.02 0.69 -0.19 1.96 1.06 0.00 0.00 176.91 180.42 1yr3 h GLN 206 N 0.12 0.74 -0.73 1.72 4.20 0.45 -0.13 115.11 121.48 1yr3 h GLN 206 Ca -0.00 -0.33 -0.06 0.00 0.06 0.00 0.00 58.65 58.32 1yr3 h GLN 206 Cb 1.06 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.79 1yr3 h GLN 206 CO 0.08 0.94 0.23 0.82 -0.67 0.00 0.00 178.83 180.23 1yr3 h ILE 207 N 0.52 1.26 0.00 2.54 2.04 -0.78 -1.50 117.51 121.60 1yr3 h ILE 207 Ca 0.07 -0.91 0.00 0.00 1.00 0.00 0.00 64.86 65.03 1yr3 h ILE 207 Cb 0.73 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1yr3 h ILE 207 CO 0.05 0.36 0.00 0.40 0.00 0.00 0.00 178.15 178.96 1yr3 h ILE 208 N 1.08 0.00 -0.00 -0.67 5.03 -1.09 -3.46 117.51 118.40 1yr3 h ILE 208 Ca 0.23 -0.13 0.00 0.00 -0.12 0.00 0.00 64.86 64.84 1yr3 h ILE 208 Cb 0.31 0.78 0.00 0.00 -3.03 0.00 0.00 36.82 34.88 1yr3 h ILE 208 CO -0.01 0.00 0.00 0.61 -0.68 0.00 0.00 178.15 178.07 1yr3 n GLY 209 N -0.63 1.85 3.94 5.37 0.00 -0.56 -5.08 105.19 110.08 1yr3 n GLY 209 Ca 0.00 -0.01 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.01 1.61 -0.02 -0.02 0.00 -0.08 -4.79 107.32 102.01 1yr3 s GLY 210 Ca 0.00 -0.99 0.02 0.00 0.00 0.00 0.00 44.72 43.75 1yr3 s GLY 210 CO 0.00 -0.97 0.01 1.22 0.00 0.00 0.00 173.10 173.36 1yr3 n ASP 211 N -0.85 4.47 -3.96 1.64 8.00 0.07 -4.60 116.55 121.32 1yr3 n ASP 211 Ca -0.06 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.29 1yr3 n ASP 211 Cb 0.55 0.56 -0.14 0.00 -0.02 0.00 0.00 41.12 42.07 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 -2.05 0.37 -0.05 2.53 1.01 -0.66 -0.50 120.40 121.05 1yr3 s VAL 212 Ca -0.01 -0.33 0.05 0.00 0.00 0.00 0.00 61.98 61.69 1yr3 s VAL 212 Cb 0.01 -0.34 -0.01 0.00 0.00 0.00 0.00 36.38 36.04 1yr3 s VAL 212 CO 0.09 0.02 -0.20 0.54 0.00 0.00 0.00 175.10 175.55 1yr3 s VAL 213 N -0.31 1.63 0.31 2.92 0.11 -0.64 0.00 120.40 124.42 1yr3 s VAL 213 Ca -0.00 -0.83 -0.10 0.00 -2.93 0.00 0.00 61.98 58.12 1yr3 s VAL 213 Cb -0.03 -1.39 0.01 0.00 -1.53 0.00 0.00 36.38 33.45 1yr3 s VAL 213 CO -0.00 0.46 0.55 -0.83 -3.33 0.00 0.00 175.10 171.96 1yr3 s GLY 214 N -0.05 0.82 -0.16 6.54 0.00 -0.99 -1.32 107.32 112.16 1yr3 s GLY 214 Ca -0.03 -1.06 0.16 0.00 0.00 0.00 0.00 44.72 43.79 1yr3 s GLY 214 CO 0.02 -0.67 1.55 1.03 0.00 0.00 0.00 173.10 175.04 1yr3 n MET 215 N -0.48 3.69 0.00 2.90 2.81 -1.26 -0.66 117.12 124.12 1yr3 n MET 215 Ca -0.02 -2.86 0.00 0.00 -1.81 0.00 0.00 57.70 53.01 1yr3 n MET 215 Cb 0.61 -1.91 0.00 0.00 -0.71 0.00 0.00 33.22 31.21 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 0.37 0.37 0.00 7.83 3.41 -1.26 -4.47 113.62 119.86 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 0.92 