#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wsa s PRO 4 N 0.00 4.08 0.02 1.97 0.02 -1.26 -4.63 135.00 135.20 1wsa s PRO 4 Ca 0.00 1.95 -0.07 0.00 0.02 0.00 0.00 61.00 62.89 1wsa s PRO 4 Cb 0.00 -2.75 -0.05 0.00 0.02 0.00 0.00 34.50 31.72 1wsa s PRO 4 CO 0.00 -0.33 0.30 -1.14 -0.33 0.00 0.00 177.00 175.50 1wsa s GLN 5 N -2.20 3.62 -0.01 5.54 0.74 -1.26 0.02 119.66 126.11 1wsa s GLN 5 Ca 0.56 -0.01 -0.08 0.00 0.05 0.00 0.00 55.36 55.88 1wsa s GLN 5 Cb -0.33 -3.07 0.01 0.00 1.10 0.00 0.00 33.01 30.71 1wsa s GLN 5 CO 0.42 0.63 0.16 0.08 -0.55 0.00 0.00 175.29 176.04 1wsa s VAL 6 N -1.31 0.06 -0.09 1.34 1.01 0.14 -1.98 120.40 119.57 1wsa s VAL 6 Ca 0.28 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.76 1wsa s VAL 6 Cb -0.13 -0.41 -0.01 0.00 0.00 0.00 0.00 36.38 35.83 1wsa s VAL 6 CO 0.16 -0.29 -0.20 -0.89 0.00 0.00 0.00 175.10 173.88 1wsa s THR 7 N -1.07 2.46 -0.20 3.92 2.01 -1.16 -1.64 115.64 119.96 1wsa s THR 7 Ca -0.12 -0.89 -0.08 0.00 0.31 0.00 0.00 61.69 60.91 1wsa s THR 7 Cb -0.06 -1.96 -0.04 0.00 0.01 0.00 0.00 72.50 70.45 1wsa s THR 7 CO 0.01 0.55 0.08 -0.63 -0.69 0.00 0.00 174.62 173.94 1wsa s ILE 8 N 0.11 4.77 -0.25 1.82 1.01 -0.42 -1.59 121.20 126.65 1wsa s ILE 8 Ca -0.10 -0.03 -0.06 0.00 0.00 0.00 0.00 60.65 60.46 1wsa s ILE 8 Cb -0.16 -3.17 -0.02 0.00 0.01 0.00 0.00 42.46 39.12 1wsa s ILE 8 CO 0.06 0.42 0.04 -0.76 0.00 0.00 0.00 174.94 174.71 1wsa s LEU 9 N 0.68 3.36 -0.07 2.97 1.02 0.42 -1.21 118.68 125.86 1wsa s LEU 9 Ca 0.04 -0.32 -0.16 0.00 0.02 0.00 0.00 54.13 53.71 1wsa s LEU 9 Cb -0.13 -1.87 -0.05 0.00 0.02 0.00 0.00 46.19 44.16 1wsa s LEU 9 CO 0.02 -0.05 0.43 0.00 0.02 0.00 0.00 176.35 176.77 1wsa s ALA 10 N 1.57 3.57 -1.44 4.21 0.00 0.43 -2.12 121.76 127.98 1wsa s ALA 10 Ca 0.06 -0.22 0.19 0.00 0.00 0.00 0.00 51.96 51.99 1wsa s ALA 10 Cb -0.15 -2.52 -0.08 0.00 0.00 0.00 0.00 23.12 20.37 1wsa s ALA 10 CO 0.02 0.20 0.91 0.25 0.00 0.00 0.00 175.76 177.14 1wsa n THR 11 N 2.91 0.00 0.00 0.00 -2.24 -1.10 -0.94 114.28 112.90 1wsa n THR 11 Ca -0.10 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1wsa n THR 11 Cb 0.52 1.14 0.00 0.00 -2.10 0.00 0.00 70.33 69.89 1wsa n THR 11 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wsa n GLY 12 N 1.35 2.10 0.00 3.38 0.00 -1.17 -1.69 105.19 109.16 1wsa n GLY 12 Ca 0.06 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.34 1wsa n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wsa n GLY 13 N 0.00 1.27 3.76 -0.02 0.00 -1.26 -4.76 105.19 104.18 1wsa n GLY 13 Ca 0.00 -2.01 -0.39 0.00 0.00 0.00 0.00 46.02 43.61 1wsa n GLY 13 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wsa s THR 14 N 0.75 4.07 -0.19 2.61 -4.23 -1.26 -4.96 115.64 112.43 1wsa s THR 14 Ca 0.00 1.97 0.10 0.00 -1.18 0.00 0.00 61.69 62.59 1wsa s THR 14 Cb 0.00 -4.21 -0.18 0.00 1.34 0.00 0.00 72.50 69.44 1wsa s THR 14 CO 0.00 0.39 -0.03 2.30 -0.54 0.00 0.00 174.62 176.73 1wsa n ILE 15 N 1.20 1.19 -2.63 2.99 -5.35 -1.26 -4.81 119.36 110.69 1wsa n ILE 15 Ca -0.01 -0.63 -0.21 0.00 -0.27 0.00 0.00 62.75 61.64 1wsa n ILE 15 Cb 0.48 -0.82 0.10 0.00 -1.74 0.00 0.00 39.64 37.66 1wsa n ILE 15 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1wsa n ALA 16 N -2.81 0.29 -0.01 -1.28 0.00 -1.26 -4.05 120.51 111.39 1wsa n ALA 16 Ca -0.32 -1.80 0.00 0.00 0.00 0.00 0.00 53.44 51.33 1wsa n ALA 16 Cb 1.00 0.32 0.00 0.00 0.00 0.00 0.00 19.45 20.77 1wsa n ALA 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wsa n GLY 17 N -1.91 -0.01 1.14 0.00 0.00 -1.26 -4.65 105.19 98.51 1wsa n GLY 17 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.29 1wsa n GLY 17 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1wsa n TYR 27 N -0.07 -2.58 -3.64 1.61 9.36 -1.26 -4.60 117.16 115.98 1wsa n TYR 27 Ca 0.00 1.42 -0.05 0.00 3.32 0.00 0.00 57.90 62.58 1wsa n TYR 27 Cb 0.00 -2.35 -0.07 0.00 -0.63 0.00 0.00 39.34 36.29 1wsa n TYR 27 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1wsa s SER 28 N -6.39 -0.80 0.34 2.98 0.15 -1.26 -4.99 113.70 103.73 1wsa s SER 28 Ca 0.00 1.28 0.18 0.00 0.70 0.00 0.00 55.95 58.11 1wsa s SER 28 Cb 0.00 1.36 0.25 0.00 -1.71 0.00 0.00 66.02 65.91 1wsa s SER 28 CO 0.00 -0.20 1.53 0.00 1.20 0.00 0.00 173.24 175.77 1wsa h ALA 29 N 6.72 0.79 0.00 5.45 0.00 -1.91 -3.48 119.26 126.84 1wsa h ALA 29 Ca -0.29 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1wsa h ALA 29 Cb 1.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1wsa h ALA 29 CO 0.17 0.44 0.00 0.41 0.00 0.00 0.00 179.25 180.27 1wsa n GLY 30 N 1.05 2.05 3.83 0.00 0.00 -1.25 0.82 105.19 111.69 1wsa n GLY 30 Ca 0.02 -0.37 -0.35 0.00 0.00 0.00 0.00 46.02 45.32 1wsa n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wsa s ALA 31 N 0.00 3.47 0.22 4.61 0.00 0.10 -4.92 121.76 125.23 1wsa s ALA 31 Ca 0.00 0.05 0.01 0.00 0.00 0.00 0.00 51.96 52.01 1wsa s ALA 31 Cb 0.00 -2.71 0.20 0.00 0.00 0.00 0.00 23.12 20.62 1wsa s ALA 31 CO 0.00 0.37 1.55 0.28 0.00 0.00 0.00 175.76 177.97 1wsa h VAL 32 N 2.69 1.34 -1.00 0.00 2.07 -1.97 -2.05 116.25 117.32 1wsa h VAL 32 Ca -0.48 -1.82 0.14 0.00 0.82 0.00 0.00 66.70 65.36 1wsa h VAL 32 Cb 1.19 1.83 -0.09 0.00 -1.52 0.00 0.00 31.29 32.70 1wsa h VAL 32 CO 0.65 0.55 0.63 0.74 0.02 0.00 0.00 177.57 180.16 1wsa h THR 33 N 0.31 0.86 0.00 2.57 2.02 -1.95 0.34 112.91 117.07 1wsa h THR 33 Ca 0.01 -0.31 -0.11 0.00 0.77 0.00 0.00 66.41 66.76 1wsa h THR 33 Cb 1.06 -0.14 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 1wsa h THR 33 CO 0.09 0.17 -0.53 0.58 0.37 0.00 0.00 175.52 176.21 1wsa h VAL 34 N 0.92 1.09 -0.18 3.16 2.07 -1.79 -2.61 116.25 118.91 1wsa h VAL 34 Ca 0.52 -2.02 -0.15 0.00 0.82 0.00 0.00 66.70 65.87 1wsa h VAL 34 Cb 0.61 2.19 -0.01 0.00 -1.52 0.00 0.00 31.29 32.56 1wsa h VAL 34 CO -0.29 0.52 -0.50 0.44 0.02 0.00 0.00 177.57 177.75 1wsa h ASP 35 N 0.00 0.54 0.52 0.57 3.32 -0.33 -2.42 116.42 118.62 1wsa h ASP 35 Ca -0.01 -0.27 -0.03 0.00 0.02 0.00 0.00 57.03 56.75 1wsa h ASP 35 Cb 1.14 -0.15 0.01 0.00 0.22 0.00 0.00 39.33 40.55 1wsa h ASP 35 CO 0.07 0.95 -0.25 0.11 -1.72 0.00 0.00 179.24 178.40 1wsa h LYS 36 N 0.39 -0.67 -0.86 3.56 1.57 -0.91 -1.84 116.57 117.81 1wsa h LYS 36 Ca 0.02 0.05 0.12 0.00 -1.87 0.00 0.00 60.65 58.96 1wsa h LYS 36 Cb 1.02 0.15 -0.08 0.00 0.08 0.00 0.00 32.23 33.40 1wsa h LYS 36 CO 0.09 -0.44 0.48 -0.07 -0.57 0.00 0.00 179.45 178.94 1wsa h LEU 37 N -0.70 0.66 -1.91 2.94 3.38 -1.47 0.11 115.31 118.31 1wsa h LEU 37 Ca -0.07 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1wsa h LEU 37 Cb 0.54 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 1wsa h LEU 37 CO 0.12 0.34 -0.11 -0.07 0.09 0.00 0.00 178.44 178.80 1wsa h LEU 38 N 0.76 0.00 0.21 1.67 3.38 -1.05 0.36 115.31 120.64 1wsa h LEU 38 Ca 0.44 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 58.06 1wsa h LEU 38 Cb 0.50 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.27 1wsa h LEU 38 CO -0.29 0.11 -1.65 0.00 0.09 0.00 0.00 178.44 176.70 1wsa h ALA 39 N 1.89 0.03 -0.63 1.53 0.00 -0.20 -2.38 119.26 119.49 1wsa h ALA 39 Ca -0.00 -1.04 -0.03 0.00 0.00 0.00 0.00 54.91 53.84 1wsa h ALA 39 Cb 0.34 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1wsa h ALA 39 CO 0.01 0.90 0.26 0.00 0.00 0.00 0.00 179.25 180.42 1wsa h ALA 40 N 0.12 1.28 -2.10 0.00 0.00 -0.01 -3.31 119.26 115.24 1wsa h ALA 40 Ca -0.31 -0.15 -0.58 0.00 0.00 0.00 0.00 54.91 53.86 1wsa h ALA 40 Cb 2.12 -0.25 -0.41 0.00 0.00 0.00 0.00 17.79 19.25 1wsa h ALA 40 CO 0.21 0.54 -0.85 0.28 0.00 0.00 0.00 179.25 179.44 1wsa n VAL 41 N -4.32 0.96 0.19 0.00 0.31 0.12 -4.82 118.33 110.76 1wsa n VAL 41 Ca 0.06 -4.69 0.08 0.00 -0.01 0.00 0.00 64.34 59.78 1wsa n VAL 41 Cb 0.16 -1.93 0.43 0.00 -0.91 0.00 0.00 33.84 31.59 1wsa n VAL 41 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1wsa h PRO 42 N 3.99 0.00 -0.83 5.55 0.11 -1.52 -1.79 132.00 137.51 1wsa h PRO 42 Ca 0.14 0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.29 1wsa h PRO 42 Cb 0.76 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.82 1wsa h PRO 42 CO 0.66 0.00 0.53 0.00 -0.21 0.00 0.00 178.00 178.98 1wsa h ALA 43 N 1.21 1.11 -0.02 -0.75 0.00 -1.90 -3.00 119.26 115.90 1wsa h ALA 43 Ca 0.00 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1wsa h ALA 43 Cb 0.63 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1wsa h ALA 43 CO 0.00 0.32 0.02 -0.84 0.00 0.00 0.00 179.25 178.75 1wsa h ILE 44 N 1.00 0.90 0.00 0.00 3.07 -1.68 -2.64 117.51 118.17 1wsa h ILE 44 Ca 0.34 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.75 1wsa h ILE 44 Cb 0.07 0.99 0.00 0.00 -0.27 0.00 0.00 36.82 37.61 1wsa h ILE 44 CO -0.14 0.00 0.00 0.78 -1.05 0.00 0.00 178.15 177.74 1wsa h ASN 45 N 0.00 0.00 0.28 2.16 2.35 -1.74 0.46 115.58 119.10 1wsa h ASN 45 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1wsa h ASN 45 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.41 1wsa h ASN 45 CO -0.00 0.00 -0.93 0.47 -1.65 0.00 0.00 177.43 175.32 1wsa n ASP 46 N -2.29 0.69 -0.10 5.81 8.00 -0.99 -4.40 116.55 123.27 1wsa n ASP 46 Ca -0.00 -0.48 -0.23 0.00 0.71 0.00 0.00 54.79 54.78 1wsa n ASP 46 Cb 0.09 0.79 -0.12 0.00 -0.02 0.00 0.00 41.12 41.86 1wsa n ASP 46 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1wsa n LEU 47 N -1.70 1.96 -4.01 0.64 4.77 0.15 -5.05 117.00 113.76 1wsa n LEU 47 Ca 0.03 0.38 -0.10 0.00 -0.03 0.00 0.00 56.01 56.30 1wsa n LEU 47 Cb 0.38 -0.97 -0.07 0.00 -2.33 0.00 0.00 43.42 40.43 1wsa n LEU 47 CO 0.40 0.38 0.01 0.00 -1.33 0.00 0.00 177.39 176.84 1wsa s ALA 48 N -2.40 0.13 -0.37 -1.18 0.00 -0.34 -4.39 121.76 113.21 1wsa s ALA 48 Ca -0.29 -1.03 -0.25 0.00 0.00 0.00 0.00 51.96 50.39 1wsa s ALA 48 Cb 0.07 1.02 0.01 0.00 0.00 0.00 0.00 23.12 24.23 1wsa s ALA 48 CO 0.60 -0.70 0.86 0.99 0.00 0.00 0.00 175.76 177.50 1wsa s THR 49 N -4.02 4.65 -0.17 0.00 2.01 0.10 -4.43 115.64 113.78 1wsa s THR 49 Ca 0.23 1.03 -0.08 0.00 0.31 0.00 0.00 61.69 63.18 1wsa s THR 49 Cb 0.03 -4.28 -0.04 0.00 0.01 0.00 0.00 72.50 68.21 1wsa s THR 49 CO 0.05 -0.50 0.08 -0.63 -0.69 0.00 0.00 174.62 172.93 1wsa s ILE 50 N 3.31 4.97 0.18 1.82 1.09 -1.26 -0.69 121.20 130.62 1wsa s ILE 50 Ca 0.35 0.03 0.10 0.00 -1.10 0.00 0.00 60.65 60.03 1wsa s ILE 50 Cb -0.12 -3.23 -0.04 0.00 -1.06 0.00 0.00 42.46 38.00 1wsa s ILE 50 CO 0.18 0.48 -0.22 -0.54 -0.10 0.00 0.00 174.94 174.74 1wsa s LYS 51 N 0.15 1.40 0.02 2.79 1.02 -0.65 -4.57 119.74 119.90 1wsa s LYS 51 Ca 0.06 -1.46 -0.04 0.00 0.02 0.00 0.00 55.97 54.55 1wsa s LYS 51 Cb -0.12 -1.63 -0.01 0.00 -0.52 0.00 0.00 37.83 35.55 1wsa s LYS 51 CO 0.00 0.35 0.07 0.20 -0.92 0.00 0.00 175.35 175.05 1wsa s GLY 52 N -2.61 0.14 0.07 -3.33 0.00 0.24 -1.30 107.32 100.54 1wsa s GLY 52 Ca 0.18 -0.38 0.03 0.00 0.00 0.00 0.00 44.72 44.55 1wsa s GLY 52 CO 0.08 -0.49 -0.09 -0.54 0.00 0.00 0.00 173.10 172.06 1wsa s GLU 53 N -1.65 0.72 -0.74 2.90 2.02 -0.35 -0.72 118.70 120.87 1wsa s GLU 53 Ca -0.13 -1.01 -0.09 0.00 0.02 0.00 0.00 54.97 53.75 1wsa s GLU 53 Cb -0.07 -0.42 0.19 0.00 0.10 0.00 0.00 34.13 33.93 1wsa s GLU 53 CO -0.00 