#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wzi s VAL 3 N 0.00 2.53 -0.21 3.44 -7.23 -1.26 -5.12 120.40 112.56 2wzi s VAL 3 Ca 0.00 -0.86 -0.04 0.00 -1.81 0.00 0.00 61.98 59.27 2wzi s VAL 3 Cb 0.00 -2.00 -0.01 0.00 0.56 0.00 0.00 36.38 34.93 2wzi s VAL 3 CO 0.00 0.55 -0.05 -0.94 -0.31 0.00 0.00 175.10 174.35 2wzi s SER 4 N 0.17 4.29 -0.06 4.85 1.04 -1.26 -5.10 113.70 117.64 2wzi s SER 4 Ca -0.11 -0.38 0.03 0.00 0.48 0.00 0.00 55.95 55.97 2wzi s SER 4 Cb -0.16 -1.73 0.01 0.00 0.10 0.00 0.00 66.02 64.24 2wzi s SER 4 CO 0.06 0.00 -0.14 -0.76 0.98 0.00 0.00 173.24 173.39 2wzi s LEU 5 N 1.35 1.74 -0.07 2.42 1.43 -1.26 -4.87 118.68 119.43 2wzi s LEU 5 Ca 0.04 -0.31 -0.01 0.00 -1.03 0.00 0.00 54.13 52.82 2wzi s LEU 5 Cb -0.14 -0.86 0.03 0.00 0.03 0.00 0.00 46.19 45.25 2wzi s LEU 5 CO -0.03 0.07 -0.00 -1.10 0.23 0.00 0.00 176.35 175.52 2wzi s GLN 6 N 0.45 0.65 0.75 1.70 -1.52 -1.26 -2.30 119.66 118.13 2wzi s GLN 6 Ca -0.11 0.09 -0.14 0.00 -1.95 0.00 0.00 55.36 53.25 2wzi s GLN 6 Cb -0.14 -0.98 0.05 0.00 -0.22 0.00 0.00 33.01 31.71 2wzi s GLN 6 CO 0.03 -0.29 1.16 -2.14 -0.25 0.00 0.00 175.29 173.81 2wzi s PRO 7 N 1.90 2.12 0.18 2.91 0.02 -1.26 -4.83 135.00 136.04 2wzi s PRO 7 Ca 0.04 1.59 -0.31 0.00 0.02 0.00 0.00 61.00 62.34 2wzi s PRO 7 Cb -0.12 -1.85 -0.09 0.00 0.02 0.00 0.00 34.50 32.46 2wzi s PRO 7 CO -0.05 -1.81 1.42 -1.25 -0.33 0.00 0.00 177.00 174.98 2wzi s PRO 8 N -4.16 4.30 0.75 5.54 0.04 -0.97 -5.00 135.00 135.50 2wzi s PRO 8 Ca 0.70 2.18 -0.14 0.00 0.04 0.00 0.00 61.00 63.78 2wzi s PRO 8 Cb -0.25 -3.18 0.05 0.00 0.04 0.00 0.00 34.50 31.16 2wzi s PRO 8 CO 0.47 -0.42 1.19 -1.25 0.04 0.00 0.00 177.00 177.02 2wzi s PRO 9 N 0.48 2.03 0.25 0.56 0.04 -1.26 -4.64 135.00 132.46 2wzi s PRO 9 Ca 0.63 1.68 -0.04 0.00 0.04 0.00 0.00 61.00 63.30 2wzi s PRO 9 Cb -0.39 -1.83 0.35 0.00 0.04 0.00 0.00 34.50 32.66 2wzi s PRO 9 CO 0.35 -1.90 1.88 1.96 0.04 0.00 0.00 177.00 179.33 2wzi h GLN 10 N -0.53 1.10 -3.37 4.56 1.08 -1.84 -3.42 115.11 112.68 2wzi h GLN 10 Ca -0.47 -0.07 -0.22 0.00 -1.45 0.00 0.00 58.65 56.45 2wzi h GLN 10 Cb 1.29 -0.25 -0.29 0.00 -0.05 0.00 0.00 27.48 28.18 2wzi h GLN 10 CO 0.49 0.73 -0.59 -1.14 -0.95 0.00 0.00 178.83 177.36 2wzi s GLN 11 N -6.06 0.11 -0.12 1.46 0.74 -0.69 -5.04 119.66 110.06 2wzi s GLN 11 Ca -0.13 0.25 -0.06 0.00 0.05 0.00 0.00 55.36 55.47 2wzi s GLN 11 Cb 0.19 -0.04 0.05 0.00 1.10 0.00 0.00 33.01 34.31 2wzi s GLN 11 CO 0.81 -0.08 0.29 -1.17 -0.55 0.00 0.00 175.29 174.58 2wzi s LEU 12 N 0.55 0.21 -0.12 3.68 2.96 -1.26 -2.32 118.68 122.38 2wzi s LEU 12 Ca -0.04 0.62 0.01 0.00 -0.22 0.00 0.00 54.13 54.50 2wzi s LEU 12 Cb -0.06 0.88 0.02 0.00 0.50 0.00 0.00 46.19 47.53 2wzi s LEU 12 CO -0.02 -0.18 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.05 2wzi s ILE 13 N 1.42 1.52 0.24 6.68 1.01 0.24 -5.00 121.20 127.32 2wzi s ILE 13 Ca -0.08 -0.64 0.09 0.00 0.00 0.00 0.00 60.65 60.02 2wzi s ILE 13 Cb -0.10 -1.40 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 2wzi s ILE 13 CO -0.10 0.45 -0.02 -0.69 0.00 0.00 0.00 174.94 174.58 2wzi s VAL 14 N 1.15 3.45 -0.16 2.92 1.01 -1.26 -0.96 120.40 126.56 2wzi s VAL 14 Ca -0.03 -1.81 0.04 0.00 0.00 0.00 0.00 61.98 60.19 2wzi s VAL 14 Cb -0.14 -2.81 -0.05 0.00 0.00 0.00 0.00 36.38 33.37 2wzi s VAL 14 CO -0.05 -0.30 0.16 0.00 0.00 0.00 0.00 175.10 174.92 2wzi n GLN 15 N -0.65 4.31 -3.21 2.72 1.13 -0.96 -5.00 117.38 115.71 2wzi n GLN 15 Ca -0.08 -0.01 -0.21 0.00 -1.94 0.00 0.00 57.00 54.76 2wzi n GLN 15 Cb 0.58 -0.80 0.05 0.00 0.11 0.00 0.00 30.24 30.18 2wzi n GLN 15 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2wzi n ASN 16 N -1.23 -5.94 -4.03 1.08 4.13 -1.26 -5.03 115.26 102.98 2wzi n ASN 16 Ca 0.00 -0.37 -0.15 0.00 1.68 0.00 0.00 54.58 55.74 2wzi n ASN 16 Cb 0.08 -4.67 -0.13 0.00 -1.54 0.00 0.00 39.78 33.52 2wzi n ASN 16 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 2wzi s LYS 17 N -5.89 0.53 0.10 3.52 2.20 -1.26 -5.08 119.74 113.86 2wzi s LYS 17 Ca 0.40 -0.53 0.09 0.00 -0.36 0.00 0.00 55.97 55.57 2wzi s LYS 17 Cb -0.18 -0.40 -0.04 0.00 -1.51 0.00 0.00 37.83 35.71 2wzi s LYS 17 CO 0.50 0.09 -0.24 0.95 -0.36 0.00 0.00 175.35 