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.87 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 -0.38 -3.33 0.31 -1.26 -4.40 118.33 109.28 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 -0.00 0.00 -0.91 0.00 0.00 33.84 32.93 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 -0.55 0.01 2.52 0.31 -1.26 -1.47 118.33 117.89 1yr3 n VAL 218 Ca 0.00 2.26 -0.11 0.00 -0.01 0.00 0.00 64.34 66.48 1yr3 n VAL 218 Cb 0.00 -2.92 -0.04 0.00 -0.91 0.00 0.00 33.84 29.96 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 -0.39 0.43 5.55 0.11 -1.88 -1.49 132.00 134.33 1yr3 h PRO 219 Ca 0.28 0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.41 1yr3 h PRO 219 Cb 0.52 0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.69 1yr3 h PRO 219 CO -0.93 -0.26 -0.44 0.93 -0.21 0.00 0.00 178.00 177.09 1yr3 h GLU 220 N -0.40 -0.86 -0.32 1.05 3.07 -1.67 -2.45 114.58 113.00 1yr3 h GLU 220 Ca 0.09 0.06 0.07 0.00 -0.50 0.00 0.00 59.36 59.08 1yr3 h GLU 220 Cb 0.54 0.19 -0.07 0.00 -0.84 0.00 0.00 28.75 28.58 1yr3 h GLU 220 CO -0.34 -0.57 -0.11 0.28 -1.40 0.00 0.00 179.01 176.87 1yr3 h VAL 221 N -0.89 0.61 -0.45 3.13 2.07 -1.15 0.17 116.25 119.75 1yr3 h VAL 221 Ca -0.04 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 1yr3 h VAL 221 Cb 0.79 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 1yr3 h VAL 221 CO -0.07 0.00 0.20 0.40 0.02 0.00 0.00 177.57 178.12 1yr3 h ILE 222 N -0.04 1.16 -0.41 4.57 2.04 -1.26 0.27 117.51 123.84 1yr3 h ILE 222 Ca 0.16 -0.48 -0.11 0.00 1.00 0.00 0.00 64.86 65.43 1yr3 h ILE 222 Cb 0.29 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1yr3 h ILE 222 CO -0.36 0.19 -0.18 0.28 0.00 0.00 0.00 178.15 178.08 1yr3 h SER 223 N 0.63 0.88 0.14 1.72 0.02 -0.82 -1.87 113.55 114.24 1yr3 h SER 223 Ca 0.16 -0.40 -0.01 0.00 -0.84 0.00 0.00 61.79 60.70 1yr3 h SER 223 Cb 0.10 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.40 1yr3 h SER 223 CO -0.02 1.08 -0.07 0.00 -1.14 0.00 0.00 176.83 176.68 1yr3 h ALA 224 N 0.83 -0.19 -0.92 3.77 0.00 0.29 -2.70 119.26 120.34 1yr3 h ALA 224 Ca 0.09 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.00 1yr3 h ALA 224 Cb 0.74 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.55 1yr3 h ALA 224 CO 0.06 -0.61 0.60 0.00 0.00 0.00 0.00 179.25 179.30 1yr3 h ARG 225 N -0.19 1.12 -0.71 0.00 2.47 -0.93 -0.30 114.38 115.84 1yr3 h ARG 225 Ca -0.02 -0.07 0.07 0.00 -1.26 0.00 0.00 59.98 58.71 1yr3 h ARG 225 Cb 0.15 -0.25 -0.06 0.00 -1.65 0.00 0.00 29.97 28.16 1yr3 h ARG 225 CO 0.02 0.74 0.39 1.25 0.56 0.00 0.00 179.97 182.94 1yr3 h HIS 226 N 1.15 0.72 -0.43 3.04 2.76 -1.03 -0.50 115.15 120.85 1yr3 h HIS 226 Ca 