0.06 0.63 -1.14 0.02 0.00 0.00 175.26 174.83 1wsa s GLN 54 N -2.39 3.17 0.35 1.61 2.00 -1.26 -0.43 119.66 122.72 1wsa s GLN 54 Ca -0.00 -2.49 0.06 0.00 -2.00 0.00 0.00 55.36 50.93 1wsa s GLN 54 Cb -0.05 -4.14 0.65 0.00 0.80 0.00 0.00 33.01 30.27 1wsa s GLN 54 CO -0.00 -1.24 1.87 0.82 -0.50 0.00 0.00 175.29 176.24 1wsa h ILE 55 N 4.98 1.20 -2.98 -2.34 1.08 -1.38 -3.46 117.51 114.61 1wsa h ILE 55 Ca 0.05 -0.83 0.06 0.00 -0.39 0.00 0.00 64.86 63.75 1wsa h ILE 55 Cb 1.00 1.09 -0.06 0.00 -3.07 0.00 0.00 36.82 35.78 1wsa h ILE 55 CO 0.74 0.27 0.23 -0.94 -0.69 0.00 0.00 178.15 177.76 1wsa s SER 56 N -6.80 -0.31 -0.48 1.72 1.04 -1.15 -4.98 113.70 102.74 1wsa s SER 56 Ca -0.07 -0.50 0.07 0.00 0.48 0.00 0.00 55.95 55.93 1wsa s SER 56 Cb 0.15 0.70 0.23 0.00 0.10 0.00 0.00 66.02 67.21 1wsa s SER 56 CO 0.75 -1.27 0.55 -1.20 0.98 0.00 0.00 173.24 173.06 1wsa n SER 57 N -0.45 1.23 -3.91 7.02 7.64 -1.20 -3.04 113.62 120.91 1wsa n SER 57 Ca -0.06 -2.88 -0.12 0.00 1.01 0.00 0.00 58.87 56.82 1wsa n SER 57 Cb 0.60 -0.64 -0.07 0.00 -1.01 0.00 0.00 64.21 63.09 1wsa n SER 57 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 1wsa s ILE 58 N -1.37 0.00 0.24 0.44 -4.36 -0.68 -4.93 121.20 110.54 1wsa s ILE 58 Ca 0.35 -1.72 -0.06 0.00 -0.26 0.00 0.00 60.65 58.96 1wsa s ILE 58 Cb 0.13 -2.42 -0.06 0.00 1.25 0.00 0.00 42.46 41.37 1wsa s ILE 58 CO -0.10 0.00 0.52 -0.83 0.24 0.00 0.00 174.94 174.77 1wsa s GLY 59 N -3.14 2.06 0.63 6.27 0.00 -1.26 -3.84 107.32 108.05 1wsa s GLY 59 Ca 0.32 -0.47 0.41 0.00 0.00 0.00 0.00 44.72 44.98 1wsa s GLY 59 CO 0.13 -0.36 2.28 1.48 0.00 0.00 0.00 173.10 176.64 1wsa h SER 60 N 2.17 0.00 0.36 1.64 4.64 -1.93 -2.13 113.55 118.30 1wsa h SER 60 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1wsa h SER 60 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1wsa h SER 60 CO 0.68 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 176.65 1wsa n GLN 61 N -3.18 0.64 -0.00 4.77 0.00 -1.26 -3.00 117.38 115.35 1wsa n GLN 61 Ca -0.02 0.00 0.08 0.00 0.00 0.00 0.00 57.00 57.06 1wsa n GLN 61 Cb 0.12 -1.50 -0.11 0.00 0.00 0.00 0.00 30.24 28.75 1wsa n GLN 61 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 1wsa n GLU 62 N -1.18 1.08 -1.43 2.61 1.02 -0.80 -5.02 120.64 116.92 1wsa n GLU 62 Ca 0.18 -0.03 -0.40 0.00 -0.02 0.00 0.00 57.16 56.89 1wsa n GLU 62 Cb 0.19 -1.35 0.02 0.00 -0.02 0.00 0.00 31.44 30.29 1wsa n GLU 62 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1wsa n MET 63 N -1.56 0.46 -4.14 3.49 2.81 -1.16 -5.01 117.12 112.01 1wsa n MET 63 Ca 0.02 0.17 -0.09 0.00 -1.81 0.00 0.00 57.70 55.99 1wsa n MET 63 Cb 0.31 -1.51 -0.10 0.00 -0.71 0.00 0.00 33.22 31.21 1wsa n MET 63 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1wsa s THR 64 N -1.67 0.38 0.52 2.03 -4.23 -1.26 -5.05 115.64 106.36 1wsa s THR 64 Ca 0.65 -1.88 0.20 0.00 -1.18 0.00 0.00 61.69 59.47 1wsa s THR 64 Cb -0.51 -1.73 0.33 0.00 1.34 0.00 0.00 72.50 71.92 1wsa s THR 64 CO 0.58 -0.80 2.07 1.23 -0.54 0.00 0.00 174.62 177.15 1wsa h GLY 65 N 2.99 0.05 0.99 3.99 0.00 -1.98 -2.41 103.07 106.70 1wsa h GLY 65 Ca -0.35 -0.02 -0.02 0.00 0.00 0.00 0.00 47.33 46.94 1wsa h GLY 65 CO 0.64 0.01 0.29 1.70 0.00 0.00 0.00 176.54 179.18 1wsa h LYS 66 N 0.04 0.88 -0.48 4.80 3.64 -1.97 -0.94 116.57 122.53 1wsa h LYS 66 Ca 0.13 -0.13 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 1wsa h LYS 66 Cb 0.48 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1wsa h LYS 66 CO -0.01 0.71 -0.10 0.28 -2.27 0.00 0.00 179.45 178.06 1wsa h VAL 67 N 0.83 1.26 0.22 2.00 2.07 -1.86 -1.93 116.25 118.84 1wsa h VAL 67 Ca 0.21 -1.20 0.00 0.00 0.82 0.00 0.00 66.70 66.53 1wsa h VAL 67 Cb 0.13 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1wsa h VAL 67 CO -0.03 0.42 -0.20 -0.50 0.02 0.00 0.00 177.57 177.28 1wsa h TRP 68 N 0.79 -0.52 -0.27 1.57 6.55 -1.01 -0.14 115.95 122.92 1wsa h TRP 68 Ca 0.13 0.00 0.04 0.00 0.95 0.00 0.00 58.89 60.01 1wsa h TRP 68 Cb 0.61 0.20 -0.04 0.00 -0.86 0.00 0.00 29.16 29.08 1wsa h TRP 68 CO 0.04 -0.30 0.05 -0.07 -1.05 0.00 0.00 178.44 177.10 1wsa h LEU 69 N -0.44 -0.00 -0.16 -4.49 3.38 -1.15 0.00 115.31 112.45 1wsa h LEU 69 Ca -0.01 0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.06 1wsa h LEU 69 Cb 0.40 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.15 1wsa h LEU 69 CO -0.03 0.03 -0.30 0.50 0.09 0.00 0.00 178.44 178.74 1wsa h LYS 70 N 0.15 -0.34 0.68 1.13 3.64 -1.20 0.12 116.57 120.74 1wsa h LYS 70 Ca 0.12 0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.50 1wsa h LYS 70 Cb 0.13 0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1wsa h LYS 70 CO -0.17 -0.23 -0.40 -0.07 -2.27 0.00 0.00 179.45 176.31 1wsa h LEU 71 N -0.35 -1.01 -0.50 5.20 3.38 -0.70 -0.83 115.31 120.49 1wsa h LEU 71 Ca 0.11 0.06 0.07 0.00 0.09 0.00 0.00 57.88 58.20 1wsa h LEU 71 Cb 0.52 0.29 -0.06 0.00 0.09 0.00 0.00 40.66 41.50 1wsa h LEU 71 CO -0.36 -0.63 0.16 0.00 0.09 0.00 0.00 178.44 177.70 1wsa h ALA 72 N -0.77 0.61 -0.31 1.53 0.00 -0.87 0.39 119.26 119.84 1wsa h ALA 72 Ca -0.09 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1wsa h ALA 72 Cb 0.81 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1wsa h ALA 72 CO 0.09 -0.24 0.15 0.87 0.00 0.00 0.00 179.25 180.13 1wsa h LYS 73 N 0.33 0.44 -0.20 0.00 1.57 -0.76 -0.52 116.57 117.43 1wsa h LYS 73 Ca 0.24 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.92 1wsa h LYS 73 Cb 0.28 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 1wsa h LYS 73 CO -0.26 0.41 -0.03 -0.09 -0.57 0.00 0.00 179.45 178.90 1wsa h ARG 74 N 0.36 0.30 -0.31 3.15 9.65 -0.55 -2.09 114.38 124.89 1wsa h ARG 74 Ca 0.11 -0.05 -0.12 0.00 -1.10 0.00 0.00 59.98 58.81 1wsa h ARG 74 Cb 0.12 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.64 1wsa h ARG 74 CO -0.01 0.36 -0.27 0.28 2.80 0.00 0.00 179.97 183.13 1wsa h VAL 75 N 0.30 1.30 -0.51 0.20 2.07 0.27 -1.93 116.25 117.94 1wsa h VAL 75 Ca 0.07 -1.43 -0.04 0.00 0.82 0.00 0.00 66.70 66.11 1wsa h VAL 75 Cb 0.26 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 1wsa h VAL 75 CO 0.01 0.46 0.14 0.78 0.02 0.00 0.00 177.57 178.98 1wsa h ASN 76 N 0.50 0.72 0.85 0.57 2.35 -0.80 -1.55 115.58 118.21 1wsa h ASN 76 Ca 0.05 -0.12 -0.04 0.00 -0.55 0.00 0.00 56.30 55.65 1wsa h ASN 76 Cb 0.84 -0.19 0.01 0.00 0.05 0.00 0.00 38.32 39.03 1wsa h ASN 76 CO 0.07 0.70 -0.41 -0.33 -1.65 0.00 0.00 177.43 175.81 1wsa h GLU 77 N 0.75 -1.10 -0.83 0.81 5.08 -1.19 -2.33 114.58 115.78 1wsa h GLU 77 Ca 0.17 0.08 0.17 0.00 -1.00 0.00 0.00 59.36 58.77 1wsa h GLU 77 Cb 0.26 0.25 -0.10 0.00 0.50 0.00 0.00 28.75 29.65 1wsa h GLU 77 CO -0.00 -0.73 0.36 -0.07 -1.00 0.00 0.00 179.01 177.57 1wsa h LEU 78 N -1.27 0.36 -1.35 1.33 3.38 -1.24 -0.63 115.31 115.89 1wsa h LEU 78 Ca -0.12 0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1wsa h LEU 78 Cb 0.88 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1wsa h LEU 78 CO 0.19 0.11 0.00 -0.07 0.09 0.00 0.00 178.44 178.76 1wsa h LEU 79 N 0.48 0.00 -0.55 1.67 4.07 -1.18 -2.71 115.31 117.09 1wsa h LEU 79 Ca 0.47 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 58.30 1wsa h LEU 79 Cb 0.76 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.48 1wsa h LEU 79 CO -0.43 0.00 -0.62 0.00 -1.08 0.00 0.00 178.44 176.31 1wsa h ALA 80 N 2.08 0.81 -2.44 1.53 0.00 -0.53 -3.44 119.26 117.26 1wsa h ALA 80 Ca 0.00 -0.57 -0.54 0.00 0.00 0.00 0.00 54.91 53.81 1wsa h ALA 80 Cb 0.43 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.13 1wsa h ALA 80 CO 0.00 0.78 0.85 -0.65 0.00 0.00 0.00 179.25 180.23 1wsa s GLN 81 N -3.34 4.27 0.63 0.00 -0.21 -1.02 -4.91 119.66 115.08 1wsa s GLN 81 Ca 0.00 2.10 0.38 0.00 0.02 0.00 0.00 55.36 57.86 1wsa s GLN 81 Cb 0.11 -3.49 2.14 0.00 1.00 0.00 0.00 33.01 32.77 1wsa s GLN 81 CO 0.75 -0.58 2.31 -0.22 -2.12 0.00 0.00 175.29 175.42 1wsa h LYS 82 N 7.68 0.00 -0.37 2.91 3.64 -1.88 -2.48 116.57 126.07 1wsa h LYS 82 Ca -0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1wsa h LYS 82 Cb 1.19 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1wsa h LYS 82 CO 0.90 0.01 0.00 -0.85 -2.27 0.00 0.00 179.45 177.24 1wsa n GLU 83 N -3.37 2.46 -3.54 1.90 -0.00 -1.26 -4.74 120.64 112.08 1wsa n GLU 83 Ca -0.03 -2.25 -0.41 0.00 -0.00 0.00 0.00 57.16 54.47 1wsa n GLU 83 Cb 0.09 -1.50 -0.08 0.00 -0.00 0.00 0.00 31.44 29.96 1wsa n GLU 83 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 1wsa s THR 84 N -1.46 4.34 0.34 3.84 2.01 -0.94 -4.11 115.64 119.67 1wsa s THR 84 Ca 0.37 -2.06 0.08 0.00 0.31 0.00 0.00 61.69 60.39 1wsa s THR 84 Cb 0.22 -3.83 0.09 0.00 0.01 0.00 0.00 72.50 69.00 1wsa s THR 84 CO 0.31 -0.83 1.80 -0.33 -0.69 0.00 0.00 174.62 174.88 1wsa h GLU 85 N 8.14 0.21 -2.36 4.92 4.39 -1.68 -3.44 114.58 124.76 1wsa h GLU 85 Ca -0.14 -0.08 0.17 0.00 0.34 0.00 0.00 59.36 59.66 1wsa h GLU 85 Cb 1.05 -0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 29.61 1wsa h GLU 85 CO 0.83 0.49 0.49 0.00 -1.16 0.00 0.00 179.01 179.66 1wsa s ALA 86 N -4.39 -1.63 -0.02 3.43 0.00 -1.26 -4.31 121.76 113.57 1wsa s ALA 86 Ca -0.05 0.07 0.01 0.00 0.00 0.00 0.00 51.96 52.00 1wsa s ALA 86 Cb 0.14 0.65 0.01 0.00 0.00 0.00 0.00 23.12 23.92 1wsa s ALA 86 CO 0.75 -1.05 -0.05 0.08 0.00 0.00 0.00 175.76 175.49 1wsa s VAL 87 N -3.18 0.47 -0.10 0.00 1.01 -0.91 -2.98 120.40 114.72 1wsa s VAL 87 Ca 0.13 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 61.95 1wsa s VAL 87 Cb -0.02 -0.45 -0.02 0.00 0.00 0.00 0.00 36.38 35.90 1wsa s VAL 87 CO 0.03 0.17 -0.16 -0.63 0.00 0.00 0.00 175.10 174.51 1wsa s ILE 88 N 0.33 2.85 -0.23 2.22 1.01 -0.62 -1.06 121.20 125.70 1wsa s ILE 88 Ca -0.04 -0.76 -0.02 0.00 0.00 0.00 0.00 60.65 59.84 1wsa s ILE 88 Cb -0.08 -2.15 0.02 0.00 0.01 0.00 0.00 42.46 40.26 1wsa s ILE 88 CO -0.00 0.55 -0.07 -0.63 0.00 0.00 0.00 174.94 174.79 1wsa s ILE 89 N 0.01 2.90 -0.16 2.92 1.09 -0.17 -0.43 121.20 127.35 1wsa s ILE 89 Ca -0.05 -0.89 -0.23 0.00 -1.10 0.00 0.00 60.65 58.37 1wsa s ILE 89 Cb -0.14 -2.41 -0.02 0.00 -1.06 0.00 0.00 42.46 38.82 1wsa s ILE 89 CO 0.04 0.29 0.74 0.42 -0.10 0.00 0.00 174.94 176.33 1wsa s THR 90 N 1.36 4.96 0.07 2.92 -4.23 -0.90 -1.40 115.64 118.41 1wsa s THR 90 Ca 0.02 1.44 0.02 0.00 -1.18 0.00 0.00 61.69 62.00 1wsa s THR 90 Cb -0.16 -4.05 -0.03 0.00 1.34 0.00 0.00 72.50 69.60 1wsa s THR 90 CO -0.05 0.09 -0.08 -2.28 -0.54 0.00 0.00 174.62 171.76 1wsa s HIS 91 N 1.85 0.83 0.70 3.99 5.04 -0.41 -2.70 115.29 124.59 1wsa s HIS 91 Ca 0.35 -0.70 -0.11 0.00 -1.54 0.00 0.00 55.06 53.06 1wsa s HIS 91 Cb -0.16 -0.48 0.01 0.00 0.04 0.00 0.00 32.58 31.99 1wsa s HIS 91 CO 0.12 -0.10 1.06 0.20 -2.34 0.00 0.00 174.74 173.69 1wsa s GLY 92 N -2.32 1.67 0.14 1.59 0.00 -1.26 -4.18 107.32 102.95 1wsa s GLY 92 Ca 0.01 0.08 0.07 0.00 0.00 0.00 0.00 44.72 44.88 1wsa s GLY 92 CO -0.02 0.39 1.31 -0.91 0.00 0.00 0.00 173.10 173.88 1wsa h THR 93 N -0.74 1.67 -0.47 0.90 1.35 -1.96 -3.19 112.91 110.47 1wsa h THR 93 Ca -0.44 -3.24 0.10 0.00 -0.55 0.00 0.00 66.41 62.28 1wsa h THR 93 Cb 1.21 2.76 -0.10 0.00 -1.73 