#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rdt n MET 1 N 0.00 2.01 -4.16 1.43 0.00 -1.26 -4.97 117.12 110.17 2rdt n MET 1 Ca 0.00 0.71 -0.31 0.00 -0.00 0.00 0.00 57.70 58.10 2rdt n MET 1 Cb 0.00 -2.33 -0.08 0.00 0.00 0.00 0.00 33.22 30.81 2rdt n MET 1 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 2rdt s LEU 2 N -1.25 3.49 0.84 -0.89 1.43 -1.26 -3.92 118.68 117.12 2rdt s LEU 2 Ca 0.58 -0.13 -0.11 0.00 -1.03 0.00 0.00 54.13 53.44 2rdt s LEU 2 Cb -0.54 -2.17 0.10 0.00 0.03 0.00 0.00 46.19 43.60 2rdt s LEU 2 CO 0.60 0.20 1.11 -2.16 0.23 0.00 0.00 176.35 176.33 2rdt s PRO 3 N -2.14 1.71 -0.42 1.29 0.04 -1.26 -5.09 135.00 129.13 2rdt s PRO 3 Ca 0.25 1.24 -0.29 0.00 0.04 0.00 0.00 61.00 62.23 2rdt s PRO 3 Cb -0.12 -1.83 0.01 0.00 0.04 0.00 0.00 34.50 32.61 2rdt s PRO 3 CO 0.17 -2.05 1.32 0.50 0.04 0.00 0.00 177.00 176.98 2rdt s ARG 4 N -4.82 3.66 -0.10 4.56 6.06 -1.25 -5.01 118.95 122.04 2rdt s ARG 4 Ca 0.63 0.88 0.04 0.00 -2.50 0.00 0.00 55.73 54.77 2rdt s ARG 4 Cb -0.19 -3.97 0.00 0.00 0.06 0.00 0.00 34.95 30.85 2rdt s ARG 4 CO 0.57 -1.46 -0.22 -0.51 -2.50 0.00 0.00 175.30 171.17 2rdt s LEU 5 N 5.04 2.04 0.00 -0.88 1.43 -1.26 -5.00 118.68 120.05 2rdt s LEU 5 Ca 0.57 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 53.13 2rdt s LEU 5 Cb -0.12 -1.35 0.00 0.00 0.03 0.00 0.00 46.19 44.75 2rdt s LEU 5 CO 0.31 0.13 0.17 2.30 0.23 0.00 0.00 176.35 179.50 2rdt n ILE 6 N 3.63 0.00 -3.84 -0.59 -0.00 -1.26 -5.01 119.36 112.29 2rdt n ILE 6 Ca -0.19 -0.18 -0.10 0.00 -0.00 0.00 0.00 62.75 62.27 2rdt n ILE 6 Cb 0.53 1.58 -0.05 0.00 -0.00 0.00 0.00 39.64 41.70 2rdt n ILE 6 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2rdt h ILE 8 N 2.39 1.08 -0.39 0.00 5.03 -1.96 -2.41 117.51 121.25 2rdt h ILE 8 Ca -0.31 -0.22 -0.05 0.00 -0.12 0.00 0.00 64.86 64.17 2rdt h ILE 8 Cb 1.24 0.38 -0.02 0.00 -3.03 0.00 0.00 36.82 35.40 2rdt h ILE 8 CO 0.44 0.12 0.04 0.78 -0.68 0.00 0.00 178.15 178.84 2rdt h ASN 9 N 0.64 0.56 -0.53 1.72 -0.26 -1.97 -2.45 115.58 113.27 2rdt h ASN 9 Ca 0.21 -0.10 0.02 0.00 -0.56 0.00 0.00 56.30 55.87 2rdt h ASN 9 Cb 0.06 -0.15 -0.03 0.00 -1.06 0.00 0.00 38.32 37.14 2rdt h ASN 9 CO -0.05 0.60 0.33 0.44 -1.06 0.00 0.00 177.43 177.69 2rdt h ASP 10 N 0.58 0.55 -0.68 5.81 3.32 -1.85 0.15 116.42 124.29 2rdt h ASP 10 Ca 0.13 -0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.23 2rdt h ASP 10 Cb 0.31 -0.12 -0.06 0.00 0.22 0.00 0.00 39.33 39.68 2rdt h ASP 10 CO 0.01 0.39 0.38 1.88 -1.72 0.00 0.00 179.24 180.18 2rdt h TYR 11 N 0.67 0.70 -0.42 4.55 0.05 -1.45 0.20 116.97 121.28 2rdt h TYR 11 Ca 0.21 0.03 -0.05 0.00 0.05 0.00 0.00 58.73 58.97 2rdt h TYR 11 Cb -0.01 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.49 2rdt h TYR 11 CO -0.05 0.34 0.08 1.49 -1.05 0.00 0.00 178.16 178.97 2rdt h GLU 12 N 0.70 0.68 -0.70 4.88 4.81 -1.07 -0.10 114.58 123.79 2rdt h GLU 12 Ca 0.31 -0.17 -0.02 0.00 -0.13 0.00 0.00 59.36 59.34 2rdt h GLU 12 Cb 0.19 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 2rdt h GLU 12 CO -0.18 0.71 0.36 0.37 -0.73 0.00 0.00 179.01 179.54 2rdt h GLN 13 N 0.55 0.98 -0.33 1.92 4.15 -0.60 -0.50 115.11 121.27 2rdt h GLN 13 Ca 0.13 -0.13 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2rdt h GLN 13 Cb 0.35 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 27.83 2rdt h GLN 13 CO 0.00 0.75 0.21 1.25 -1.93 0.00 0.00 178.83 179.12 2rdt h HIS 14 N 0.96 0.43 -0.82 3.99 2.76 -0.51 -2.84 115.15 119.12 2rdt h HIS 14 Ca 0.24 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.40 2rdt h HIS 14 Cb 0.07 -0.14 -0.04 0.00 1.55 0.00 0.00 27.41 28.85 2rdt h HIS 14 CO -0.00 0.29 0.43 0.00 -1.30 0.00 0.00 177.93 177.34 2rdt h ALA 15 N 1.11 1.20 -0.51 5.26 0.00 -0.41 -0.45 119.26 125.45 2rdt h ALA 15 Ca 0.12 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2rdt h ALA 15 Cb -0.03 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.41 2rdt h ALA 15 CO -0.02 0.63 0.34 -0.22 0.00 0.00 0.00 179.25 179.97 2rdt h LYS 16 N 1.16 0.57 0.00 0.00 3.64 -1.06 -1.11 116.57 119.76 2rdt h LYS 16 Ca 0.29 -0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 59.51 2rdt h LYS 16 Cb 0.06 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 2rdt h LYS 16 CO -0.04 0.37 -0.60 0.66 -2.27 0.00 0.00 179.45 177.57 2rdt h SER 17 N 0.58 0.00 0.00 4.20 4.64 -0.84 -3.37 113.55 118.76 2rdt h SER 17 Ca 0.21 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.46 2rdt h SER 17 Cb 0.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 2rdt h SER 17 CO -0.05 0.60 -1.72 1.33 -0.87 0.00 0.00 176.83 176.12 2rdt n VAL 18 N -3.40 0.24 -3.02 0.95 0.24 -0.94 -5.00 118.33 107.40 2rdt n VAL 18 Ca 0.01 -0.39 -0.39 0.00 -2.04 0.00 0.00 64.34 61.53 2rdt n VAL 18 Cb 0.71 -0.04 -0.06 0.00 -1.47 0.00 0.00 33.84 32.98 2rdt n VAL 18 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2rdt s LEU 19 N -4.26 4.55 0.27 1.34 1.43 -0.44 -5.03 118.68 116.55 2rdt s LEU 19 Ca -0.06 1.58 -0.29 0.00 -1.03 0.00 0.00 54.13 54.34 2rdt s LEU 19 Cb 0.08 -3.32 -0.14 0.00 0.03 0.00 0.00 46.19 42.84 2rdt s LEU 19 CO 0.59 0.18 1.04 -2.65 0.23 0.00 0.00 176.35 175.74 2rdt n PRO 20 N 1.45 1.36 -0.21 1.29 -0.02 -1.26 -4.67 135.00 132.93 2rdt n PRO 20 Ca -0.05 0.48 -0.01 0.00 -2.02 0.00 0.00 63.50 61.89 2rdt n PRO 20 Cb 0.49 -1.87 0.06 0.00 -0.02 0.00 0.00 33.50 32.16 2rdt n PRO 20 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2rdt h LYS 21 N 2.22 -0.02 0.00 -0.52 3.64 -1.96 -0.45 116.57 119.49 2rdt h LYS 21 Ca -0.40 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 58.95 2rdt h LYS 21 Cb 1.34 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.16 2rdt h LYS 21 CO 0.62 -0.01 -0.16 0.66 -2.27 0.00 0.00 179.45 178.29 2rdt h SER 22 N -0.02 0.00 0.03 4.20 4.64 -1.96 0.33 113.55 120.78 2rdt h SER 22 Ca 0.30 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.54 2rdt h SER 22 Cb 0.47 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.57 2rdt h SER 22 CO -0.65 0.16 -0.31 0.40 -0.87 0.00 0.00 176.83 175.56 2rdt h ILE 23 N 0.00 1.59 -0.19 0.95 2.04 -1.58 -1.48 117.51 118.85 2rdt h ILE 23 Ca -0.00 -2.15 0.04 0.00 1.00 0.00 0.00 64.86 63.74 2rdt h ILE 23 Cb 0.31 2.99 -0.04 0.00 -0.74 0.00 0.00 36.82 39.34 2rdt h ILE 23 CO 0.02 0.59 -0.07 0.22 0.00 0.00 0.00 178.15 178.91 2rdt h TYR 24 N -0.58 -0.15 -0.54 1.37 3.20 -0.81 -1.84 116.97 117.63 2rdt h TYR 24 Ca -0.05 0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.90 2rdt h TYR 24 Cb 1.14 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 39.45 2rdt h TYR 24 CO 0.20 -0.11 0.24 -0.44 -1.64 0.00 0.00 178.16 176.42 2rdt h ASP 25 N -0.03 0.30 -0.44 -2.11 3.45 -0.44 0.46 116.42 117.62 2rdt h ASP 25 Ca 0.09 0.05 0.07 0.00 0.43 0.00 0.00 57.03 57.67 2rdt h ASP 25 Cb 0.17 -0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 38.89 2rdt h ASP 25 CO -0.21 0.20 0.10 0.22 -1.57 0.00 0.00 179.24 177.99 2rdt h TYR 26 N 0.45 0.17 -0.33 4.55 3.20 -0.90 -0.65 116.97 123.47 2rdt h TYR 26 Ca 0.25 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 62.09 2rdt h TYR 26 Cb 0.22 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.47 2rdt h TYR 26 CO -0.13 0.03 -0.00 1.88 -1.64 0.00 0.00 178.16 178.29 2rdt h TYR 27 N 0.24 0.63 -0.29 -3.82 0.05 -0.84 -3.31 116.97 109.64 2rdt h TYR 27 Ca 0.22 -0.11 -0.16 0.00 0.05 0.00 0.00 58.73 58.72 2rdt h TYR 27 Cb 0.26 -0.16 -0.00 0.00 1.01 0.00 0.00 36.73 37.83 2rdt h TYR 27 CO -0.20 0.70 -0.45 -0.09 -1.05 0.00 0.00 178.16 177.07 2rdt h ARG 28 N 0.38 0.81 -6.72 4.88 2.43 -0.78 -3.48 114.38 111.90 2rdt h ARG 28 Ca 0.09 -0.49 -0.58 0.00 -0.81 0.00 0.00 59.98 58.20 2rdt h ARG 28 Cb 0.45 0.05 0.15 0.00 -0.42 0.00 0.00 29.97 30.19 2rdt h ARG 28 CO 0.02 1.12 0.13 0.43 -1.51 0.00 0.00 179.97 180.16 2rdt n SER 29 N -4.11 1.00 -4.00 -3.80 7.64 -0.26 -5.04 113.62 105.05 2rdt n SER 29 Ca -0.04 0.93 -0.16 0.00 1.01 0.00 0.00 58.87 60.61 2rdt n SER 29 Cb 0.57 -1.37 0.02 0.00 -1.01 0.00 0.00 64.21 62.43 2rdt n SER 29 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2rdt n GLY 30 N 1.24 2.42 3.76 0.23 0.00 -1.26 -4.76 105.19 106.82 2rdt n GLY 30 Ca 0.11 -2.23 -0.39 0.00 0.00 0.00 0.00 46.02 43.51 2rdt n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rdt s ALA 31 N -2.52 3.29 0.00 4.61 0.00 0.11 -4.44 121.76 122.82 2rdt s ALA 31 Ca 0.31 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.94 2rdt s ALA 31 Cb -0.02 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.86 2rdt s ALA 31 CO 0.20 0.07 0.00 0.09 0.00 0.00 0.00 175.76 176.12 2rdt n ASN 32 N 1.00 0.00 -0.24 0.00 4.13 0.12 -0.58 115.26 119.69 2rdt n ASN 32 Ca 0.00 0.00 0.11 0.00 1.68 0.00 0.00 54.58 56.37 2rdt n ASN 32 Cb 0.48 0.00 0.56 0.00 -1.54 0.00 0.00 39.78 39.28 2rdt n ASN 32 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 2rdt n ASP 33 N 5.93 0.73 -3.18 6.41 10.43 -1.26 -4.65 116.55 130.96 2rdt n ASP 33 Ca 0.00 -1.45 -0.23 0.00 2.57 0.00 0.00 54.79 55.68 2rdt n ASP 33 Cb 0.00 -0.03 0.05 0.00 1.84 0.00 0.00 41.12 42.97 2rdt n ASP 33 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 2rdt n GLU 34 N -0.34 -5.72 -0.03 -1.24 1.02 0.25 -4.91 120.64 109.66 2rdt n GLU 34 Ca 0.17 0.89 -0.12 0.00 -0.02 0.00 0.00 57.16 58.08 2rdt n GLU 34 Cb 0.20 -5.81 -0.06 0.00 -0.02 0.00 0.00 31.44 25.75 2rdt n GLU 34 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2rdt h GLU 35 N -1.74 0.19 0.00 3.49 5.08 -1.91 -2.73 114.58 116.96 2rdt h GLU 35 Ca -0.54 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 57.68 2rdt h GLU 35 Cb 1.37 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 2rdt h GLU 35 CO 0.57 0.36 -0.41 1.15 -1.00 0.00 0.00 179.01 179.68 2rdt h THR 36 N -0.01 1.25 -0.47 1.13 2.02 -1.90 -2.00 112.91 112.93 2rdt h THR 36 Ca 0.04 -1.44 -0.06 0.00 0.77 0.00 0.00 66.41 65.72 2rdt h THR 36 Cb 0.26 1.78 -0.02 0.00 -1.74 0.00 0.00 68.15 68.44 2rdt h THR 36 CO 0.00 0.40 0.07 0.25 0.37 0.00 0.00 175.52 176.61 2rdt h LEU 37 N 0.00 0.75 -0.70 2.58 5.85 -1.79 0.32 115.31 122.31 2rdt h LEU 37 Ca -0.00 -0.26 -0.10 0.00 0.84 0.00 0.00 57.88 58.35 2rdt h LEU 37 Cb 0.75 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 2rdt h LEU 37 CO 0.05 0.82 -0.06 0.00 -0.34 0.00 0.00 178.44 178.91 2rdt h ALA 38 N 0.95 0.90 -0.16 1.25 0.00 -1.27 -3.23 119.26 117.70 2rdt h ALA 38 Ca 0.14 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.58 2rdt h ALA 38 Cb 0.40 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2rdt h ALA 38 CO 0.01 0.64 -0.55 0.22 0.00 0.00 0.00 179.25 179.57 2rdt h ASP 39 N 0.85 0.55 -0.98 0.00 3.58 -0.80 -0.79 116.42 118.83 2rdt h ASP 39 Ca 0.14 -0.29 0.21 0.00 0.42 0.00 0.00 57.03 57.52 2rdt h ASP 39 Cb 0.59 -0.16 -0.09 0.00 1.72 0.00 0.00 39.33 41.39 2rdt h ASP 39 CO 0.04 0.99 0.62 0.78 -2.88 0.00 0.00 179.24 178.79 2rdt h ASN 40 N 0.38 0.56 0.00 2.28 2.35 -0.41 0.14 115.58 120.88 2rdt h ASN 40 Ca 0.01 0.07 -0.06 0.00 -0.55 0.00 0.00 56.30 55.77 2rdt h ASN 40 Cb 1.08 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 39.42 2rdt h ASN 40 CO 0.10 0.19 -0.44 0.40 -1.65 0.00 0.00 177.43 176.03 2rdt h ILE 41 N 0.54 0.83 -0.85 2.81 2.04 -1.64 -3.35 117.51 117.89 2rdt h ILE 41 Ca 0.54 -1.76 0.09 0.00 1.00 0.00 0.00 64.86 64.73 2rdt h ILE 41 Cb 1.16 1.70 -0.06 0.00 -0.74 0.00 0.00 36.82 38.88 2rdt h ILE 41 CO -0.28 0.28 0.55 0.00 0.00 0.00 0.00 178.15 178.70 2rdt h ALA 42 N -0.54 1.65 -1.01 1.87 0.00 -0.96 -2.04 119.26 118.23 2rdt h ALA 42 Ca -0.10 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.84 2rdt h ALA 42 Cb 0.77 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 2rdt h ALA 42 CO -0.06 0.19 0.66 0.00 0.00 0.00 0.00 179.25 180.04 2rdt h ALA 43 N 1.56 1.35 -0.84 0.00 0.00 -0.90 -1.74 119.26 118.69 2rdt h ALA 43 Ca 0.38 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.27 2rdt h ALA 43 Cb 0.36 -0.35 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 2rdt h ALA 43 CO -0.15 0.54 0.55 0.74 0.00 0.00 0.00 179.25 180.93 2rdt h PHE 44 N 1.26 1.04 0.00 0.00 -1.00 -1.50 -2.36 116.94 114.37 2rdt h PHE 44 Ca 0.40 0.03 -0.03 0.00 2.81 0.00 0.00 57.97 61.18 2rdt h PHE 44 Cb 0.02 -0.35 -0.00 0.00 3.61 0.00 0.00 35.95 39.23 2rdt h PHE 44 CO -0.00 0.63 -0.16 0.66 -1.61 0.00 0.00 178.31 177.83 2rdt h SER 45 N 1.10 0.00 0.44 2.17 4.64 -1.28 -2.79 113.55 117.83 2rdt h SER 45 Ca 0.32 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.47 2rdt h SER 45 Cb -0.