0.37 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.57 1yr3 h HIS 226 Cb 0.02 -0.22 0.00 0.00 1.55 0.00 0.00 27.41 28.77 1yr3 h HIS 226 CO -0.01 0.32 0.00 0.00 -1.30 0.00 0.00 177.93 176.94 1yr3 n ASP 228 N 0.56 -6.75 -3.94 0.00 2.03 -0.20 -4.93 116.55 103.32 1yr3 n ASP 228 Ca 0.19 -0.56 -0.30 0.00 0.52 0.00 0.00 54.79 54.64 1yr3 n ASP 228 Cb 0.81 -4.79 -0.16 0.00 -0.72 0.00 0.00 41.12 36.26 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 -5.07 2.29 0.32 -2.67 0.20 -0.19 -5.00 118.68 108.56 1yr3 s LEU 229 Ca 0.29 -1.00 -0.28 0.00 0.69 0.00 0.00 54.13 53.82 1yr3 s LEU 229 Cb -0.05 -1.13 -0.13 0.00 -0.43 0.00 0.00 46.19 44.44 1yr3 s LEU 229 CO 0.77 -0.20 1.17 0.29 -0.29 0.00 0.00 176.35 178.08 1yr3 n LYS 230 N 4.72 1.79 -4.57 1.98 5.02 -1.26 -4.12 118.16 121.72 1yr3 n LYS 230 Ca -0.13 0.63 -0.29 0.00 -2.02 0.00 0.00 58.31 56.50 1yr3 n LYS 230 Cb 0.45 -2.12 -0.13 0.00 -0.02 0.00 0.00 35.03 33.21 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 -1.08 2.29 -0.06 -0.18 1.01 -1.24 -0.47 120.40 120.67 1yr3 s VAL 231 Ca 0.57 -1.59 -0.02 0.00 0.00 0.00 0.00 61.98 60.93 1yr3 s VAL 231 Cb -0.63 -1.98 0.04 0.00 0.00 0.00 0.00 36.38 33.82 1yr3 s VAL 231 CO 0.61 0.19 0.11 -0.69 0.00 0.00 0.00 175.10 175.33 1yr3 s VAL 232 N -0.98 -0.12 -0.00 2.92 1.01 0.10 -1.45 120.40 121.88 1yr3 s VAL 232 Ca 0.14 0.28 0.03 0.00 0.00 0.00 0.00 61.98 62.42 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 0.05 0.12 -0.09 0.00 0.00 0.00 0.00 175.10 175.18 1yr3 s ALA 233 N 1.65 0.73 -0.06 5.51 0.00 -1.26 0.96 121.76 129.29 1yr3 s ALA 233 Ca -0.03 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.53 1yr3 s ALA 233 Cb -0.12 -0.18 0.02 0.00 0.00 0.00 0.00 23.12 22.85 1yr3 s ALA 233 CO -0.05 0.17 -0.04 0.08 0.00 0.00 0.00 175.76 175.93 1yr3 s VAL 234 N -0.26 0.56 0.01 0.00 1.01 -0.33 -1.83 120.40 119.57 1yr3 s VAL 234 Ca 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 61.98 61.92 1yr3 s VAL 234 Cb -0.04 -0.63 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 1yr3 s VAL 234 CO -0.00 0.26 0.17 -0.44 0.00 0.00 0.00 175.10 175.09 1yr3 s SER 235 N 1.33 6.24 -0.41 3.32 0.01 0.61 -2.89 113.70 121.91 1yr3 s SER 235 Ca -0.04 0.28 -0.09 0.00 1.31 0.00 0.00 55.95 57.41 1yr3 s SER 235 Cb -0.14 -1.92 0.07 0.00 0.21 0.00 0.00 66.02 64.25 1yr3 s SER 235 CO -0.02 0.23 0.24 0.00 0.41 0.00 0.00 173.24 174.10 1yr3 s ALA 236 N -1.36 3.27 0.25 1.44 0.00 0.33 -1.26 121.76 124.41 1yr3 s ALA 236 Ca 0.29 -2.09 -0.30 0.00 0.00 0.00 0.00 51.96 49.86 1yr3 s ALA 236 Cb -0.13 -2.61 -0.11 0.00 0.00 0.00 0.00 23.12 20.28 1yr3 s ALA 236 CO 0.21 -1.60 1.53 0.42 0.00 0.00 0.00 175.76 176.32 