0.00 0.00 68.15 70.30 1wsa h THR 93 CO 0.57 0.93 -0.21 0.44 -0.25 0.00 0.00 175.52 177.00 1wsa h ASP 94 N 0.01 -0.72 -0.31 5.36 5.19 -1.94 -2.79 116.42 121.21 1wsa h ASP 94 Ca -0.02 0.17 0.00 0.00 -0.62 0.00 0.00 57.03 56.56 1wsa h ASP 94 Cb 1.69 0.40 0.00 0.00 0.18 0.00 0.00 39.33 41.60 1wsa h ASP 94 CO 0.13 -0.24 0.00 0.35 -3.12 0.00 0.00 179.24 176.36 1wsa n THR 95 N -5.40 1.06 -0.32 0.35 -2.24 -1.26 -4.76 114.28 101.71 1wsa n THR 95 Ca 0.04 -1.04 0.14 0.00 -2.27 0.00 0.00 64.05 60.92 1wsa n THR 95 Cb 0.31 0.47 0.33 0.00 -2.10 0.00 0.00 70.33 69.33 1wsa n THR 95 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 1wsa h MET 96 N 1.82 0.46 -0.13 -0.78 -1.53 -1.48 -0.83 114.93 112.46 1wsa h MET 96 Ca 0.00 -0.03 -0.02 0.00 -3.44 0.00 0.00 59.70 56.21 1wsa h MET 96 Cb 0.74 -0.10 -0.01 0.00 -0.55 0.00 0.00 31.60 31.68 1wsa h MET 96 CO 0.01 0.30 -0.01 1.05 0.14 0.00 0.00 176.91 178.40 1wsa h GLU 97 N 0.47 0.19 -0.04 0.39 4.11 -1.86 -1.94 114.58 115.90 1wsa h GLU 97 Ca 0.58 -0.02 -0.05 0.00 0.07 0.00 0.00 59.36 59.95 1wsa h GLU 97 Cb 1.10 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1wsa h GLU 97 CO -0.50 0.22 -0.15 0.93 0.07 0.00 0.00 179.01 179.58 1wsa h GLU 98 N 0.19 0.18 -0.53 1.06 5.08 -1.50 -2.52 114.58 116.53 1wsa h GLU 98 Ca 0.04 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1wsa h GLU 98 Cb 0.16 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 1wsa h GLU 98 CO 0.00 0.76 0.35 1.15 -1.00 0.00 0.00 179.01 180.28 1wsa h THR 99 N -0.37 1.14 -0.39 1.13 2.02 -1.33 -1.24 112.91 113.86 1wsa h THR 99 Ca -0.01 -0.26 -0.09 0.00 0.77 0.00 0.00 66.41 66.83 1wsa h THR 99 Cb 0.78 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.54 1wsa h THR 99 CO 0.03 0.13 -0.11 0.00 0.37 0.00 0.00 175.52 175.95 1wsa h ALA 100 N 1.19 1.07 -0.42 6.16 0.00 -1.45 -1.17 119.26 124.65 1wsa h ALA 100 Ca 0.19 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1wsa h ALA 100 Cb -0.08 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1wsa h ALA 100 CO -0.04 0.57 -0.07 0.35 0.00 0.00 0.00 179.25 180.06 1wsa h PHE 101 N 0.63 0.88 0.66 0.00 3.57 -1.10 -0.22 116.94 121.36 1wsa h PHE 101 Ca 0.11 -0.18 -0.03 0.00 3.53 0.00 0.00 57.97 61.40 1wsa h PHE 101 Cb 0.56 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 39.08 1wsa h PHE 101 CO 0.03 0.89 -0.39 0.35 -2.23 0.00 0.00 178.31 176.95 1wsa h PHE 102 N 0.61 -1.05 -1.02 0.41 3.57 -1.02 -1.98 116.94 116.47 1wsa h PHE 102 Ca 0.11 -0.01 0.24 0.00 3.53 0.00 0.00 57.97 61.84 1wsa h PHE 102 Cb 0.59 0.37 -0.11 0.00 2.79 0.00 0.00 35.95 39.59 1wsa h PHE 102 CO 0.05 -0.59 0.63 -0.07 -2.23 0.00 0.00 178.31 176.09 1wsa h LEU 103 N -0.98 0.60 -2.07 0.59 3.38 -1.21 -1.52 115.31 114.10 1wsa h LEU 103 Ca -0.09 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1wsa h LEU 103 Cb 0.78 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 1wsa h LEU 103 CO 0.10 0.13 -0.05 -1.13 0.09 0.00 0.00 178.44 177.58 1wsa h ASN 104 N 0.54 0.00 -0.12 -0.43 -0.00 -0.25 0.29 115.58 115.60 1wsa h ASN 104 Ca 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.91 1wsa h ASN 104 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.60 1wsa h ASN 104 CO -0.39 0.05 0.00 0.18 -0.00 0.00 0.00 177.43 177.27 1wsa n LEU 105 N -4.21 2.78 0.00 0.34 4.32 -0.60 0.53 117.00 120.16 1wsa n LEU 105 Ca -0.03 -1.17 0.00 0.00 -0.02 0.00 0.00 56.01 54.79 1wsa n LEU 105 Cb 0.13 -0.07 0.00 0.00 -1.62 0.00 0.00 43.42 41.86 1wsa n LEU 105 CO 0.32 0.53 -0.23 0.41 -1.22 0.00 0.00 177.39 177.20 1wsa n THR 106 N 1.11 0.00 -3.18 -5.08 -1.04 -0.92 -4.29 114.28 100.88 1wsa n THR 106 Ca 0.13 -0.06 -0.39 0.00 -2.04 0.00 0.00 64.05 61.69 1wsa n THR 106 Cb 0.49 0.44 -0.06 0.00 -1.82 0.00 0.00 70.33 69.39 1wsa n THR 106 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1wsa s VAL 107 N -1.02 5.10 -0.93 12.58 1.01 0.04 -4.76 120.40 132.43 1wsa s VAL 107 Ca 0.00 1.17 -0.01 0.00 0.00 0.00 0.00 61.98 63.14 1wsa s VAL 107 Cb 0.00 -3.92 0.30 0.00 0.00 0.00 0.00 36.38 32.76 1wsa s VAL 107 CO 0.00 0.25 1.30 0.29 0.00 0.00 0.00 175.10 176.94 1wsa n LYS 108 N 4.04 4.01 -3.65 2.72 4.01 -1.26 -3.78 118.16 124.25 1wsa n LYS 108 Ca -0.04 -4.62 -0.10 0.00 -0.51 0.00 0.00 58.31 53.04 1wsa n LYS 108 Cb 0.51 -2.43 -0.04 0.00 -0.51 0.00 0.00 35.03 32.57 1wsa n LYS 108 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 1wsa s SER 109 N -2.03 -0.30 0.00 4.39 0.15 -1.26 -4.83 113.70 109.82 1wsa s SER 109 Ca 0.35 -0.34 0.22 0.00 0.70 0.00 0.00 55.95 56.88 1wsa s SER 109 Cb 0.10 0.54 -0.09 0.00 -1.71 0.00 0.00 66.02 64.86 1wsa s SER 109 CO 0.04 -0.96 1.00 0.00 1.20 0.00 0.00 173.24 174.52 1wsa n GLN 110 N -0.30 0.19 -2.32 5.44 6.02 -1.26 -4.30 117.38 120.84 1wsa n GLN 110 Ca -0.13 -0.15 -0.37 0.00 -0.01 0.00 0.00 57.00 56.34 1wsa n GLN 110 Cb 0.63 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 30.38 1wsa n GLN 110 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1wsa s LYS 111 N -2.92 3.81 0.28 -1.09 1.02 -1.26 -1.34 119.74 118.25 1wsa s LYS 111 Ca 0.10 1.70 -0.30 0.00 0.02 0.00 0.00 55.97 57.49 1wsa s LYS 111 Cb 0.17 -2.39 -0.10 0.00 -0.52 0.00 0.00 37.83 34.98 1wsa s LYS 111 CO 0.80 -0.49 1.46 -2.14 -0.92 0.00 0.00 175.35 174.07 1wsa s PRO 112 N -2.72 4.23 -0.21 -1.68 0.02 -1.26 -4.87 135.00 128.50 1wsa s PRO 112 Ca 0.63 2.39 0.00 0.00 0.02 0.00 0.00 61.00 64.04 1wsa s PRO 112 Cb -0.27 -3.07 0.05 0.00 0.02 0.00 0.00 34.50 31.24 1wsa s PRO 112 CO 0.32 -0.45 -0.06 0.08 -0.33 0.00 0.00 177.00 176.56 1wsa s VAL 113 N -0.28 1.41 -0.19 3.83 1.01 -1.26 -2.14 120.40 122.78 1wsa s VAL 113 Ca 0.58 -1.02 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 1wsa s VAL 113 Cb -0.44 -1.63 -0.01 0.00 0.00 0.00 0.00 36.38 34.31 1wsa s VAL 113 CO 0.48 -0.01 -0.08 -0.69 0.00 0.00 0.00 175.10 174.80 1wsa s VAL 114 N 1.47 3.14 -0.14 2.92 1.01 -0.22 -2.12 120.40 126.46 1wsa s VAL 114 Ca -0.03 -0.59 -0.12 0.00 0.00 0.00 0.00 61.98 61.24 1wsa s VAL 114 Cb -0.17 -2.39 -0.05 0.00 0.00 0.00 0.00 36.38 33.77 1wsa s VAL 114 CO -0.07 0.46 0.24 -0.76 0.00 0.00 0.00 175.10 174.98 1wsa s LEU 115 N 1.17 4.29 0.03 3.92 1.02 -0.43 -0.99 118.68 127.69 1wsa s LEU 115 Ca 0.02 0.50 0.02 0.00 0.02 0.00 0.00 54.13 54.69 1wsa s LEU 115 Cb -0.14 -2.28 -0.02 0.00 0.02 0.00 0.00 46.19 43.76 1wsa s LEU 115 CO -0.03 0.20 -0.07 0.54 0.02 0.00 0.00 176.35 177.02 1wsa s VAL 116 N -0.04 0.46 0.00 -1.59 0.11 -0.50 -1.70 120.40 117.15 1wsa s VAL 116 Ca 0.15 -0.91 0.00 0.00 -2.93 0.00 0.00 61.98 58.30 1wsa s VAL 116 Cb -0.13 -0.52 0.00 0.00 -1.53 0.00 0.00 36.38 34.20 1wsa s VAL 116 CO 0.04 -0.31 0.00 0.61 -3.33 0.00 0.00 175.10 172.11 1wsa n GLY 117 N 1.74 3.58 3.15 6.54 0.00 -1.26 -1.28 105.19 117.65 1wsa n GLY 117 Ca -0.21 -1.14 -0.12 0.00 0.00 0.00 0.00 46.02 44.55 1wsa n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wsa s ALA 118 N -1.44 -0.74 -0.05 4.61 0.00 -1.26 -4.60 121.76 118.27 1wsa s ALA 118 Ca 0.00 1.12 0.18 0.00 0.00 0.00 0.00 51.96 53.25 1wsa s ALA 118 Cb 0.00 -0.69 0.34 0.00 0.00 0.00 0.00 23.12 22.77 1wsa s ALA 118 CO 0.00 -0.20 1.57 0.52 0.00 0.00 0.00 175.76 177.65 1wsa h MET 119 N 6.82 0.00 -6.54 0.00 2.86 -1.90 -3.43 114.93 112.73 1wsa h MET 119 Ca -0.36 0.00 -0.68 0.00 -2.06 0.00 0.00 59.70 56.60 1wsa h MET 119 Cb 1.17 0.00 -0.19 0.00 0.06 0.00 0.00 31.60 32.64 1wsa h MET 119 CO 0.34 0.41 -0.77 1.03 1.06 0.00 0.00 176.91 178.98 1wsa s ARG 120 N -3.21 2.12 0.76 1.72 0.52 -1.26 -5.00 118.95 114.60 1wsa s ARG 120 Ca 0.03 -0.98 -0.15 0.00 -0.52 0.00 0.00 55.73 54.11 1wsa s ARG 120 Cb 0.09 -2.26 0.04 0.00 0.52 0.00 0.00 34.95 33.34 1wsa s ARG 120 CO 0.71 0.53 1.15 -2.30 0.02 0.00 0.00 175.30 175.41 1wsa n PRO 121 N 1.21 0.45 0.26 3.54 -0.01 -1.26 -4.52 135.00 134.67 1wsa n PRO 121 Ca -0.15 0.22 0.15 0.00 -0.01 0.00 0.00 63.50 63.71 1wsa n PRO 121 Cb 0.52 -2.39 0.55 0.00 -0.01 0.00 0.00 33.50 32.17 1wsa n PRO 121 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 175.50 176.27 1wsa h GLY 122 N -0.46 0.00 0.34 -1.23 0.00 -1.83 -1.71 103.07 98.17 1wsa h GLY 122 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1wsa h GLY 122 CO 0.47 0.00 -0.06 -1.14 0.00 0.00 0.00 176.54 175.81 1wsa n SER 123 N -3.13 0.82 -4.84 0.19 3.41 -1.26 -4.53 113.62 104.28 1wsa n SER 123 Ca 0.01 -1.05 -0.33 0.00 -0.26 0.00 0.00 58.87 57.24 1wsa n SER 123 Cb 0.37 -0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.25 1wsa n SER 123 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1wsa s SER 124 N -2.20 6.87 0.40 4.04 0.15 -0.65 -5.02 113.70 117.30 1wsa s SER 124 Ca 0.36 1.42 -0.25 0.00 0.70 0.00 0.00 55.95 58.19 1wsa s SER 124 Cb 0.21 -2.43 -0.08 0.00 -1.71 0.00 0.00 66.02 62.00 1wsa s SER 124 CO 0.41 -0.22 1.14 0.00 1.20 0.00 0.00 173.24 175.76 1wsa s MET 125 N -2.90 4.06 -1.30 5.44 0.23 -1.26 -2.83 119.30 120.74 1wsa s MET 125 Ca 0.55 1.75 -0.08 0.00 -1.03 0.00 0.00 55.69 56.88 1wsa s MET 125 Cb -0.11 -2.63 0.01 0.00 -1.53 0.00 0.00 34.83 30.57 1wsa s MET 125 CO 0.17 -0.29 1.00 0.43 -2.03 0.00 0.00 175.02 174.30 1wsa n SER 126 N 0.01 -6.05 -4.71 -1.18 7.64 -1.26 -4.93 113.62 103.14 1wsa n SER 126 Ca 0.05 -0.45 -0.42 0.00 1.01 0.00 0.00 58.87 59.05 1wsa n SER 126 Cb 0.47 -4.71 -0.03 0.00 -1.01 0.00 0.00 64.21 58.93 1wsa n SER 126 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wsa s ALA 127 N -3.27 3.80 0.05 -0.43 0.00 -1.13 -4.91 121.76 115.88 1wsa s ALA 127 Ca 0.49 1.41 0.22 0.00 0.00 0.00 0.00 51.96 54.08 1wsa s ALA 127 Cb -0.22 -3.66 0.70 0.00 0.00 0.00 0.00 23.12 19.94 1wsa s ALA 127 CO 0.61 -0.91 1.73 0.38 0.00 0.00 0.00 175.76 177.58 1wsa h ASP 128 N 7.21 0.00 -0.63 0.00 2.03 -1.85 -3.38 116.42 119.80 1wsa h ASP 128 Ca -0.43 0.00 0.13 0.00 -0.73 0.00 0.00 57.03 56.00 1wsa h ASP 128 Cb 1.20 0.00 -0.12 0.00 -0.83 0.00 0.00 39.33 39.58 1wsa h ASP 128 CO 0.93 0.28 -0.16 1.23 -1.03 0.00 0.00 179.24 180.49 1wsa h GLY 129 N 2.45 0.45 0.88 7.15 0.00 -1.81 -1.45 103.07 110.74 1wsa h GLY 129 Ca -0.00 0.21 0.03 0.00 0.00 0.00 0.00 47.33 47.56 1wsa h GLY 129 CO 0.04 -0.24 0.42 -2.55 0.00 0.00 0.00 176.54 174.20 1wsa h PRO 130 N -0.00 0.79 -0.01 4.80 0.11 -1.81 -0.81 132.00 135.07 1wsa h PRO 130 Ca 0.30 -0.05 -0.17 0.00 0.11 0.00 0.00 66.00 66.20 1wsa h PRO 130 Cb 0.46 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.37 1wsa h PRO 130 CO -0.65 0.53 -0.76 1.98 -0.21 0.00 0.00 178.00 178.89 1wsa h MET 131 N 0.82 0.09 -0.74 1.05 1.85 -1.79 -1.64 114.93 114.57 1wsa h MET 131 Ca 0.27 -0.08 -0.06 0.00 -0.61 0.00 0.00 59.70 59.21 1wsa h MET 131 Cb 0.01 0.02 -0.03 0.00 0.43 0.00 0.00 31.60 32.03 1wsa h MET 131 CO -0.10 0.81 0.21 -0.91 -0.40 0.00 0.00 176.91 176.52 1wsa h ASN 132 N 0.06 1.10 -0.22 1.39 2.35 -0.80 -1.04 115.58 118.40 1wsa h ASN 132 Ca -0.02 -0.22 -0.04 0.00 -0.55 0.00 0.00 56.30 55.47 1wsa h ASN 132 Cb 1.34 -0.29 -0.01 0.00 0.05 0.00 0.00 38.32 39.42 1wsa h ASN 132 CO 0.11 1.03 -0.04 0.25 -1.65 0.00 0.00 177.43 177.13 1wsa h LEU 133 N 1.11 0.41 -0.49 1.61 6.46 -1.03 0.29 115.31 123.67 1wsa h LEU 133 Ca 0.24 -0.35 0.04 0.00 -0.12 0.00 