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 2rdt h SER 45 CO -0.09 0.16 -0.74 0.03 -0.87 0.00 0.00 176.83 175.32 2rdt h ARG 46 N 0.00 0.25 -6.32 4.77 3.08 -1.11 -3.41 114.38 111.63 2rdt h ARG 46 Ca -0.00 -0.21 -0.57 0.00 0.07 0.00 0.00 59.98 59.27 2rdt h ARG 46 Cb 0.38 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.44 2rdt h ARG 46 CO 0.02 0.88 1.16 -1.58 -1.07 0.00 0.00 179.97 179.38 2rdt s TRP 47 N -3.51 2.06 0.06 3.04 0.52 -1.05 -1.49 118.94 118.58 2rdt s TRP 47 Ca -0.04 0.60 -0.08 0.00 0.02 0.00 0.00 56.10 56.60 2rdt s TRP 47 Cb 0.11 -4.08 -0.05 0.00 -1.15 0.00 0.00 33.47 28.30 2rdt s TRP 47 CO 0.82 -2.77 0.35 0.15 0.02 0.00 0.00 176.95 175.52 2rdt s LYS 48 N 5.03 3.68 0.03 4.98 -0.14 -0.24 -4.92 119.74 128.16 2rdt s LYS 48 Ca 0.72 0.05 -0.15 0.00 -1.36 0.00 0.00 55.97 55.23 2rdt s LYS 48 Cb -0.22 -3.00 -0.06 0.00 -1.68 0.00 0.00 37.83 32.86 2rdt s LYS 48 CO 0.31 0.58 0.44 -0.51 -0.76 0.00 0.00 175.35 175.41 2rdt s LEU 49 N -1.97 4.46 -0.69 3.17 1.43 -1.26 -1.96 118.68 121.85 2rdt s LEU 49 Ca 0.32 0.99 0.05 0.00 -1.03 0.00 0.00 54.13 54.46 2rdt s LEU 49 Cb -0.13 -2.73 0.18 0.00 0.03 0.00 0.00 46.19 43.53 2rdt s LEU 49 CO 0.18 0.28 0.52 -1.22 0.23 0.00 0.00 176.35 176.35 2rdt n TYR 50 N 1.60 3.19 -2.23 0.29 4.01 0.64 -4.98 117.16 119.68 2rdt n TYR 50 Ca -0.12 -4.27 -0.41 0.00 -0.16 0.00 0.00 57.90 52.94 2rdt n TYR 50 Cb 0.52 -0.60 -0.03 0.00 -0.31 0.00 0.00 39.34 38.93 2rdt n TYR 50 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2rdt s PRO 51 N -1.56 4.44 0.08 -0.72 0.04 -1.26 -4.62 135.00 131.40 2rdt s PRO 51 Ca 0.27 2.08 -0.23 0.00 0.04 0.00 0.00 61.00 63.16 2rdt s PRO 51 Cb -0.02 -3.12 -0.06 0.00 0.04 0.00 0.00 34.50 31.34 2rdt s PRO 51 CO -0.15 -0.08 0.69 1.03 0.04 0.00 0.00 177.00 178.52 2rdt s ARG 52 N -1.46 4.41 0.26 4.56 0.52 -0.57 -4.97 118.95 121.70 2rdt s ARG 52 Ca 0.49 0.95 0.05 0.00 -0.52 0.00 0.00 55.73 56.69 2rdt s ARG 52 Cb -0.37 -3.30 -0.03 0.00 0.52 0.00 0.00 34.95 31.77 2rdt s ARG 52 CO 0.48 0.47 0.39 -1.64 0.02 0.00 0.00 175.30 175.02 2rdt s MET 53 N -0.67 3.41 -1.19 3.54 -1.94 -1.26 -2.74 119.30 118.46 2rdt s MET 53 Ca 0.34 -0.74 -0.03 0.00 -1.71 0.00 0.00 55.69 53.55 2rdt s MET 53 Cb -0.21 -2.86 0.00 0.00 2.01 0.00 0.00 34.83 33.78 2rdt s MET 53 CO 0.22 0.36 1.01 1.28 -0.01 0.00 0.00 175.02 177.88 2rdt n LEU 54 N -1.48 -3.72 -0.00 -0.03 4.77 -1.26 -4.92 117.00 110.37 2rdt n LEU 54 Ca -0.08 -0.56 0.07 0.00 -0.03 0.00 0.00 56.01 55.42 2rdt n LEU 54 Cb 0.57 -2.95 -0.10 0.00 -2.33 0.00 0.00 43.42 38.61 2rdt n LEU 54 CO 0.45 0.45 -0.24 0.54 -1.33 0.00 0.00 177.39 177.26 2rdt n ARG 55 N -4.24 1.49 -1.68 3.23 5.12 -1.26 -5.06 116.66 114.25 2rdt n ARG 55 Ca -0.17 -0.05 -0.01 0.00 -1.93 0.00 0.00 57.85 55.69 2rdt n ARG 55 Cb 0.62 -1.27 -0.01 0.00 -1.16 0.00 0.00 32.46 30.65 2rdt n ARG 55 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2rdt n ASN 56 N -1.58 -2.08 -1.19 0.55 2.85 -1.26 -5.01 115.26 107.54 2rdt n ASN 56 Ca 0.01 0.22 -0.04 0.00 -0.11 0.00 0.00 54.58 54.66 2rdt n ASN 56 Cb 0.29 -1.70 0.13 0.00 1.24 0.00 0.00 39.78 39.74 2rdt n ASN 56 CO 0.00 0.00 0.00 1.33 -2.11 0.00 0.00 177.26 176.48 2rdt n VAL 57 N 0.23 2.16 0.09 3.44 0.24 -1.26 -4.74 118.33 118.50 2rdt n VAL 57 Ca -0.05 -3.43 0.01 0.00 -2.04 0.00 0.00 64.34 58.83 2rdt n VAL 57 Cb 0.08 -0.42 0.36 0.00 -1.47 0.00 0.00 33.84 32.39 2rdt n VAL 57 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2rdt h ALA 58 N 1.44 1.44 -3.26 2.33 0.00 -1.98 -3.40 119.26 115.83 2rdt h ALA 58 Ca 0.10 -0.23 -0.61 0.00 0.00 0.00 0.00 54.91 54.18 2rdt h ALA 58 Cb 1.24 -0.10 -0.34 0.00 0.00 0.00 0.00 17.79 18.59 2rdt h ALA 58 CO 0.26 0.39 -0.84 -1.21 0.00 0.00 0.00 179.25 177.85 2rdt s GLU 59 N -4.71 2.40 0.00 0.00 2.02 -1.26 -5.11 118.70 112.05 2rdt s GLU 59 Ca -0.06 -0.63 0.07 0.00 0.02 0.00 0.00 54.97 54.37 2rdt s GLU 59 Cb 0.15 -2.00 -0.03 0.00 0.10 0.00 0.00 34.13 32.35 2rdt s GLU 59 CO 0.74 -0.04 -0.21 0.95 0.02 0.00 0.00 175.26 176.72 2rdt s THR 60 N 0.91 2.51 -0.23 3.63 -4.23 -1.26 -4.72 115.64 112.26 2rdt s THR 60 Ca -0.07 -1.10 -0.01 0.00 -1.18 0.00 0.00 61.69 59.32 2rdt s THR 60 Cb -0.15 -1.98 0.06 0.00 1.34 0.00 0.00 72.50 71.78 2rdt s THR 60 CO -0.01 0.47 -0.00 -0.62 -0.54 0.00 0.00 174.62 173.92 2rdt s ASP 61 N -1.01 3.48 0.00 3.99 -1.08 -0.08 -5.00 116.67 116.97 2rdt s ASP 61 Ca 0.12 -1.08 0.26 0.00 -0.52 0.00 0.00 52.55 51.33 2rdt s ASP 61 Cb -0.10 -0.91 1.04 0.00 -1.46 0.00 0.00 42.92 41.49 2rdt s ASP 61 CO 0.02 -0.28 1.73 0.18 0.52 0.00 0.00 175.17 177.33 2rdt n LEU 62 N 4.84 1.32 -4.78 -1.34 4.32 -1.26 -3.99 117.00 116.11 2rdt n LEU 62 Ca -0.10 -0.49 -0.35 0.00 -0.02 0.00 0.00 56.01 55.06 2rdt n LEU 62 Cb 0.45 -0.03 0.01 0.00 -1.62 0.00 0.00 43.42 42.22 2rdt n LEU 62 CO 0.15 0.24 0.77 -0.94 -1.22 0.00 0.00 177.39 176.40 2rdt s SER 63 N -1.84 5.67 0.00 -1.43 1.04 -1.16 -3.58 113.70 112.40 2rdt s SER 63 Ca 0.37 2.12 0.00 0.00 0.48 0.00 0.00 55.95 58.92 2rdt s SER 63 Cb 0.19 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.74 2rdt s SER 63 CO 0.31 -1.25 0.00 1.07 0.98 0.00 0.00 173.24 174.34 2rdt n THR 64 N -1.47 0.00 -3.86 2.02 5.66 -0.68 -4.64 114.28 111.32 2rdt n THR 64 Ca 0.11 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 61.00 2rdt n THR 64 Cb 0.51 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.18 2rdt n THR 64 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2rdt s SER 65 N 1.26 -0.04 -0.15 1.09 1.04 -1.26 -1.32 113.70 114.32 2rdt s SER 65 Ca 0.00 0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.44 2rdt s SER 65 Cb 0.00 0.24 0.03 0.00 0.10 0.00 0.00 66.02 66.39 2rdt s SER 65 CO 0.00 -0.21 -0.10 -0.69 0.98 0.00 0.00 173.24 173.22 2rdt s VAL 66 N -0.68 1.37 -1.46 5.02 1.01 0.87 -4.74 120.40 121.80 2rdt s VAL 66 Ca -0.08 -0.64 -0.12 0.00 0.00 0.00 0.00 61.98 61.15 2rdt s VAL 66 Cb -0.05 -1.39 0.09 0.00 0.00 0.00 0.00 36.38 35.03 2rdt s VAL 66 CO 0.01 0.31 0.71 0.18 0.00 0.00 0.00 175.10 176.31 2rdt n LEU 67 N 4.81 -1.98 0.00 3.92 4.77 -1.26 -1.50 117.00 125.76 2rdt n LEU 67 Ca -0.14 -0.61 0.00 0.00 -0.03 0.00 0.00 56.01 55.22 2rdt n LEU 67 Cb 0.49 -2.32 0.00 0.00 -2.33 0.00 0.00 43.42 39.26 2rdt n LEU 67 CO 0.19 0.29 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 2rdt n GLY 68 N -1.40 0.93 3.58 -0.72 0.00 -1.26 -5.03 105.19 101.29 2rdt n GLY 68 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 2rdt n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2rdt s GLN 69 N -0.45 3.66 0.32 1.61 -1.52 -0.56 -5.07 119.66 117.65 2rdt s GLN 69 Ca 0.00 -0.43 -0.29 0.00 -1.95 0.00 0.00 55.36 52.69 2rdt s GLN 69 Cb 0.00 -3.00 -0.10 0.00 -0.22 0.00 0.00 33.01 29.69 2rdt s GLN 69 CO 0.00 0.34 1.33 0.50 -0.25 0.00 0.00 175.29 177.22 2rdt s ARG 70 N 0.12 4.33 0.09 2.91 3.52 -1.26 -0.09 118.95 128.57 2rdt s ARG 70 Ca 0.02 2.24 0.04 0.00 -0.13 0.00 0.00 55.73 57.90 2rdt s ARG 70 Cb -0.13 -3.07 -0.03 0.00 -1.56 0.00 0.00 34.95 30.15 2rdt s ARG 70 CO 0.02 -0.24 -0.11 0.14 -0.81 0.00 0.00 175.30 174.30 2rdt s VAL 71 N -0.96 0.94 0.08 7.11 -7.23 -0.43 -4.88 120.40 115.03 2rdt s VAL 71 Ca 0.51 -1.53 0.33 0.00 -1.81 0.00 0.00 61.98 59.48 2rdt s VAL 71 Cb -0.40 -1.24 0.36 0.00 0.56 0.00 0.00 36.38 35.66 2rdt s VAL 71 CO 0.52 -0.48 1.99 0.77 -0.31 0.00 0.00 175.10 177.58 2rdt h SER 72 N 3.77 0.00 -4.47 4.85 4.64 -1.16 -1.80 113.55 119.39 2rdt h SER 72 Ca -0.38 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.02 2rdt h SER 72 Cb 1.19 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 63.09 2rdt h SER 72 CO 0.49 0.00 0.47 0.00 -0.87 0.00 0.00 176.83 176.93 2rdt s MET 73 N -3.69 0.76 -0.13 4.77 0.23 -1.24 -2.97 119.30 117.03 2rdt s MET 73 Ca 0.00 -0.04 -0.02 0.00 -1.03 0.00 0.00 55.69 54.61 2rdt s MET 73 Cb 0.10 0.35 0.02 0.00 -1.53 0.00 0.00 34.83 33.77 2rdt s MET 73 CO 0.45 -0.28 2.37 -0.35 -2.03 0.00 0.00 175.02 175.18 2rdt n PRO 74 N 0.33 1.53 -3.65 3.16 -0.04 -1.25 -4.70 135.00 130.38 2rdt n PRO 74 Ca -0.11 -0.82 -0.25 0.00 -0.04 0.00 0.00 63.50 62.28 2rdt n PRO 74 Cb 0.60 -1.45 -0.17 0.00 -0.04 0.00 0.00 33.50 32.43 2rdt n PRO 74 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2rdt s ILE 75 N -0.65 0.05 0.23 0.52 1.01 -1.26 -0.71 121.20 120.39 2rdt s ILE 75 Ca 0.26 -0.11 0.03 0.00 0.00 0.00 0.00 60.65 60.84 2rdt s ILE 75 Cb 0.16 -0.58 -0.05 0.00 0.01 0.00 0.00 42.46 42.00 2rdt s ILE 75 CO -0.02 -0.15 -0.00 0.00 0.00 0.00 0.00 174.94 174.76 2rdt s VAL 77 N -3.43 5.04 0.56 0.00 1.01 -0.51 -1.17 120.40 121.91 2rdt s VAL 77 Ca 0.28 0.84 -0.12 0.00 0.00 0.00 0.00 61.98 62.98 2rdt s VAL 77 Cb 0.06 -3.87 -0.05 0.00 0.00 0.00 0.00 36.38 32.51 2rdt s VAL 77 CO 0.09 0.02 0.98 -0.83 0.00 0.00 0.00 175.10 175.36 2rdt s GLY 78 N 1.58 1.79 0.07 4.51 0.00 0.04 -0.14 107.32 115.17 2rdt s GLY 78 Ca 0.22 -0.05 -0.31 0.00 0.00 0.00 0.00 44.72 44.58 2rdt s GLY 78 CO 0.10 0.21 1.83 0.00 0.00 0.00 0.00 173.10 175.24 2rdt s ALA 79 N -2.92 3.68 -0.13 3.20 0.00 -1.15 -4.71 121.76 119.73 2rdt s ALA 79 Ca 0.55 1.33 -0.01 0.00 0.00 0.00 0.00 51.96 53.83 2rdt s ALA 79 Cb -0.11 -3.78 0.04 0.00 0.00 0.00 0.00 23.12 19.28 2rdt s ALA 79 CO 0.45 -1.33 -0.01 0.95 0.00 0.00 0.00 175.76 175.82 2rdt s THR 80 N 3.37 0.69 0.54 0.00 -4.23 -1.26 -4.90 115.64 109.85 2rdt s THR 80 Ca 0.82 -0.31 -0.20 0.00 -1.18 0.00 0.00 61.69 60.82 2rdt s THR 80 Cb -0.43 -0.93 -0.08 0.00 1.34 0.00 0.00 72.50 72.40 2rdt s THR 80 CO 0.37 0.11 0.70 0.00 -0.54 0.00 0.00 174.62 175.26 2rdt n ALA 81 N 5.02 -0.68 -3.62 3.99 0.00 -1.26 -4.05 120.51 119.91 2rdt n ALA 81 Ca -0.09 0.04 -0.20 0.00 0.00 0.00 0.00 53.44 53.19 2rdt n ALA 81 Cb 0.49 -1.92 0.05 0.00 0.00 0.00 0.00 19.45 18.06 2rdt n ALA 81 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2rdt n MET 82 N -0.17 -5.21 0.27 0.00 2.81 -0.99 -4.87 117.12 108.96 2rdt n MET 82 Ca 0.12 0.68 0.15 0.00 -1.81 0.00 0.00 57.70 56.83 2rdt n MET 82 Cb 0.45 -5.34 0.76 0.00 -0.71 0.00 0.00 33.22 28.38 2rdt n MET 82 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 2rdt h GLN 83 N -1.86 0.00 0.00 0.03 4.20 -1.88 -2.81 115.11 112.79 2rdt h GLN 83 Ca -0.61 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.10 2rdt h GLN 83 Cb 1.35 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.13 2rdt h GLN 83 CO 0.54 0.09 0.00 0.54 -0.67 0.00 0.00 178.83 179.34 2rdt n ARG 84 N -3.43 0.00 0.16 1.46 1.74 -1.26 -1.40 116.66 113.93 2rdt n ARG 84 Ca -0.01 0.35 0.01 0.00 -0.77 0.00 0.00 57.85 57.43 2rdt n ARG 84 Cb 0.25 -1.50 0.24 0.00 -1.02 0.00 0.00 32.46 30.43 2rdt n ARG 84 CO 0.00 0.00 0.00 0.52 -1.52 0.00 0.00 177.63 176.63 2rdt h MET 85 N 0.00 0.00 0.09 5.56 2.86 -1.88 -3.29 114.93 118.27 2rdt h