176.29 2wzi s THR 18 N -0.83 1.95 0.03 3.43 -4.23 -1.26 -0.52 115.64 114.20 2wzi s THR 18 Ca -0.04 -1.57 0.05 0.00 -1.18 0.00 0.00 61.69 58.95 2wzi s THR 18 Cb -0.07 -1.73 -0.02 0.00 1.34 0.00 0.00 72.50 72.02 2wzi s THR 18 CO 0.00 0.06 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.35 2wzi s ILE 19 N -1.05 1.27 0.37 2.99 1.01 0.21 -4.89 121.20 121.12 2wzi s ILE 19 Ca 0.10 -0.95 -0.26 0.00 0.00 0.00 0.00 60.65 59.55 2wzi s ILE 19 Cb -0.10 -1.11 -0.09 0.00 0.01 0.00 0.00 42.46 41.17 2wzi s ILE 19 CO 0.04 0.15 1.10 -1.81 0.00 0.00 0.00 174.94 174.43 2wzi s ASP 20 N -0.92 6.80 0.30 3.58 1.01 -1.26 -0.16 116.67 126.02 2wzi s ASP 20 Ca 0.04 2.19 -0.29 0.00 0.71 0.00 0.00 52.55 55.21 2wzi s ASP 20 Cb -0.07 -2.60 -0.10 0.00 1.01 0.00 0.00 42.92 41.15 2wzi s ASP 20 CO 0.01 -0.47 1.14 -0.22 0.21 0.00 0.00 175.17 175.84 2wzi s LEU 21 N -2.31 4.50 -0.03 1.23 2.96 0.07 -4.83 118.68 120.27 2wzi s LEU 21 Ca 0.54 2.34 -0.30 0.00 -0.22 0.00 0.00 54.13 56.49 2wzi s LEU 21 Cb -0.27 -3.67 -0.04 0.00 0.50 0.00 0.00 46.19 42.71 2wzi s LEU 21 CO 0.34 -0.25 1.16 -2.84 -1.32 0.00 0.00 176.35 173.44 2wzi s PRO 22 N -1.60 4.40 0.06 0.98 0.02 -1.26 -4.96 135.00 132.64 2wzi s PRO 22 Ca 0.46 1.65 -0.21 0.00 0.02 0.00 0.00 61.00 62.92 2wzi s PRO 22 Cb -0.33 -3.50 -0.13 0.00 0.02 0.00 0.00 34.50 30.57 2wzi s PRO 22 CO 0.43 -0.35 1.47 0.00 -0.33 0.00 0.00 177.00 178.21 2wzi h ALA 23 N 7.21 0.20 -3.22 -1.55 0.00 -2.00 -3.41 119.26 116.50 2wzi h ALA 23 Ca -0.36 -0.21 -0.65 0.00 0.00 0.00 0.00 54.91 53.69 2wzi h ALA 23 Cb 1.18 -0.05 -0.24 0.00 0.00 0.00 0.00 17.79 18.67 2wzi h ALA 23 CO 0.85 -0.08 -0.70 0.08 0.00 0.00 0.00 179.25 179.40 2wzi s VAL 24 N -4.89 3.63 -0.03 0.00 1.01 -1.26 -5.12 120.40 113.74 2wzi s VAL 24 Ca -0.14 -0.44 -0.05 0.00 0.00 0.00 0.00 61.98 61.34 2wzi s VAL 24 Cb 0.06 -2.60 0.01 0.00 0.00 0.00 0.00 36.38 33.85 2wzi s VAL 24 CO 0.72 0.48 0.13 -0.72 0.00 0.00 0.00 175.10 175.71 2wzi s TYR 25 N 0.67 -0.07 -0.19 5.22 1.13 -1.26 -2.50 117.35 120.36 2wzi s TYR 25 Ca -0.03 0.17 -0.12 0.00 -1.41 0.00 0.00 57.07 55.68 2wzi s TYR 25 Cb -0.15 0.01 -0.05 0.00 -1.10 0.00 0.00 41.96 40.67 2wzi s TYR 25 CO 0.02 -0.15 0.22 -1.14 -2.51 0.00 0.00 175.55 171.99 2wzi s GLN 26 N -0.47 4.21 -0.21 -3.49 0.74 0.83 -4.72 119.66 116.56 2wzi s GLN 26 Ca -0.06 -0.06 -0.08 0.00 0.05 0.00 0.00 55.36 55.21 2wzi s GLN 26 Cb -0.04 -3.44 -0.04 0.00 1.10 0.00 0.00 33.01 30.59 2wzi s GLN 26 CO 0.01 0.23 0.09 -1.17 -0.55 0.00 0.00 175.29 173.90 2wzi s LEU 27 N 0.52 3.83 -0.17 3.68 2.96 -1.26 -0.42 118.68 127.80 2wzi s LEU 27 Ca 0.12 0.03 0.01 0.00 -0.22 0.00 0.00 54.13 54.08 2wzi s LEU 27 Cb -0.12 -1.99 0.02 0.00 0.50 0.00 0.00 46.19 44.59 2wzi s LEU 27 CO 0.02 0.11 -0.18 0.21 -1.32 0.00 0.00 176.35 175.18 2wzi s ASN 28 N 0.79 3.03 0.00 3.68 3.84 0.59 -4.65 114.94 122.22 2wzi s ASN 28 Ca 0.05 -0.62 0.00 0.00 0.21 0.00 0.00 52.86 52.49 2wzi s ASN 28 Cb -0.13 -1.39 0.00 0.00 -0.55 0.00 0.00 41.25 39.18 2wzi s ASN 28 CO 0.02 -0.02 0.00 0.61 -2.79 0.00 0.00 177.10 174.92 2wzi n GLY 29 N 4.66 0.90 0.36 1.21 0.00 -1.26 -1.33 105.19 109.73 2wzi n GLY 29 Ca -0.20 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.85 2wzi n GLY 29 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wzi h GLY 30 N 0.00 1.22 1.89 -0.02 0.00 -1.83 -1.05 103.07 103.29 2wzi h GLY 30 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.91 2wzi h GLY 30 CO 0.00 0.36 -0.08 1.18 0.00 0.00 0.00 176.54 178.00 2wzi n GLU 31 N -4.45 0.26 -0.00 4.80 1.02 -1.26 -4.17 120.64 116.84 2wzi n GLU 31 Ca 0.11 0.19 0.01 0.00 -0.02 0.00 0.00 57.16 57.46 2wzi n GLU 31 Cb 0.12 -1.78 -0.02 0.00 -0.02 0.00 0.00 31.44 29.74 2wzi n GLU 31 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2wzi n GLU 32 N -2.23 0.22 -2.03 3.49 4.71 -1.06 -5.03 120.64 118.72 2wzi n GLU 32 Ca 0.05 -0.02 -0.33 0.00 -0.01 0.00 0.00 57.16 56.85 2wzi n GLU 32 Cb 0.43 -1.06 0.02 0.00 -1.01 0.00 0.00 31.44 29.82 2wzi n GLU 32 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2wzi s ALA 33 N -2.16 2.68 -0.45 0.62 0.00 -0.42 -4.84 121.76 117.19 2wzi s ALA 33 Ca -0.01 0.49 -0.40 0.00 0.00 0.00 0.00 51.96 52.04 2wzi s ALA 33 Cb 0.01 -3.27 -0.17 0.00 0.00 0.00 0.00 23.12 19.69 2wzi s ALA 33 CO 0.10 -0.89 1.72 -1.71 0.00 0.00 0.00 175.76 174.98 2wzi n ASN 34 N -1.98 0.83 -0.21 0.00 2.85 -1.26 -4.78 115.26 110.71 2wzi n ASN 34 Ca 0.09 0.78 0.14 0.00 -0.11 0.00 0.00 54.58 55.49 2wzi n ASN 34 Cb 0.52 -0.80 0.45 0.00 1.24 0.00 0.00 39.78 41.20 2wzi n ASN 34 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2wzi h PRO 35 N 6.64 0.51 -0.92 1.20 0.11 -1.91 -0.77 132.00 136.87 2wzi h PRO 35 Ca -0.21 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.89 2wzi h PRO 35 Cb 1.25 -0.12 -0.05 0.00 0.11 0.00 0.00 31.00 32.20 2wzi h PRO 35 CO 0.93 0.34 0.61 0.45 -0.21 0.00 0.00 178.00 180.12 2wzi h HIS 36 N 0.53 1.15 -0.19 0.65 3.86 -1.89 0.33 115.15 119.59 2wzi h HIS 36 Ca 0.40 0.03 -0.18 0.00 -1.16 0.00 0.00 60.37 59.46 2wzi h HIS 36 Cb 0.80 -0.39 0.01 0.00 1.06 0.00 0.00 27.41 28.88 2wzi h HIS 36 CO -0.00 0.71 -0.57 0.00 0.86 0.00 0.00 177.93 178.93 2wzi h ALA 37 N 1.43 0.32 -0.53 2.45 0.00 -1.52 -3.00 119.26 118.42 2wzi h ALA 37 Ca 0.34 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2wzi h ALA 37 Cb -0.12 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 2wzi h ALA 37 CO -0.08 0.55 0.33 0.28 0.00 0.00 0.00 179.25 180.34 2wzi h VAL 38 N 0.43 1.15 -0.28 0.00 2.07 -0.89 -1.05 116.25 117.67 2wzi h VAL 38 Ca -0.02 -0.31 0.05 0.00 0.82 0.00 0.00 66.70 67.23 2wzi h VAL 38 Cb 1.20 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 31.33 2wzi h VAL 38 CO 0.12 0.15 0.00 0.50 0.02 0.00 0.00 177.57 178.37 2wzi h LYS 39 N 0.71 0.08 -0.52 1.57 3.64 -0.99 0.37 116.57 121.44 2wzi h LYS 39 Ca 0.19 -0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.62 2wzi h LYS 39 Cb -0.04 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.71 2wzi h LYS 39 CO -0.04 0.06 0.24 0.28 -2.27 0.00 0.00 179.45 177.72 2wzi h VAL 40 N 0.09 0.91 -0.39 2.00 2.07 -1.33 0.44 116.25 120.03 2wzi h VAL 40 Ca 0.13 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 2wzi h VAL 40 Cb 0.17 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 2wzi h VAL 40 CO -0.22 0.08 0.13 0.25 0.02 0.00 0.00 177.57 177.83 2wzi h LEU 41 N 0.46 0.56 -1.37 2.57 5.85 -0.53 -0.87 115.31 121.98 2wzi h LEU 41 Ca 0.24 -0.20 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 2wzi h LEU 41 Cb 0.19 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 2wzi h LEU 41 CO -0.19 0.60 -0.29 0.11 -0.34 0.00 0.00 178.44 178.33 2wzi h LYS 42 N 0.48 0.00 -0.10 1.25 1.57 0.07 -2.29 116.57 117.55 2wzi h LYS 42 Ca 0.13 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.68 2wzi h LYS 42 Cb 0.24 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.56 2wzi h LYS 42 CO -0.01 0.29 -0.84 0.93 -0.57 0.00 0.00 179.45 179.26 2wzi h GLU 43 N 0.00 0.69 0.00 3.15 5.08 -0.75 -3.24 114.58 119.51 2wzi h GLU 43 Ca -0.00 -0.61 -0.02 0.00 -1.00 0.00 0.00 59.36 57.73 2wzi h GLU 43 Cb 0.61 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.00 2wzi h GLU 43 CO 0.04 1.22 -0.07 -0.07 -1.00 0.00 0.00 179.01 179.12 2wzi h LEU 44 N 0.45 0.00 0.00 1.33 3.38 -0.71 -3.51 115.31 116.25 2wzi h LEU 44 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2wzi h LEU 44 Cb 1.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.21 2wzi h LEU 44 CO 0.16 0.07 0.00 0.18 0.09 0.00 0.00 178.44 178.95 2wzi n LEU 45 N -3.46 0.00 0.00 1.67 4.77 -0.90 -5.09 117.00 113.99 2wzi n LEU 45 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 2wzi n LEU 45 Cb 0.21 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 2wzi n LEU 45 CO 0.28 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 2wzi n GLY 54 N 5.00 3.95 3.73 -0.72 0.00 -1.26 -5.07 105.19 110.82 2wzi n GLY 54 Ca 0.00 -1.32 -0.41 0.00 0.00 0.00 0.00 46.02 44.28 2wzi n GLY 54 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2wzi s MET 55 N -2.65 4.41 0.08 1.61 -2.45 -1.04 -3.98 119.30 115.28 2wzi s MET 55 Ca 0.00 1.98 -0.31 0.00 -1.25 0.00 0.00 55.69 56.11 2wzi s MET 55 Cb 0.00 -3.23 -0.07 0.00 1.25 0.00 0.00 34.83 32.78 2wzi s MET 55 CO 0.00 -0.24 1.41 -1.17 1.05 0.00 0.00 175.02 176.08 2wzi s LEU 56 N 0.17 4.35 -0.19 4.11 2.96 -1.25 -0.12 118.68 128.72 2wzi s LEU 56 Ca 0.57 2.27 0.01 0.00 -0.22 