0.00 57.88 57.69 1wsa h LEU 133 Cb 0.34 -0.11 -0.04 0.00 -0.73 0.00 0.00 40.66 40.11 1wsa h LEU 133 CO -0.00 0.66 0.26 0.22 -0.62 0.00 0.00 178.44 178.96 1wsa h TYR 134 N 0.15 0.47 -0.23 1.25 3.20 -1.20 -1.52 116.97 119.10 1wsa h TYR 134 Ca 0.06 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.87 1wsa h TYR 134 Cb 0.47 -0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.60 1wsa h TYR 134 CO 0.05 0.24 -0.17 -0.91 -1.64 0.00 0.00 178.16 175.73 1wsa h ASN 135 N 0.51 0.55 -0.53 -2.11 2.35 -1.04 -2.82 115.58 112.47 1wsa h ASN 135 Ca 0.21 -0.44 0.08 0.00 -0.55 0.00 0.00 56.30 55.60 1wsa h ASN 135 Cb 0.11 -0.15 -0.07 0.00 0.05 0.00 0.00 38.32 38.26 1wsa h ASN 135 CO -0.14 0.88 0.16 0.00 -1.65 0.00 0.00 177.43 176.68 1wsa h ALA 136 N 0.69 0.65 -0.87 -0.83 0.00 -0.15 -1.67 119.26 117.08 1wsa h ALA 136 Ca 0.04 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1wsa h ALA 136 Cb 0.70 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.53 1wsa h ALA 136 CO 0.05 -0.25 0.52 0.28 0.00 0.00 0.00 179.25 179.85 1wsa h VAL 137 N 0.32 1.24 -0.16 0.00 2.07 -1.29 -1.26 116.25 117.17 1wsa h VAL 137 Ca 0.27 -0.52 -0.09 0.00 0.82 0.00 0.00 66.70 67.17 1wsa h VAL 137 Cb 0.33 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.10 1wsa h VAL 137 CO -0.30 0.25 -0.32 0.78 0.02 0.00 0.00 177.57 178.00 1wsa h ASN 138 N 1.20 0.31 -0.10 0.57 2.35 -1.09 -2.80 115.58 116.02 1wsa h ASN 138 Ca 0.31 -0.11 -0.04 0.00 -0.55 0.00 0.00 56.30 55.91 1wsa h ASN 138 Cb -0.05 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.23 1wsa h ASN 138 CO -0.06 0.62 -0.11 0.58 -1.65 0.00 0.00 177.43 176.81 1wsa h VAL 139 N 0.27 1.37 -0.53 2.81 2.07 -0.56 -2.83 116.25 118.85 1wsa h VAL 139 Ca 0.04 -1.30 0.10 0.00 0.82 0.00 0.00 66.70 66.36 1wsa h VAL 139 Cb 0.70 2.00 -0.09 0.00 -1.52 0.00 0.00 31.29 32.39 1wsa h VAL 139 CO 0.05 0.37 0.01 0.00 0.02 0.00 0.00 177.57 178.02 1wsa h ALA 140 N 0.56 0.51 -0.10 1.67 0.00 -1.21 -0.34 119.26 120.35 1wsa h ALA 140 Ca 0.01 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1wsa h ALA 140 Cb 0.64 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1wsa h ALA 140 CO 0.03 -0.38 0.00 0.44 0.00 0.00 0.00 179.25 179.34 1wsa n ILE 141 N -5.23 0.13 -2.88 0.00 -5.35 -1.06 -4.74 119.36 100.23 1wsa n ILE 141 Ca 0.06 -0.20 -0.41 0.00 -0.27 0.00 0.00 62.75 61.93 1wsa n ILE 141 Cb 0.29 0.10 -0.04 0.00 -1.74 0.00 0.00 39.64 38.24 1wsa n ILE 141 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1wsa s ASN 142 N -1.53 7.09 0.54 7.28 3.84 -0.14 -4.94 114.94 127.09 1wsa s ASN 142 Ca 0.29 1.33 0.29 0.00 0.21 0.00 0.00 52.86 54.97 1wsa s ASN 142 Cb 0.15 -2.48 1.45 0.00 -0.55 0.00 0.00 41.25 39.82 1wsa s ASN 142 CO 0.23 -0.27 1.94 0.50 -2.79 0.00 0.00 177.10 176.70 1wsa h LYS 143 N 6.99 0.00 0.00 0.43 3.64 -1.89 -0.34 116.57 125.40 1wsa h LYS 143 Ca -0.36 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 1wsa h LYS 143 Cb 1.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1wsa h LYS 143 CO 0.79 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.97 1wsa n ALA 144 N -2.62 2.26 1.26 5.00 0.00 -1.26 -3.47 120.51 121.68 1wsa n ALA 144 Ca 0.13 -0.02 0.14 0.00 0.00 0.00 0.00 53.44 53.69 1wsa n ALA 144 Cb 0.76 -1.47 0.70 0.00 0.00 0.00 0.00 19.45 19.44 1wsa n ALA 144 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1wsa n SER 145 N -2.25 0.01 -4.75 0.00 7.64 -0.14 -4.76 113.62 109.38 1wsa n SER 145 Ca 0.05 0.09 -0.41 0.00 1.01 0.00 0.00 58.87 59.62 1wsa n SER 145 Cb 0.42 -0.36 -0.03 0.00 -1.01 0.00 0.00 64.21 63.24 1wsa n SER 145 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1wsa s THR 146 N -2.74 3.10 0.00 0.44 2.01 -1.23 -2.92 115.64 114.31 1wsa s THR 146 Ca 0.23 0.96 0.00 0.00 0.31 0.00 0.00 61.69 63.19 1wsa s THR 146 Cb 0.20 -3.61 0.00 0.00 0.01 0.00 0.00 72.50 69.09 1wsa s THR 146 CO 0.49 0.17 0.00 0.59 -0.69 0.00 0.00 174.62 175.18 1wsa n ASN 147 N 2.03 -3.43 0.00 3.53 4.13 -0.45 -4.86 115.26 116.22 1wsa n ASN 147 Ca 0.04 0.00 0.12 0.00 1.68 0.00 0.00 54.58 56.42 1wsa n ASN 147 Cb 0.43 -1.41 0.33 0.00 -1.54 0.00 0.00 39.78 37.59 1wsa n ASN 147 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1wsa n LYS 148 N -1.71 0.01 0.00 3.52 4.76 -1.15 -5.03 118.16 118.57 1wsa n LYS 148 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1wsa n LYS 148 Cb 0.14 -1.51 0.00 0.00 -1.84 0.00 0.00 35.03 31.83 1wsa n LYS 148 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wsa n GLY 149 N 1.49 -2.20 3.75 0.72 0.00 -1.26 -4.75 105.19 102.94 1wsa n GLY 149 Ca 0.06 -1.72 -0.41 0.00 0.00 0.00 0.00 46.02 43.95 1wsa n GLY 149 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wsa s VAL 150 N -0.22 3.55 0.13 1.61 1.01 -1.26 -4.47 120.40 120.75 1wsa s VAL 150 Ca 0.00 1.40 0.04 0.00 0.00 0.00 0.00 61.98 63.42 1wsa s VAL 150 Cb 0.00 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 1wsa s VAL 150 CO 0.00 0.27 -0.10 0.68 0.00 0.00 0.00 175.10 175.95 1wsa s VAL 151 N -0.50 1.09 -0.10 2.92 -7.23 -0.90 -1.80 120.40 113.88 1wsa s VAL 151 Ca 0.49 -1.91 0.02 0.00 -1.81 0.00 0.00 61.98 58.77 1wsa s VAL 151 Cb -0.32 -1.68 -0.02 0.00 0.56 0.00 0.00 36.38 34.92 1wsa s VAL 151 CO 0.39 -0.68 -0.16 -0.63 -0.31 0.00 0.00 175.10 173.71 1wsa s ILE 152 N -3.01 2.81 -0.32 -0.62 1.01 -0.22 -1.32 121.20 119.53 1wsa s ILE 152 Ca 0.13 -0.77 0.00 0.00 0.00 0.00 0.00 60.65 60.01 1wsa s ILE 152 Cb 0.01 -2.13 0.08 0.00 0.01 0.00 0.00 42.46 40.42 1wsa s ILE 152 CO 0.00 0.55 0.03 -0.69 0.00 0.00 0.00 174.94 174.83 1wsa s VAL 153 N 0.00 2.70 -0.01 2.92 1.01 -0.69 -1.45 120.40 124.88 1wsa s VAL 153 Ca -0.05 -1.80 -0.01 0.00 0.00 0.00 0.00 61.98 60.12 1wsa s VAL 153 Cb -0.14 -2.72 0.01 0.00 0.00 0.00 0.00 36.38 33.52 1wsa s VAL 153 CO 0.04 -0.32 0.03 -0.04 0.00 0.00 0.00 175.10 174.81 1wsa s MET 154 N 1.11 0.02 -1.35 2.72 -1.94 -1.08 -4.26 119.30 114.53 1wsa s MET 154 Ca 0.00 0.06 -0.01 0.00 -1.71 0.00 0.00 55.69 54.04 1wsa s MET 154 Cb -0.20 -0.03 -0.00 0.00 2.01 0.00 0.00 34.83 36.61 1wsa s MET 154 CO -0.04 -0.03 0.56 -1.71 -0.01 0.00 0.00 175.02 173.79 1wsa n ASN 155 N 3.24 -0.92 -0.16 3.03 5.15 -1.26 -0.79 115.26 123.55 1wsa n ASN 155 Ca -0.14 -0.92 -0.02 0.00 -0.60 0.00 0.00 54.58 52.90 1wsa n ASN 155 Cb 0.58 -3.54 -0.01 0.00 -0.53 0.00 0.00 39.78 36.28 1wsa n ASN 155 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1wsa n ASP 156 N -3.01 -5.30 -4.48 1.20 8.00 -1.26 -4.97 116.55 106.72 1wsa n ASP 156 Ca -0.30 0.05 -0.27 0.00 0.71 0.00 0.00 54.79 54.98 1wsa n ASP 156 Cb 0.68 -2.99 -0.11 0.00 -0.02 0.00 0.00 41.12 38.69 1wsa n ASP 156 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1wsa s GLU 157 N -1.80 1.73 -0.21 -1.24 2.02 0.03 -0.96 118.70 118.27 1wsa s GLU 157 Ca 0.00 -1.41 0.02 0.00 0.02 0.00 0.00 54.97 53.60 1wsa s GLU 157 Cb 0.00 -1.97 0.04 0.00 0.10 0.00 0.00 34.13 32.29 1wsa s GLU 157 CO 0.00 0.42 -0.15 0.42 0.02 0.00 0.00 175.26 175.97 1wsa s ILE 158 N -1.65 2.05 -0.04 -1.63 1.01 0.15 -2.65 121.20 118.45 1wsa s ILE 158 Ca 0.22 -1.23 0.01 0.00 0.00 0.00 0.00 60.65 59.65 1wsa s ILE 158 Cb -0.08 -2.01 -0.03 0.00 0.01 0.00 0.00 42.46 40.34 1wsa s ILE 158 CO 0.12 0.26 -0.04 -1.00 0.00 0.00 0.00 174.94 174.28 1wsa s HIS 159 N 1.23 3.00 0.33 3.97 3.76 -0.53 0.70 115.29 127.76 1wsa s HIS 159 Ca -0.01 0.06 -0.28 0.00 -0.15 0.00 0.00 55.06 54.68 1wsa s HIS 159 Cb -0.16 -1.69 -0.09 0.00 1.11 0.00 0.00 32.58 31.74 1wsa s HIS 159 CO -0.09 0.40 1.13 0.00 -0.85 0.00 0.00 174.74 175.33 1wsa s ALA 160 N -0.93 3.31 0.43 -1.40 0.00 -1.26 -1.06 121.76 120.86 1wsa s ALA 160 Ca 0.15 0.93 0.25 0.00 0.00 0.00 0.00 51.96 53.28 1wsa s ALA 160 Cb -0.11 -3.35 1.37 0.00 0.00 0.00 0.00 23.12 21.03 1wsa s ALA 160 CO 0.05 -0.31 2.06 0.00 0.00 0.00 0.00 175.76 177.56 1wsa h ALA 161 N 3.29 1.39 -0.40 0.00 0.00 -1.69 -2.15 119.26 119.69 1wsa h ALA 161 Ca -0.48 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.22 1wsa h ALA 161 Cb 1.22 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1wsa h ALA 161 CO 0.65 0.16 -0.12 -0.09 0.00 0.00 0.00 179.25 179.85 1wsa h ARG 162 N 0.00 0.79 0.00 0.00 2.43 -1.90 -3.33 114.38 112.36 1wsa h ARG 162 Ca -0.00 -0.31 -0.10 0.00 -0.81 0.00 0.00 59.98 58.75 1wsa h ARG 162 Cb 0.32 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 1wsa h ARG 162 CO 0.02 0.93 -0.80 0.93 -1.51 0.00 0.00 179.97 179.54 1wsa h GLU 163 N 0.60 0.00 -6.93 0.20 4.39 -1.81 -3.48 114.58 107.54 1wsa h GLU 163 Ca 0.10 0.00 -0.50 0.00 0.34 0.00 0.00 59.36 59.30 1wsa h GLU 163 Cb 0.65 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 29.34 1wsa h GLU 163 CO 0.04 0.33 0.46 0.00 -1.16 0.00 0.00 179.01 178.68 1wsa s ALA 164 N -3.02 3.15 0.07 3.43 0.00 -0.86 -4.10 121.76 120.43 1wsa s ALA 164 Ca 0.02 0.83 -0.14 0.00 0.00 0.00 0.00 51.96 52.67 1wsa s ALA 164 Cb 0.08 -3.32 0.02 0.00 0.00 0.00 0.00 23.12 19.90 1wsa s ALA 164 CO 0.76 -0.34 0.32 -0.08 0.00 0.00 0.00 175.76 176.43 1wsa s THR 165 N -1.49 0.08 -0.47 0.00 -1.32 -0.21 -4.87 115.64 107.36 1wsa s THR 165 Ca 0.56 -0.70 -0.18 0.00 -1.21 0.00 0.00 61.69 60.16 1wsa s THR 165 Cb -0.27 -1.05 0.05 0.00 -1.51 0.00 0.00 72.50 69.72 1wsa s THR 165 CO 0.34 -0.39 0.50 -0.75 -2.21 0.00 0.00 174.62 172.11 1wsa s LYS 166 N -3.01 3.08 0.00 7.08 2.20 -1.26 -2.14 119.74 125.69 1wsa s LYS 166 Ca -0.02 -0.97 0.25 0.00 -0.36 0.00 0.00 55.97 54.88 1wsa s LYS 166 Cb 0.01 -4.06 0.51 0.00 -1.51 0.00 0.00 37.83 32.77 1wsa s LYS 166 CO -0.06 -1.05 1.41 1.28 -0.36 0.00 0.00 175.35 176.57 1wsa n LEU 167 N 5.72 0.78 -3.96 5.43 4.77 0.03 -4.96 117.00 124.81 1wsa n LEU 167 Ca -0.08 -0.16 -0.10 0.00 -0.03 0.00 0.00 56.01 55.63 1wsa n LEU 167 Cb 0.46 -0.18 -0.12 0.00 -2.33 0.00 0.00 43.42 41.25 1wsa n LEU 167 CO 0.50 0.17 -0.37 0.21 -1.33 0.00 0.00 177.39 176.57 1wsa s ASN 168 N -2.81 0.24 0.20 -1.43 3.84 -1.23 -5.07 114.94 108.68 1wsa s ASN 168 Ca 0.15 -0.35 0.02 0.00 0.21 0.00 0.00 52.86 52.89 1wsa s ASN 168 Cb 0.18 0.06 0.14 0.00 -0.55 0.00 0.00 41.25 41.08 1wsa s ASN 168 CO 0.65 -0.19 1.48 0.71 -2.79 0.00 0.00 177.10 176.96 1wsa h THR 169 N 4.79 1.40 0.00 -5.21 1.35 -1.94 -3.41 112.91 109.89 1wsa h THR 169 Ca -0.30 -2.14 0.00 0.00 -0.55 0.00 0.00 66.41 63.42 1wsa h THR 169 Cb 1.21 2.11 0.00 0.00 -1.73 0.00 0.00 68.15 69.74 1wsa h THR 169 CO 0.44 0.63 -0.69 0.35 -0.25 0.00 0.00 175.52 176.01 1wsa n THR 170 N -3.83 0.00 -1.71 6.82 -2.24 -1.26 -5.08 114.28 106.98 1wsa n THR 170 Ca -0.03 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.34 1wsa n THR 170 Cb 0.68 0.10 0.01 0.00 -2.10 0.00 0.00 70.33 69.02 1wsa n THR 170 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wsa n ALA 171 N -1.15 1.44 0.29 6.98 0.00 -1.26 -4.85 120.51 121.96 1wsa n ALA 171 Ca 0.00 0.29 0.17 0.00 0.00 0.00 0.00 53.44 53.90 1wsa n ALA 171 Cb 0.08 -2.29 0.86 0.00 0.00 0.00 0.00 19.45 18.10 1wsa n ALA 171 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1wsa h VAL 172 N 2.27 0.28 -0.99 0.00 -1.51 -1.98 -1.92 116.25 112.40 1wsa h VAL 172 Ca -0.48 -0.37 -0.54 0.00 -1.23 0.00 0.00 66.70 64.08 1wsa h VAL 172 Cb 1.29 1.28 -0.30 0.00 -2.13 0.00 0.00 31.29 31.42 1wsa h VAL 172 CO 0.61 0.05 0.69 -0.46 -1.23 0.00 0.00 177.57 177.23 1wsa n ASN 173 N -3.36 4.34 0.24 4.19 6.94 -1.26 -4.59 115.26 121.76 1wsa n ASN 173 Ca -0.02 -3.62 0.17 0.00 -0.02 0.00 0.00 54.58 51.09 1wsa n ASN 173 Cb 0.20 -0.86 0.81 0.00 -2.36 0.00 0.00 39.78 37.58 1wsa n ASN 173 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1wsa h ALA 174 N 1.16 1.00 -2.73 -2.53 0.00 -1.65 -3.43 119.26 111.08 1wsa h ALA 174 Ca 0.63 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.98 1wsa h ALA 174 Cb 2.56 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 20.29 1wsa h ALA 174 CO 1.17 0.00 0.05 -0.06 0.00 0.00 0.00 179.25 180.42 1wsa s PHE 175 N -3.74 3.58 0.18 0.00 0.40 -1.26 -0.79 117.98 116.35 1wsa s PHE 175 Ca -0.01 1.21 -0.01 0.00 -0.60 0.00 0.00 56.93 57.52 1wsa s PHE 175 Cb 0.10 -2.76 -0.04 0.00 0.51 0.00 0.00 43.02 40.83 1wsa s PHE 175 CO 0.38 0.13 0.10 0.00 0.70 0.00 0.00 175.22 176.52 1wsa s ALA 176 N 0.66 1.12 -0.55 5.36 0.00 -0.91 -4.97 121.76 122.48 1wsa s ALA 176 Ca 0.36 -1.64 0.05 0.00 0.00 0.00 0.00 51.96 50.73 1wsa s ALA 176 Cb -0.18 1.20 0.20 0.00 0.00 0.00 0.00 23.12 24.34 1wsa s ALA 176 CO 0.17 -0.55 0.49 0.43 0.00 0.00 0.00 175.76 176.31 1wsa n SER 177 N -0.23 1.56 -0.32 0.00 7.64 -1.26 -1.04 113.62 119.96 1wsa n SER 177 Ca -0.01 -2.90 0.20 0.00 1.01 0.00 0.00 58.87 57.18 1wsa n SER 177 Cb 0.65 -0.66 0.41 0.00 -1.01 0.00 0.00 64.21 63.60 1wsa n SER 177 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 1wsa h PRO 178 N 5.03 0.14 0.00 1.43 0.11 -1.93 -2.09 132.00 134.69 1wsa h PRO 178 Ca 0.18 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 66.14 1wsa h PRO 178 Cb 0.81 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.86 1wsa h PRO 178 CO 0.58 0.09 -0.87 -0.91 -0.21 0.00 0.00 178.00 176.69 1wsa h ASN 179 N 0.14 0.00 0.00 -2.05 2.35 -1.93 -3.46 115.58 110.64 1wsa h ASN 179 Ca 0.68 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.43 1wsa h ASN 179 Cb 1.54 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.91 1wsa h ASN 179 CO -0.73 0.62 0.00 0.35 -1.65 0.00 0.00 177.43 176.02 1wsa n THR 180 N -3.15 0.00 0.00 2.81 -2.24 -0.84 -5.06 114.28 105.80 1wsa n THR 180 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1wsa n THR 180 Cb 0.81 -0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.92 1wsa n THR 180 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wsa n GLY 181 N 3.66 1.10 3.63 3.38 0.00 -0.88 -4.95 105.19 111.13 1wsa n GLY 181 Ca 0.00 -1.28 -0.30 0.00 0.00 0.00 0.00 46.02 44.44 1wsa n GLY 181 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wsa s LYS 182 N -1.94 0.55 -0.02 1.61 -2.85 -1.26 -4.76 119.74 111.06 1wsa s LYS 182 Ca 0.00 1.29 0.15 0.00 -1.00 0.00 0.00 55.97 56.42 1wsa s LYS 182 Cb 0.00 -1.69 -0.22 0.00 -2.06 0.00 0.00 37.83 33.85 1wsa s LYS 182 CO 0.00 -2.87 0.41 0.44 0.10 0.00 0.00 175.35 173.43 1wsa n ILE 183 N -4.37 0.00 -3.85 3.79 -5.35 0.22 -4.86 119.36 104.93 1wsa n ILE 183 Ca 0.09 -0.31 -0.10 0.00 -0.27 0.00 0.00 62.75 62.16 1wsa n ILE 183 Cb 0.53 0.33 0.01 0.00 -1.74 0.00 0.00 39.64 38.77 1wsa n ILE 183 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1wsa s GLY 184 N -3.49 0.54 0.06 3.28 0.00 -0.99 0.48 107.32 107.20 1wsa s GLY 184 Ca -0.03 -0.87 0.01 0.00 0.00 0.00 0.00 44.72 43.83 1wsa s GLY 184 CO 0.64 -0.42 -0.06 -0.51 0.00 0.00 0.00 173.10 172.75 1wsa s THR 185 N -2.45 0.48 -0.19 0.90 -4.23 0.92 -0.67 115.64 110.40 1wsa s THR 185 Ca 0.18 -1.55 -0.04 0.00 -1.18 0.00 0.00 61.69 59.10 1wsa s THR 185 Cb -0.04 -1.18 0.09 0.00 1.34 0.00 0.00 72.50 72.71 1wsa s THR 185 CO 0.13 -0.72 0.23 0.54 -0.54 0.00 0.00 174.62 174.26 1wsa s VAL 186 N -2.80 -0.35 -0.25 2.29 0.11 -0.13 -0.80 120.40 118.47 1wsa s VAL 186 Ca 0.01 -0.03 -0.01 0.00 -2.93 0.00 0.00 61.98 59.02 1wsa s VAL 186 Cb -0.00 -0.63 0.03 0.00 -1.53 0.00 0.00 36.38 34.25 1wsa s VAL 186 CO -0.04 -0.14 -0.07 -0.47 -3.33 0.00 0.00 175.10 171.05 1wsa s TYR 187 N 2.35 3.08 -1.47 1.54 5.04 -0.22 -4.33 117.35 123.33 1wsa s TYR 187 Ca 0.06 -1.67 -0.05 0.00 -2.44 0.00 0.00 57.07 52.98 1wsa s TYR 187 Cb -0.15 -2.04 0.04 0.00 0.35 0.00 0.00 41.96 40.16 1wsa s TYR 187 CO -0.11 -0.76 0.52 0.66 -1.34 0.00 0.00 175.55 174.52 1wsa n TYR 188 N 4.64 -1.70 -0.83 4.97 4.02 -1.26 -1.42 117.16 125.58 1wsa n TYR 188 Ca -0.16 0.77 0.00 0.00 -0.01 0.00 0.00 57.90 58.49 1wsa n TYR 188 Cb 0.46 -3.60 0.00 0.00 -0.02 0.00 0.00 39.34 36.19 1wsa n TYR 188 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1wsa n GLY 189 N -1.85 1.19 3.64 2.72 0.00 -1.26 -5.00 105.19 104.62 1wsa n GLY 189 Ca -0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 1wsa n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1wsa s LYS 190 N -0.06 4.13 -0.12 1.61 2.47 -0.51 -4.86 119.74 122.40 1wsa s LYS 190 Ca 0.00 0.50 -0.02 0.00 -1.56 0.00 0.00 55.97 54.88 1wsa s LYS 190 Cb 0.00 -3.63 -0.03 0.00 -1.46 0.00 0.00 37.83 32.71 1wsa s LYS 190 CO 0.00 -0.33 -0.03 0.54 0.16 0.00 0.00 175.35 175.68 1wsa s VAL 191 N 2.24 3.97 -0.02 4.02 0.11 -1.26 -1.06 120.40 128.40 1wsa s VAL 191 Ca 0.25 -0.36 0.00 0.00 -2.93 0.00 0.00 61.98 58.95 1wsa s VAL 191 Cb -0.16 -2.69 0.03 0.00 -1.53 0.00 0.00 36.38 32.03 1wsa s VAL 191 CO 0.09 0.55 0.01 -1.61 -3.33 0.00 0.00 175.10 170.81 1wsa s GLU 192 N -0.26 0.13 -0.07 1.54 0.41 0.01 -5.00 118.70 115.48 1wsa s GLU 192 Ca 0.05 0.12 0.01 0.00 -0.41 0.00 0.00 54.97 54.74 1wsa s GLU 192 Cb -0.13 -0.35 -0.03 0.00 -1.78 0.00 0.00 34.13 31.84 1wsa s GLU 192 CO 0.02 -0.14 -0.09 0.71 -0.49 0.00 0.00 175.26 175.27 1wsa s TYR 193 N 0.99 2.87 -0.05 1.61 2.02 -1.26 -0.05 117.35 123.48 1wsa s TYR 193 Ca -0.09 -0.08 0.04 0.00 -0.37 0.00 0.00 57.07 56.58 1wsa s TYR 193 Cb -0.13 -1.71 -0.06 0.00 -0.40 0.00 0.00 41.96 39.66 1wsa s TYR 193 CO -0.02 0.25 0.02 1.19 -1.57 0.00 0.00 175.55 175.41 1wsa n PHE 194 N 2.38 0.00 -4.37 2.71 3.72 0.18 -4.94 117.46 117.14 1wsa n PHE 194 Ca -0.18 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.01 1wsa n PHE 194 Cb 0.53 -0.24 -0.08 0.00 -0.94 0.00 0.00 39.48 38.74 1wsa n PHE 194 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1wsa s THR 195 N -2.12 0.28 -0.01 4.37 -4.23 -0.93 -5.07 115.64 107.93 1wsa s THR 195 Ca -0.02 -2.00 -0.19 0.00 -1.18 0.00 0.00 61.69 58.29 1wsa s THR 195 Cb 0.01 -2.45 0.04 0.00 1.34 0.00 0.00 72.50 71.44 1wsa s THR 195 CO 0.20 0.00 0.41 0.00 -0.54 0.00 0.00 174.62 174.69 1wsa s GLN 196 N -3.65 0.81 0.58 3.99 -2.07 -1.26 -4.78 119.66 113.27 1wsa s GLN 196 Ca 0.33 -0.13 -0.19 0.00 -1.82 0.00 0.00 55.36 53.56 1wsa s GLN 196 Cb 0.03 0.36 -0.04 0.00 -1.09 0.00 0.00 33.01 32.28 1wsa s GLN 196 CO 0.20 -0.24 1.20 0.45 -1.32 0.00 0.00 175.29 175.58 1wsa s SER 197 N -1.43 5.27 0.00 12.60 0.15 -1.26 -4.94 113.70 124.09 1wsa s SER 197 Ca -0.11 2.37 0.05 0.00 0.70 0.00 0.00 55.95 58.95 1wsa s SER 197 Cb -0.03 -2.60 -0.02 0.00 -1.71 0.00 0.00 66.02 61.66 1wsa s SER 197 CO 0.04 -1.54 0.37 0.52 1.20 0.00 0.00 173.24 173.84 1wsa n VAL 198 N -1.53 0.00 -3.55 4.45 0.31 -1.26 -4.97 118.33 111.79 1wsa n VAL 198 Ca 0.13 -0.42 -0.38 0.00 -0.01 0.00 0.00 64.34 63.66 1wsa n VAL 198 Cb 0.50 1.04 -0.06 0.00 -0.91 0.00 0.00 33.84 34.41 1wsa n VAL 198 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1wsa s ARG 199 N -1.12 3.86 0.05 5.55 1.81 -1.26 -5.03 118.95 122.80 1wsa s ARG 199 Ca 0.03 0.34 -0.36 0.00 -1.72 0.00 0.00 55.73 54.03 1wsa s ARG 199 Cb 0.04 -3.21 -0.15 0.00 -0.45 0.00 0.00 34.95 31.17 1wsa s ARG 199 CO 0.16 0.70 1.49 -2.30 -0.68 0.00 0.00 175.30 174.67 1wsa n PRO 200 N 1.82 1.49 -4.08 3.54 -0.02 -1.26 -5.03 135.00 131.45 1wsa n PRO 200 Ca -0.15 0.54 -0.09 0.00 -2.02 0.00 0.00 63.50 61.78 1wsa n PRO 200 Cb 0.53 -2.23 -0.09 0.00 -0.02 0.00 0.00 33.50 31.68 1wsa n PRO 200 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1wsa s HIS 201 N 1.21 0.69 0.00 6.00 -3.43 -1.26 -4.80 115.29 113.69 1wsa s HIS 201 Ca 0.85 -1.07 0.00 0.00 -0.80 0.00 0.00 55.06 54.04 1wsa s HIS 201 Cb -0.88 -0.34 0.00 0.00 -1.43 0.00 0.00 32.58 29.93 1wsa s HIS 201 CO 0.47 -0.57 0.00 0.25 -2.00 0.00 0.00 174.74 172.89 1wsa n THR 202 N -0.11 0.00 0.30 -5.38 -2.24 0.19 -1.34 114.28 105.69 1wsa n THR 202 Ca -0.07 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.86 1wsa n THR 202 Cb 0.63 0.00 0.80 0.00 -2.10 0.00 0.00 70.33 69.66 1wsa n THR 202 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1wsa h LEU 203 N 0.00 0.00 -2.23 3.22 5.85 -1.75 0.55 115.31 120.95 1wsa h LEU 203 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1wsa h LEU 203 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1wsa h LEU 203 CO 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.10 1wsa n ALA 204 N -1.86 2.42 -2.30 1.25 0.00 -0.45 -4.93 120.51 114.64 1wsa n ALA 204 Ca -0.02 -0.98 -0.37 0.00 0.00 0.00 0.00 53.44 52.07 1wsa n ALA 204 Cb 0.30 -0.91 -0.06 0.00 0.00 0.00 0.00 19.45 18.77 1wsa n ALA 204 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1wsa s SER 205 N -1.39 6.96 0.00 0.00 0.15 0.19 -4.62 113.70 114.98 1wsa s SER 205 Ca 0.39 1.19 0.29 0.00 0.70 0.00 0.00 55.95 58.53 1wsa s SER 205 Cb 0.22 -2.33 1.26 0.00 -1.71 0.00 0.00 66.02 63.46 1wsa s SER 205 CO 0.31 0.18 1.93 -1.84 1.20 0.00 0.00 173.24 175.02 1wsa n GLU 206 N 1.25 0.07 -3.20 5.44 0.28 -1.26 -4.88 120.64 118.33 1wsa n GLU 206 Ca -0.08 -0.00 -0.35 0.00 -0.16 0.00 0.00 57.16 56.57 1wsa n GLU 206 Cb 0.51 -1.50 -0.06 0.00 1.43 0.00 0.00 31.44 31.82 1wsa n GLU 206 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 1wsa s PHE 207 N -2.93 3.58 -0.05 -1.84 0.08 -1.26 -5.06 117.98 110.50 1wsa s PHE 207 Ca 0.16 1.24 -0.02 0.00 0.12 0.00 0.00 56.93 58.43 1wsa s PHE 207 Cb 0.19 -2.51 0.04 0.00 -0.57 0.00 0.00 43.02 40.17 1wsa s PHE 207 CO 0.53 0.33 0.09 0.34 -0.10 0.00 0.00 175.22 176.41 1wsa s ASP 208 N -1.80 0.53 0.00 1.36 -1.08 -1.26 -4.72 116.67 109.70 1wsa s ASP 208 Ca 0.43 0.18 0.16 0.00 -0.52 0.00 0.00 52.55 52.80 1wsa s ASP 208 Cb -0.15 0.05 0.36 0.00 -1.46 0.00 0.00 42.92 41.72 1wsa s ASP 208 CO 0.20 -0.20 1.27 2.30 0.52 0.00 0.00 175.17 179.26 1wsa n ILE 209 N 4.81 0.72 -2.56 4.11 -6.64 -1.26 -4.79 119.36 113.75 1wsa n ILE 209 Ca -0.14 -0.86 -0.41 0.00 -1.77 0.00 0.00 62.75 59.57 1wsa n ILE 209 Cb 0.50 0.74 -0.04 0.00 -1.44 0.00 0.00 39.64 39.40 1wsa n ILE 209 CO 0.00 0.00 0.00 -0.94 -1.77 0.00 0.00 176.55 173.84 1wsa s SER 210 N -1.10 7.31 0.00 7.28 1.04 -1.26 -2.46 113.70 124.51 1wsa s SER 210 Ca 0.30 2.00 0.00 0.00 0.48 0.00 0.00 55.95 58.73 1wsa s SER 210 Cb 0.17 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.69 1wsa s SER 210 CO 0.22 -0.21 0.00 1.17 0.98 0.00 0.00 173.24 175.41 1wsa n LYS 211 N 2.63 0.00 -2.95 4.02 0.00 -1.26 -5.05 118.16 115.56 1wsa n LYS 211 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 58.31 57.94 1wsa n LYS 211 Cb 0.47 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.45 1wsa n LYS 211 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1wsa s ILE 212 N -2.93 4.72 0.00 3.15 1.01 -1.03 -4.95 121.20 121.17 1wsa s