MET 85 Ca 0.00 0.00 -0.30 0.00 -2.06 0.00 0.00 59.70 57.34 2rdt h MET 85 Cb 0.15 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.80 2rdt h MET 85 CO 0.00 0.52 -1.52 0.00 1.06 0.00 0.00 176.91 176.97 2rdt h ALA 86 N 1.48 0.36 -2.31 6.32 0.00 -1.44 -3.48 119.26 120.20 2rdt h ALA 86 Ca -0.01 -1.15 -0.08 0.00 0.00 0.00 0.00 54.91 53.67 2rdt h ALA 86 Cb 1.00 0.28 -0.21 0.00 0.00 0.00 0.00 17.79 18.86 2rdt h ALA 86 CO 0.07 1.22 -0.03 -1.58 0.00 0.00 0.00 179.25 178.93 2rdt s HIS 87 N -2.62 -0.56 0.36 0.00 5.65 -1.12 -3.87 115.29 113.13 2rdt s HIS 87 Ca -0.08 1.23 0.16 0.00 0.25 0.00 0.00 55.06 56.62 2rdt s HIS 87 Cb 0.07 0.24 1.05 0.00 -1.18 0.00 0.00 32.58 32.76 2rdt s HIS 87 CO 0.84 -0.38 1.72 -0.24 -0.65 0.00 0.00 174.74 176.03 2rdt h VAL 88 N 3.90 0.45 0.00 0.89 3.04 -1.88 -0.50 116.25 122.15 2rdt h VAL 88 Ca -0.28 -0.14 0.00 0.00 -1.01 0.00 0.00 66.70 65.27 2rdt h VAL 88 Cb 1.16 -0.01 0.00 0.00 -2.01 0.00 0.00 31.29 30.44 2rdt h VAL 88 CO 0.24 0.08 -0.14 0.47 -1.01 0.00 0.00 177.57 177.21 2rdt n ASP 89 N -4.80 0.68 0.00 3.17 8.00 -1.26 -4.92 116.55 117.42 2rdt n ASP 89 Ca 0.28 0.45 0.00 0.00 0.71 0.00 0.00 54.79 56.23 2rdt n ASP 89 Cb 0.90 -0.54 0.00 0.00 -0.02 0.00 0.00 41.12 41.46 2rdt n ASP 89 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2rdt n GLY 90 N 1.34 1.78 0.26 0.44 0.00 -0.19 -1.06 105.19 107.75 2rdt n GLY 90 Ca 0.05 0.23 0.13 0.00 0.00 0.00 0.00 46.02 46.43 2rdt n GLY 90 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2rdt h GLU 91 N 0.00 0.00 -0.39 1.61 3.07 -1.89 -2.53 114.58 114.46 2rdt h GLU 91 Ca 0.00 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.79 2rdt h GLU 91 Cb 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 2rdt h GLU 91 CO 0.00 0.12 -0.05 -0.07 -1.40 0.00 0.00 179.01 177.61 2rdt h LEU 92 N 0.00 0.71 -0.73 1.33 3.38 -1.49 -1.76 115.31 116.76 2rdt h LEU 92 Ca -0.00 -0.34 0.02 0.00 0.09 0.00 0.00 57.88 57.65 2rdt h LEU 92 Cb 0.52 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 2rdt h LEU 92 CO 0.02 0.88 0.47 0.00 0.09 0.00 0.00 178.44 179.90 2rdt h ALA 93 N 0.85 0.95 0.06 1.53 0.00 -1.09 -2.09 119.26 119.47 2rdt h ALA 93 Ca 0.10 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2rdt h ALA 93 Cb 0.55 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2rdt h ALA 93 CO 0.03 0.28 -0.03 1.15 0.00 0.00 0.00 179.25 180.68 2rdt h THR 94 N 0.93 1.03 -0.45 0.00 2.02 -1.35 -2.01 112.91 113.08 2rdt h THR 94 Ca 0.28 -0.30 -0.06 0.00 0.77 0.00 0.00 66.41 67.10 2rdt h THR 94 Cb -0.03 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 2rdt h THR 94 CO -0.09 0.08 0.04 1.62 0.37 0.00 0.00 175.52 177.53 2rdt h VAL 95 N -0.22 1.22 -0.35 3.16 3.04 -1.29 -1.26 116.25 120.54 2rdt h VAL 95 Ca -0.01 -0.86 0.01 0.00 -1.01 0.00 0.00 66.70 64.83 2rdt h VAL 95 Cb 0.19 0.84 -0.02 0.00 -2.01 0.00 0.00 31.29 30.29 2rdt h VAL 95 CO 0.01 0.31 0.22 0.03 -1.01 0.00 0.00 177.57 177.13 2rdt h ARG 96 N 0.67 0.44 -0.79 4.17 3.08 -1.24 0.14 114.38 120.86 2rdt h ARG 96 Ca 0.14 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.14 2rdt h ARG 96 Cb 0.36 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.27 2rdt h ARG 96 CO 0.01 0.29 0.41 0.00 -1.07 0.00 0.00 179.97 179.61 2rdt h ALA 97 N 1.14 1.01 -0.67 0.04 0.00 -1.06 -0.97 119.26 118.75 2rdt h ALA 97 Ca 0.13 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2rdt h ALA 97 Cb -0.04 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.41 2rdt h ALA 97 CO -0.04 0.54 0.21 0.00 0.00 0.00 0.00 179.25 179.96 2rdt h GLN 99 N 0.99 0.35 -0.46 0.00 4.15 -0.46 0.81 115.11 120.50 2rdt h GLN 99 Ca 0.22 -0.03 0.03 0.00 0.77 0.00 0.00 58.65 59.64 2rdt h GLN 99 Cb 0.28 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 27.86 2rdt h GLN 99 CO -0.01 0.29 0.24 0.77 -1.93 0.00 0.00 178.83 178.19 2rdt h SER 100 N 0.32 0.36 1.30 -0.69 0.02 -0.85 -3.00 113.55 111.01 2rdt h SER 100 Ca 0.09 0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 60.97 2rdt h SER 100 Cb 0.03 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 2rdt h SER 100 CO -0.02 0.25 -0.45 -0.07 -1.14 0.00 0.00 176.83 175.41 2rdt h LEU 101 N 0.48 0.00 0.00 5.07 -0.00 -1.16 -3.48 115.31 116.22 2rdt h LEU 101 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.07 2rdt h LEU 101 Cb 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.74 2rdt h LEU 101 CO -0.13 0.45 0.00 0.61 -0.00 0.00 0.00 178.44 179.38 2rdt n GLY 102 N 0.91 0.51 3.67 0.83 0.00 0.23 -4.61 105.19 106.74 2rdt n GLY 102 Ca 0.01 -0.84 -0.26 0.00 0.00 0.00 0.00 46.02 44.93 2rdt n GLY 102 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2rdt s THR 103 N -2.00 2.17 0.18 2.61 -1.32 -0.93 -0.69 115.64 115.66 2rdt s THR 103 Ca 0.00 -1.86 -0.09 0.00 -1.21 0.00 0.00 61.69 58.53 2rdt s THR 103 Cb 0.00 -2.99 -0.07 0.00 -1.51 0.00 0.00 72.50 67.94 2rdt s THR 103 CO 0.00 -0.01 0.50 -0.83 -2.21 0.00 0.00 174.62 172.07 2rdt s GLY 104 N -3.80 2.30 -0.18 6.08 0.00 -1.26 -4.21 107.32 106.26 2rdt s GLY 104 Ca 0.38 -0.32 -0.02 0.00 0.00 0.00 0.00 44.72 44.76 2rdt s GLY 104 CO 0.20 -0.16 -0.10 -0.29 0.00 0.00 0.00 173.10 172.74 2rdt s MET 105 N -2.56 3.32 -0.35 2.90 1.75 0.24 -1.42 119.30 123.18 2rdt s MET 105 Ca 0.43 -0.68 -0.20 0.00 -1.25 0.00 0.00 55.69 53.99 2rdt s MET 105 Cb -0.12 -2.79 0.00 0.00 2.84 0.00 0.00 34.83 34.76 2rdt s MET 105 CO 0.21 -0.03 0.60 1.41 -0.65 0.00 0.00 175.02 176.57 2rdt s MET 106 N 0.97 3.65 -0.19 4.11 1.75 0.80 -1.23 119.30 129.17 2rdt s MET 106 Ca -0.01 -0.02 -0.21 0.00 -1.25 0.00 0.00 55.69 54.20 2rdt s MET 106 Cb -0.15 -3.81 -0.03 0.00 2.84 0.00 0.00 34.83 33.69 2rdt s MET 106 CO -0.01 -0.71 0.63 -1.17 -0.65 0.00 0.00 175.02 173.11 2rdt s LEU 107 N 2.62 4.15 0.35 4.11 2.96 0.06 -2.91 118.68 130.02 2rdt s LEU 107 Ca 0.23 0.85 -0.29 0.00 -0.22 0.00 0.00 54.13 54.70 2rdt s LEU 107 Cb -0.15 -2.89 -0.12 0.00 0.50 0.00 0.00 46.19 43.54 2rdt s LEU 107 CO 0.14 -0.26 1.46 -0.24 -1.32 0.00 0.00 176.35 176.14 2rdt n SER 108 N 4.96 3.55 0.23 3.68 2.88 -1.26 0.30 113.62 127.95 2rdt n SER 108 Ca -0.02 1.21 0.13 0.00 -1.33 0.00 0.00 58.87 58.86 2rdt n SER 108 Cb 0.50 -1.58 0.76 0.00 -0.75 0.00 0.00 64.21 63.14 2rdt n SER 108 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2rdt h SER 109 N 3.26 0.00 -0.77 -3.46 0.02 -1.74 -2.69 113.55 108.16 2rdt h SER 109 Ca -0.49 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 59.95 2rdt h SER 109 Cb 1.25 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.56 2rdt h SER 109 CO 0.67 0.00 0.67 0.79 -1.14 0.00 0.00 176.83 177.82 2rdt n TRP 110 N -4.19 2.50 -2.51 3.45 5.03 -1.26 -4.99 117.44 115.47 2rdt n TRP 110 Ca -0.00 -2.50 -0.36 0.00 3.03 0.00 0.00 57.50 57.67 2rdt n TRP 110 Cb 0.20 -1.21 -0.03 0.00 -1.03 0.00 0.00 31.31 29.24 2rdt n TRP 110 CO 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 177.69 177.66 2rdt s ALA 111 N -2.93 3.01 -1.21 6.99 0.00 -1.02 -2.34 121.76 124.26 2rdt s ALA 111 Ca 0.50 0.70 0.07 0.00 0.00 0.00 0.00 51.96 53.23 2rdt s ALA 111 Cb 0.39 -3.28 0.31 0.00 0.00 0.00 0.00 23.12 20.54 2rdt s ALA 111 CO -0.00 -0.30 1.09 0.25 0.00 0.00 0.00 175.76 176.81 2rdt n THR 112 N -0.38 0.85 -3.92 0.00 -2.24 -1.26 -4.79 114.28 102.53 2rdt n THR 112 Ca 0.07 -0.51 -0.10 0.00 -2.27 0.00 0.00 64.05 61.23 2rdt n THR 112 Cb 0.50 -0.17 -0.12 0.00 -2.10 0.00 0.00 70.33 68.44 2rdt n THR 112 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2rdt s SER 113 N -0.58 0.10 0.62 3.42 0.01 -1.26 -4.94 113.70 111.07 2rdt s SER 113 Ca 0.21 -0.24 -0.12 0.00 1.31 0.00 0.00 55.95 57.11 2rdt s SER 113 Cb 0.14 0.11 -0.04 0.00 0.21 0.00 0.00 66.02 66.45 2rdt s SER 113 CO 0.09 -0.21 1.03 -0.94 0.41 0.00 0.00 173.24 173.63 2rdt s SER 114 N -0.91 6.12 0.20 2.44 1.04 -1.26 -4.88 113.70 116.45 2rdt s SER 114 Ca -0.10 1.49 -0.15 0.00 0.48 0.00 0.00 55.95 57.68 2rdt s SER 114 Cb -0.06 -2.48 0.20 0.00 0.10 0.00 0.00 66.02 63.78 2rdt s SER 114 CO -0.00 -0.94 1.63 0.40 0.98 0.00 0.00 173.24 175.30 2rdt h ILE 115 N -0.18 0.38 -0.36 -1.02 2.04 -1.97 -1.57 117.51 114.83 2rdt h ILE 115 Ca -0.44 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 2rdt h ILE 115 Cb 1.19 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 2rdt h ILE 115 CO 0.61 0.00 0.22 -0.08 0.00 0.00 0.00 178.15 178.90 2rdt h GLU 116 N -0.02 0.49 -0.68 2.37 4.81 -1.93 -1.94 114.58 117.68 2rdt h GLU 116 Ca 0.28 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.41 2rdt h GLU 116 Cb 0.45 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 2rdt h GLU 116 CO -0.62 0.36 0.21 0.93 -0.73 0.00 0.00 179.01 179.15 2rdt h GLU 117 N 0.48 1.05 -0.55 1.92 5.08 -1.82 -1.50 114.58 119.23 2rdt h GLU 117 Ca 0.13 -0.22 -0.10 0.00 -1.00 0.00 0.00 59.36 58.17 2rdt h GLU 117 Cb -0.01 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 2rdt h GLU 117 CO -0.03 0.90 -0.07 0.28 -1.00 0.00 0.00 179.01 179.10 2rdt h VAL 118 N 1.01 1.27 -0.63 3.13 2.07 -1.15 0.08 116.25 122.02 2rdt h VAL 118 Ca 0.22 -1.21 -0.02 0.00 0.82 0.00 0.00 66.70 66.51 2rdt h VAL 118 Cb 0.30 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 2rdt h VAL 118 CO -0.01 0.43 0.31 0.00 0.02 0.00 0.00 177.57 178.32 2rdt h ALA 119 N 1.00 1.36 0.05 1.67 0.00 -0.88 -1.70 119.26 120.76 2rdt h ALA 119 Ca 0.15 -0.12 -0.24 0.00 0.00 0.00 0.00 54.91 54.70 2rdt h ALA 119 Cb 0.62 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2rdt h ALA 119 CO 0.04 0.51 -1.04 0.93 0.00 0.00 0.00 179.25 179.69 2rdt h GLU 120 N 0.89 0.33 -0.42 0.00 5.08 -0.73 -1.60 114.58 118.14 2rdt h GLU 120 Ca 0.22 -0.42 -0.08 0.00 -1.00 0.00 0.00 59.36 58.08 2rdt h GLU 120 Cb 0.08 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2rdt h GLU 120 CO -0.03 1.13 -0.06 0.00 -1.00 0.00 0.00 179.01 179.05 2rdt h ALA 121 N 0.71 0.57 -2.20 3.43 0.00 -0.88 -3.37 119.26 117.52 2rdt h ALA 121 Ca -0.09 -0.30 -0.58 0.00 0.00 0.00 0.00 54.91 53.94 2rdt h ALA 121 Cb 1.71 -0.15 -0.42 0.00 0.00 0.00 0.00 17.79 18.94 2rdt h ALA 121 CO 0.17 0.40 -0.72 0.41 0.00 0.00 0.00 179.25 179.52 2rdt n GLY 122 N -0.26 4.93 0.26 0.00 0.00 -0.65 -4.70 105.19 104.76 2rdt n GLY 122 Ca -0.01 -2.57 0.12 0.00 0.00 0.00 0.00 46.02 43.56 2rdt n GLY 122 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rdt h PRO 123 N 3.46 0.00 -0.02 1.61 0.13 -1.46 -0.89 132.00 134.82 2rdt h PRO 123 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2rdt h PRO 123 Cb 0.63 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.76 2rdt h PRO 123 CO 0.76 0.11 -0.16 0.39 -0.23 0.00 0.00 178.00 178.87 2rdt n GLU 124 N -3.75 1.74 -2.49 0.86 4.71 -1.26 -4.96 120.64 115.49 2rdt n GLU 124 Ca -0.02 -1.35 -0.36 0.00 -0.01 0.00 0.00 57.16 55.42 2rdt n GLU 124 Cb 0.21 -1.47 -0.03 0.00 -1.01 0.00 0.00 31.44 29.14 2rdt n GLU 124 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2rdt s ALA 125 N -2.19 2.98 -0.17 0.62 0.00 -0.34 -4.95 121.76 117.72 2rdt s ALA 125 Ca 0.27 0.71 -0.29 0.00 0.00 0.00 0.00 51.96 52.64 2rdt s ALA 125 Cb 0.20 -3.28 -0.02 0.00 0.00 0.00 0.00 23.12 20.01 2rdt s ALA 125 CO 0.41 -0.33 1.31 -1.17 0.00 0.00 0.00 175.76 175.98 2rdt s LEU 126 N -3.02 4.15 -0.04 0.00 0.20 -1.26 -5.01 118.68 113.70 2rdt s LEU 126 Ca 0.62 1.68 0.03 0.00 0.69 0.00 0.00 54.13 57.16 2rdt s LEU 126 Cb -0.21 -3.54 0.00 0.00 -0.43 0.00 0.00 46.19 42.01 2rdt s LEU 126 CO 0.26 -0.82 -0.14 -0.13 -0.29 0.00 0.00 176.35 175.23 2rdt s ARG 127 N 3.65 1.51 0.14 1.98 0.52 -1.26 -0.59 118.95 124.90 2rdt s ARG 127 Ca 0.57 -0.49 0.06 0.00 -0.52 0.00 0.00 55.73 55.35 2rdt s ARG 127 Cb -0.22 -1.33 -0.04 0.00 