0.00 0.00 54.13 56.76 2wzi s LEU 56 Cb -0.35 -3.58 0.03 0.00 0.50 0.00 0.00 46.19 42.80 2wzi s LEU 56 CO 0.36 -0.69 -0.15 -0.63 -1.32 0.00 0.00 176.35 173.91 2wzi s ILE 57 N 1.63 1.84 -0.26 6.68 1.01 0.43 -1.56 121.20 130.97 2wzi s ILE 57 Ca 0.65 -0.96 -0.06 0.00 0.00 0.00 0.00 60.65 60.28 2wzi s ILE 57 Cb -0.35 -1.77 -0.01 0.00 0.01 0.00 0.00 42.46 40.34 2wzi s ILE 57 CO 0.29 0.36 0.04 -0.44 0.00 0.00 0.00 174.94 175.19 2wzi s SER 58 N 1.35 4.89 -0.04 3.58 0.01 -0.26 -0.30 113.70 122.93 2wzi s SER 58 Ca 0.02 -0.45 0.04 0.00 1.31 0.00 0.00 55.95 56.87 2wzi s SER 58 Cb -0.15 -1.85 -0.00 0.00 0.21 0.00 0.00 66.02 64.23 2wzi s SER 58 CO -0.10 -0.09 -0.16 -0.51 0.41 0.00 0.00 173.24 172.79 2wzi s ILE 59 N 1.53 1.35 0.00 1.44 2.07 -0.44 -0.89 121.20 126.26 2wzi s ILE 59 Ca 0.05 -0.68 0.00 0.00 -1.41 0.00 0.00 60.65 58.61 2wzi s ILE 59 Cb -0.16 -1.16 0.00 0.00 0.13 0.00 0.00 42.46 41.27 2wzi s ILE 59 CO 0.01 0.39 0.00 0.61 -1.91 0.00 0.00 174.94 174.04 2wzi n GLY 60 N 3.11 0.07 3.91 1.50 0.00 -0.95 -4.18 105.19 108.64 2wzi n GLY 60 Ca -0.18 -1.06 -0.30 0.00 0.00 0.00 0.00 46.02 44.49 2wzi n GLY 60 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wzi s GLU 61 N -2.00 3.39 -0.16 1.61 8.01 -1.26 -1.23 118.70 127.05 2wzi s GLU 61 Ca 0.00 -0.51 -0.42 0.00 0.01 0.00 0.00 54.97 54.06 2wzi s GLU 61 Cb 0.00 -2.99 -0.19 0.00 -4.31 0.00 0.00 34.13 26.64 2wzi s GLU 61 CO 0.00 0.58 1.32 1.17 0.01 0.00 0.00 175.26 178.34 2wzi n LYS 62 N 0.08 0.24 0.00 1.61 4.81 0.30 -0.91 118.16 124.29 2wzi n LYS 62 Ca -0.06 0.09 0.00 0.00 -0.87 0.00 0.00 58.31 57.47 2wzi n LYS 62 Cb 0.52 -1.62 0.00 0.00 0.02 0.00 0.00 35.03 33.95 2wzi n LYS 62 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2wzi n GLY 63 N 2.59 2.50 3.78 3.14 0.00 -1.26 -4.95 105.19 110.99 2wzi n GLY 63 Ca 0.24 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.90 2wzi n GLY 63 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wzi s ASP 64 N -0.33 6.22 0.35 1.61 1.01 -0.09 -4.95 116.67 120.49 2wzi s ASP 64 Ca 0.00 2.11 0.05 0.00 0.71 0.00 0.00 52.55 55.43 2wzi s ASP 64 Cb 0.00 -2.58 0.64 0.00 1.01 0.00 0.00 42.92 41.98 2wzi s ASP 64 CO 0.00 -0.87 1.88 0.11 0.21 0.00 0.00 175.17 176.49 2wzi h LYS 65 N 1.78 0.46 -0.61 8.23 1.79 -1.98 -2.97 116.57 123.26 2wzi h LYS 65 Ca -0.49 -0.10 0.01 0.00 -2.18 0.00 0.00 60.65 57.88 2wzi h LYS 65 Cb 1.24 -0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 31.79 2wzi h LYS 65 CO 0.59 0.52 0.40 0.66 -1.08 0.00 0.00 179.45 180.54 2wzi h SER 66 N 0.44 0.70 -0.37 0.86 4.64 -1.91 -3.00 113.55 114.92 2wzi h SER 66 Ca 0.09 -0.02 -0.03 0.00 -0.47 0.00 0.00 61.79 61.37 2wzi h SER 66 Cb 0.35 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.25 2wzi h SER 66 CO 0.01 0.51 0.02 1.33 -0.87 0.00 0.00 176.83 177.83 2wzi n VAL 67 N -4.44 2.46 -0.28 0.95 0.24 -1.13 -4.71 118.33 111.43 2wzi n VAL 67 Ca 0.06 -1.82 0.01 0.00 -2.04 0.00 0.00 64.34 60.55 2wzi n VAL 67 Cb 0.04 -0.27 0.14 0.00 -1.47 0.00 0.00 33.84 32.28 2wzi n VAL 67 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 2wzi h ARG 68 N 2.27 0.76 0.00 7.34 3.08 -1.53 -2.22 114.38 124.08 2wzi h ARG 68 Ca 0.03 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 2wzi h ARG 68 Cb 1.64 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 31.52 2wzi h ARG 68 CO 0.33 0.50 -0.04 -0.22 -1.07 0.00 0.00 179.97 179.47 2wzi h LYS 69 N 0.78 0.00 -0.29 0.04 3.64 -1.85 -3.07 116.57 115.82 2wzi h LYS 69 Ca 0.37 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.75 2wzi h LYS 69 Cb 0.29 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 2wzi h LYS 69 CO -0.22 0.04 0.00 0.66 -2.27 0.00 0.00 179.45 177.66 2wzi n TYR 70 N -3.42 0.52 -0.17 1.91 4.01 -0.85 -4.72 117.16 114.44 2wzi n TYR 70 Ca -0.02 -0.60 0.10 0.00 -0.16 0.00 0.00 57.90 57.22 2wzi n TYR 70 Cb 0.16 -0.10 0.41 0.00 -0.31 0.00 0.00 39.34 39.51 2wzi n TYR 70 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2wzi h SER 71 N 1.73 0.55 1.65 7.72 4.64 -1.43 0.11 113.55 128.52 2wzi h SER 71 Ca 0.00 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2wzi h SER 71 Cb 0.88 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 2wzi h SER 71 