1yr3 s ILE 237 N 1.43 2.40 0.00 0.00 -1.09 -0.17 -1.90 121.20 121.87 1yr3 s ILE 237 Ca 0.03 0.33 0.00 0.00 -2.23 0.00 0.00 60.65 58.77 1yr3 s ILE 237 Cb -0.22 -3.21 0.00 0.00 -1.58 0.00 0.00 42.46 37.45 1yr3 s ILE 237 CO 0.02 0.05 0.68 0.35 -1.23 0.00 0.00 174.94 174.81 1yr3 n THR 238 N 2.67 0.41 0.00 2.92 -2.24 -0.03 -1.33 114.28 116.67 1yr3 n THR 238 Ca 0.09 -0.66 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 1yr3 n THR 238 Cb 0.39 0.85 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 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 -0.21 0.00 -4.85 3.42 6.94 -1.26 -4.77 115.26 114.54 1yr3 n ASN 239 Ca 0.00 0.00 -0.32 0.00 -0.02 0.00 0.00 54.58 54.24 1yr3 n ASN 239 Cb 0.14 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.51 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 3.98 0.95 -3.83 -1.94 -1.26 -1.22 119.30 113.97 1yr3 s MET 240 Ca 0.00 0.79 -0.10 0.00 -1.71 0.00 0.00 55.69 54.66 1yr3 s MET 240 Cb 0.00 -2.29 0.17 0.00 2.01 0.00 0.00 34.83 34.72 1yr3 s MET 240 CO 0.00 -0.04 1.12 0.00 -0.01 0.00 0.00 175.02 176.09 1yr3 s ALA 241 N -2.29 1.17 0.07 3.03 0.00 0.83 -4.68 121.76 119.89 1yr3 s ALA 241 Ca 0.56 0.46 -0.35 0.00 0.00 0.00 0.00 51.96 52.64 1yr3 s ALA 241 Cb -0.10 -3.41 -0.14 0.00 0.00 0.00 0.00 23.12 19.47 1yr3 s ALA 241 CO 0.24 -2.91 1.63 -1.91 0.00 0.00 0.00 175.76 172.81 1yr3 n GLU 242 N -4.33 1.99 -0.35 0.00 4.07 -1.26 -2.35 120.64 118.40 1yr3 n GLU 242 Ca 0.10 0.72 0.00 0.00 -0.06 0.00 0.00 57.16 57.92 1yr3 n GLU 242 Cb 0.52 -2.49 0.00 0.00 -0.06 0.00 0.00 31.44 29.41 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 3.59 0.73 0.92 8.31 0.00 -1.26 -4.20 105.19 113.28 1yr3 n GLY 243 Ca 0.19 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.32 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 2.97 0.00 0.99 4.77 -0.99 -5.01 117.00 119.73 1yr3 n LEU 244 Ca 0.00 -1.22 0.00 0.00 -0.03 0.00 0.00 56.01 54.76 1yr3 n LEU 244 Cb 0.00 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 1yr3 n LEU 244 CO 0.00 0.57 0.00 -1.54 -1.33 0.00 0.00 177.39 175.09 1yr3 n SER 245 N 1.23 0.00 -0.10 -1.43 3.41 -1.26 -5.01 113.62 110.47 1yr3 n SER 245 Ca 0.14 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.78 1yr3 n SER 245 Cb 0.54 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.48 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 0.78 -4.75 4.04 5.75 -1.26 -5.04 116.55 116.07 1yr3 n ASP 246 Ca 0.00 -0.89 -0.41 0.00 -0.01 0.00 0.00 54.79 53.48 1yr3 n ASP 246 Cb 0.00 0.53 -0.04 0.00 -1.03 0.00 0.00 41.12 40.58 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 -0.94 3.45 0.15 2.12 1.01 -1.26 -5.04 120.40 119.89 