0.52 0.00 0.00 34.95 33.88 2rdt s ARG 127 CO 0.17 0.18 -0.14 -1.58 0.02 0.00 0.00 175.30 173.95 2rdt s TRP 128 N 0.16 1.47 -0.18 -0.53 0.51 -0.37 -0.50 118.94 119.51 2rdt s TRP 128 Ca -0.05 -0.58 -0.07 0.00 -2.12 0.00 0.00 56.10 53.28 2rdt s TRP 128 Cb -0.11 -0.74 -0.04 0.00 -0.81 0.00 0.00 33.47 31.77 2rdt s TRP 128 CO 0.02 0.19 0.05 -1.17 -0.51 0.00 0.00 176.95 175.52 2rdt s LEU 129 N -2.74 3.72 -0.21 2.99 2.96 -0.28 -0.76 118.68 124.36 2rdt s LEU 129 Ca 0.13 0.04 -0.20 0.00 -0.22 0.00 0.00 54.13 53.89 2rdt s LEU 129 Cb -0.03 -1.94 -0.03 0.00 0.50 0.00 0.00 46.19 44.70 2rdt s LEU 129 CO 0.04 0.17 0.58 -1.58 -1.32 0.00 0.00 176.35 174.24 2rdt s GLN 130 N 0.39 4.18 -0.13 1.98 -0.44 0.15 0.54 119.66 126.33 2rdt s GLN 130 Ca 0.02 0.51 -0.00 0.00 -2.50 0.00 0.00 55.36 53.39 2rdt s GLN 130 Cb -0.13 -3.59 -0.02 0.00 -1.64 0.00 0.00 33.01 27.64 2rdt s GLN 130 CO 0.01 -0.24 -0.11 -1.17 0.50 0.00 0.00 175.29 174.27 2rdt s LEU 131 N 1.94 2.82 -0.09 3.68 2.96 0.65 -1.76 118.68 128.87 2rdt s LEU 131 Ca 0.26 -0.28 -0.10 0.00 -0.22 0.00 0.00 54.13 53.80 2rdt s LEU 131 Cb -0.16 -1.64 -0.05 0.00 0.50 0.00 0.00 46.19 44.85 2rdt s LEU 131 CO 0.10 0.18 0.23 -0.31 -1.32 0.00 0.00 176.35 175.23 2rdt s TYR 132 N 0.25 3.63 -0.76 5.38 2.02 -1.26 -1.96 117.35 124.65 2rdt s TYR 132 Ca -0.08 0.67 -0.25 0.00 -0.37 0.00 0.00 57.07 57.04 2rdt s TYR 132 Cb -0.15 -2.06 0.05 0.00 -0.40 0.00 0.00 41.96 39.39 2rdt s TYR 132 CO 0.05 0.68 1.19 0.42 -1.57 0.00 0.00 175.55 176.32 2rdt s ILE 133 N -0.96 3.99 0.59 2.71 1.01 -1.26 -4.85 121.20 122.43 2rdt s ILE 133 Ca 0.18 -0.09 -0.17 0.00 0.00 0.00 0.00 60.65 60.57 2rdt s ILE 133 Cb -0.13 -4.85 -0.04 0.00 0.01 0.00 0.00 42.46 37.45 2rdt s ILE 133 CO 0.07 -1.72 1.09 -0.31 0.00 0.00 0.00 174.94 174.07 2rdt s TYR 134 N 4.95 2.77 0.36 3.97 2.02 -1.26 -2.23 117.35 127.93 2rdt s TYR 134 Ca 0.32 1.54 0.13 0.00 -0.37 0.00 0.00 57.07 58.69 2rdt s TYR 134 Cb -0.10 -3.15 0.95 0.00 -0.40 0.00 0.00 41.96 39.27 2rdt s TYR 134 CO 0.09 -1.41 1.77 0.87 -1.57 0.00 0.00 175.55 175.30 2rdt h LYS 135 N 0.63 0.52 -6.36 -0.62 1.57 -1.64 -3.30 116.57 107.37 2rdt h LYS 135 Ca -0.48 -0.03 -0.54 0.00 -1.87 0.00 0.00 60.65 57.72 2rdt h LYS 135 Cb 1.24 -0.12 -0.08 0.00 0.08 0.00 0.00 32.23 33.35 2rdt h LYS 135 CO 0.56 0.35 1.03 0.34 -0.57 0.00 0.00 179.45 181.16 2rdt s ASP 136 N -5.33 6.20 0.48 0.86 3.68 -1.26 -4.86 116.67 116.44 2rdt s ASP 136 Ca -0.10 -0.39 0.29 0.00 2.13 0.00 0.00 52.55 54.48 2rdt s ASP 136 Cb 0.25 -2.55 0.99 0.00 -1.45 0.00 0.00 42.92 40.16 2rdt s ASP 136 CO 0.80 -1.78 1.84 0.03 0.13 0.00 0.00 175.17 176.19 2rdt h ARG 137 N 9.95 0.00 -0.10 4.34 2.47 -1.98 -2.63 114.38 126.43 2rdt h ARG 137 Ca -0.28 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.42 2rdt h ARG 137 Cb 1.05 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.37 2rdt h ARG 137 CO 1.26 0.00 -0.01 0.93 0.56 0.00 0.00 179.97 182.71 2rdt h GLU 138 N 0.00 0.18 -0.31 0.04 4.39 -1.92 -0.22 114.58 116.75 2rdt h GLU 138 Ca 0.00 -0.07 -0.10 0.00 0.34 0.00 0.00 59.36 59.54 2rdt h GLU 138 Cb 0.67 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.29 2rdt h GLU 138 CO 0.00 0.47 -0.21 0.28 -1.16 0.00 0.00 179.01 178.39 2rdt h VAL 139 N -0.12 1.26 0.10 3.13 2.07 -1.96 -0.53 116.25 120.20 2rdt h VAL 139 Ca 0.03 -1.23 0.02 0.00 0.82 0.00 0.00 66.70 66.33 2rdt h VAL 139 Cb 0.40 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.39 2rdt h VAL 139 CO 0.01 0.40 -0.24 0.74 0.02 0.00 0.00 177.57 178.50 2rdt h THR 140 N 0.52 0.46 -0.91 2.57 2.02 -1.35 -1.01 112.91 115.21 2rdt h THR 140 Ca 0.08 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.33 2rdt h THR 140 Cb 0.65 0.46 -0.06 0.00 -1.74 0.00 0.00 68.15 67.45 2rdt h THR 140 CO 0.05 0.00 0.57 0.50 0.37 0.00 0.00 175.52 177.01 2rdt h LYS 141 N -0.43 1.00 -0.66 6.66 3.64 -0.96 -2.87 116.57 122.95 2rdt h LYS 141 Ca 0.03 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2rdt h LYS 141 Cb 0.46 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 2rdt h LYS 141 CO -0.15 0.66 0.43 -0.22 -2.27 0.00 0.00 179.45 177.91 2rdt h LYS 142 N 1.03 0.87 -0.11 1.90 3.64 -0.45 -1.12 116.57 122.33 2rdt h LYS 142 Ca 0.40 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.74 2rdt h LYS 142 Cb 0.19 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 2rdt h LYS 142 CO -0.18 0.58 -0.01 -0.07 -2.27 0.00 0.00 179.45 177.50 2rdt h LEU 143 N 0.89 -0.07 -0.36 5.20 3.38 -1.02 0.78 115.31 124.11 2rdt h LEU 143 Ca 0.24 0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.29 2rdt h LEU 143 Cb -0.09 0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 2rdt h LEU 143 CO -0.05 -0.02 0.08 0.58 0.09 0.00 0.00 178.44 179.12 2rdt h VAL 144 N 0.02 0.83 -0.60 1.22 2.07 -1.30 0.73 116.25 119.22 2rdt h VAL 144 Ca 0.05 -0.07 -0.08 0.00 0.82 0.00 0.00 66.70 67.42 2rdt h VAL 144 Cb 0.07 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 2rdt h VAL 144 CO -0.10 0.04 0.08 0.03 0.02 0.00 0.00 177.57 177.64 2rdt h ARG 145 N 0.21 1.01 -0.54 1.57 2.47 -0.93 0.96 114.38 119.13 2rdt h ARG 145 Ca 0.17 -0.28 -0.02 0.00 -1.26 0.00 0.00 59.98 58.59 2rdt h ARG 145 Cb 0.19 -0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 28.37 2rdt h ARG 145 CO -0.22 0.96 0.25 1.96 0.56 0.00 0.00 179.97 183.48 2rdt h GLN 146 N 0.91 0.79 -0.37 0.04 4.20 -0.69 -0.54 115.11 119.46 2rdt h GLN 146 Ca 0.18 -0.12 0.04 0.00 0.06 0.00 0.00 58.65 58.81 2rdt h GLN 146 Cb 0.45 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 28.05 2rdt h GLN 146 CO 0.02 0.66 0.14 0.00 -0.67 0.00 0.00 178.83 178.97 2rdt h ALA 147 N 1.09 0.44 -0.16 3.87 0.00 -0.41 0.99 119.26 125.08 2rdt h ALA 147 Ca 0.19 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 2rdt h ALA 147 Cb 0.14 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2rdt h ALA 147 CO -0.02 -0.25 0.09 0.93 0.00 0.00 0.00 179.25 179.99 2rdt h GLU 148 N 0.29 0.22 -0.53 0.00 5.08 -0.62 -0.56 114.58 118.46 2rdt h GLU 148 Ca 0.17 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.43 2rdt h GLU 148 Cb 0.14 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2rdt h GLU 148 CO -0.17 0.22 0.05 -0.22 -1.00 0.00 0.00 179.01 177.89 2rdt h LYS 149 N 0.16 0.86 -0.17 2.33 3.64 -0.96 -2.87 116.57 119.56 2rdt h LYS 149 Ca 0.06 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 2rdt h LYS 149 Cb 0.06 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 2rdt h LYS 149 CO -0.01 0.83 0.00 -1.33 -2.27 0.00 0.00 179.45 176.67 2rdt n MET 150 N -4.23 1.41 -1.80 1.90 2.81 0.33 -4.91 117.12 112.63 2rdt n MET 150 Ca 0.03 -0.64 -0.03 0.00 -1.81 0.00 0.00 57.70 55.25 2rdt n MET 150 Cb 0.28 -1.16 -0.00 0.00 -0.71 0.00 0.00 33.22 31.63 2rdt n MET 150 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2rdt n GLY 151 N 0.80 0.34 3.81 3.03 0.00 -1.08 -4.86 105.19 107.24 2rdt n GLY 151 Ca 0.07 -0.80 -0.33 0.00 0.00 0.00 0.00 46.02 44.96 2rdt n GLY 151 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2rdt s TYR 152 N -2.15 3.12 -0.31 1.61 2.02 -0.24 -4.75 117.35 116.64 2rdt s TYR 152 Ca 0.00 1.51 0.03 0.00 -0.37 0.00 0.00 57.07 58.24 2rdt s TYR 152 Cb 0.00 -2.96 0.01 0.00 -0.40 0.00 0.00 41.96 38.62 2rdt s TYR 152 CO 0.00 -0.87 0.50 1.63 -1.57 0.00 0.00 175.55 175.24 2rdt n LYS 153 N -1.76 0.73 -3.60 -0.62 4.76 0.35 -4.66 118.16 113.36 2rdt n LYS 153 Ca 0.08 -0.54 -0.07 0.00 -2.87 0.00 0.00 58.31 54.91 2rdt n LYS 153 Cb 0.53 -0.97 -0.02 0.00 -1.84 0.00 0.00 35.03 32.73 2rdt n LYS 153 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2rdt s ALA 154 N -0.44 -1.71 -0.15 7.82 0.00 -1.26 -4.23 121.76 121.78 2rdt s ALA 154 Ca 0.03 0.58 0.00 0.00 0.00 0.00 0.00 51.96 52.57 2rdt s ALA 154 Cb 0.02 0.56 -0.00 0.00 0.00 0.00 0.00 23.12 23.70 2rdt s ALA 154 CO 0.05 -0.84 -0.15 0.42 0.00 0.00 0.00 175.76 175.24 2rdt s ILE 155 N -3.28 2.72 -0.43 0.00 -1.09 -0.12 -1.12 121.20 117.87 2rdt s ILE 155 Ca 0.07 -0.75 -0.14 0.00 -2.23 0.00 0.00 60.65 57.60 2rdt s ILE 155 Cb -0.01 -2.15 0.05 0.00 -1.58 0.00 0.00 42.46 38.77 2rdt s ILE 155 CO -0.05 0.51 0.32 -0.36 -1.23 0.00 0.00 174.94 174.14 2rdt s PHE 156 N 0.76 3.26 -0.28 3.97 0.08 0.19 -0.69 117.98 125.27 2rdt s PHE 156 Ca -0.06 -0.95 -0.21 0.00 0.12 0.00 0.00 56.93 55.83 2rdt s PHE 156 Cb -0.15 -2.88 -0.01 0.00 -0.57 0.00 0.00 43.02 39.41 2rdt s PHE 156 CO 0.01 -0.73 0.65 0.54 -0.10 0.00 0.00 175.22 175.59 2rdt s VAL 157 N 1.60 4.94 -0.14 -0.44 0.11 0.31 -0.26 120.40 126.52 2rdt s VAL 157 Ca 0.04 1.02 -0.27 0.00 -2.93 0.00 0.00 61.98 59.84 2rdt s VAL 157 Cb -0.22 -3.99 -0.01 0.00 -1.53 0.00 0.00 36.38 30.62 2rdt s VAL 157 CO 0.07 -0.08 0.90 -0.89 -3.33 0.00 0.00 175.10 171.76 2rdt s THR 158 N 2.61 4.84 0.00 5.04 2.01 -0.83 -0.66 115.64 128.65 2rdt s THR 158 Ca 0.27 1.79 0.00 0.00 0.31 0.00 0.00 61.69 64.06 2rdt s THR 158 Cb -0.15 -4.21 0.00 0.00 0.01 0.00 0.00 72.50 68.15 2rdt s THR 158 CO 0.10 0.02 0.73 1.33 -0.69 0.00 0.00 174.62 176.11 2rdt n VAL 159 N 4.65 0.48 -0.35 3.82 0.24 -0.03 -4.62 118.33 122.52 2rdt n VAL 159 Ca 0.06 -0.72 0.07 0.00 -2.04 0.00 0.00 64.34 61.71 2rdt n VAL 159 Cb 0.49 0.78 0.21 0.00 -1.47 0.00 0.00 33.84 33.85 2rdt n VAL 159 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2rdt n ASP 160 N -0.24 3.38 -2.89 -1.34 3.85 -1.25 -4.71 116.55 113.36 2rdt n ASP 160 Ca 0.00 -2.17 -0.22 0.00 -0.71 0.00 0.00 54.79 51.69 2rdt n ASP 160 Cb 0.13 -0.34 -0.02 0.00 -1.35 0.00 0.00 41.12 39.54 2rdt n ASP 160 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.20 176.60 2rdt n THR 161 N 0.62 1.67 0.23 2.12 -1.04 -1.26 -4.84 114.28 111.78 2rdt n THR 161 Ca 0.16 -4.80 0.06 0.00 -2.04 0.00 0.00 64.05 57.44 2rdt n THR 161 Cb 0.56 -0.73 0.54 0.00 -1.82 0.00 0.00 70.33 68.88 2rdt n THR 161 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 2rdt h PRO 162 N 2.92 0.00 -4.51 -2.82 0.13 -1.87 -3.43 132.00 122.41 2rdt h PRO 162 Ca 0.12 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.06 2rdt h PRO 162 Cb 0.82 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 31.80 2rdt h PRO 162 CO 0.68 0.17 -0.69 0.71 -0.23 0.00 0.00 178.00 178.64 2rdt s TYR 163 N -4.61 0.77 0.34 1.56 1.51 -1.26 -3.75 117.35 111.91 2rdt s TYR 163 Ca -0.04 -0.97 -0.26 0.00 -1.01 0.00 0.00 57.07 54.79 2rdt s TYR 163 Cb 0.16 -0.48 -0.10 0.00 -0.11 0.00 0.00 41.96 41.43 2rdt s TYR 163 CO 0.68 -0.23 0.99 -1.17 -1.11 0.00 0.00 175.55 174.71 2rdt s LEU 164 N -3.00 4.32 0.97 -1.29 2.96 -1.26 -5.05 118.68 116.33 2rdt s LEU 164 Ca 0.11 1.95 -0.11 0.00 -0.22 0.00 0.00 54.13 55.85 2rdt s LEU 164 Cb 0.06 -4.00 0.17 0.00 0.50 0.00 0.00 46.19 42.92 2rdt s LEU 164 CO -0.06 -0.19 1.09 -0.83 -1.32 0.00 0.00 176.35 175.04 2rdt s GLY 165 N -1.50 1.62 -0.55 7.98 0.00 -1.25 -4.98 107.32 108.64 2rdt s GLY 165 Ca 0.51 0.12 -0.18 0.00 0.00 0.00 0.00 44.72 45.17 2rdt s GLY 165 CO 0.27 0.65 0.63 0.21 0.00 0.00 0.00 173.10 174.85 2rdt s ASN 166 N -2.96 6.19 -0.39 1.64 3.04 -1.26 -4.90 114.94 116.31 2rdt s ASN 166 Ca 0.66 -1.36 -0.12 0.00 0.04 0.00 0.00 52.86 52.08 2rdt s ASN 166 Cb -0.21 -2.27 0.03 0.00 -1.54 0.00 0.00 41.25 37.26 2rdt s ASN 166 CO 0.59 -0.98 0.24 -0.13 -3.04 0.00 0.00 177.10 173.78 2rdt s ARG 167 N 2.42 2.83 0.20 0.43 3.00 -1.26 0.16 118.95 126.73 2rdt s ARG 167 Ca 0.10 -1.11 -0.11 0.00 0.00 0.00 0.00 55.73 54.61 2rdt s ARG 167 Cb -0.24 -3.80 0.24 0.00 0.00 0.00 0.00 34.95 31.15 2rdt s ARG 167 CO 0.07 -0.74 1.74 -0.07 0.00 0.00 0.00 175.30 176.30 2rdt h LEU 168 N 8.48 0.19 -1.12 2.53 4.07 -1.83 -2.27 115.31 125.36 2rdt h LEU 168 Ca -0.26 0.08 0.00 