ILE 212 Ca 0.00 1.68 0.00 0.00 0.00 0.00 0.00 60.65 62.33 1wsa s ILE 212 Cb 0.00 -4.14 0.00 0.00 0.01 0.00 0.00 42.46 38.33 1wsa s ILE 212 CO 0.00 0.35 0.00 -0.62 0.00 0.00 0.00 174.94 174.67 1wsa n GLU 213 N 2.88 2.66 -3.80 2.79 -0.58 -1.26 -5.01 120.64 118.32 1wsa n GLU 213 Ca -0.02 0.00 -0.13 0.00 -0.42 0.00 0.00 57.16 56.60 1wsa n GLU 213 Cb 0.50 -0.74 -0.13 0.00 -0.57 0.00 0.00 31.44 30.50 1wsa n GLU 213 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1wsa s GLU 214 N -1.36 0.15 0.10 3.49 2.02 -1.26 -4.86 118.70 116.98 1wsa s GLU 214 Ca 0.00 0.26 -0.03 0.00 0.02 0.00 0.00 54.97 55.22 1wsa s GLU 214 Cb 0.00 0.01 -0.05 0.00 0.10 0.00 0.00 34.13 34.19 1wsa s GLU 214 CO 0.00 -0.06 0.30 -0.51 0.02 0.00 0.00 175.26 175.00 1wsa s LEU 215 N 0.40 4.31 0.53 1.80 1.43 -1.26 -5.08 118.68 120.82 1wsa s LEU 215 Ca -0.03 0.44 -0.22 0.00 -1.03 0.00 0.00 54.13 53.29 1wsa s LEU 215 Cb -0.04 -3.14 -0.06 0.00 0.03 0.00 0.00 46.19 42.99 1wsa s LEU 215 CO -0.02 0.11 1.30 -2.65 0.23 0.00 0.00 176.35 175.32 1wsa n PRO 216 N 0.20 1.64 -2.72 1.29 -0.02 -1.26 -4.99 135.00 129.15 1wsa n PRO 216 Ca -0.04 0.60 -0.41 0.00 -2.02 0.00 0.00 63.50 61.63 1wsa n PRO 216 Cb 0.51 -2.50 -0.04 0.00 -0.02 0.00 0.00 33.50 31.46 1wsa n PRO 216 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1wsa s ARG 217 N -2.76 4.64 -0.10 -0.52 3.52 -1.26 -4.85 118.95 117.62 1wsa s ARG 217 Ca 0.70 1.44 -0.03 0.00 -0.13 0.00 0.00 55.73 57.71 1wsa s ARG 217 Cb -0.43 -3.41 0.05 0.00 -1.56 0.00 0.00 34.95 29.60 1wsa s ARG 217 CO 0.50 0.10 0.13 0.08 -0.81 0.00 0.00 175.30 175.30 1wsa s VAL 218 N 0.42 -0.20 0.21 7.11 1.01 -1.26 0.32 120.40 128.02 1wsa s VAL 218 Ca 0.49 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.69 1wsa s VAL 218 Cb -0.22 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.76 1wsa s VAL 218 CO 0.29 0.03 0.38 -1.81 0.00 0.00 0.00 175.10 174.00 1wsa s ASP 219 N 2.24 6.37 -0.17 3.32 1.01 -0.82 -4.91 116.67 123.71 1wsa s ASP 219 Ca 0.04 0.35 -0.00 0.00 0.71 0.00 0.00 52.55 53.64 1wsa s ASP 219 Cb -0.13 -1.99 0.00 0.00 1.01 0.00 0.00 42.92 41.81 1wsa s ASP 219 CO -0.06 -0.05 -0.14 -0.63 0.21 0.00 0.00 175.17 174.49 1wsa s ILE 220 N -1.89 2.69 -0.07 0.77 1.01 -1.26 0.10 121.20 122.55 1wsa s ILE 220 Ca 0.38 -0.75 -0.03 0.00 0.00 0.00 0.00 60.65 60.25 1wsa s ILE 220 Cb -0.11 -2.15 -0.04 0.00 0.01 0.00 0.00 42.46 40.17 1wsa s ILE 220 CO 0.29 0.51 0.08 -0.76 0.00 0.00 0.00 174.94 175.06 1wsa s LEU 221 N 0.97 3.97 -0.25 2.97 1.43 0.31 -4.96 118.68 123.11 1wsa s LEU 221 Ca -0.02 0.26 -0.05 0.00 -1.03 0.00 0.00 54.13 53.28 1wsa s LEU 221 Cb -0.15 -2.08 -0.01 0.00 0.03 0.00 0.00 46.19 43.98 1wsa s LEU 221 CO -0.02 0.35 0.01 -0.47 0.23 0.00 0.00 176.35 176.45 1wsa s TYR 222 N -1.05 3.04 0.30 0.29 5.04 -1.26 0.51 117.35 124.23 1wsa s TYR 222 Ca 0.18 -0.87 -0.26 0.00 -2.44 0.00 0.00 57.07 53.67 1wsa s TYR 222 Cb -0.12 -2.17 -0.10 0.00 0.35 0.00 0.00 41.96 39.92 1wsa s TYR 222 CO 0.07 -0.52 0.93 0.00 -1.34 0.00 0.00 175.55 174.69 1wsa s ALA 223 N 1.51 3.25 -0.05 3.97 0.00 -0.24 -4.98 121.76 125.22 1wsa s ALA 223 Ca 0.05 0.52 -0.30 0.00 0.00 0.00 0.00 51.96 52.23 1wsa s ALA 223 Cb -0.15 -3.17 0.09 0.00 0.00 0.00 0.00 23.12 19.89 1wsa s ALA 223 CO -0.00 0.19 0.76 -3.38 0.00 0.00 0.00 175.76 173.33 1wsa s HIS 224 N -1.52 -0.56 0.71 0.00 -3.43 -1.26 -4.73 115.29 104.50 1wsa s HIS 224 Ca 0.48 0.87 -0.16 0.00 -0.80 0.00 0.00 55.06 55.45 1wsa s HIS 224 Cb -0.20 0.44 0.01 0.00 -1.43 0.00 0.00 32.58 31.41 1wsa s HIS 224 CO 0.25 -0.56 1.12 -0.35 -2.00 0.00 0.00 174.74 173.20 1wsa n PRO 225 N 0.67 0.66 -3.16 -0.38 -0.04 -1.26 -1.93 135.00 129.55 1wsa n PRO 225 Ca -0.16 0.28 -0.20 0.00 -0.04 0.00 0.00 63.50 63.38 1wsa n PRO 225 Cb 0.58 -2.37 0.05 0.00 -0.04 0.00 0.00 33.50 31.72 1wsa n PRO 225 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1wsa n ASP 226 N -2.04 -5.71 -4.67 3.54 -0.08 -1.26 -4.96 116.55 101.37 1wsa n ASP 226 Ca 0.14 -0.35 -0.29 0.00 -1.51 0.00 0.00 54.79 52.78 1wsa n ASP 226 Cb 0.49 -4.44 0.17 0.00 2.34 0.00 0.00 41.12 39.68 1wsa n ASP 226 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1wsa s ASP 227 N -2.98 2.74 0.36 1.67 -1.08 -0.81 -5.08 116.67 111.49 1wsa s ASP 227 Ca 0.37 1.32 0.09 0.00 -0.52 0.00 0.00 52.55 53.81 1wsa s ASP 227 Cb -0.17 -1.99 -0.06 0.00 -1.46 0.00 0.00 42.92 39.24 1wsa s ASP 227 CO 0.46 -3.08 0.01 0.28 0.52 0.00 0.00 175.17 173.37 1wsa s THR 228 N -2.91 2.40 -1.28 1.71 -1.32 -1.26 -4.75 115.64 108.23 1wsa s THR 228 Ca 0.65 -1.99 0.11 0.00 -1.21 0.00 0.00 61.69 59.25 1wsa s THR 228 Cb -0.19 -2.82 0.07 0.00 -1.51 0.00 0.00 72.50 68.05 1wsa s THR 228 CO 0.58 -0.14 0.80 -0.90 -2.21 0.00 0.00 174.62 172.75 1wsa n ASP 229 N -0.96 1.77 0.22 8.08 5.75 -1.26 -4.25 116.55 125.90 1wsa n ASP 229 Ca -0.04 -1.39 0.14 0.00 -0.01 0.00 0.00 54.79 53.49 1wsa n ASP 229 Cb 0.64 0.10 0.38 0.00 -1.03 0.00 0.00 41.12 41.20 1wsa n ASP 229 CO 0.00 0.00 0.00 -0.37 -0.11 0.00 0.00 177.20 176.72 1wsa h VAL 230 N 1.94 0.00 0.08 2.12 -1.51 -1.97 -2.78 116.25 114.12 1wsa h VAL 230 Ca 0.00 -0.74 -0.27 0.00 -1.23 0.00 0.00 66.70 64.45 1wsa h VAL 230 Cb 0.43 1.73 -0.02 0.00 -2.13 0.00 0.00 31.29 31.31 1wsa h VAL 230 CO 0.00 0.00 -1.37 -0.07 -1.23 0.00 0.00 177.57 174.90 1wsa h LEU 231 N 0.00 0.25 0.51 4.19 3.38 -1.99 -1.23 115.31 120.42 1wsa h LEU 231 Ca 0.00 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 1wsa h LEU 231 Cb 0.78 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1wsa h LEU 231 CO 0.00 1.27 -0.24 0.58 0.09 0.00 0.00 178.44 180.13 1wsa h VAL 232 N 0.04 0.49 -0.55 1.22 2.07 -1.85 -2.03 116.25 115.64 1wsa h VAL 232 Ca -0.17 -0.15 0.11 0.00 0.82 0.00 0.00 66.70 67.31 1wsa h VAL 232 Cb 1.95 0.55 -0.11 0.00 -1.52 0.00 0.00 31.29 32.16 1wsa h VAL 232 CO 0.15 0.02 -0.25 -1.13 0.02 0.00 0.00 177.57 176.39 1wsa h ASN 233 N -0.77 -0.86 -0.06 0.57 -1.24 -1.54 -0.75 115.58 110.93 1wsa h ASN 233 Ca -0.07 0.20 -0.08 0.00 0.71 0.00 0.00 56.30 57.06 1wsa h ASN 233 Cb 0.56 0.47 -0.01 0.00 0.73 0.00 0.00 38.32 40.06 1wsa h ASN 233 CO 0.11 -0.26 -0.18 0.00 -1.29 0.00 0.00 177.43 175.81 1wsa h ALA 234 N 1.23 1.24 -0.07 1.57 0.00 -1.17 0.68 119.26 122.74 1wsa h ALA 234 Ca 0.25 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1wsa h ALA 234 Cb 0.50 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1wsa h ALA 234 CO -0.62 0.50 -0.01 0.00 0.00 0.00 0.00 179.25 179.11 1wsa h ALA 235 N 1.42 0.09 -0.65 0.00 0.00 -0.54 -0.62 119.26 118.97 1wsa h ALA 235 Ca 0.07 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 1wsa h ALA 235 Cb 0.54 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1wsa h ALA 235 CO 0.04 -0.20 0.08 1.25 0.00 0.00 0.00 179.25 180.41 1wsa h LEU 236 N -0.21 1.04 -1.20 0.00 5.85 -1.00 -1.31 115.31 118.48 1wsa h LEU 236 Ca 0.02 -0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.42 1wsa h LEU 236 Cb 0.40 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1wsa h LEU 236 CO 0.01 1.05 -0.26 1.56 -0.34 0.00 0.00 178.44 180.45 1wsa h GLN 237 N 1.01 0.00 -0.12 1.25 1.08 -0.86 -1.93 115.11 115.54 1wsa h GLN 237 Ca 0.19 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.39 1wsa h GLN 237 Cb 0.46 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.89 1wsa h GLN 237 CO 0.02 0.26 0.00 0.00 -0.95 0.00 0.00 178.83 178.16 1wsa n ALA 238 N -2.27 2.54 -0.86 3.87 0.00 -0.24 -4.92 120.51 118.62 1wsa n ALA 238 Ca -0.00 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.08 1wsa n ALA 238 Cb 0.42 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.74 1wsa n ALA 238 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wsa n GLY 239 N 0.95 0.87 3.76 0.00 0.00 -0.72 -5.04 105.19 105.01 1wsa n GLY 239 Ca 0.13 -0.56 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 1wsa n GLY 239 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wsa s ALA 240 N -2.00 3.52 -0.12 4.61 0.00 -0.57 -4.69 121.76 122.51 1wsa s ALA 240 Ca 0.00 1.28 0.17 0.00 0.00 0.00 0.00 51.96 53.41 1wsa s ALA 240 Cb 0.00 -3.50 -0.21 0.00 0.00 0.00 0.00 23.12 19.42 1wsa s ALA 240 CO 0.00 -0.67 0.54 1.63 0.00 0.00 0.00 175.76 177.26 1wsa n LYS 241 N 1.11 0.65 -4.05 0.00 4.76 0.15 -4.81 118.16 115.97 1wsa n LYS 241 Ca 0.01 0.11 -0.07 0.00 -2.87 0.00 0.00 58.31 55.49 1wsa n LYS 241 Cb 0.41 -1.69 -0.10 0.00 -1.84 0.00 0.00 35.03 31.82 1wsa n LYS 241 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1wsa s GLY 242 N -5.01 0.40 -0.08 0.72 0.00 -1.04 -0.19 107.32 102.13 1wsa s GLY 242 Ca -0.06 -1.10 -0.03 0.00 0.00 0.00 0.00 44.72 43.54 1wsa s GLY 242 CO 0.83 -1.22 0.13 -0.42 0.00 0.00 0.00 173.10 172.42 1wsa s ILE 243 N -3.82 -0.21 -0.39 0.90 1.01 -0.10 -1.95 121.20 116.64 1wsa s ILE 243 Ca 0.06 0.36 -0.20 0.00 0.00 0.00 0.00 60.65 60.86 1wsa s ILE 243 Cb 0.07 -0.26 0.01 0.00 0.01 0.00 0.00 42.46 42.28 1wsa s ILE 243 CO -0.10 0.14 0.63 -0.63 0.00 0.00 0.00 174.94 174.98 1wsa s ILE 244 N 2.25 4.87 -0.52 2.92 -1.09 0.11 -1.68 121.20 128.07 1wsa s ILE 244 Ca 0.04 0.37 -0.21 0.00 -2.23 0.00 0.00 60.65 58.63 1wsa s ILE 244 Cb -0.12 -4.12 0.05 0.00 -1.58 0.00 0.00 42.46 36.69 1wsa s ILE 244 CO -0.05 -0.42 0.72 -2.28 -1.23 0.00 0.00 174.94 171.68 1wsa s HIS 245 N 2.73 2.97 -1.12 3.97 5.65 -0.43 -0.53 115.29 128.53 1wsa s HIS 245 Ca 0.23 -0.37 -0.21 0.00 0.25 0.00 0.00 55.06 54.96 1wsa s HIS 245 Cb -0.14 -3.69 0.06 0.00 -1.18 0.00 0.00 32.58 27.62 1wsa s HIS 245 CO 0.16 -1.12 1.56 0.00 -0.65 0.00 0.00 174.74 174.69 1wsa s ALA 246 N 3.03 2.94 0.95 1.58 0.00 0.18 -0.46 121.76 129.99 1wsa s ALA 246 Ca 0.20 -2.51 -0.14 0.00 0.00 0.00 0.00 51.96 49.51 1wsa s ALA 246 Cb -0.17 -4.57 0.17 0.00 0.00 0.00 0.00 23.12 18.54 1wsa s ALA 246 CO 0.14 -3.50 1.17 0.20 0.00 0.00 0.00 175.76 173.77 1wsa s GLY 247 N 4.69 1.61 -0.01 0.00 0.00 -0.78 -1.08 107.32 111.75 1wsa s GLY 247 Ca 0.49 -0.70 -0.30 0.00 0.00 0.00 0.00 44.72 44.21 1wsa s GLY 247 CO -0.03 -0.07 1.01 1.06 0.00 0.00 0.00 173.10 175.07 1wsa s MET 248 N -5.41 4.53 6.90 2.90 -1.94 0.37 -0.68 119.30 125.96 1wsa s MET 248 Ca 0.66 1.45 0.00 0.00 -1.71 0.00 0.00 55.69 56.10 1wsa s MET 248 Cb -0.12 -3.46 0.00 0.00 2.01 0.00 0.00 34.83 33.26 1wsa s MET 248 CO 0.53 -0.11 0.00 0.41 -0.01 0.00 0.00 175.02 175.85 1wsa n GLY 249 N 2.96 3.94 2.37 -0.03 0.00 -1.26 -0.85 105.19 112.32 1wsa n GLY 249 Ca 0.07 0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1wsa n GLY 249 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1wsa n ASN 250 N 7.14 8.37 -2.79 1.61 5.15 -1.26 -4.54 115.26 128.94 1wsa n ASN 250 Ca 0.00 -2.71 -0.22 0.00 -0.60 0.00 0.00 54.58 51.05 1wsa n ASN 250 Cb 0.00 -1.52 0.02 0.00 -0.53 0.00 0.00 39.78 37.75 1wsa n ASN 250 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1wsa n GLY 251 N 3.20 -0.49 3.83 8.20 0.00 -1.18 -4.78 105.19 113.96 1wsa n GLY 251 Ca 0.74 0.08 -0.37 0.00 0.00 0.00 0.00 46.02 46.46 1wsa n GLY 251 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wsa s ASN 252 N -2.55 6.94 0.29 1.61 0.01 -0.03 -4.70 114.94 116.52 1wsa s ASN 252 Ca 0.22 1.15 0.08 0.00 -0.71 0.00 