1yr3 s VAL 247 Ca 0.04 1.38 -0.21 0.00 0.00 0.00 0.00 61.98 63.19 1yr3 s VAL 247 Cb 0.04 -3.88 -0.08 0.00 0.00 0.00 0.00 36.38 32.46 1yr3 s VAL 247 CO 0.13 0.30 0.67 -0.75 0.00 0.00 0.00 175.10 175.45 1yr3 s LYS 248 N -1.13 4.30 -0.13 2.72 2.20 -1.26 -4.94 119.74 121.51 1yr3 s LYS 248 Ca 0.47 0.88 -0.15 0.00 -0.36 0.00 0.00 55.97 56.81 1yr3 s LYS 248 Cb -0.33 -3.11 -0.05 0.00 -1.51 0.00 0.00 37.83 32.83 1yr3 s LYS 248 CO 0.41 0.53 0.35 -0.51 -0.36 0.00 0.00 175.35 175.77 1yr3 s LEU 249 N -1.45 4.29 0.15 5.43 1.43 -1.26 -4.94 118.68 122.33 1yr3 s LEU 249 Ca 0.36 0.65 -0.17 0.00 -1.03 0.00 0.00 54.13 53.94 1yr3 s LEU 249 Cb -0.19 -2.48 0.04 0.00 0.03 0.00 0.00 46.19 43.59 1yr3 s LEU 249 CO 0.22 0.12 0.46 -0.94 0.23 0.00 0.00 176.35 176.43 1yr3 s SER 250 N 0.23 -0.27 0.32 2.29 1.04 -1.26 -5.01 113.70 111.04 1yr3 s SER 250 Ca 0.20 -0.35 0.12 0.00 0.48 0.00 0.00 55.95 56.40 1yr3 s SER 250 Cb -0.14 0.52 0.54 0.00 0.10 0.00 0.00 66.02 67.05 1yr3 s SER 250 CO 0.07 -0.93 1.72 -0.74 0.98 0.00 0.00 173.24 174.33 1yr3 h HIS 251 N 2.27 0.00 -0.43 5.02 2.76 -1.99 -2.44 115.15 120.34 1yr3 h HIS 251 Ca -0.32 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 57.78 1yr3 h HIS 251 Cb 1.26 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.20 1yr3 h HIS 251 CO 0.32 0.49 -0.01 0.00 -1.30 0.00 0.00 177.93 177.44 1yr3 h ALA 252 N 1.51 1.19 -0.46 5.26 0.00 -2.00 -1.20 119.26 123.56 1yr3 h ALA 252 Ca -0.00 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.54 1yr3 h ALA 252 Cb 0.88 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1yr3 h ALA 252 CO 0.06 0.53 -0.20 0.37 0.00 0.00 0.00 179.25 180.02 1yr3 h GLN 253 N 0.65 0.95 0.68 0.00 5.75 -1.82 -2.45 115.11 118.87 1yr3 h GLN 253 Ca 0.13 -0.40 -0.03 0.00 -0.15 0.00 0.00 58.65 58.19 1yr3 h GLN 253 Cb 0.42 -0.03 0.01 0.00 1.07 0.00 0.00 27.48 28.94 1yr3 h GLN 253 CO 0.02 1.07 -0.33 1.15 -2.65 0.00 0.00 178.83 178.09 1yr3 h THR 254 N 0.79 0.31 -0.85 2.39 2.02 -0.98 0.16 112.91 116.76 1yr3 h THR 254 Ca 0.11 -0.07 0.09 0.00 0.77 0.00 0.00 66.41 67.31 1yr3 h THR 254 Cb 0.77 0.33 -0.07 0.00 -1.74 0.00 0.00 68.15 67.44 1yr3 h THR 254 CO 0.06 0.01 0.50 -0.07 0.37 0.00 0.00 175.52 176.39 1yr3 h LEU 255 N -0.96 0.73 0.05 2.58 3.38 -1.27 -2.47 115.31 117.35 1yr3 h LEU 255 Ca -0.09 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1yr3 h LEU 255 Cb 0.71 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1yr3 h LEU 255 CO 0.15 0.43 -0.03 0.00 0.09 0.00 0.00 178.44 179.09 1yr3 h ALA 256 N 1.45 -0.07 0.00 1.53 0.00 -1.35 -3.18 119.26 117.64 1yr3 h ALA 256 Ca 0.40 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1yr3 h ALA 