CO 0.05 0.33 -0.00 0.03 -0.87 0.00 0.00 176.83 176.37 2wzi h ARG 72 N 0.61 0.00 0.00 4.77 3.08 -1.87 -3.20 114.38 117.78 2wzi h ARG 72 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 2wzi h ARG 72 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.55 2wzi h ARG 72 CO -0.12 0.00 -0.57 1.96 -1.07 0.00 0.00 179.97 180.17 2wzi h GLN 73 N 0.00 0.00 -6.16 0.04 1.08 -1.14 -3.45 115.11 105.48 2wzi h GLN 73 Ca 0.00 0.00 -0.57 0.00 -1.45 0.00 0.00 58.65 56.63 2wzi h GLN 73 Cb 0.83 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.20 2wzi h GLN 73 CO 0.00 0.00 0.86 0.42 -0.95 0.00 0.00 178.83 179.16 2wzi s ILE 74 N -3.27 4.48 0.43 2.54 1.01 -1.03 -4.64 121.20 120.72 2wzi s ILE 74 Ca 0.04 1.76 -0.25 0.00 0.00 0.00 0.00 60.65 62.20 2wzi s ILE 74 Cb 0.09 -4.21 -0.09 0.00 0.01 0.00 0.00 42.46 38.26 2wzi s ILE 74 CO 0.73 -0.24 1.29 -2.65 0.00 0.00 0.00 174.94 174.07 2wzi n PRO 75 N 6.59 1.95 -2.00 2.79 -0.02 -1.26 -4.87 135.00 138.18 2wzi n PRO 75 Ca 0.13 0.70 -0.40 0.00 -2.02 0.00 0.00 63.50 61.90 2wzi n PRO 75 Cb 0.46 -2.41 -0.00 0.00 -0.02 0.00 0.00 33.50 31.52 2wzi n PRO 75 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2wzi n ASP 76 N 0.13 7.63 -3.94 2.55 2.03 -1.26 -4.65 116.55 119.03 2wzi n ASP 76 Ca 0.07 -3.10 -0.16 0.00 0.52 0.00 0.00 54.79 52.12 2wzi n ASP 76 Cb 0.40 -1.39 -0.14 0.00 -0.72 0.00 0.00 41.12 39.26 2wzi n ASP 76 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2wzi s HIS 77 N -0.69 0.43 0.13 -0.67 3.76 -1.26 -5.09 115.29 111.90 2wzi s HIS 77 Ca 0.53 -0.08 -0.35 0.00 -0.15 0.00 0.00 55.06 55.01 2wzi s HIS 77 Cb 0.17 -0.29 -0.16 0.00 1.11 0.00 0.00 32.58 33.41 2wzi s HIS 77 CO -0.08 -0.02 1.24 1.63 -0.85 0.00 0.00 174.74 176.66 2wzi n LYS 78 N 3.03 1.11 -0.90 1.40 4.76 -1.26 -1.10 118.16 125.20 2wzi n LYS 78 Ca -0.14 0.40 0.00 0.00 -2.87 0.00 0.00 58.31 55.70 2wzi n LYS 78 Cb 0.58 -1.96 0.00 0.00 -1.84 0.00 0.00 35.03 31.81 2wzi n LYS 78 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2wzi n GLU 79 N 2.10 -0.45 -1.49 1.97 1.02 -1.26 -4.53 120.64 117.99 2wzi n GLU 79 Ca 0.17 0.11 -0.30 0.00 -0.02 0.00 0.00 57.16 57.12 2wzi n GLU 79 Cb 0.21 -3.60 0.08 0.00 -0.02 0.00 0.00 31.44 28.11 2wzi n GLU 79 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2wzi s GLY 80 N -2.00 1.65 0.12 0.62 0.00 -0.26 -4.17 107.32 103.28 2wzi s GLY 80 Ca 0.00 -0.03 -0.20 0.00 0.00 0.00 0.00 44.72 44.49 2wzi s GLY 80 CO 0.00 0.35 0.51 -2.52 0.00 0.00 0.00 173.10 171.44 2wzi s TYR 81 N -3.06 -0.39 -0.10 1.90 -0.85 0.04 -0.87 117.35 114.01 2wzi s TYR 81 Ca 0.60 0.20 0.00 0.00 -0.52 0.00 0.00 57.07 57.36 2wzi s TYR 81 Cb -0.15 0.40 -0.02 0.00 0.38 0.00 0.00 41.96 42.57 2wzi s TYR 81 CO 0.55 -0.75 -0.11 -0.47 -1.52 0.00 0.00 175.55 173.25 2wzi s TYR 82 N -3.47 2.84 -0.04 -3.49 5.04 0.42 -1.68 117.35 116.96 2wzi s TYR 82 Ca 0.00 -0.34 0.02 0.00 -2.44 0.00 0.00 57.07 54.31 2wzi s TYR 82 Cb 0.00 -1.78 0.01 0.00 0.35 0.00 0.00 41.96 40.55 2wzi s TYR 82 CO -0.10 0.02 -0.08 -1.17 -1.34 0.00 0.00 175.55 172.88 2wzi s LEU 83 N -0.15 1.57 0.00 6.97 0.20 -0.01 -1.38 118.68 125.88 2wzi s LEU 83 Ca 0.00 -0.20 0.00 0.00 0.69 0.00 0.00 54.13 54.63 2wzi s LEU 83 Cb -0.13 -0.59 -0.00 0.00 -0.43 0.00 0.00 46.19 45.04 2wzi s LEU 83 CO 0.03 0.01 -0.00 -0.55 -0.29 0.00 0.00 176.35 175.55 2wzi s SER 84 N 0.60 0.01 -0.08 3.68 0.15 -0.43 -0.61 113.70 117.02 2wzi s SER 84 Ca -0.10 -0.02 -0.02 0.00 0.70 0.00 0.00 55.95 56.51 2wzi s SER 84 Cb -0.13 0.00 0.03 0.00 -1.71 0.00 0.00 66.02 64.22 2wzi s SER 84 CO 0.01 -0.01 0.03 -0.69 1.20 0.00 0.00 173.24 173.78 2wzi s VAL 85 N -0.07 0.20 0.32 4.45 1.01 -0.10 -0.42 120.40 125.80 2wzi s VAL 85 Ca -0.01 0.12 0.07 0.00 0.00 0.00 0.00 61.98 62.16 2wzi s VAL 85 Cb -0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 36.38 35.87 2wzi s VAL 85 CO -0.00 0.13 0.28 -0.46 0.00 0.00 0.00 175.10 175.05 2wzi n ASN 86 N 5.20 -0.70 0.27 3.32 0.23 -0.80 -1.77 115.26 121.01 2wzi n ASN 86 Ca -0.06 -3.12 0.13 0.00 -0.53 0.00 0.00 54.58 51.01 2wzi n ASN 86 Cb 0.50 1.63 0.78 0.00 -2.08 0.00 0.00 39.78 40.60 2wzi n ASN 86 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 2wzi h GLU 87 N 0.00 0.00 0.00 -3.83 