0.00 0.08 0.00 0.00 57.88 57.78 2rdt h LEU 168 Cb 1.10 0.06 -0.04 0.00 1.08 0.00 0.00 40.66 42.87 2rdt h LEU 168 CO 0.69 0.12 0.54 0.44 -1.08 0.00 0.00 178.44 179.15 2rdt h ASP 169 N 0.37 0.99 -0.67 -0.43 3.32 -1.93 -0.37 116.42 117.70 2rdt h ASP 169 Ca 0.29 -0.04 0.03 0.00 0.02 0.00 0.00 57.03 57.33 2rdt h ASP 169 Cb 0.35 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.60 2rdt h ASP 169 CO -0.30 0.74 0.41 0.44 -1.72 0.00 0.00 179.24 178.82 2rdt h ASP 170 N 1.16 0.67 -0.23 6.45 3.32 -1.75 0.38 116.42 126.42 2rdt h ASP 170 Ca 0.31 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.33 2rdt h ASP 170 Cb -0.09 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 2rdt h ASP 170 CO -0.06 0.46 0.03 0.58 -1.72 0.00 0.00 179.24 178.52 2rdt h VAL 171 N 0.80 1.23 -0.46 -1.35 2.07 -1.26 0.15 116.25 117.43 2rdt h VAL 171 Ca 0.27 -0.79 0.01 0.00 0.82 0.00 0.00 66.70 67.02 2rdt h VAL 171 Cb 0.04 1.31 -0.03 0.00 -1.52 0.00 0.00 31.29 31.10 2rdt h VAL 171 CO -0.12 0.25 0.28 0.03 0.02 0.00 0.00 177.57 178.03 2rdt h ARG 172 N 0.18 0.56 0.00 1.57 3.08 -0.74 -2.40 114.38 116.63 2rdt h ARG 172 Ca 0.07 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2rdt h ARG 172 Cb 0.34 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.27 2rdt h ARG 172 CO 0.01 0.37 0.00 0.09 -1.07 0.00 0.00 179.97 179.37 2rdt n ASN 173 N -4.81 0.00 -3.80 7.04 3.02 0.13 -4.90 115.26 111.95 2rdt n ASN 173 Ca 0.02 -1.12 -0.23 0.00 -0.03 0.00 0.00 54.58 53.21 2rdt n ASN 173 Cb 0.05 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.24 2rdt n ASN 173 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2rdt n ARG 174 N -0.92 -4.48 0.00 3.52 1.74 -0.51 -5.03 116.66 110.98 2rdt n ARG 174 Ca 0.20 0.55 0.00 0.00 -0.77 0.00 0.00 57.85 57.83 2rdt n ARG 174 Cb 0.09 -5.02 0.00 0.00 -1.02 0.00 0.00 32.46 26.51 2rdt n ARG 174 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2rdt n PHE 175 N -4.34 0.00 0.00 -1.55 -0.00 0.40 -5.04 117.46 106.92 2rdt n PHE 175 Ca -0.27 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.18 2rdt n PHE 175 Cb 0.67 -0.01 0.00 0.00 -0.00 0.00 0.00 39.48 40.13 2rdt n PHE 175 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 2rdt n LEU 205 N -0.54 0.00 -0.25 -2.13 4.77 -1.26 -5.12 117.00 112.46 2rdt n LEU 205 Ca 0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.97 2rdt n LEU 205 Cb 0.00 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.20 2rdt n LEU 205 CO 0.00 0.00 1.11 0.00 -1.33 0.00 0.00 177.39 177.17 2rdt h ALA 206 N 0.00 0.96 -0.47 -1.18 0.00 -1.93 -1.28 119.26 115.36 2rdt h ALA 206 Ca 0.00 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 2rdt h ALA 206 Cb 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2rdt h ALA 206 CO 0.00 0.09 -0.07 0.00 0.00 0.00 0.00 179.25 179.27 2rdt h ALA 207 N 1.36 0.65 -0.68 0.00 0.00 -1.99 -1.96 119.26 116.65 2rdt h ALA 207 Ca 0.32 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2rdt h ALA 207 Cb 0.19 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2rdt h ALA 207 CO -0.18 0.51 0.27 1.88 0.00 0.00 0.00 179.25 181.73 2rdt h TYR 208 N 0.73 1.03 -0.64 0.00 0.05 -1.93 -1.65 116.97 114.56 2rdt h TYR 208 Ca 0.13 -0.08 -0.08 0.00 0.05 0.00 0.00 58.73 58.75 2rdt h TYR 208 Cb 0.61 -0.31 -0.02 0.00 1.01 0.00 0.00 36.73 38.01 2rdt h TYR 208 CO 0.05 0.80 0.08 0.28 -1.05 0.00 0.00 178.16 178.32 2rdt h VAL 209 N 0.96 1.26 -0.04 -2.88 2.07 -1.21 -1.96 116.25 114.46 2rdt h VAL 209 Ca 0.23 -1.06 -0.06 0.00 0.82 0.00 0.00 66.70 66.63 2rdt h VAL 209 Cb 0.20 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 2rdt h VAL 209 CO -0.02 0.39 -0.25 0.00 0.02 0.00 0.00 177.57 177.71 2rdt h ALA 210 N 1.03 1.51 -0.05 1.67 0.00 -1.06 0.46 119.26 122.82 2rdt h ALA 210 Ca 0.19 -0.25 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 2rdt h ALA 210 Cb 0.47 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2rdt h ALA 210 CO 0.02 0.36 -0.65 0.87 0.00 0.00 0.00 179.25 179.85 2rdt h LYS 211 N 0.06 0.19 0.00 0.00 1.57 -1.04 -3.40 116.57 113.95 2rdt h LYS 211 Ca 0.01 -0.14 -0.38 0.00 -1.87 0.00 0.00 60.65 58.27 2rdt h LYS 211 Cb 0.48 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.76 2rdt h LYS 211 CO 0.03 0.77 -2.34 0.00 -0.57 0.00 0.00 179.45 177.35 2rdt n ALA 212 N -2.46 1.46 -2.20 3.86 0.00 -0.76 -4.93 120.51 115.49 2rdt n ALA 212 Ca -0.02 -0.98 -0.38 0.00 0.00 0.00 0.00 53.44 52.06 2rdt n ALA 212 Cb 0.65 0.07 -0.06 0.00 0.00 0.00 0.00 19.45 20.11 2rdt n ALA 212 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2rdt s ILE 213 N -2.45 4.65 -0.43 0.00 -1.09 0.16 -1.92 121.20 120.11 2rdt s ILE 213 Ca -0.33 1.29 -0.23 0.00 -2.23 0.00 0.00 60.65 59.15 2rdt s ILE 213 Cb 0.11 -3.93 0.02 0.00 -1.58 0.00 0.00 42.46 37.08 2rdt s ILE 213 CO 0.48 0.48 0.79 -0.62 -1.23 0.00 0.00 174.94 174.84 2rdt s ASP 214 N -1.24 6.45 0.00 3.58 -1.08 -0.94 -4.63 116.67 118.81 2rdt s ASP 214 Ca 0.33 0.02 0.24 0.00 -0.52 0.00 0.00 52.55 52.62 2rdt s ASP 214 Cb -0.20 -2.39 1.05 0.00 -1.46 0.00 0.00 42.92 39.92 2rdt s ASP 214 CO 0.21 -0.88 1.77 -0.81 0.52 0.00 0.00 175.17 175.98 2rdt n PRO 215 N 6.67 0.05 0.00 4.34 -0.04 -1.25 -3.10 135.00 141.68 2rdt n PRO 215 Ca 0.03 0.09 0.15 0.00 -0.04 0.00 0.00 63.50 63.72 2rdt n PRO 215 Cb 0.48 -1.50 0.77 0.00 -0.04 0.00 0.00 33.50 33.21 2rdt n PRO 215 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2rdt n SER 216 N -1.47 0.00 -4.73 3.54 3.41 -1.26 -4.91 113.62 108.21 2rdt n SER 216 Ca 0.07 -0.31 -0.61 0.00 -0.26 0.00 0.00 58.87 57.76 2rdt n SER 216 Cb 0.27 -0.22 -0.08 0.00 -0.26 0.00 0.00 64.21 63.91 2rdt n SER 216 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2rdt n ILE 217 N -1.22 0.20 -4.08 -1.33 3.06 -1.18 -4.98 119.36 109.83 2rdt n ILE 217 Ca 0.16 -0.04 -0.04 0.00 -2.50 0.00 0.00 62.75 60.33 2rdt n ILE 217 Cb 0.21 -0.98 -0.01 0.00 0.54 0.00 0.00 39.64 39.39 2rdt n ILE 217 CO 0.00 0.00 0.00 -1.54 -2.50 0.00 0.00 176.55 172.51 2rdt n SER 218 N 4.92 0.96 0.28 9.51 3.41 -1.26 -5.02 113.62 126.42 2rdt n SER 218 Ca 0.28 -1.36 0.14 0.00 -0.26 0.00 0.00 58.87 57.66 2rdt n SER 218 Cb 0.06 0.18 0.80 0.00 -0.26 0.00 0.00 64.21 64.99 2rdt n SER 218 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 2rdt h TRP 219 N 1.12 0.00 -0.82 7.33 4.06 -2.00 -2.07 115.95 123.57 2rdt h TRP 219 Ca -0.05 0.00 0.04 0.00 2.06 0.00 0.00 58.89 60.94 2rdt h TRP 219 Cb 0.20 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.31 2rdt h TRP 219 CO 0.00 0.08 0.52 0.93 -3.56 0.00 0.00 178.44 176.40 2rdt h GLU 220 N 0.00 0.96 0.00 0.49 4.39 -1.98 -1.29 114.58 117.16 2rdt h GLU 220 Ca -0.00 -0.06 -0.09 0.00 0.34 0.00 0.00 59.36 59.55 2rdt h GLU 220 Cb 0.21 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 2rdt h GLU 220 CO 0.01 0.63 -0.41 -0.44 -1.16 0.00 0.00 179.01 177.64 2rdt h ASP 221 N 0.99 0.00 -0.17 1.42 3.32 -1.77 -0.54 116.42 119.67 2rdt h ASP 221 Ca 0.34 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.23 2rdt h ASP 221 Cb 0.06 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 2rdt h ASP 221 CO -0.13 0.41 -0.44 0.40 -1.72 0.00 0.00 179.24 177.76 2rdt h ILE 222 N 0.00 1.29 -0.26 0.35 1.08 -1.34 -0.49 117.51 118.14 2rdt h ILE 222 Ca -0.00 -1.63 -0.02 0.00 -0.39 0.00 0.00 64.86 62.82 2rdt h ILE 222 Cb 0.89 1.54 -0.01 0.00 -3.07 0.00 0.00 36.82 36.17 2rdt h ILE 222 CO 0.05 0.52 0.07 0.11 -0.69 0.00 0.00 178.15 178.22 2rdt h LYS 223 N 0.58 0.41 -0.33 2.37 1.57 -0.74 0.34 116.57 120.77 2rdt h LYS 223 Ca 0.04 -0.09 0.07 0.00 -1.87 0.00 0.00 60.65 58.80 2rdt h LYS 223 Cb 0.99 -0.06 -0.08 0.00 0.08 0.00 0.00 32.23 33.16 2rdt h LYS 223 CO 0.09 0.49 -0.30 2.35 -0.57 0.00 0.00 179.45 181.52 2rdt h TRP 224 N 0.25 -0.81 -0.62 -1.35 7.01 -1.07 -1.30 115.95 118.05 2rdt h TRP 224 Ca 0.08 0.05 -0.06 0.00 2.11 0.00 0.00 58.89 61.08 2rdt h TRP 224 Cb 0.26 0.41 -0.03 0.00 -2.10 0.00 0.00 29.16 27.70 2rdt h TRP 224 CO 0.01 -0.37 0.16 1.25 -2.79 0.00 0.00 178.44 176.71 2rdt h LEU 225 N -0.27 0.90 -1.40 0.65 7.12 -0.83 -1.39 115.31 120.08 2rdt h LEU 225 Ca 0.16 -0.17 -0.02 0.00 0.13 0.00 0.00 57.88 57.98 2rdt h LEU 225 Cb 0.52 -0.23 -0.02 0.00 -0.53 0.00 0.00 40.66 40.39 2rdt h LEU 225 CO -0.47 0.86 0.18 -0.09 -0.13 0.00 0.00 178.44 178.79 2rdt h ARG 226 N 0.92 0.58 0.00 1.25 9.65 -0.56 -2.58 114.38 123.65 2rdt h ARG 226 Ca 0.20 -0.07 -0.11 0.00 -1.10 0.00 0.00 59.98 58.90 2rdt h ARG 226 Cb 0.31 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 28.76 2rdt h ARG 226 CO -0.00 0.47 -0.52 0.00 2.80 0.00 0.00 179.97 182.72 2rdt h ARG 227 N 0.59 0.00 -0.02 0.20 3.08 -0.31 -3.34 114.38 114.58 2rdt h ARG 227 Ca 0.15 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.98 2rdt h ARG 227 Cb 0.10 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 2rdt h ARG 227 CO -0.02 0.52 -0.88 1.25 -1.07 0.00 0.00 179.97 179.77 2rdt h LEU 228 N 0.00 0.51 -8.03 3.04 7.12 -0.89 -3.46 115.31 113.60 2rdt h LEU 228 Ca -0.01 -0.39 -0.33 0.00 0.13 0.00 0.00 57.88 57.28 2rdt h LEU 228 Cb 1.16 -0.16 -0.26 0.00 -0.53 0.00 0.00 40.66 40.87 2rdt h LEU 228 CO 0.07 1.17 -0.76 0.28 -0.13 0.00 0.00 178.44 179.08 2rdt s THR 229 N -3.36 0.55 -1.78 1.05 -1.32 -1.12 -5.01 115.64 104.66 2rdt s THR 229 Ca -0.06 -0.55 0.27 0.00 -1.21 0.00 0.00 61.69 60.14 2rdt s THR 229 Cb 0.09 -0.51 0.29 0.00 -1.51 0.00 0.00 72.50 70.86 2rdt s THR 229 CO 0.86 -0.02 1.60 -1.20 -2.21 0.00 0.00 174.62 173.65 2rdt n SER 230 N 2.44 1.00 -4.75 8.08 7.64 -1.26 -4.77 113.62 122.00 2rdt n SER 230 Ca -0.16 -0.89 -0.38 0.00 1.01 0.00 0.00 58.87 58.45 2rdt n SER 230 Cb 0.57 0.11 0.05 0.00 -1.01 0.00 0.00 64.21 63.93 2rdt n SER 230 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2rdt s LEU 231 N -2.48 3.76 0.24 -3.43 1.43 -1.26 -4.95 118.68 111.99 2rdt s LEU 231 Ca 0.25 2.68 -0.31 0.00 -1.03 0.00 0.00 54.13 55.73 2rdt s LEU 231 Cb 0.19 -4.40 -0.14 0.00 0.03 0.00 0.00 46.19 41.87 2rdt s LEU 231 CO 0.51 -1.68 1.26 -2.65 0.23 0.00 0.00 176.35 174.02 2rdt n PRO 232 N -1.31 1.69 -5.10 1.29 -0.02 -1.26 -4.82 135.00 125.48 2rdt n PRO 232 Ca 0.12 0.60 -0.31 0.00 -2.02 0.00 0.00 63.50 61.89 2rdt n PRO 232 Cb 0.46 -2.16 -0.17 0.00 -0.02 0.00 0.00 33.50 31.62 2rdt n PRO 232 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2rdt s ILE 233 N -0.39 1.92 -0.16 4.25 1.01 -1.26 -0.95 121.20 125.61 2rdt s ILE 233 Ca 0.66 -0.93 -0.02 0.00 0.00 0.00 0.00 60.65 60.36 2rdt s ILE 233 Cb -0.70 -1.67 -0.01 0.00 0.01 0.00 0.00 42.46 40.09 2rdt s ILE 233 CO 0.54 0.53 -0.10 -0.69 0.00 0.00 0.00 174.94 175.22 2rdt s VAL 234 N 0.41 3.20 -0.34 2.92 1.01 0.14 -0.34 120.40 127.41 2rdt s VAL 234 Ca -0.18 -0.59 -0.29 0.00 0.00 0.00 0.00 61.98 60.93 2rdt s VAL 234 Cb -0.18 -2.39 0.01 0.00 0.00 0.00 0.00 36.38 33.82 2rdt s VAL 234 CO 0.08 0.49 1.29 0.00 0.00 0.00 0.00 175.10 176.96 2rdt s ALA 235 N 0.76 3.30 -0.24 5.51 0.00 -0.95 -0.53 121.76 129.60 2rdt s ALA 235 Ca -0.04 -0.01 -0.11 0.00 0.00 0.00 0.00 51.96 51.80 2rdt s ALA 235 Cb -0.15 -3.81 -0.05 0.00 0.00 0.00 0.00 23.12 19.11 2rdt s ALA 235 CO 0.01 -1.91 0.20 0.21 0.00 0.00 0.00 175.76 174.28 2rdt s LYS 236 N 4.29 4.06 0.00 0.00 2.20 0.16 0.07 119.74 130.53 2rdt s LYS 236 Ca 0.56 -0.21 0.00 0.00 -0.36 0.00 0.00 55.97 55.95 2rdt s LYS 236 Cb -0.15 -3.56 0.00 0.00 -1.51 0.00 0.00 37.83 32.61 2rdt s LYS 236 CO 0.25 0.01 0.00 0.41 -0.36 0.00 0.00 175.35 175.66 2rdt n GLY 237 N 4.36 1.29 3.72 5.54 0.00 -0.50 -0.85 105.19 118.76 2rdt n GLY 237 Ca -0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 2rdt n GLY 237 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2rdt