0.00 52.86 53.60 1wsa s ASN 252 Cb -0.10 -2.32 -0.03 0.00 0.41 0.00 0.00 41.25 39.21 1wsa s ASN 252 CO 0.27 0.22 0.19 -2.16 -1.51 0.00 0.00 177.10 174.11 1wsa s PRO 253 N -1.41 2.69 0.19 -0.60 0.04 -1.26 -0.48 135.00 134.17 1wsa s PRO 253 Ca 0.31 -1.25 -0.30 0.00 0.04 0.00 0.00 61.00 59.80 1wsa s PRO 253 Cb -0.17 -2.42 -0.08 0.00 0.04 0.00 0.00 34.50 31.86 1wsa s PRO 253 CO 0.18 0.26 1.24 0.12 0.04 0.00 0.00 177.00 178.84 1wsa s PHE 254 N -2.26 3.36 0.38 0.56 5.36 -1.26 -4.86 117.98 119.27 1wsa s PHE 254 Ca 0.36 1.36 0.22 0.00 -0.96 0.00 0.00 56.93 57.90 1wsa s PHE 254 Cb -0.06 -3.49 1.28 0.00 -0.34 0.00 0.00 43.02 40.41 1wsa s PHE 254 CO 0.24 -1.44 1.62 -1.35 -1.46 0.00 0.00 175.22 172.84 1wsa h PRO 255 N 5.23 0.14 -0.24 10.12 0.11 -1.98 -0.73 132.00 144.65 1wsa h PRO 255 Ca -0.45 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 1wsa h PRO 255 Cb 1.21 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1wsa h PRO 255 CO 0.75 0.09 -0.04 1.25 -0.21 0.00 0.00 178.00 179.85 1wsa h LEU 256 N 0.14 0.44 -0.98 2.35 5.85 -1.91 -2.68 115.31 118.52 1wsa h LEU 256 Ca 0.80 -0.35 -0.01 0.00 0.84 0.00 0.00 57.88 59.16 1wsa h LEU 256 Cb 2.15 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 43.06 1wsa h LEU 256 CO -0.60 0.69 -0.07 0.00 -0.34 0.00 0.00 178.44 178.12 1wsa h THR 257 N 0.20 0.15 -0.48 1.05 1.03 -1.34 -2.60 112.91 110.91 1wsa h THR 257 Ca 0.06 -0.82 -0.06 0.00 -0.01 0.00 0.00 66.41 65.58 1wsa h THR 257 Cb 0.48 1.72 -0.02 0.00 -1.07 0.00 0.00 68.15 69.26 1wsa h THR 257 CO 0.02 0.07 0.06 -0.61 -0.01 0.00 0.00 175.52 175.04 1wsa h GLN 258 N 0.00 0.81 -0.01 0.00 4.15 -1.08 0.48 115.11 119.46 1wsa h GLN 258 Ca -0.00 -0.23 -0.00 0.00 0.77 0.00 0.00 58.65 59.19 1wsa h GLN 258 Cb 0.71 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.31 1wsa h GLN 258 CO 0.01 0.83 0.01 -0.91 -1.93 0.00 0.00 178.83 176.84 1wsa h ASN 259 N 0.68 0.02 -0.83 -0.69 -0.26 -1.30 0.85 115.58 114.04 1wsa h ASN 259 Ca 0.14 -0.07 0.04 0.00 -0.56 0.00 0.00 56.30 55.84 1wsa h ASN 259 Cb 0.43 -0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 37.64 1wsa h ASN 259 CO 0.01 0.09 0.55 0.00 -1.06 0.00 0.00 177.43 177.02 1wsa h ALA 260 N 0.93 1.49 0.00 -0.83 0.00 -1.09 -1.87 119.26 117.89 1wsa h ALA 260 Ca 0.00 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1wsa h ALA 260 Cb 0.07 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1wsa h ALA 260 CO -0.00 0.42 -0.56 -0.07 0.00 0.00 0.00 179.25 179.04 1wsa h LEU 261 N 1.02 0.00 -0.40 0.00 3.38 0.54 -2.62 115.31 117.24 1wsa h LEU 261 Ca 0.33 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.12 1wsa h LEU 261 Cb 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1wsa h LEU 261 CO -0.10 0.56 -0.66 -0.08 0.09 0.00 0.00 178.44 178.25 1wsa h GLU 262 N 0.00 0.55 -0.43 1.13 4.81 -0.27 -2.76 114.58 117.62 1wsa h GLU 262 Ca -0.01 -0.40 -0.11 0.00 -0.13 0.00 0.00 59.36 58.71 1wsa h GLU 262 Cb 1.05 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 1wsa h GLU 262 CO 0.07 1.03 -0.15 0.87 -0.73 0.00 0.00 179.01 180.10 1wsa h LYS 263 N 0.40 0.85 0.00 1.92 1.79 -1.24 -2.91 116.57 117.38 1wsa h LYS 263 Ca -0.02 -0.35 -0.03 0.00 -2.18 0.00 0.00 60.65 58.07 1wsa h LYS 263 Cb 1.24 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 31.85 1wsa h LYS 263 CO 0.12 0.99 -0.14 0.00 -1.08 0.00 0.00 179.45 179.34 1wsa h ALA 264 N 0.84 1.04 0.00 3.86 0.00 -1.49 -1.39 119.26 122.13 1wsa h ALA 264 Ca 0.10 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1wsa h ALA 264 Cb 0.70 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1wsa h ALA 264 CO 0.05 0.17 -0.67 0.00 0.00 0.00 0.00 179.25 178.81 1wsa h ALA 265 N 1.86 0.58 0.00 0.00 0.00 -1.39 0.29 119.26 120.59 1wsa h ALA 265 Ca -0.00 -0.60 -0.16 0.00 0.00 0.00 0.00 54.91 54.15 1wsa h ALA 265 Cb 0.63 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1wsa h ALA 265 CO 0.02 0.82 -0.80 0.87 0.00 0.00 0.00 179.25 180.16 1wsa h LYS 266 N 0.00 0.00 -0.00 0.00 1.57 -1.26 -2.62 116.57 114.26 1wsa h LYS 266 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1wsa h LYS 266 Cb 1.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.82 1wsa h LYS 266 CO 0.08 0.73 0.00 0.43 -0.57 0.00 0.00 179.45 180.13 1wsa n SER 267 N -3.27 0.02 0.00 0.86 7.64 -0.56 -4.89 113.62 113.41 1wsa n SER 267 Ca 0.00 -1.98 0.00 0.00 1.01 0.00 0.00 58.87 57.90 1wsa n SER 267 Cb 0.84 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.04 1wsa n SER 267 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wsa n GLY 268 N 0.51 0.81 3.72 0.23 0.00 -0.99 -5.04 105.19 104.45 1wsa n GLY 268 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1wsa n GLY 268 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wsa s VAL 269 N -3.14 4.63 -0.26 1.61 1.01 0.08 -4.98 120.40 119.35 1wsa s VAL 269 Ca 0.00 2.04 -0.26 0.00 0.00 0.00 0.00 61.98 63.76 1wsa s VAL 269 Cb 0.00 -4.31 0.00 0.00 0.00 0.00 0.00 36.38 32.07 1wsa s VAL 269 CO 0.00 0.27 0.90 -0.69 0.00 0.00 0.00 175.10 175.58 1wsa s VAL 270 N 0.30 4.76 -0.33 2.92 1.01 0.73 -3.97 120.40 125.82 1wsa s VAL 270 Ca 0.48 1.64 -0.10 0.00 0.00 0.00 0.00 61.98 63.99 1wsa s VAL 270 Cb -0.22 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 31.96 1wsa s VAL 270 CO 0.29 -0.17 0.17 -0.69 0.00 0.00 0.00 175.10 174.70 1wsa s VAL 271 N 3.04 4.63 -0.21 2.92 1.01 -1.26 -0.92 120.40 129.60 1wsa s VAL 271 Ca 0.38 -0.51 -0.05 0.00 0.00 0.00 0.00 61.98 61.80 1wsa s VAL 271 Cb -0.15 -3.41 -0.02 0.00 0.00 0.00 0.00 36.38 32.80 1wsa s VAL 271 CO 0.09 -0.01 -0.01 0.00 0.00 0.00 0.00 175.10 175.17 1wsa s ALA 272 N 1.60 2.96 -0.28 5.51 0.00 -0.68 -0.74 121.76 130.14 1wsa s ALA 272 Ca 0.04 -1.04 -0.25 0.00 0.00 0.00 0.00 51.96 50.71 1wsa s ALA 272 Cb -0.18 -1.75 0.00 0.00 0.00 0.00 0.00 23.12 21.20 1wsa s ALA 272 CO 0.07 -0.23 0.87 1.03 0.00 0.00 0.00 175.76 177.49 1wsa s ARG 273 N 1.14 4.08 0.00 0.00 0.52 0.14 -1.32 118.95 123.52 1wsa s ARG 273 Ca 0.02 0.85 0.00 0.00 -0.52 0.00 0.00 55.73 56.08 1wsa s ARG 273 Cb -0.14 -3.69 0.00 0.00 0.52 0.00 0.00 34.95 31.63 1wsa s ARG 273 CO 0.01 -0.65 0.00 0.45 0.02 0.00 0.00 175.30 175.13 1wsa n SER 274 N 6.24 0.91 -3.77 0.23 2.88 0.39 -1.11 113.62 119.39 1wsa n SER 274 Ca 0.06 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.47 1wsa n SER 274 Cb 0.48 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.83 1wsa n SER 274 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1wsa s SER 275 N 0.84 -0.26 0.43 -3.46 0.15 -1.26 -1.87 113.70 108.27 1wsa s SER 275 Ca 0.00 0.41 0.23 0.00 0.70 0.00 0.00 55.95 57.29 1wsa s SER 275 Cb 0.00 0.51 0.36 0.00 -1.71 0.00 0.00 66.02 65.19 1wsa s SER 275 CO 0.00 -0.24 1.62 0.08 1.20 0.00 0.00 173.24 175.90 1wsa h ARG 276 N 4.98 0.00 -0.81 5.44 -0.00 -1.01 -3.39 114.38 119.60 1wsa h ARG 276 Ca -0.28 0.00 0.19 0.00 -0.00 0.00 0.00 59.98 59.90 1wsa h ARG 276 Cb 1.18 0.00 -0.14 0.00 -0.00 0.00 0.00 29.97 31.02 1wsa h ARG 276 CO 0.34 0.00 0.06 0.28 -0.00 0.00 0.00 179.97 180.65 1wsa h VAL 277 N 0.00 0.31 0.00 0.08 2.07 -1.84 -3.47 116.25 113.39 1wsa h VAL 277 Ca 0.00 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1wsa h VAL 277 Cb 0.99 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1wsa h VAL 277 CO 0.00 0.02 0.00 0.61 0.02 0.00 0.00 177.57 178.22 1wsa n GLY 278 N -1.42 0.98 3.71 2.17 0.00 -1.26 -5.08 105.19 104.28 1wsa n GLY 278 Ca 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.10 1wsa n GLY 278 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wsa s SER 279 N -0.92 -0.23 0.00 1.61 1.04 -1.26 -4.96 113.70 108.98 1wsa s SER 279 Ca 0.00 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 55.79 1wsa s SER 279 Cb 0.00 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.78 1wsa s SER 279 CO 0.00 -1.22 0.00 0.61 0.98 0.00 0.00 173.24 173.61 1wsa n GLY 280 N -0.41 0.16 3.86 7.32 0.00 -1.26 -4.97 105.19 109.88 1wsa n GLY 280 Ca -0.05 -1.90 -0.37 0.00 0.00 0.00 0.00 46.02 43.70 1wsa n GLY 280 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wsa s SER 281 N -1.00 6.35 -0.70 1.61 0.15 -1.26 -4.33 113.70 114.52 1wsa s SER 281 Ca 0.00 0.44 -0.17 0.00 0.70 0.00 0.00 55.95 56.92 1wsa s SER 281 Cb 0.00 -2.07 0.15 0.00 -1.71 0.00 0.00 66.02 62.39 1wsa s SER 281 CO 0.00 0.38 0.74 -0.89 1.20 0.00 0.00 173.24 174.67 1wsa s THR 282 N -0.85 5.14 0.71 6.45 2.01 -0.67 -4.90 115.64 123.53 1wsa s THR 282 Ca 0.14 -1.64 -0.13 0.00 0.31 0.00 0.00 61.69 60.37 1wsa s THR 282 Cb -0.12 -4.49 0.02 0.00 0.01 0.00 0.00 72.50 67.92 1wsa s THR 282 CO 0.03 -1.09 1.10 0.42 -0.69 0.00 0.00 174.62 174.39 1wsa s THR 283 N 1.67 3.29 0.40 -0.82 -4.23 -1.26 -2.23 115.64 112.44 1wsa s THR 283 Ca 0.14 0.52 -0.13 0.00 -1.18 0.00 0.00 61.69 61.04 1wsa s THR 283 Cb -0.18 -3.03 -0.07 0.00 1.34 0.00 0.00 72.50 70.55 1wsa s THR 283 CO -0.01 -0.45 0.80 -1.10 -0.54 0.00 0.00 174.62 173.32 1wsa s GLN 284 N -4.43 3.88 -1.05 3.99 -0.21 -1.26 -4.35 119.66 116.23 1wsa s GLN 284 Ca 0.64 0.62 -0.17 0.00 0.02 0.00 0.00 55.36 56.47 1wsa s GLN 284 Cb -0.19 -2.36 0.00 0.00 1.00 0.00 0.00 33.01 31.46 1wsa s GLN 284 CO 0.47 -0.02 0.74 -0.85 -2.12 0.00 0.00 175.29 173.52 1wsa n GLU 285 N -1.06 -1.15 0.00 2.91 0.28 -1.26 -4.99 120.64 115.37 1wsa n GLU 285 Ca 0.03 0.58 0.00 0.00 -0.16 0.00 0.00 57.16 57.61 1wsa n GLU 285 Cb 0.54 -3.79 0.00 0.00 1.43 0.00 0.00 31.44 29.62 1wsa n GLU 285 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1wsa n ALA 286 N -3.76 0.00 0.06 -1.84 0.00 -1.26 -5.02 120.51 108.69 1wsa n ALA 286 Ca -0.12 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.20 1wsa n ALA 286 Cb 0.59 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.91 1wsa n ALA 286 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1wsa h GLU 287 N 0.00 0.14 -5.48 0.00 5.08 -1.91 -3.45 114.58 108.96 1wsa h GLU 287 Ca 0.00 -0.23 -0.64 0.00 -1.00 0.00 0.00 59.36 57.49 1wsa h GLU 287 Cb 0.00 0.09 -0.11 0.00 0.50 0.00 0.00 28.75 29.23 1wsa h GLU 287 CO 0.00 1.02 -0.51 0.54 -1.00 0.00 0.00 179.01 179.06 1wsa s VAL 288 N -2.65 5.27 -0.65 3.13 0.11 -1.26 -5.05 120.40 119.29 1wsa s VAL 288 Ca -0.04 0.13 -0.23 0.00 -2.93 0.00 0.00 61.98 58.91 1wsa s VAL 288 Cb 0.08 -3.34 0.06 0.00 -1.53 0.00 0.00 36.38 31.65 1wsa s VAL 288 CO 0.84 0.53 0.99 -0.62 -3.33 0.00 0.00 175.10 173.51 1wsa s ASP 289 N -0.29 6.19 0.18 3.54 -1.08 -1.26 -4.40 116.67 119.55 1wsa s ASP 289 Ca 0.10 -0.86 -0.02 0.00 -0.52 0.00 0.00 52.55 51.26 1wsa s ASP 289 Cb -0.12 -2.43 0.08 0.00 -1.46 0.00 0.00 42.92 38.99 1wsa s ASP 289 CO 0.01 -1.45 1.46 0.44 0.52 0.00 0.00 175.17 176.15 1wsa h ASP 290 N 9.58 0.50 0.70 -0.34 3.32 -1.97 -2.22 116.42 126.00 1wsa h ASP 290 Ca -0.28 -0.31 -0.03 0.00 0.02 0.00 0.00 57.03 56.42 1wsa h ASP 290 Cb 1.07 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.48 1wsa h ASP 290 CO 1.18 1.04 -0.35 0.11 -1.72 0.00 0.00 179.24 179.49 1wsa h LYS 291 N 0.31 -0.93 -0.85 3.56 1.57 -1.91 0.91 116.57 119.23 1wsa h LYS 291 Ca -0.02 0.06 0.05 0.00 -1.87 0.00 0.00 60.65 58.87 1wsa h LYS 291 Cb 1.24 0.21 -0.05 0.00 0.08 0.00 0.00 