3.07 -1.99 -3.02 114.58 108.81 2wzi h GLU 87 Ca -0.23 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.63 2wzi h GLU 87 Cb 1.16 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.07 2wzi h GLU 87 CO 0.33 0.09 -0.01 -0.22 -1.40 0.00 0.00 179.01 177.80 2wzi h LYS 88 N 0.00 0.00 -3.33 2.33 3.64 -1.97 -3.50 116.57 113.74 2wzi h LYS 88 Ca -0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2wzi h LYS 88 Cb 0.25 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 31.98 2wzi h LYS 88 CO 0.01 0.90 0.03 -1.83 -2.27 0.00 0.00 179.45 176.29 2wzi s GLU 89 N -2.16 1.49 -0.07 1.90 -1.05 -1.14 -3.92 118.70 113.75 2wzi s GLU 89 Ca -0.17 -0.98 0.06 0.00 -0.15 0.00 0.00 54.97 53.73 2wzi s GLU 89 Cb -0.03 0.52 -0.01 0.00 -0.44 0.00 0.00 34.13 34.18 2wzi s GLU 89 CO 0.62 -0.64 -0.25 0.42 0.95 0.00 0.00 175.26 176.36 2wzi s ILE 90 N -3.91 2.05 -0.06 1.83 1.01 -0.60 -1.91 121.20 119.59 2wzi s ILE 90 Ca 0.13 -1.05 0.03 0.00 0.00 0.00 0.00 60.65 59.75 2wzi s ILE 90 Cb -0.02 -1.74 0.01 0.00 0.01 0.00 0.00 42.46 40.72 2wzi s ILE 90 CO 0.02 0.57 -0.15 -0.69 0.00 0.00 0.00 174.94 174.68 2wzi s VAL 91 N -0.05 1.34 -0.33 2.92 1.01 0.44 -1.10 120.40 124.64 2wzi s VAL 91 Ca -0.07 -0.62 -0.02 0.00 0.00 0.00 0.00 61.98 61.28 2wzi s VAL 91 Cb -0.15 -1.19 0.12 0.00 0.00 0.00 0.00 36.38 35.17 2wzi s VAL 91 CO 0.05 0.40 0.17 -0.76 0.00 0.00 0.00 175.10 174.96 2wzi s LEU 92 N 0.44 0.87 -0.22 3.92 1.43 -0.07 -1.31 118.68 123.74 2wzi s LEU 92 Ca -0.12 -1.80 -0.01 0.00 -1.03 0.00 0.00 54.13 51.16 2wzi s LEU 92 Cb -0.15 -0.40 0.06 0.00 0.03 0.00 0.00 46.19 45.73 2wzi s LEU 92 CO 0.04 -0.37 0.00 0.00 0.23 0.00 0.00 176.35 176.25 2wzi s ALA 93 N 1.51 1.44 0.19 4.21 0.00 -0.48 -2.25 121.76 126.37 2wzi s ALA 93 Ca 0.14 -1.03 -0.12 0.00 0.00 0.00 0.00 51.96 50.95 2wzi s ALA 93 Cb -0.20 -1.31 -0.07 0.00 0.00 0.00 0.00 23.12 21.54 2wzi s ALA 93 CO -0.16 -1.21 0.55 0.20 0.00 0.00 0.00 175.76 175.15 2wzi s GLY 94 N 1.65 2.38 0.56 0.00 0.00 -0.37 -0.44 107.32 111.10 2wzi s GLY 94 Ca -0.03 -0.19 0.24 0.00 0.00 0.00 0.00 44.72 44.75 2wzi s GLY 94 CO -0.08 0.03 2.21 -0.57 0.00 0.00 0.00 173.10 174.69 2wzi h ASN 95 N 3.10 0.00 -5.24 1.64 -1.24 -1.27 0.86 115.58 113.42 2wzi h ASN 95 Ca -0.48 0.00 -0.12 0.00 0.71 0.00 0.00 56.30 56.41 2wzi h ASN 95 Cb 1.18 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 40.19 2wzi h ASN 95 CO 0.67 0.00 0.04 1.51 -1.29 0.00 0.00 177.43 178.37 2wzi s ASP 96 N -6.52 0.36 0.21 1.15 1.47 -1.26 -4.25 116.67 107.83 2wzi s ASP 96 Ca -0.05 -1.24 -0.10 0.00 1.18 0.00 0.00 52.55 52.34 2wzi s ASP 96 Cb 0.16 0.75 0.20 0.00 -0.34 0.00 0.00 42.92 43.68 2wzi s ASP 96 CO 0.60 -1.46 1.83 -0.33 0.68 0.00 0.00 175.17 176.49 2wzi h GLU 97 N 2.07 0.76 -0.67 2.11 5.08 -1.96 -1.13 114.58 120.85 2wzi h GLU 97 Ca -0.29 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.01 2wzi h GLU 97 Cb 1.25 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.29 2wzi h GLU 97 CO 0.38 0.51 0.37 -0.09 -1.00 0.00 0.00 179.01 179.18 2wzi h ARG 98 N 0.79 0.93 -0.73 2.33 2.43 -1.96 -2.44 114.38 115.73 2wzi h ARG 98 Ca 0.28 -0.10 0.13 0.00 -0.81 0.00 0.00 59.98 59.48 2wzi h ARG 98 Cb 0.08 -0.18 -0.09 0.00 -0.42 0.00 0.00 29.97 29.35 2wzi h ARG 98 CO -0.13 0.69 0.30 0.78 -1.51 0.00 0.00 179.97 180.09 2wzi h GLY 99 N 0.91 1.09 0.99 2.80 0.00 -1.40 0.13 103.07 107.60 2wzi h GLY 99 Ca 0.24 -0.15 -0.02 0.00 0.00 0.00 0.00 47.33 47.40 2wzi h GLY 99 CO -0.04 -0.07 0.31 -0.84 0.00 0.00 0.00 176.54 175.90 2wzi h THR 100 N 0.46 1.21 -0.73 4.70 2.02 -0.90 0.46 112.91 120.12 2wzi h THR 100 Ca 0.39 -0.57 -0.00 0.00 0.77 0.00 0.00 66.41 67.00 2wzi h THR 100 Cb 0.56 0.46 -0.04 0.00 -1.74 0.00 0.00 68.15 67.39 2wzi h THR 100 CO -0.37 0.24 0.45 0.22 0.37 0.00 0.00 175.52 176.42 2wzi h TYR 101 N 0.83 0.95 -0.48 3.16 3.20 -0.94 -2.19 116.97 121.51 2wzi h TYR 101 Ca 0.21 0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.98 2wzi h TYR 101 Cb 0.09 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 38.03 2wzi h TYR 101 CO -0.00 0.63 -0.10 1.88 -1.64 0.00 0.00 178.16 178.93 2wzi h TYR 102 N 0.99 0.97 -0.83 -3.82 0.05 -0.26 -1.38 116.97 112.69 2wzi h TYR 102 Ca 0.26 -0.19 0.16 0.00 