s ILE 238 N -2.00 4.02 0.00 -0.61 -1.09 -1.22 -4.62 121.20 115.68 2rdt s ILE 238 Ca 0.00 1.53 0.00 0.00 -2.23 0.00 0.00 60.65 59.95 2rdt s ILE 238 Cb 0.00 -3.98 0.00 0.00 -1.58 0.00 0.00 42.46 36.90 2rdt s ILE 238 CO 0.00 0.16 0.06 0.18 -1.23 0.00 0.00 174.94 174.11 2rdt n LEU 239 N 3.45 0.11 -4.45 2.97 4.77 -1.26 -3.23 117.00 119.36 2rdt n LEU 239 Ca 0.07 -0.47 -0.32 0.00 -0.03 0.00 0.00 56.01 55.26 2rdt n LEU 239 Cb 0.46 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.42 2rdt n LEU 239 CO 0.55 0.03 -0.48 -0.13 -1.33 0.00 0.00 177.39 176.03 2rdt s ARG 240 N -0.71 2.35 0.32 3.23 0.52 -1.26 -4.97 118.95 118.43 2rdt s ARG 240 Ca 0.00 -0.79 0.01 0.00 -0.52 0.00 0.00 55.73 54.43 2rdt s ARG 240 Cb 0.00 -2.29 0.53 0.00 0.52 0.00 0.00 34.95 33.71 2rdt s ARG 240 CO 0.00 0.60 1.93 0.78 0.02 0.00 0.00 175.30 178.63 2rdt h GLY 241 N 5.17 0.89 0.96 -3.53 0.00 -1.94 -1.72 103.07 102.90 2rdt h GLY 241 Ca -0.46 -0.41 -0.09 0.00 0.00 0.00 0.00 47.33 46.37 2rdt h GLY 241 CO 0.49 0.39 -0.11 1.29 0.00 0.00 0.00 176.54 178.60 2rdt h ASP 242 N 0.84 0.74 -0.45 0.19 3.04 -1.96 -2.00 116.42 116.82 2rdt h ASP 242 Ca 0.21 -0.37 -0.00 0.00 -3.24 0.00 0.00 57.03 53.62 2rdt h ASP 242 Cb 0.07 -0.20 -0.02 0.00 -1.04 0.00 0.00 39.33 38.14 2rdt h ASP 242 CO -0.03 0.94 0.28 0.44 -2.04 0.00 0.00 179.24 178.83 2rdt h ASP 243 N 0.52 0.53 -0.57 4.15 3.45 -1.96 -1.12 116.42 121.42 2rdt h ASP 243 Ca 0.09 -0.05 0.11 0.00 0.43 0.00 0.00 57.03 57.62 2rdt h ASP 243 Cb 0.63 -0.13 -0.09 0.00 -0.56 0.00 0.00 39.33 39.18 2rdt h ASP 243 CO 0.04 0.42 0.05 0.00 -1.57 0.00 0.00 179.24 178.18 2rdt h ALA 244 N 1.13 0.60 -0.42 3.45 0.00 -1.21 0.21 119.26 123.03 2rdt h ALA 244 Ca 0.16 0.16 -0.11 0.00 0.00 0.00 0.00 54.91 55.12 2rdt h ALA 244 Cb -0.02 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2rdt h ALA 244 CO -0.03 -0.36 -0.17 0.00 0.00 0.00 0.00 179.25 178.69 2rdt h ARG 245 N 0.17 0.80 -0.71 0.00 3.08 -1.00 -1.93 114.38 114.79 2rdt h ARG 245 Ca 0.30 -0.30 0.01 0.00 0.07 0.00 0.00 59.98 60.06 2rdt h ARG 245 Cb 0.46 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.42 2rdt h ARG 245 CO -0.45 0.91 0.47 1.49 -1.07 0.00 0.00 179.97 181.32 2rdt h GLU 246 N 0.71 0.91 -0.45 0.04 4.57 -0.29 -1.31 114.58 118.77 2rdt h GLU 246 Ca 0.11 -0.05 0.08 0.00 -1.18 0.00 0.00 59.36 58.31 2rdt h GLU 246 Cb 0.67 -0.21 -0.06 0.00 -0.16 0.00 0.00 28.75 28.99 2rdt h GLU 246 CO 0.05 0.60 0.06 0.00 -1.18 0.00 0.00 179.01 178.55 2rdt h ALA 247 N 1.27 0.47 -0.51 2.92 0.00 -0.16 -2.07 119.26 121.18 2rdt h ALA 247 Ca 0.27 0.10 0.07 0.00 0.00 0.00 0.00 54.91 55.35 2rdt h ALA 247 Cb -0.08 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.80 2rdt h ALA 247 CO -0.07 -0.34 0.17 0.28 0.00 0.00 0.00 179.25 179.29 2rdt h VAL 248 N 0.19 0.81 -0.37 0.00 2.07 -0.93 -2.62 116.25 115.40 2rdt h VAL 248 Ca 0.22 -0.12 0.01 0.00 0.82 0.00 0.00 66.70 67.63 2rdt h VAL 248 Cb 0.30 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 2rdt h VAL 248 CO -0.31 0.06 0.24 0.11 0.02 0.00 0.00 177.57 177.69 2rdt h LYS 249 N 0.34 0.46 -0.33 1.57 1.57 -0.83 -1.98 116.57 117.37 2rdt h LYS 249 Ca 0.25 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 2rdt h LYS 249 Cb 0.28 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.49 2rdt h LYS 249 CO -0.26 0.30 0.00 0.72 -0.57 0.00 0.00 179.45 179.64 2rdt n HIS 250 N -4.48 0.34 -1.19 -1.35 8.25 -0.82 -4.90 115.22 111.07 2rdt n HIS 250 Ca 0.03 -0.15 -0.06 0.00 -0.26 0.00 0.00 57.72 57.27 2rdt n HIS 250 Cb 0.08 -0.04 -0.03 0.00 1.12 0.00 0.00 29.99 31.12 2rdt n HIS 250 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2rdt n GLY 251 N 0.71 0.88 3.77 -1.41 0.00 -0.74 -4.89 105.19 103.51 2rdt n GLY 251 Ca 0.07 -0.74 -0.33 0.00 0.00 0.00 0.00 46.02 45.02 2rdt n GLY 251 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2rdt s LEU 252 N -1.46 3.42 0.00 0.99 1.02 -1.01 -4.90 118.68 116.74 2rdt s LEU 252 Ca 0.00 2.02 0.17 0.00 0.02 0.00 0.00 54.13 56.34 2rdt s LEU 252 Cb 0.00 -4.55 -0.08 0.00 0.02 0.00 0.00 46.19 41.58 2rdt s LEU 252 CO 0.00 -1.59 0.82 0.59 0.02 0.00 0.00 176.35 176.19 2rdt n ASN 253 N -2.31 1.31 -3.58 2.29 3.02 0.54 -4.69 115.26 111.85 2rdt n ASN 253 Ca 0.10 -1.16 -0.07 0.00 -0.03 0.00 0.00 54.58 53.43 2rdt n ASN 253 Cb 0.52 0.70 -0.02 0.00 -0.61 0.00 0.00 39.78 40.37 2rdt n ASN 253 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2rdt s GLY 254 N -2.26 -0.39 -0.13 7.41 0.00 -1.15 -3.10 107.32 107.69 2rdt s GLY 254 Ca 0.11 0.75 0.02 0.00 0.00 0.00 0.00 44.72 45.60 2rdt s GLY 254 CO 0.54 0.23 -0.20 -0.42 0.00 0.00 0.00 173.10 173.26 2rdt s ILE 255 N -3.15 1.90 -0.52 0.90 -1.09 0.08 -2.25 121.20 117.07 2rdt s ILE 255 Ca 0.07 -0.89 -0.17 0.00 -2.23 0.00 0.00 60.65 57.44 2rdt s ILE 255 Cb -0.01 -1.69 0.09 0.00 -1.58 0.00 0.00 42.46 39.27 2rdt s ILE 255 CO -0.06 0.52 0.52 -0.22 -1.23 0.00 0.00 174.94 174.48 2rdt s LEU 256 N 0.82 5.61 -0.20 2.97 2.96 0.11 -0.59 118.68 130.36 2rdt s LEU 256 Ca -0.08 -1.39 -0.29 0.00 -0.22 0.00 0.00 54.13 52.15 2rdt s LEU 256 Cb -0.16 -2.26 -0.04 0.00 0.50 0.00 0.00 46.19 44.24 2rdt s LEU 256 CO -0.01 -0.83 1.76 -0.69 -1.32 0.00 0.00 176.35 175.25 2rdt s VAL 257 N 2.00 3.50 -0.21 1.68 1.01 -0.38 -1.40 120.40 126.61 2rdt s VAL 257 Ca 0.07 0.56 -0.20 0.00 0.00 0.00 0.00 61.98 62.41 2rdt s VAL 257 Cb -0.25 -3.53 0.06 0.00 0.00 0.00 0.00 36.38 32.66 2rdt s VAL 257 CO 0.07 -0.24 0.58 -0.55 0.00 0.00 0.00 175.10 174.96 2rdt s SER 258 N 4.99 -0.60 -0.23 3.32 0.15 -1.20 -2.04 113.70 118.10 2rdt s SER 258 Ca 0.78 1.13 0.13 0.00 0.70 0.00 0.00 55.95 58.69 2rdt s SER 258 Cb -0.28 1.14 0.49 0.00 -1.71 0.00 0.00 66.02 65.67 2rdt s SER 258 CO 0.32 -0.22 1.41 -0.46 1.20 0.00 0.00 173.24 175.49 2rdt n ASN 259 N 2.68 3.03 -2.90 5.45 0.23 -1.26 -4.04 115.26 118.45 2rdt n ASN 259 Ca -0.14 -3.39 -0.18 0.00 -0.53 0.00 0.00 54.58 50.34 2rdt n ASN 259 Cb 0.56 -0.57 0.06 0.00 -2.08 0.00 0.00 39.78 37.75 2rdt n ASN 259 CO 0.00 0.00 0.00 1.57 -0.93 0.00 0.00 177.26 177.90 2rdt n HIS 260 N -0.91 -2.23 -3.27 -2.53 -0.00 -1.26 -1.73 115.22 103.29 2rdt n HIS 260 Ca 0.26 0.79 -0.24 0.00 -0.00 0.00 0.00 57.72 58.53 2rdt n HIS 260 Cb 0.93 -4.14 0.02 0.00 -0.00 0.00 0.00 29.99 26.80 2rdt n HIS 260 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2rdt n GLY 261 N -1.66 -0.51 2.38 1.57 0.00 -1.26 -2.51 105.19 103.21 2rdt n GLY 261 Ca 0.00 0.13 -0.17 0.00 0.00 0.00 0.00 46.02 45.99 2rdt n GLY 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rdt n ALA 262 N -3.78 -0.39 0.66 4.61 0.00 -0.71 -4.79 120.51 116.12 2rdt n ALA 262 Ca -0.05 0.19 0.07 0.00 0.00 0.00 0.00 53.44 53.65 2rdt n ALA 262 Cb 0.58 -1.80 -0.02 0.00 0.00 0.00 0.00 19.45 18.20 2rdt n ALA 262 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2rdt n ARG 263 N -2.56 1.91 0.00 0.00 1.74 -1.04 0.05 116.66 116.75 2rdt n ARG 263 Ca -0.18 -0.56 0.00 0.00 -0.77 0.00 0.00 57.85 56.33 2rdt n ARG 263 Cb 0.61 -1.22 0.00 0.00 -1.02 0.00 0.00 32.46 30.83 2rdt n ARG 263 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2rdt n GLN 264 N -0.47 0.00 -3.02 5.56 1.13 -1.26 -3.80 117.38 115.53 2rdt n GLN 264 Ca 0.05 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.70 2rdt n GLN 264 Cb 0.29 0.00 -0.06 0.00 0.11 0.00 0.00 30.24 30.58 2rdt n GLN 264 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 2rdt s LEU 265 N 0.00 4.12 0.32 1.08 2.96 -1.26 -4.41 118.68 121.48 2rdt s LEU 265 Ca 0.00 0.52 -0.26 0.00 -0.22 0.00 0.00 54.13 54.17 2rdt s LEU 265 Cb 0.00 -2.95 -0.10 0.00 0.50 0.00 0.00 46.19 43.64 2rdt s LEU 265 CO 0.00 -0.56 0.96 -0.62 -1.32 0.00 0.00 176.35 174.80 2rdt s ASP 266 N 1.65 7.33 0.00 3.68 3.68 -1.26 -3.74 116.67 128.01 2rdt s ASP 266 Ca 0.29 1.88 0.00 0.00 2.13 0.00 0.00 52.55 56.85 2rdt s ASP 266 Cb -0.14 -2.58 0.00 0.00 -1.45 0.00 0.00 42.92 38.74 2rdt s ASP 266 CO 0.13 -0.07 0.00 0.61 0.13 0.00 0.00 175.17 175.96 2rdt n GLY 267 N 0.67 0.73 3.82 2.66 0.00 -1.26 -4.96 105.19 106.85 2rdt n GLY 267 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 2rdt n GLY 267 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2rdt s VAL 268 N -2.26 4.14 0.78 1.61 -7.23 -1.24 -5.00 120.40 111.20 2rdt s VAL 268 Ca 0.00 0.92 -0.12 0.00 -1.81 0.00 0.00 61.98 60.97 2rdt s VAL 268 Cb 0.00 -3.53 0.07 0.00 0.56 0.00 0.00 36.38 33.48 2rdt s VAL 268 CO 0.00 -0.69 1.14 -2.16 -0.31 0.00 0.00 175.10 173.08 2rdt s PRO 269 N -4.36 1.96 0.42 4.82 0.04 -1.26 -4.66 135.00 131.95 2rdt s PRO 269 Ca 0.60 1.46 -0.25 0.00 0.04 0.00 0.00 61.00 62.85 2rdt s PRO 269 Cb -0.13 -1.84 -0.10 0.00 0.04 0.00 0.00 34.50 32.46 2rdt s PRO 269 CO 0.40 -1.91 1.16 0.00 0.04 0.00 0.00 177.00 176.69 2rdt n ALA 270 N -3.35 0.79 0.02 8.56 0.00 -1.26 -4.90 120.51 120.36 2rdt n ALA 270 Ca 0.11 0.25 0.03 0.00 0.00 0.00 0.00 53.44 53.84 2rdt n ALA 270 Cb 0.52 -2.18 0.41 0.00 0.00 0.00 0.00 19.45 18.20 2rdt n ALA 270 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2rdt h THR 271 N 1.84 1.12 -0.07 0.00 1.35 -1.85 -2.25 112.91 113.06 2rdt h THR 271 Ca -0.46 -0.32 -0.08 0.00 -0.55 0.00 0.00 66.41 64.99 2rdt h THR 271 Cb 1.31 0.66 -0.01 0.00 -1.73 0.00 0.00 68.15 68.38 2rdt h THR 271 CO 0.59 0.13 -0.33 -0.29 -0.25 0.00 0.00 175.52 175.37 2rdt h ILE 272 N 0.49 1.26 0.00 6.82 6.09 -1.89 -1.46 117.51 128.83 2rdt h ILE 272 Ca 0.13 -1.25 -0.19 0.00 -1.37 0.00 0.00 64.86 62.17 2rdt h ILE 272 Cb 0.04 1.58 -0.01 0.00 0.47 0.00 0.00 36.82 38.90 2rdt h ILE 272 CO -0.02 0.37 -0.87 0.44 -3.07 0.00 0.00 178.15 175.00 2rdt h ASP 273 N 0.12 0.21 0.91 2.19 3.45 -1.78 -3.31 116.42 118.21 2rdt h ASP 273 Ca 0.01 -0.17 0.00 0.00 0.43 0.00 0.00 57.03 57.30 2rdt h ASP 273 Cb 0.65 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 39.35 2rdt h ASP 273 CO 0.05 0.98 -0.97 1.33 -1.57 0.00 0.00 179.24 179.06 2rdt n VAL 274 N -3.64 0.53 -0.17 -1.35 0.24 -1.06 -4.49 118.33 108.39 2rdt n VAL 274 Ca -0.03 -0.48 -0.05 0.00 -2.04 0.00 0.00 64.34 61.74 2rdt n VAL 274 Cb 0.81 -0.25 0.02 0.00 -1.47 0.00 0.00 33.84 32.94 2rdt n VAL 274 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 2rdt h LEU 275 N 0.00 -0.93 -1.31 1.34 5.85 -1.35 -2.01 115.31 116.90 2rdt h LEU 275 Ca 0.00 0.20 0.04 0.00 0.84 0.00 0.00 57.88 58.96 2rdt h LEU 275 Cb 0.94 0.49 -0.04 0.00 0.37 0.00 0.00 40.66 42.41 2rdt h LEU 275 CO 0.00 -0.28 0.50 1.55 -0.34 0.00 0.00 178.44 179.87 2rdt h PRO 276 N -0.14 0.86 -0.10 5.25 0.13 -1.78 0.16 132.00 136.37 2rdt h PRO 276 Ca 0.23 -0.05 -0.14 0.00 -0.87 0.00 0.00 66.00 65.17 2rdt h PRO 276 Cb 0.51 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 31.44 2rdt h PRO 276 CO -0.61 0.57 -0.56 1.05 -0.23 0.00 0.00 178.00 178.22 2rdt h GLU 277 N 0.88 0.31 -0.38 0.86 4.11 -1.66 -0.36 114.58 118.34 2rdt h GLU 277 Ca 0.31 -0.19 -0.06 0.00 0.07 0.00 0.00 59.36 59.48 2rdt h GLU 277 Cb 0.11 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2rdt h GLU 277 CO -0.09 0.78 0.00 0.82 0.07 0.00 0.00 179.01 180.59 2rdt h ILE 278 N 0.24 1.26 -0.20 -1.06 1.08 -0.85 -0.54 117.51 117.43 2rdt h ILE 278 Ca 0.00 -0.99 0.00 0.00 -0.39 0.00 0.00 64.86 63.48 2rdt h ILE 278 Cb 1.05 1.15 -0.01 0.00 -3.07 0.00 0.00 36.82 35.94 2rdt h ILE 278 CO 0.09 0.33 0.13 0.58 -0.69 0.00 0.00 178.15 178.59 2rdt h VAL 279 N 0.49 1.05 -0.59 1.67 2.07 -0.63 -1.91 116.25 118.40 2rdt h VAL 279 Ca 0.11 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 2rdt h VAL 279 Cb 0.47 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 2rdt h VAL 279 CO 0.02 0.05 0.35 -0.08 0.02 0.00 0.00 177.57 