32.23 33.71 1wsa h LYS 291 CO 0.12 -0.62 0.55 -0.22 -0.57 0.00 0.00 179.45 178.72 1wsa h LYS 292 N -0.96 0.98 0.00 3.15 3.64 -1.96 -2.65 116.57 118.77 1wsa h LYS 292 Ca -0.09 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.18 1wsa h LYS 292 Cb 0.75 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 1wsa h LYS 292 CO 0.14 0.65 -1.28 1.28 -2.27 0.00 0.00 179.45 177.97 1wsa n LEU 293 N -4.46 0.71 0.00 5.20 4.77 -0.83 -5.00 117.00 117.39 1wsa n LEU 293 Ca 0.12 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 1wsa n LEU 293 Cb 0.15 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1wsa n LEU 293 CO 0.34 -0.06 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1wsa n GLY 294 N 1.26 1.05 3.99 -0.72 0.00 0.30 -4.79 105.19 106.29 1wsa n GLY 294 Ca -0.04 -0.43 -0.18 0.00 0.00 0.00 0.00 46.02 45.37 1wsa n GLY 294 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wsa s PHE 295 N -2.00 2.71 0.09 1.61 0.08 -0.53 -4.57 117.98 115.37 1wsa s PHE 295 Ca 0.00 -0.43 0.09 0.00 0.12 0.00 0.00 56.93 56.70 1wsa s PHE 295 Cb 0.00 -2.34 -0.03 0.00 -0.57 0.00 0.00 43.02 40.08 1wsa s PHE 295 CO 0.00 -0.42 -0.23 0.08 -0.10 0.00 0.00 175.22 174.55 1wsa s VAL 296 N -2.39 1.90 -0.23 -0.44 1.01 0.08 -4.50 120.40 115.83 1wsa s VAL 296 Ca 0.54 -1.51 -0.09 0.00 0.00 0.00 0.00 61.98 60.93 1wsa s VAL 296 Cb -0.09 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 1wsa s VAL 296 CO 0.33 0.09 0.11 0.00 0.00 0.00 0.00 175.10 175.63 1wsa s ALA 297 N -1.01 3.46 -1.60 5.51 0.00 -1.26 0.28 121.76 127.14 1wsa s ALA 297 Ca 0.09 -0.90 0.22 0.00 0.00 0.00 0.00 51.96 51.37 1wsa s ALA 297 Cb -0.10 -2.16 1.18 0.00 0.00 0.00 0.00 23.12 22.04 1wsa s ALA 297 CO 0.04 -0.15 1.71 0.25 0.00 0.00 0.00 175.76 177.61 1wsa n THR 298 N 4.22 0.23 -0.24 0.00 -2.24 -0.27 -4.82 114.28 111.16 1wsa n THR 298 Ca -0.16 0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1wsa n THR 298 Cb 0.52 -0.70 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 1wsa n THR 298 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1wsa n GLU 299 N -1.20 0.00 -1.10 -0.78 1.02 -0.95 -3.71 120.64 113.92 1wsa n GLU 299 Ca 0.12 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 57.01 1wsa n GLU 299 Cb 0.15 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 31.48 1wsa n GLU 299 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1wsa n SER 300 N 2.14 6.79 -3.80 1.62 2.88 -1.26 -1.66 113.62 120.32 1wsa n SER 300 Ca 0.00 -2.48 -0.12 0.00 -1.33 0.00 0.00 58.87 54.93 1wsa n SER 300 Cb 0.00 -1.42 -0.11 0.00 -0.75 0.00 0.00 64.21 61.93 1wsa n SER 300 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1wsa s LEU 301 N 0.09 1.13 0.79 2.46 1.43 -1.24 -4.95 118.68 118.39 1wsa s LEU 301 Ca 0.64 0.32 -0.12 0.00 -1.03 0.00 0.00 54.13 53.95 1wsa s LEU 301 Cb 0.23 0.85 0.06 0.00 0.03 0.00 0.00 46.19 47.36 1wsa s LEU 301 CO -0.03 -0.17 1.13 0.54 0.23 0.00 0.00 176.35 178.04 1wsa s ASN 302 N -0.29 4.69 0.25 2.29 2.20 -1.26 -4.72 114.94 118.09 1wsa s ASN 302 Ca -0.04 1.03 -0.04 0.00 -0.94 0.00 0.00 52.86 52.87 1wsa s ASN 302 Cb -0.03 -1.69 0.45 0.00 -2.00 0.00 0.00 41.25 37.98 1wsa s ASN 302 CO 0.01 -1.82 1.76 -0.65 -2.94 0.00 0.00 177.10 173.47 1wsa h PRO 303 N -0.99 0.57 0.00 3.55 0.11 -1.98 0.16 132.00 133.42 1wsa h PRO 303 Ca -0.46 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.53 1wsa h PRO 303 Cb 1.29 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1wsa h PRO 303 CO 0.63 0.38 -0.37 -0.56 -0.21 0.00 0.00 178.00 177.87 1wsa h GLN 304 N 0.59 0.00 0.02 1.05 -0.00 -1.97 -2.10 115.11 112.71 1wsa h GLN 304 Ca 0.41 0.00 -0.31 0.00 -0.00 0.00 0.00 58.65 58.75 1wsa h GLN 304 Cb 0.54 0.00 -0.05 0.00 -0.00 0.00 0.00 27.48 27.98 1wsa h GLN 304 CO -0.34 0.37 -1.80 1.63 -0.00 0.00 0.00 178.83 178.69 1wsa n LYS 305 N -3.31 0.66 0.17 0.06 5.02 -1.05 -3.47 118.16 116.25 1wsa n LYS 305 Ca 0.01 0.28 0.05 0.00 -2.02 0.00 0.00 58.31 56.63 1wsa n LYS 305 Cb 0.60 -1.76 0.51 0.00 -0.02 0.00 0.00 35.03 34.35 1wsa n LYS 305 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1wsa h ALA 306 N 0.82 1.75 -0.16 7.82 0.00 -0.68 -2.39 119.26 126.42 1wsa h ALA 306 Ca -0.32 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 1wsa h ALA 306 Cb 2.03 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.76 1wsa h ALA 306 CO 0.08 0.19 0.00 -0.09 0.00 0.00 0.00 179.25 179.43 1wsa h ARG 307 N 0.15 0.28 -0.88 0.00 2.43 -1.45 -1.09 114.38 113.82 1wsa h ARG 307 Ca 0.04 -0.09 0.10 0.00 -0.81 0.00 0.00 59.98 59.21 1wsa h ARG 307 Cb 0.17 -0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 29.62 1wsa h ARG 307 CO 0.01 0.50 0.52 0.28 -1.51 0.00 0.00 179.97 179.76 1wsa h VAL 308 N 0.02 0.93 -0.40 0.20 2.07 -1.49 -0.31 116.25 117.27 1wsa h VAL 308 Ca 0.04 -0.30 -0.06 0.00 0.82 0.00 0.00 66.70 67.20 1wsa h VAL 308 Cb 0.37 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 1wsa h VAL 308 CO 0.01 0.16 0.00 0.25 0.02 0.00 0.00 177.57 178.01 1wsa h LEU 309 N 0.87 0.69 -0.58 2.57 6.46 -1.26 -2.15 115.31 121.90 1wsa h LEU 309 Ca 0.42 -0.30 -0.03 0.00 -0.12 0.00 0.00 57.88 57.84 1wsa h LEU 309 Cb 0.36 -0.19 -0.03 0.00 -0.73 0.00 0.00 40.66 40.08 1wsa h LEU 309 CO -0.24 0.83 0.24 0.25 -0.62 0.00 0.00 178.44 178.90 1wsa h LEU 310 N 0.53 0.80 0.23 2.25 6.46 -0.70 0.19 115.31 125.08 1wsa h LEU 310 Ca 0.11 -0.16 0.00 0.00 -0.12 0.00 0.00 57.88 57.71 1wsa h LEU 310 Cb 0.47 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 40.17 1wsa h LEU 310 CO 0.02 0.74 -0.23 0.24 -0.62 0.00 0.00 178.44 178.59 1wsa h MET 311 N 0.80 -0.47 -0.98 1.25 2.86 -0.94 0.71 114.93 118.16 1wsa h MET 311 Ca 0.20 0.03 0.02 0.00 -2.06 0.00 0.00 59.70 57.89 1wsa h MET 311 Cb 0.19 0.11 -0.05 0.00 0.06 0.00 0.00 31.60 31.90 1wsa h MET 311 CO -0.02 -0.32 0.65 -0.07 1.06 0.00 0.00 176.91 178.21 1wsa h LEU 312 N -0.49 1.11 -0.72 1.22 3.38 -1.23 -1.99 115.31 116.59 1wsa h LEU 312 Ca -0.00 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1wsa h LEU 312 Cb 0.46 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1wsa h LEU 312 CO -0.05 0.79 0.39 0.00 0.09 0.00 0.00 178.44 179.66 1wsa h ALA 313 N 1.40 0.92 0.00 1.53 0.00 -0.25 -2.37 119.26 120.49 1wsa h ALA 313 Ca 0.37 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1wsa h ALA 313 Cb -0.11 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.40 1wsa h ALA 313 CO -0.09 0.44 -0.00 -0.07 0.00 0.00 0.00 179.25 179.53 1wsa h LEU 314 N 0.99 0.00 0.00 0.00 3.38 -0.11 -2.00 115.31 117.57 1wsa h LEU 314 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1wsa h LEU 314 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1wsa h LEU 314 CO -0.04 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.84 1wsa n THR 315 N -3.09 0.47 -0.98 0.22 -2.24 -0.89 -3.86 114.28 103.91 1wsa n THR 315 Ca -0.02 0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 1wsa n THR 315 Cb 0.17 -0.75 0.00 0.00 -2.10 0.00 0.00 70.33 67.65 1wsa n THR 315 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1wsa n LYS 316 N -1.45 0.19 0.00 -0.78 2.85 -0.82 -5.13 118.16 113.03 1wsa n LYS 316 Ca 0.06 -0.59 0.00 0.00 -1.05 0.00 0.00 58.31 56.73 1wsa n LYS 316 Cb 0.24 -0.53 0.00 0.00 -0.65 0.00 0.00 35.03 34.08 1wsa n LYS 316 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 1wsa n THR 317 N -0.04 0.00 -1.89 0.58 5.66 -0.83 -5.03 114.28 112.73 1wsa n THR 317 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1wsa n THR 317 Cb 0.49 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.27 1wsa n THR 317 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1wsa n SER 318 N 0.00 0.00 -4.73 1.09 7.64 -1.26 -3.96 113.62 112.40 1wsa n SER 318 Ca 0.00 -1.39 -0.41 0.00 1.01 0.00 0.00 58.87 58.08 1wsa n SER 318 Cb 0.00 -0.08 -0.04 0.00 -1.01 0.00 0.00 64.21 63.08 1wsa n SER 318 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1wsa s ASP 319 N -0.39 7.32 0.15 6.43 2.15 -1.26 -4.96 116.67 126.11 1wsa s ASP 319 Ca 0.00 1.59 -0.17 0.00 0.43 0.00 0.00 52.55 54.40 1wsa s ASP 319 Cb 0.00 -2.53 0.03 0.00 -0.30 0.00 0.00 42.92 40.12 1wsa s ASP 319 CO 0.00 -0.10 1.75 -0.09 -0.17 0.00 0.00 175.17 176.56 1wsa h ARG 320 N 6.08 0.25 -0.69 4.34 2.43 -1.97 -0.25 114.38 124.55 1wsa h ARG 320 Ca -0.42 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 58.73 1wsa h ARG 320 Cb 1.21 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.67 1wsa h ARG 320 CO 0.73 0.16 0.42 1.49 -1.51 0.00 0.00 179.97 181.26 1wsa h GLU 321 N 0.26 0.94 -0.20 0.20 4.57 -1.96 -1.77 114.58 116.63 1wsa h GLU 321 Ca 0.14 -0.09 -0.16 0.00 -1.18 0.00 0.00 59.36 58.08 1wsa h GLU 321 Cb 0.10 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.49 1wsa h GLU 321 CO -0.14 0.67 -0.52 0.00 -1.18 0.00 0.00 179.01 177.84 1wsa h ALA 322 N 1.22 0.72 -0.37 2.92 0.00 -1.85 -2.22 119.26 119.68 1wsa h ALA 322 Ca 0.25 -0.50 -0.15 0.00 0.00 0.00 0.00 54.91 54.51 1wsa h ALA 322 Cb -0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1wsa h ALA 322 CO -0.05 0.68 -0.36 0.82 0.00 0.00 0.00 179.25 180.35 1wsa h ILE 323 N 0.43 1.28 -0.74 0.00 2.04 -0.85 -2.42 117.51 117.25 1wsa h ILE 323 Ca 0.01 -1.53 -0.01 0.00 1.00 0.00 0.00 64.86 64.33 1wsa h ILE 323 Cb 1.06 1.40 -0.04 0.00 -0.74 0.00 0.00 36.82 38.51 1wsa h ILE 323 CO 0.10 0.51 0.40 -0.61 0.00 0.00 0.00 178.15 178.55 1wsa h GLN 324 N 0.71 1.02 -0.45 2.37 5.75 -1.27 -0.29 115.11 122.95 1wsa h GLN 324 Ca 0.06 -0.11 -0.04 0.00 -0.15 0.00 0.00 58.65 58.41 1wsa h GLN 324 Cb 0.95 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 29.27 1wsa h GLN 324 CO 0.09 0.75 0.10 -0.22 -2.65 0.00 0.00 178.83 176.90 1wsa h LYS 325 N 1.03 0.68 -0.42 1.69 3.11 -1.28 -0.22 116.57 121.16 1wsa h LYS 325 Ca 0.26 -0.13 -0.11 0.00 -2.81 0.00 0.00 60.65 57.87 1wsa h LYS 325 Cb 0.03 -0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 31.14 1wsa h LYS 325 CO -0.04 0.62 -0.15 0.82 -2.81 0.00 0.00 179.45 177.89 1wsa h ILE 326 N 0.66 1.28 0.00 2.00 2.04 -0.57 -1.44 117.51 121.48 1wsa h ILE 326 Ca 0.15 -1.28 -0.05 0.00 1.00 0.00 0.00 64.86 64.68 1wsa h ILE 326 Cb 0.26 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1wsa h ILE 326 CO -0.00 0.43 -0.26 -0.26 0.00 0.00 0.00 178.15 178.06 1wsa h PHE 327 N 0.67 0.00 -0.01 1.37 0.04 -0.81 0.75 116.94 118.95 1wsa h PHE 327 Ca 0.10 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.87 1wsa h PHE 327 Cb 0.70 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.85 1wsa h PHE 327 CO 0.05 0.26 -0.01 0.43 -0.60 0.00 0.00 178.31 178.45 1wsa n SER 328 N -3.93 1.33 -0.08 2.17 7.64 -0.14 -4.33 113.62 116.28 1wsa n SER 328 Ca -0.02 -1.43 -0.17 0.00 1.01 0.00 0.00 58.87 58.26 1wsa n SER 328 Cb 0.34 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.48 1wsa n SER 328 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1wsa n THR 329 N 0.03 0.86 1.63 0.44 -1.04 0.05 -5.05 114.28 111.21 1wsa n THR 329 Ca 0.19 -0.21 0.15 0.00 -2.04 0.00 0.00 64.05 62.14 1wsa n THR 329 Cb 0.33 -1.72 0.64 0.00 -1.82 0.00 0.00 70.33 67.76 1wsa n THR 329 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21