0.05 0.00 0.00 58.73 59.01 2wzi h TYR 102 Cb -0.05 -0.25 -0.10 0.00 1.01 0.00 0.00 36.73 37.34 2wzi h TYR 102 CO -0.01 0.93 0.40 0.00 -1.05 0.00 0.00 178.16 178.43 2wzi h ALA 103 N 1.08 1.25 -0.05 3.88 0.00 -0.68 -1.37 119.26 123.38 2wzi h ALA 103 Ca 0.13 0.10 -0.14 0.00 0.00 0.00 0.00 54.91 55.00 2wzi h ALA 103 Cb 0.62 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2wzi h ALA 103 CO 0.04 -0.16 -0.61 -0.07 0.00 0.00 0.00 179.25 178.46 2wzi h LEU 104 N 0.55 0.19 -0.89 0.00 -0.00 -0.65 0.50 115.31 115.00 2wzi h LEU 104 Ca 0.47 -0.11 -0.10 0.00 -0.00 0.00 0.00 57.88 58.13 2wzi h LEU 104 Cb 0.71 -0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 41.30 2wzi h LEU 104 CO -0.40 0.75 -0.32 1.56 -0.00 0.00 0.00 178.44 180.04 2wzi h GLN 105 N 0.12 0.44 -0.06 1.13 1.08 -0.46 -0.24 115.11 117.13 2wzi h GLN 105 Ca -0.01 -0.18 -0.06 0.00 -1.45 0.00 0.00 58.65 56.95 2wzi h GLN 105 Cb 1.10 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.52 2wzi h GLN 105 CO 0.09 0.71 -0.19 1.15 -0.95 0.00 0.00 178.83 179.64 2wzi h THR 106 N 0.38 1.43 -0.77 -0.54 2.02 -1.02 -3.18 112.91 111.23 2wzi h THR 106 Ca 0.05 -1.58 0.16 0.00 0.77 0.00 0.00 66.41 65.81 2wzi h THR 106 Cb 0.74 2.30 -0.10 0.00 -1.74 0.00 0.00 68.15 69.35 2wzi h THR 106 CO 0.06 0.44 0.28 0.15 0.37 0.00 0.00 175.52 176.82 2wzi h PHE 107 N -0.27 0.47 -0.74 3.16 3.57 -0.72 -1.85 116.94 120.57 2wzi h PHE 107 Ca -0.01 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.60 2wzi h PHE 107 Cb 0.81 -0.09 -0.05 0.00 2.79 0.00 0.00 35.95 39.42 2wzi h PHE 107 CO 0.13 0.01 0.49 0.00 -2.23 0.00 0.00 178.31 176.70 2wzi h ALA 108 N 1.59 1.71 0.00 2.41 0.00 -1.02 -2.36 119.26 121.59 2wzi h ALA 108 Ca 0.44 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 55.18 2wzi h ALA 108 Cb 0.71 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2wzi h ALA 108 CO -0.45 0.16 -0.69 1.96 0.00 0.00 0.00 179.25 180.23 2wzi h GLN 109 N 0.75 0.00 -0.28 0.00 4.20 -1.35 -3.21 115.11 115.22 2wzi h GLN 109 Ca 0.33 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.93 2wzi h GLN 109 Cb 0.30 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 2wzi h GLN 109 CO -0.11 0.69 -0.26 -0.07 -0.67 0.00 0.00 178.83 178.41 2wzi h LEU 110 N 0.00 0.57 -9.29 1.46 3.38 -1.08 -3.44 115.31 106.91 2wzi h LEU 110 Ca -0.01 -0.20 -0.55 0.00 0.09 0.00 0.00 57.88 57.22 2wzi h LEU 110 Cb 1.43 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 42.02 2wzi h LEU 110 CO 0.09 0.81 1.06 -0.22 0.09 0.00 0.00 178.44 180.28 2wzi s LEU 111 N -8.70 4.33 -0.20 1.67 2.96 -1.00 -4.45 118.68 113.29 2wzi s LEU 111 Ca -0.07 2.26 -0.04 0.00 -0.22 0.00 0.00 54.13 56.06 2wzi s LEU 111 Cb 0.13 -3.54 0.09 0.00 0.50 0.00 0.00 46.19 43.37 2wzi s LEU 111 CO 0.80 -0.91 0.19 -0.54 -1.32 0.00 0.00 176.35 174.57 2wzi s LYS 112 N 3.78 0.16 -1.30 1.98 -0.14 -0.34 -4.91 119.74 118.96 2wzi s LYS 112 Ca 0.73 0.12 -0.06 0.00 -1.36 0.00 0.00 55.97 55.40 2wzi s LYS 112 Cb -0.34 -1.36 0.01 0.00 -1.68 0.00 0.00 37.83 34.46 2wzi s LYS 112 CO 0.30 -0.67 1.11 -0.25 -0.76 0.00 0.00 175.35 175.08 2wzi n ASP 113 N 5.31 -4.76 -0.07 2.83 9.92 -1.26 -2.10 116.55 126.42 2wzi n ASP 113 Ca -0.06 -0.58 -0.01 0.00 -0.53 0.00 0.00 54.79 53.62 2wzi n ASP 113 Cb 0.49 -5.05 -0.00 0.00 -0.64 0.00 0.00 41.12 35.92 2wzi n ASP 113 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2wzi n GLY 114 N -1.69 0.45 3.28 0.44 0.00 -1.26 -5.02 105.19 101.39 2wzi n GLY 114 Ca -0.10 -0.15 -0.27 0.00 0.00 0.00 0.00 46.02 45.51 2wzi n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wzi s LYS 115 N -0.85 1.49 -0.02 1.61 1.02 -0.89 -0.75 119.74 121.35 2wzi s LYS 115 Ca 0.00 -1.01 0.06 0.00 0.02 0.00 0.00 55.97 55.04 2wzi s LYS 115 Cb 0.00 -1.64 -0.01 0.00 -0.52 0.00 0.00 37.83 35.66 2wzi s LYS 115 CO 0.00 0.42 -0.19 -0.51 -0.92 0.00 0.00 175.35 174.14 2wzi s LEU 116 N -1.25 2.03 0.41 3.17 1.43 0.77 -1.20 118.68 124.05 2wzi s LEU 116 Ca 0.09 -0.36 -0.22 0.00 -1.03 0.00 0.00 54.13 52.61 2wzi s LEU 116 Cb -0.09 -1.01 -0.10 0.00 0.03 0.00 0.00 46.19 45.01 2wzi s LEU 116 CO 0.02 0.23 0.96 -2.16 0.23 0.00 0.00 176.35 175.64 2wzi s PRO 117 N -0.40 4.25 -0.42 1.29 0.04 -1.26 0.68 135.00 