177.93 2rdt h GLU 280 N 0.26 0.80 -0.30 1.57 4.81 -0.97 -3.00 114.58 117.76 2rdt h GLU 280 Ca 0.07 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 2rdt h GLU 280 Cb -0.03 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.17 2rdt h GLU 280 CO -0.02 0.58 0.05 0.00 -0.73 0.00 0.00 179.01 178.89 2rdt h ALA 281 N 1.17 1.53 0.00 2.92 0.00 -0.70 -2.80 119.26 121.38 2rdt h ALA 281 Ca 0.21 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 2rdt h ALA 281 Cb -0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2rdt h ALA 281 CO -0.04 0.35 -0.60 0.28 0.00 0.00 0.00 179.25 179.24 2rdt h VAL 282 N 0.43 0.42 -4.13 0.00 2.07 -1.27 -3.44 116.25 110.33 2rdt h VAL 282 Ca 0.10 -1.65 -0.37 0.00 0.82 0.00 0.00 66.70 65.60 2rdt h VAL 282 Cb 0.21 2.09 0.06 0.00 -1.52 0.00 0.00 31.29 32.13 2rdt h VAL 282 CO 0.00 0.24 -0.56 -0.62 0.02 0.00 0.00 177.57 176.66 2rdt n GLU 283 N -3.05 -4.56 -1.42 1.57 1.02 -1.06 -1.81 120.64 111.33 2rdt n GLU 283 Ca 0.00 0.83 -0.15 0.00 -0.02 0.00 0.00 57.16 57.83 2rdt n GLU 283 Cb 0.67 -5.53 -0.06 0.00 -0.02 0.00 0.00 31.44 26.50 2rdt n GLU 283 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2rdt n GLY 284 N -1.47 1.44 0.20 0.62 0.00 -1.26 -4.89 105.19 99.83 2rdt n GLY 284 Ca -0.10 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 45.93 2rdt n GLY 284 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rdt h LYS 285 N 0.03 0.00 -2.84 1.61 1.57 -1.74 -3.46 116.57 111.74 2rdt h LYS 285 Ca -0.30 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.40 2rdt h LYS 285 Cb 1.12 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 33.25 2rdt h LYS 285 CO 0.44 0.00 -0.09 0.54 -0.57 0.00 0.00 179.45 179.77 2rdt s VAL 286 N -3.28 0.04 0.28 0.50 0.11 -1.26 -5.04 120.40 111.76 2rdt s VAL 286 Ca 0.06 -0.37 -0.29 0.00 -2.93 0.00 0.00 61.98 58.46 2rdt s VAL 286 Cb 0.07 -0.87 -0.09 0.00 -1.53 0.00 0.00 36.38 33.96 2rdt s VAL 286 CO 0.61 -0.20 1.04 -1.61 -3.33 0.00 0.00 175.10 171.62 2rdt s GLU 287 N -1.97 4.66 -0.13 1.54 2.02 -1.18 -4.90 118.70 118.75 2rdt s GLU 287 Ca -0.08 1.67 0.03 0.00 0.02 0.00 0.00 54.97 56.61 2rdt s GLU 287 Cb -0.02 -3.15 0.00 0.00 0.10 0.00 0.00 34.13 31.07 2rdt s GLU 287 CO 0.01 0.27 -0.21 0.08 0.02 0.00 0.00 175.26 175.43 2rdt s VAL 288 N -1.22 2.18 0.39 2.63 1.01 -1.26 -0.74 120.40 123.38 2rdt s VAL 288 Ca 0.45 -0.95 0.08 0.00 0.00 0.00 0.00 61.98 61.55 2rdt s VAL 288 Cb -0.29 -1.87 -0.05 0.00 0.00 0.00 0.00 36.38 34.17 2rdt s VAL 288 CO 0.37 0.55 0.14 -0.36 0.00 0.00 0.00 175.10 175.80 2rdt s PHE 289 N 0.63 2.62 0.02 5.22 0.40 0.24 -0.10 117.98 127.01 2rdt s PHE 289 Ca -0.11 -0.52 0.02 0.00 -0.60 0.00 0.00 56.93 55.72 2rdt s PHE 289 Cb -0.16 -1.81 -0.01 0.00 0.51 0.00 0.00 43.02 41.54 2rdt s PHE 289 CO 0.02 0.27 -0.07 -1.17 0.70 0.00 0.00 175.22 174.97 2rdt s LEU 290 N -3.86 2.13 0.22 -0.37 0.20 -0.94 -1.24 118.68 114.81 2rdt s LEU 290 Ca 0.39 -0.32 0.00 0.00 0.69 0.00 0.00 54.13 54.89 2rdt s LEU 290 Cb 0.02 -0.28 -0.04 0.00 -0.43 0.00 0.00 46.19 45.46 2rdt s LEU 290 CO 0.22 -0.04 0.11 1.51 -0.29 0.00 0.00 176.35 177.86 2rdt s ASP 291 N -0.81 0.63 0.00 3.68 1.47 -0.86 -0.96 116.67 119.81 2rdt s ASP 291 Ca -0.03 -1.38 0.00 0.00 1.18 0.00 0.00 52.55 52.33 2rdt s ASP 291 Cb -0.06 0.28 0.00 0.00 -0.34 0.00 0.00 42.92 42.80 2rdt s ASP 291 CO 0.00 -0.78 0.00 0.61 0.68 0.00 0.00 175.17 175.68 2rdt n GLY 292 N -0.35 0.96 1.08 2.12 0.00 -1.26 -4.59 105.19 103.15 2rdt n GLY 292 Ca 0.01 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.33 2rdt n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rdt n GLY 293 N 0.08 0.71 3.66 -0.02 0.00 -1.26 -4.72 105.19 103.64 2rdt n GLY 293 Ca 0.00 -0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 2rdt n GLY 293 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2rdt s VAL 294 N -2.00 4.19 0.00 1.61 1.01 -1.26 -4.67 120.40 119.28 2rdt s VAL 294 Ca 0.00 1.44 0.00 0.00 0.00 0.00 0.00 61.98 63.42 2rdt s VAL 294 Cb 0.00 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 32.45 2rdt s VAL 294 CO 0.00 -0.12 0.00 0.54 0.00 0.00 0.00 175.10 175.52 2rdt n ARG 295 N 6.65 4.25 -4.05 2.72 5.12 -1.26 -4.85 116.66 125.23 2rdt n ARG 295 Ca 0.14 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.98 2rdt n ARG 295 Cb 0.45 -0.60 -0.11 0.00 -1.16 0.00 0.00 32.46 31.04 2rdt n ARG 295 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2rdt s LYS 296 N -0.52 0.50 0.26 5.56 1.02 -1.26 -4.32 119.74 120.99 2rdt s LYS 296 Ca 0.00 -0.94 -0.01 0.00 0.02 0.00 0.00 55.97 55.04 2rdt s LYS 296 Cb 0.00 0.10 0.54 0.00 -0.52 0.00 0.00 37.83 37.95 2rdt s LYS 296 CO 0.00 -0.07 1.75 0.78 -0.92 0.00 0.00 175.35 176.89 2rdt h GLY 297 N 3.86 1.35 1.65 -3.33 0.00 -1.79 -2.07 103.07 102.74 2rdt h GLY 297 Ca -0.33 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 46.76 2rdt h GLY 297 CO 0.54 -0.07 0.15 -0.91 0.00 0.00 0.00 176.54 176.25 2rdt h THR 298 N 0.57 1.12 -0.68 4.70 1.35 -1.93 -1.59 112.91 116.46 2rdt h THR 298 Ca 0.46 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.96 2rdt h THR 298 Cb 0.68 0.71 -0.03 0.00 -1.73 0.00 0.00 68.15 67.78 2rdt h THR 298 CO -0.38 0.14 0.43 0.44 -0.25 0.00 0.00 175.52 175.90 2rdt h ASP 299 N 0.46 0.80 -0.16 5.36 3.32 -1.78 -0.32 116.42 124.09 2rdt h ASP 299 Ca 0.12 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 2rdt h ASP 299 Cb 0.07 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 2rdt h ASP 299 CO -0.02 0.60 0.09 0.58 -1.72 0.00 0.00 179.24 178.77 2rdt h VAL 300 N 0.92 1.11 -0.56 -1.35 2.07 -1.21 -1.70 116.25 115.53 2rdt h VAL 300 Ca 0.25 -0.31 0.02 0.00 0.82 0.00 0.00 66.70 67.48 2rdt h VAL 300 Cb -0.08 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 2rdt h VAL 300 CO -0.05 0.10 0.34 0.25 0.02 0.00 0.00 177.57 178.24 2rdt h LEU 301 N 0.15 0.57 -0.36 2.57 5.85 -1.00 -1.98 115.31 121.11 2rdt h LEU 301 Ca 0.06 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.73 2rdt h LEU 301 Cb 0.09 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 2rdt h LEU 301 CO -0.01 0.40 0.04 0.11 -0.34 0.00 0.00 178.44 178.64 2rdt h LYS 302 N 0.69 0.61 -0.37 1.25 1.57 -0.87 0.49 116.57 119.94 2rdt h LYS 302 Ca 0.22 -0.17 0.05 0.00 -1.87 0.00 0.00 60.65 58.87 2rdt h LYS 302 Cb 0.00 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.20 2rdt h LYS 302 CO -0.09 0.69 0.11 0.00 -0.57 0.00 0.00 179.45 179.60 2rdt h ALA 303 N 0.89 0.42 -0.68 3.86 0.00 -1.16 -1.77 119.26 120.82 2rdt h ALA 303 Ca 0.11 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2rdt h ALA 303 Cb 0.39 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2rdt h ALA 303 CO 0.01 -0.28 0.22 -0.07 0.00 0.00 0.00 179.25 179.13 2rdt h LEU 304 N 0.26 0.97 -1.51 0.00 4.07 -1.14 -1.64 115.31 116.32 2rdt h LEU 304 Ca 0.17 -0.20 0.00 0.00 0.08 0.00 0.00 57.88 57.93 2rdt h LEU 304 Cb 0.16 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.62 2rdt h LEU 304 CO -0.19 0.91 0.31 0.00 -1.08 0.00 0.00 178.44 178.39 2rdt h ALA 305 N 1.10 1.64 0.00 1.53 0.00 -0.70 -1.08 119.26 121.74 2rdt h ALA 305 Ca 0.22 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2rdt h ALA 305 Cb 0.28 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2rdt h ALA 305 CO -0.01 0.33 0.00 1.28 0.00 0.00 0.00 179.25 180.85 2rdt n LEU 306 N -4.45 0.00 0.00 0.00 4.77 -0.68 -3.68 117.00 112.95 2rdt n LEU 306 Ca 0.04 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 2rdt n LEU 306 Cb 0.06 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.80 2rdt n LEU 306 CO 0.36 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 2rdt n GLY 307 N 1.32 1.26 3.74 -0.72 0.00 -0.41 -4.45 105.19 105.93 2rdt n GLY 307 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2rdt n GLY 307 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rdt s ALA 308 N -2.00 3.61 0.13 4.61 0.00 -0.67 -4.68 121.76 122.76 2rdt s ALA 308 Ca 0.00 1.28 -0.08 0.00 0.00 0.00 0.00 51.96 53.16 2rdt s ALA 308 Cb 0.00 -3.54 -0.07 0.00 0.00 0.00 0.00 23.12 19.51 2rdt s ALA 308 CO 0.00 -0.70 1.36 -0.22 0.00 0.00 0.00 175.76 176.20 2rdt h LYS 309 N 5.11 0.65 -2.86 0.00 1.63 -0.84 -3.36 116.57 116.90 2rdt h LYS 309 Ca -0.46 -0.52 -0.03 0.00 -0.85 0.00 0.00 60.65 58.79 2rdt h LYS 309 Cb 1.22 0.11 -0.14 0.00 -0.60 0.00 0.00 32.23 32.82 2rdt h LYS 309 CO 0.78 1.14 0.16 0.00 -3.45 0.00 0.00 179.45 178.08 2rdt s ALA 310 N -3.71 -1.53 0.25 5.00 0.00 -1.26 -4.82 121.76 115.69 2rdt s ALA 310 Ca -0.08 0.58 0.10 0.00 0.00 0.00 0.00 51.96 52.55 2rdt s ALA 310 Cb 0.09 0.68 -0.04 0.00 0.00 0.00 0.00 23.12 23.85 2rdt s ALA 310 CO 0.88 -0.67 -0.09 0.14 0.00 0.00 0.00 175.76 176.02 2rdt s VAL 311 N -3.23 3.08 0.01 0.00 -7.23 0.12 -2.23 120.40 110.92 2rdt s VAL 311 Ca -0.01 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.23 2rdt s VAL 311 Cb -0.01 -2.61 -0.03 0.00 0.56 0.00 0.00 36.38 34.30 2rdt s VAL 311 CO -0.08 -0.31 -0.22 -0.36 -0.31 0.00 0.00 175.10 173.81 2rdt s PHE 312 N -2.21 2.45 -0.12 2.82 0.08 -0.14 -0.99 117.98 119.87 2rdt s PHE 312 Ca 0.29 -0.34 -0.01 0.00 0.12 0.00 0.00 56.93 57.00 2rdt s PHE 312 Cb -0.07 -1.48 -0.02 0.00 -0.57 0.00 0.00 43.02 40.88 2rdt s PHE 312 CO 0.17 0.13 -0.08 0.14 -0.10 0.00 0.00 175.22 175.47 2rdt s VAL 313 N -0.77 3.51 0.00 -0.44 -7.23 -0.32 -4.28 120.40 110.87 2rdt s VAL 313 Ca 0.12 -0.51 0.00 0.00 -1.81 0.00 0.00 61.98 59.78 2rdt s VAL 313 Cb -0.10 -2.48 0.00 0.00 0.56 0.00 0.00 36.38 34.35 2rdt s VAL 313 CO 0.02 0.54 0.00 0.61 -0.31 0.00 0.00 175.10 175.96 2rdt n GLY 314 N 3.11 -0.23 0.27 2.32 0.00 -1.26 -0.78 105.19 108.62 2rdt n GLY 314 Ca -0.18 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.87 2rdt n GLY 314 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2rdt h ARG 315 N 0.00 0.47 -0.69 1.61 3.08 -1.95 -2.32 114.38 114.58 2rdt h ARG 315 Ca 0.00 -0.03 0.18 0.00 0.07 0.00 0.00 59.98 60.21 2rdt h ARG 315 Cb 0.00 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 29.91 2rdt h ARG 315 CO 0.00 0.31 0.49 -1.35 -1.07 0.00 0.00 179.97 178.34 2rdt h PRO 316 N 0.48 0.09 -0.45 0.04 0.11 -1.88 -0.24 132.00 130.14 2rdt h PRO 316 Ca 0.37 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 66.34 2rdt h PRO 316 Cb 0.50 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.57 2rdt h PRO 316 CO -0.34 0.06 -0.25 0.82 -0.21 0.00 0.00 178.00 178.07 2rdt h ILE 317 N 0.09 1.27 -0.50 4.15 1.08 -1.70 -0.95 117.51 120.96 2rdt h ILE 317 Ca 0.33 -1.42 -0.13 0.00 -0.39 0.00 0.00 64.86 63.26 2rdt h ILE 317 Cb 1.18 1.19 -0.01 0.00 -3.07 0.00 0.00 36.82 36.11 2rdt h ILE 317 CO -0.03 0.48 -0.18 0.58 -0.69 0.00 0.00 178.15 178.31 2rdt h VAL 318 N 0.81 1.27 -0.57 1.67 2.07 -1.14 -1.18 116.25 119.18 2rdt h VAL 318 Ca 0.10 -1.34 0.00 0.00 0.82 0.00 0.00 66.70 66.28 2rdt h VAL 318 Cb 0.83 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 2rdt h VAL 318 CO 0.07 0.47 0.36 -0.50 0.02 0.00 0.00 177.57 177.99 2rdt h TRP 319 N 0.86 0.74 -0.28 1.57 -0.00 -1.20 -0.51 115.95 117.12 2rdt h TRP 319 Ca 0.12 0.01 0.05 0.00 -0.00 0.00 0.00 58.89 59.06 2rdt h TRP 319 Cb 0.76 -0.25 -0.05 0.00 -0.00 0.00 0.00 29.16 29.62 2rdt h TRP 319 CO 0.05 0.49 -0.01 0.78 -0.00 0.00 0.00 178.44 179.75 2rdt h GLY 320 N 0.77 0.26 0.88 1.49 0.00 -0.94 -1.73 103.07 103.80 2rdt h GLY 320 Ca 0.21 0.04 0.03 0.00 0.00 0.00 0.00 47.33 47.61 2rdt h GLY 320 CO -0.04 -0.07 0.34 -2.00 0.00 0.00 0.00 176.54 174.77 2rdt h LEU 321 N 0.07 0.55 -1.66 3.11 5.85 -0.95 -1.80 115.31 120.48 2rdt h LEU 321 Ca 0.13 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 2rdt h LEU 321 Cb 0.18 