256 Cb 0.33 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1yr3 h ALA 256 CO -0.23 -0.35 0.00 0.00 0.00 0.00 0.00 179.25 178.67 1yr3 n ALA 257 N -2.33 1.82 1.15 0.00 0.00 0.04 -2.22 120.51 118.97 1yr3 n ALA 257 Ca -0.08 -0.07 0.10 0.00 0.00 0.00 0.00 53.44 53.39 1yr3 n ALA 257 Cb 0.21 -1.21 0.35 0.00 0.00 0.00 0.00 19.45 18.80 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 -1.20 2.51 0.37 0.00 0.00 -0.95 -3.71 120.51 117.52 1yr3 n ALA 258 Ca 0.07 -0.55 0.11 0.00 0.00 0.00 0.00 53.44 53.07 1yr3 n ALA 258 Cb 0.08 -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 0.39 0.42 0.04 0.00 4.07 -0.94 -3.22 120.64 121.40 1yr3 n GLU 259 Ca 0.16 -0.02 -0.13 0.00 -0.06 0.00 0.00 57.16 57.10 1yr3 n GLU 259 Cb 0.34 -1.62 -0.03 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 0.62 -0.97 4.31 3.38 -1.78 -3.28 115.31 117.60 1yr3 h LEU 260 Ca 0.00 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1yr3 h LEU 260 Cb 0.83 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1yr3 h LEU 260 CO 0.00 1.22 -0.47 -1.54 0.09 0.00 0.00 178.44 177.74 1yr3 n SER 261 N -3.82 1.97 -0.28 -0.43 3.41 -1.26 -4.57 113.62 108.65 1yr3 n SER 261 Ca -0.06 -1.48 0.06 0.00 -0.26 0.00 0.00 58.87 57.13 1yr3 n SER 261 Cb 0.78 0.47 0.20 0.00 -0.26 0.00 0.00 64.21 65.40 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 2.36 0.57 -0.15 4.33 3.64 -1.60 0.47 116.57 126.18 1yr3 h LYS 262 Ca 0.00 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 1yr3 h LYS 262 Cb 0.74 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.43 1yr3 h LYS 262 CO 0.00 0.37 -0.06 0.37 -2.27 0.00 0.00 179.45 177.87 1yr3 h GLN 263 N 0.58 0.30 -0.77 1.90 5.75 -1.80 -2.11 115.11 118.96 1yr3 h GLN 263 Ca 0.44 -0.13 -0.00 0.00 -0.15 0.00 0.00 58.65 58.81 1yr3 h GLN 263 Cb 0.61 -0.01 -0.04 0.00 1.07 0.00 0.00 27.48 29.11 1yr3 h GLN 263 CO -0.36 0.61 0.47 -0.91 -2.65 0.00 0.00 178.83 175.99 1yr3 h ASN 264 N -0.03 0.91 0.04 -0.69 2.35 -1.76 -1.74 115.58 114.67 1yr3 h ASN 264 Ca 0.03 -0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1yr3 h ASN 264 Cb 0.51 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.66 1yr3 h ASN 264 CO 0.02 0.69 -0.02 0.15 -1.65 0.00 0.00 177.43 176.62 1yr3 h PHE 265 N 1.05 -0.06 -0.51 1.19 3.04 -0.74 0.17 116.94 121.08 1yr3 h PHE 265 Ca 0.28 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 62.22 1yr3 h PHE 265 Cb -0.06 0.02 -0.03 0.00 2.56 0.00 0.00 35.95 38.45 1yr3 h PHE 265 CO 0.00 -0.04 0.28 0.82 -2.02 0.00 0.00 178.31 177.36 1yr3 h ILE 266 N -0.06 1.15 -0.28 1.41 2.04 -1.02 0.56 117.51 121.32 1yr3 h ILE 266 Ca -0.01 -0.38 -0.16 0.00 1.00 0.00 0.00 64.86 65.32 1yr3 h