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 2rdt h LEU 321 CO -0.24 0.39 -0.06 0.00 -0.34 0.00 0.00 178.44 178.19 2rdt h ALA 322 N 1.25 1.73 0.02 1.25 0.00 -0.76 0.98 119.26 123.72 2rdt h ALA 322 Ca 0.23 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2rdt h ALA 322 Cb 0.02 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2rdt h ALA 322 CO -0.10 0.21 -0.01 0.35 0.00 0.00 0.00 179.25 179.70 2rdt h PHE 323 N 0.14 -0.02 -0.01 0.00 3.57 -0.85 -3.45 116.94 116.31 2rdt h PHE 323 Ca 0.03 -0.00 -0.17 0.00 3.53 0.00 0.00 57.97 61.36 2rdt h PHE 323 Cb 0.20 0.01 -0.16 0.00 2.79 0.00 0.00 35.95 38.79 2rdt h PHE 323 CO 0.00 0.72 -0.30 0.94 -2.23 0.00 0.00 178.31 177.44 2rdt n GLN 324 N -4.72 1.21 0.00 1.11 7.27 -0.72 -4.96 117.38 116.57 2rdt n GLN 324 Ca -0.09 -1.26 0.00 0.00 0.07 0.00 0.00 57.00 55.72 2rdt n GLN 324 Cb 0.37 0.37 0.00 0.00 2.41 0.00 0.00 30.24 33.39 2rdt n GLN 324 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2rdt n GLY 325 N -1.34 3.16 0.21 1.69 0.00 0.33 -2.33 105.19 106.91 2rdt n GLY 325 Ca -0.18 -0.14 -0.02 0.00 0.00 0.00 0.00 46.02 45.67 2rdt n GLY 325 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2rdt h GLU 326 N 0.00 0.03 -0.46 1.61 4.81 -1.89 -1.52 114.58 117.16 2rdt h GLU 326 Ca 0.00 -0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.15 2rdt h GLU 326 Cb 0.00 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.35 2rdt h GLU 326 CO 0.00 0.02 -0.01 -0.22 -0.73 0.00 0.00 179.01 178.07 2rdt h LYS 327 N 0.04 0.77 -0.01 1.92 3.11 -1.81 -0.30 116.57 120.28 2rdt h LYS 327 Ca 0.26 -0.21 0.00 0.00 -2.81 0.00 0.00 60.65 57.89 2rdt h LYS 327 Cb 0.40 -0.09 -0.00 0.00 -1.00 0.00 0.00 32.23 31.55 2rdt h LYS 327 CO -0.51 0.78 0.01 0.78 -2.81 0.00 0.00 179.45 177.70 2rdt h GLY 328 N 0.97 0.02 0.85 5.01 0.00 -1.12 0.25 103.07 109.03 2rdt h GLY 328 Ca 0.14 -0.01 0.02 0.00 0.00 0.00 0.00 47.33 47.48 2rdt h GLY 328 CO 0.02 0.01 0.17 -2.08 0.00 0.00 0.00 176.54 174.66 2rdt h VAL 329 N 0.01 0.99 -0.63 4.60 2.07 -1.00 -1.09 116.25 121.20 2rdt h VAL 329 Ca 0.00 -0.12 0.09 0.00 0.82 0.00 0.00 66.70 67.49 2rdt h VAL 329 Cb 0.00 0.61 -0.07 0.00 -1.52 0.00 0.00 31.29 30.31 2rdt h VAL 329 CO -0.00 0.06 0.27 -0.61 0.02 0.00 0.00 177.57 177.31 2rdt h GLN 330 N 0.35 0.45 -0.49 1.57 4.15 -0.74 0.16 115.11 120.57 2rdt h GLN 330 Ca 0.14 -0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.54 2rdt h GLN 330 Cb 0.05 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 27.61 2rdt h GLN 330 CO -0.09 0.30 0.32 -0.44 -1.93 0.00 0.00 178.83 176.98 2rdt h ASP 331 N 0.47 0.54 -0.20 -0.69 3.32 -0.08 -0.07 116.42 119.71 2rdt h ASP 331 Ca 0.32 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.32 2rdt h ASP 331 Cb 0.37 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 2rdt h ASP 331 CO -0.29 0.39 -0.01 0.58 -1.72 0.00 0.00 179.24 178.18 2rdt h VAL 332 N 0.64 1.26 -0.80 -1.35 2.07 -0.60 0.14 116.25 117.60 2rdt h VAL 332 Ca 0.18 -0.92 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 2rdt h VAL 332 Cb -0.05 1.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 2rdt h VAL 332 CO -0.05 0.28 0.47 -0.07 0.02 0.00 0.00 177.57 178.22 2rdt h LEU 333 N 0.10 0.97 -0.40 2.57 3.38 -0.84 -1.61 115.31 119.48 2rdt h LEU 333 Ca 0.05 -0.06 -0.18 0.00 0.09 0.00 0.00 57.88 57.78 2rdt h LEU 333 Cb 0.42 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 2rdt h LEU 333 CO 0.01 0.75 -0.76 -0.33 0.09 0.00 0.00 178.44 178.20 2rdt h GLU 334 N 1.11 0.32 -0.33 1.13 5.08 -0.81 -0.14 114.58 120.94 2rdt h GLU 334 Ca 0.29 -0.28 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2rdt h GLU 334 Cb -0.03 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2rdt h GLU 334 CO -0.05 0.94 0.19 0.82 -1.00 0.00 0.00 179.01 179.91 2rdt h ILE 335 N 0.21 1.12 -0.60 3.13 2.04 -0.41 -2.18 117.51 120.82 2rdt h ILE 335 Ca -0.03 -0.30 -0.04 0.00 1.00 0.00 0.00 64.86 65.49 2rdt h ILE 335 Cb 1.34 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 38.12 2rdt h ILE 335 CO 0.12 0.12 0.23 -0.07 0.00 0.00 0.00 178.15 178.56 2rdt h LEU 336 N 0.42 0.82 0.02 1.44 3.38 -1.15 0.05 115.31 120.29 2rdt h LEU 336 Ca 0.12 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.93 2rdt h LEU 336 Cb 0.03 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2rdt h LEU 336 CO -0.02 0.77 -0.12 0.50 0.09 0.00 0.00 178.44 179.67 2rdt h LYS 337 N 0.83 -0.20 0.02 1.13 3.64 -0.93 -0.47 116.57 120.58 2rdt h LYS 337 Ca 0.20 0.01 -0.22 0.00 -1.27 0.00 0.00 60.65 59.37 2rdt h LYS 337 Cb 0.21 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.07 2rdt h LYS 337 CO -0.02 -0.13 -0.96 0.93 -2.27 0.00 0.00 179.45 177.01 2rdt h GLU 338 N -0.21 0.32 -0.55 1.90 4.39 -1.33 0.35 114.58 119.45 2rdt h GLU 338 Ca 0.04 -0.36 0.00 0.00 0.34 0.00 0.00 59.36 59.37 2rdt h GLU 338 Cb 0.25 0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.98 2rdt h GLU 338 CO -0.10 1.07 0.35 0.93 -1.16 0.00 0.00 179.01 180.10 2rdt h GLU 339 N 0.17 0.74 -0.47 2.33 5.08 -0.98 -0.75 114.58 120.70 2rdt h GLU 339 Ca -0.07 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.14 2rdt h GLU 339 Cb 1.60 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.68 2rdt h GLU 339 CO 0.16 0.51 -0.06 0.35 -1.00 0.00 0.00 179.01 178.97 2rdt h PHE 340 N 0.75 0.96 -0.18 4.33 3.57 -0.85 -0.93 116.94 124.59 2rdt h PHE 340 Ca 0.20 -0.19 0.04 0.00 3.53 0.00 0.00 57.97 61.55 2rdt h PHE 340 Cb -0.05 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.41 2rdt h PHE 340 CO -0.03 0.93 -0.04 -0.09 -2.23 0.00 0.00 178.31 176.86 2rdt h ARG 341 N 0.72 0.01 -0.08 1.11 2.43 -0.08 -0.13 114.38 118.35 2rdt h ARG 341 Ca 0.13 -0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.32 2rdt h ARG 341 Cb 0.59 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.11 2rdt h ARG 341 CO 0.04 0.01 -0.07 1.25 -1.51 0.00 0.00 179.97 179.68 2rdt h LEU 342 N 0.01 -0.21 -0.81 3.80 5.85 -1.04 -0.56 115.31 122.35 2rdt h LEU 342 Ca 0.09 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.86 2rdt h LEU 342 Cb 0.13 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 2rdt h LEU 342 CO -0.18 -0.10 0.54 0.00 -0.34 0.00 0.00 178.44 178.36 2rdt h ALA 343 N 0.99 1.02 0.04 1.25 0.00 -1.03 0.20 119.26 121.73 2rdt h ALA 343 Ca 0.06 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2rdt h ALA 343 Cb 0.16 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2rdt h ALA 343 CO -0.13 0.44 -0.15 0.52 0.00 0.00 0.00 179.25 179.93 2rdt h MET 344 N 1.10 -0.25 -0.69 0.00 2.86 -0.78 -1.37 114.93 115.80 2rdt h MET 344 Ca 0.30 0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.93 2rdt h MET 344 Cb -0.13 0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.56 2rdt h MET 344 CO -0.06 -0.17 0.34 0.00 1.06 0.00 0.00 176.91 178.08 2rdt h ALA 345 N 0.65 0.88 0.00 6.32 0.00 -0.67 0.22 119.26 126.66 2rdt h ALA 345 Ca 0.04 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2rdt h ALA 345 Cb 0.31 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2rdt h ALA 345 CO -0.12 0.43 -0.25 -0.07 0.00 0.00 0.00 179.25 179.25 2rdt h LEU 346 N 0.95 0.00 -1.44 0.00 3.38 -0.50 -2.31 115.31 115.38 2rdt h LEU 346 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2rdt h LEU 346 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2rdt h LEU 346 CO -0.03 0.25 0.00 -1.54 0.09 0.00 0.00 178.44 177.21 2rdt n SER 347 N -3.75 2.18 0.00 -0.43 3.41 -0.53 -4.65 113.62 109.85 2rdt n SER 347 Ca -0.01 -1.77 0.00 0.00 -0.26 0.00 0.00 58.87 56.82 2rdt n SER 347 Cb 0.36 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 2rdt n SER 347 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2rdt n GLY 348 N 1.24 0.56 3.41 5.00 0.00 -0.87 -1.50 105.19 113.03 2rdt n GLY 348 Ca 0.17 -0.61 -0.37 0.00 0.00 0.00 0.00 46.02 45.20 2rdt n GLY 348 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rdt h GLN 350 N 8.28 0.00 -3.15 0.00 7.50 -1.84 -3.31 115.11 122.58 2rdt h GLN 350 Ca -0.34 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 58.78 2rdt h GLN 350 Cb 1.15 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.66 2rdt h GLN 350 CO 0.60 0.41 0.19 0.54 -1.50 0.00 0.00 178.83 179.07 2rdt s ASN 351 N -6.40 0.04 0.50 1.46 2.20 -1.26 -0.90 114.94 110.57 2rdt s ASN 351 Ca 0.04 -1.05 0.28 0.00 -0.94 0.00 0.00 52.86 51.19 2rdt s ASN 351 Cb 0.08 0.79 0.86 0.00 -2.00 0.00 0.00 41.25 40.97 2rdt s ASN 351 CO 0.72 -1.54 1.80 -0.37 -2.94 0.00 0.00 177.10 174.77 2rdt h VAL 352 N 2.02 0.00 0.00 3.54 -1.51 -1.82 -3.08 116.25 115.40 2rdt h VAL 352 Ca -0.28 -0.75 -0.07 0.00 -1.23 0.00 0.00 66.70 64.36 2rdt h VAL 352 Cb 1.25 1.75 -0.01 0.00 -2.13 0.00 0.00 31.29 32.15 2rdt h VAL 352 CO 0.36 0.00 -0.31 0.11 -1.23 0.00 0.00 177.57 176.50 2rdt h LYS 353 N 0.00 0.00 -0.02 5.19 1.79 -1.93 -2.75 116.57 118.85 2rdt h LYS 353 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2rdt h LYS 353 Cb 0.75 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.40 2rdt h LYS 353 CO 0.00 0.31 -0.12 1.33 -1.08 0.00 0.00 179.45 179.89 2rdt n VAL 354 N -3.76 0.00 -2.10 0.50 0.24 -1.16 -4.82 118.33 107.22 2rdt n VAL 354 Ca -0.01 -0.31 -0.42 0.00 -2.04 0.00 0.00 64.34 61.56 2rdt n VAL 354 Cb 0.41 0.91 -0.03 0.00 -1.47 0.00 0.00 33.84 33.66 2rdt n VAL 354 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2rdt s ILE 355 N -2.17 3.32 0.32 1.34 1.01 -1.04 -4.97 121.20 119.01 2rdt s ILE 355 Ca 0.29 0.83 0.03 0.00 0.00 0.00 0.00 60.65 61.80 2rdt s ILE 355 Cb 0.20 -3.53 -0.04 0.00 0.01 0.00 0.00 42.46 39.10 2rdt s ILE 355 CO 0.39 0.02 0.15 1.51 0.00 0.00 0.00 174.94 177.02 2rdt s ASP 356 N 1.75 1.72 0.44 3.58 -4.77 -1.26 -4.88 116.67 113.25 2rdt s ASP 356 Ca 0.67 -1.57 0.24 0.00 -3.30 0.00 0.00 52.55 48.60 2rdt s ASP 356 Cb -0.36 0.38 0.91 0.00 -1.09 0.00 0.00 42.92 42.75 2rdt s ASP 356 CO 0.29 -0.88 1.82 0.07 0.70 0.00 0.00 175.17 177.17 2rdt h LYS 357 N 2.16 0.00 0.00 2.11 2.10 -1.92 -2.60 116.57 118.43 2rdt h LYS 357 Ca -0.34 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 2rdt h LYS 357 Cb 1.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 2rdt h LYS 357 CO 0.53 0.22 0.00 0.25 -2.00 0.00 0.00 179.45 178.45 2rdt n THR 358 N -3.37 0.85 0.33 0.07 -2.24 -1.26 -2.68 114.28 105.98 2rdt n THR 358 Ca 0.00 0.21 0.15 0.00 -2.27 0.00 0.00 64.05 62.15 2rdt n THR 358 Cb 0.43 -0.96 0.64 0.00 -2.10 0.00 0.00 70.33 68.34 2rdt n THR 358 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2rdt h LEU 359 N 0.00 0.00 -8.25 3.22 4.07 -1.72 -3.43 115.31 109.21 2rdt h LEU 359 Ca 0.00 0.00 -0.34 0.00 0.08 0.00 0.00 57.88 57.62 2rdt h LEU 359 Cb 0.21 0.00 -0.22 0.00 1.08 0.00 0.00 40.66 41.73 2rdt h LEU 359 CO 0.00 0.00 -0.76 0.68 -1.08 0.00 0.00 178.44 177.28 2rdt s VAL 360 N -3.55 0.78 -0.18 1.22 -7.23 -1.09 -0.26 120.40 110.09 2rdt s VAL 360 Ca 0.02 -1.09 -0.12 0.00 -1.81 0.00 0.00 61.98 58.98 2rdt s VAL 360 Cb 0.09 -0.79 0.06 0.00 0.56 0.00 0.00 36.38 36.30 2rdt s VAL 360 CO 0.46 -0.25 0.45 -0.60 -0.31 0.00 0.00 175.10 174.85 2rdt s ARG 361 N -1.49 0.47 0.14 4.82 3.52 -0.83 -4.98 118.95 120.61 2rdt s ARG 361 Ca -0.05 0.79 -0.27 0.00 -0.13 0.00 0.00 55.73 56.07 2rdt s ARG 361 Cb -0.09 0.08 -0.07 0.00 -1.56 0.00 0.00 34.95 33.31 2rdt s ARG 361 CO 0.01 -0.13 0.83 0.21 -0.81 0.00 0.00 175.30 175.42 2rdt s LYS 362 N 1.07 4.63 0.00 5.12 2.20 -1.26 -1.08 119.74 130.42 2rdt s LYS 362 Ca -0.07 1.24 0.30 0.00 -0.36 0.00 0.00 55.97 57.09 2rdt s LYS 362 Cb -0.06 -3.31 1.42 0.00 -1.51 0.00 0.00 37.83 34.37 2rdt s LYS 362 CO -0.09 0.43 1.96 -1.71 -0.36 0.00 0.00 175.35 175.57