ILE 266 Cb 0.05 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 36.59 1yr3 h ILE 266 CO 0.01 0.17 -0.45 0.78 0.00 0.00 0.00 178.15 178.66 1yr3 h ASN 267 N 0.70 0.87 -0.24 1.72 -0.26 -0.91 0.81 115.58 118.27 1yr3 h ASN 267 Ca 0.18 -0.52 -0.00 0.00 -0.56 0.00 0.00 56.30 55.40 1yr3 h ASN 267 Cb 0.01 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 37.01 1yr3 h ASN 267 CO -0.03 1.23 0.15 0.25 -1.06 0.00 0.00 177.43 177.97 1yr3 h LEU 268 N 0.55 0.29 0.67 1.61 5.85 0.09 0.24 115.31 124.60 1yr3 h LEU 268 Ca 0.02 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 1yr3 h LEU 268 Cb 1.05 -0.07 0.01 0.00 0.37 0.00 0.00 40.66 42.02 1yr3 h LEU 268 CO 0.10 0.24 -0.32 0.40 -0.34 0.00 0.00 178.44 178.52 1yr3 h ILE 269 N 0.31 0.11 -0.08 4.05 2.04 -0.87 0.80 117.51 123.86 1yr3 h ILE 269 Ca 0.09 -0.32 0.02 0.00 1.00 0.00 0.00 64.86 65.65 1yr3 h ILE 269 Cb 0.00 0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.23 1yr3 h ILE 269 CO -0.02 0.02 0.20 0.00 0.00 0.00 0.00 178.15 178.35 1yr3 h GLY 271 N 0.00 0.26 0.66 0.00 0.00 -0.24 -2.92 103.07 100.83 1yr3 h GLY 271 Ca 0.04 -0.67 0.02 0.00 0.00 0.00 0.00 47.33 46.72 1yr3 h GLY 271 CO -0.00 0.59 -0.13 -2.75 0.00 0.00 0.00 176.54 174.25 1yr3 h PHE 272 N -0.52 -0.33 -0.85 5.60 3.57 0.13 -2.18 116.94 122.36 1yr3 h PHE 272 Ca -0.11 0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.52 1yr3 h PHE 272 Cb 1.50 0.15 -0.08 0.00 2.79 0.00 0.00 35.95 40.31 1yr3 h PHE 272 CO 0.21 -0.20 0.47 -0.07 -2.23 0.00 0.00 178.31 176.50 1yr3 h LEU 273 N -0.21 0.62 -1.34 0.59 4.07 -1.00 -1.30 115.31 116.75 1yr3 h LEU 273 Ca 0.05 0.07 -0.05 0.00 0.08 0.00 0.00 57.88 58.03 1yr3 h LEU 273 Cb 0.28 -0.04 -0.01 0.00 1.08 0.00 0.00 40.66 41.96 1yr3 h LEU 273 CO -0.14 0.31 -0.08 -0.09 -1.08 0.00 0.00 178.44 177.37 1yr3 h ARG 274 N 0.72 0.35 0.00 1.13 2.43 -1.20 0.26 114.38 118.07 1yr3 h ARG 274 Ca 0.44 -0.08 -0.14 0.00 -0.81 0.00 0.00 59.98 59.40 1yr3 h ARG 274 Cb 0.52 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 1yr3 h ARG 274 CO -0.30 0.44 -0.65 0.87 -1.51 0.00 0.00 179.97 178.82 1yr3 h LYS 275 N 0.33 0.00 0.00 0.20 1.57 -0.80 -3.26 116.57 114.61 1yr3 h LYS 275 Ca 0.07 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 1yr3 h LYS 275 Cb 0.35 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 1yr3 h LYS 275 CO 0.02 0.65 -1.14 0.97 -0.57 0.00 0.00 179.45 179.37 1yr3 h ILE 276 N 0.00 0.31 0.00 1.86 2.10 -1.08 -3.52 117.51 117.18 1yr3 h ILE 276 Ca -0.01 -1.59 0.00 0.00 1.08 0.00 0.00 64.86 64.34 1yr3 h ILE 276 Cb 1.42 1.85 0.00 0.00 -1.09 0.00 0.00 36.82 39.00 1yr3 h ILE 276 CO 0.08 0.18 0.00 0.00 -1.08 0.00 0.00 178.15 177.33