139.17 2wzi s PRO 117 Ca 0.06 1.21 -0.29 0.00 0.04 0.00 0.00 61.00 62.02 2wzi s PRO 117 Cb -0.08 -2.31 0.01 0.00 0.04 0.00 0.00 34.50 32.15 2wzi s PRO 117 CO -0.00 -0.02 1.43 -2.00 0.04 0.00 0.00 177.00 176.45 2wzi s GLU 118 N -2.92 3.53 0.04 4.56 2.12 0.32 -4.77 118.70 121.58 2wzi s GLU 118 Ca 0.60 0.91 -0.02 0.00 0.36 0.00 0.00 54.97 56.82 2wzi s GLU 118 Cb -0.12 -4.05 -0.03 0.00 0.26 0.00 0.00 34.13 30.19 2wzi s GLU 118 CO 0.17 -1.63 -0.00 0.14 -0.54 0.00 0.00 175.26 173.40 2wzi s VAL 119 N 5.60 0.17 -0.06 3.70 -7.23 -0.73 -2.28 120.40 119.58 2wzi s VAL 119 Ca 0.61 -1.42 -0.00 0.00 -1.81 0.00 0.00 61.98 59.37 2wzi s VAL 119 Cb -0.14 -1.06 0.02 0.00 0.56 0.00 0.00 36.38 35.77 2wzi s VAL 119 CO 0.32 -0.78 -0.03 -0.70 -0.31 0.00 0.00 175.10 173.60 2wzi s GLU 120 N -3.02 0.78 -0.07 4.82 2.12 -0.13 -0.92 118.70 122.28 2wzi s GLU 120 Ca -0.01 -0.02 0.02 0.00 0.36 0.00 0.00 54.97 55.31 2wzi s GLU 120 Cb 0.01 -0.95 0.01 0.00 0.26 0.00 0.00 34.13 33.47 2wzi s GLU 120 CO -0.07 -0.19 -0.12 0.42 -0.54 0.00 0.00 175.26 174.76 2wzi s ILE 121 N 1.43 1.14 -0.15 -3.70 1.01 0.22 -0.59 121.20 120.56 2wzi s ILE 121 Ca -0.03 -0.47 0.01 0.00 0.00 0.00 0.00 60.65 60.16 2wzi s ILE 121 Cb -0.13 -1.05 -0.00 0.00 0.01 0.00 0.00 42.46 41.29 2wzi s ILE 121 CO -0.03 0.36 -0.17 -0.54 0.00 0.00 0.00 174.94 174.56 2wzi s LYS 122 N 0.74 3.19 0.06 2.79 1.02 -0.98 -0.83 119.74 125.72 2wzi s LYS 122 Ca -0.13 -0.77 -0.09 0.00 0.02 0.00 0.00 55.97 55.00 2wzi s LYS 122 Cb -0.16 -2.57 -0.00 0.00 -0.52 0.00 0.00 37.83 34.58 2wzi s LYS 122 CO 0.03 0.03 0.18 0.34 -0.92 0.00 0.00 175.35 175.01 2wzi s ASP 123 N 0.75 0.08 -0.21 2.83 2.15 -0.67 -1.70 116.67 119.90 2wzi s ASP 123 Ca -0.07 -0.49 -0.34 0.00 0.43 0.00 0.00 52.55 52.08 2wzi s ASP 123 Cb -0.16 0.30 0.15 0.00 -0.30 0.00 0.00 42.92 42.91 2wzi s ASP 123 CO 0.01 -0.61 1.24 -0.72 -0.17 0.00 0.00 175.17 174.91 2wzi s TYR 124 N -3.03 -0.12 0.32 -5.34 -0.85 -1.26 -0.78 117.35 106.29 2wzi s TYR 124 Ca -0.01 0.10 -0.21 0.00 -0.52 0.00 0.00 57.07 56.43 2wzi s TYR 124 Cb 0.01 0.51 -0.10 0.00 0.38 0.00 0.00 41.96 42.76 2wzi s TYR 124 CO -0.06 -0.16 0.84 -1.25 -1.52 0.00 0.00 175.55 173.39 2wzi s PRO 125 N -2.08 4.28 0.40 -3.49 0.04 -1.26 -4.69 135.00 128.20 2wzi s PRO 125 Ca 0.09 1.01 0.22 0.00 0.04 0.00 0.00 61.00 62.36 2wzi s PRO 125 Cb -0.01 -2.59 0.28 0.00 0.04 0.00 0.00 34.50 32.22 2wzi s PRO 125 CO -0.04 0.21 1.54 0.77 0.04 0.00 0.00 177.00 179.51 2wzi h SER 126 N 2.73 0.00 -3.65 6.66 0.02 -0.98 -3.45 113.55 114.88 2wzi h SER 126 Ca -0.48 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 59.80 2wzi h SER 126 Cb 1.19 0.00 -0.32 0.00 0.14 0.00 0.00 62.40 63.40 2wzi h SER 126 CO 0.64 0.05 -0.88 -0.69 -1.14 0.00 0.00 176.83 174.82 2wzi s VAL 127 N -3.20 1.97 0.03 2.27 1.01 -1.15 -4.65 120.40 116.69 2wzi s VAL 127 Ca 0.06 -0.99 -0.24 0.00 0.00 0.00 0.00 61.98 60.81 2wzi s VAL 127 Cb 0.06 -1.69 -0.17 0.00 0.00 0.00 0.00 36.38 34.58 2wzi s VAL 127 CO 0.69 0.54 1.48 -0.09 0.00 0.00 0.00 175.10 177.72 2wzi h ARG 128 N 6.43 0.05 -5.28 2.72 9.65 -1.82 -3.43 114.38 122.70 2wzi h ARG 128 Ca -0.26 -0.01 -0.64 0.00 -1.10 0.00 0.00 59.98 57.97 2wzi h ARG 128 Cb 1.21 -0.00 -0.23 0.00 -1.39 0.00 0.00 29.97 29.55 2wzi h ARG 128 CO 0.47 0.31 -0.69 0.71 2.80 0.00 0.00 179.97 183.57 2wzi s TYR 129 N -5.09 2.97 -0.08 2.20 2.02 -1.04 -4.98 117.35 113.35 2wzi s TYR 129 Ca -0.15 -0.41 -0.04 0.00 -0.37 0.00 0.00 57.07 56.11 2wzi s TYR 129 Cb 0.04 -1.94 0.04 0.00 -0.40 0.00 0.00 41.96 39.70 2wzi s TYR 129 CO 0.68 -0.10 0.18 1.03 -1.57 0.00 0.00 175.55 175.76 2wzi s ARG 130 N 0.43 0.12 0.00 -0.62 0.52 -1.26 -0.48 118.95 117.66 2wzi s ARG 130 Ca -0.05 0.46 0.00 0.00 -0.52 0.00 0.00 55.73 55.62 2wzi s ARG 130 Cb -0.15 -0.17 0.00 0.00 0.52 0.00 0.00 34.95 35.16 2wzi s ARG 130 CO 0.03 -0.19 0.00 0.41 0.02 0.00 0.00 175.30 175.57 2wzi n GLY 131 N 4.41 -0.69 3.12 -3.53 0.00 -1.00 -0.15 105.19 107.36 2wzi n GLY 131 Ca -0.22 -0.31 -0.26 0.00 0.00 0.00 0.00 46.02 45.23 2wzi n GLY 131 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wzi s VAL 132 N -4.00 1.41 -0.30 1.61 1.01 -0.95 -1.11 120.40 118.06 2wzi s VAL 132 Ca 0.00 -0.69 -0.09 0.00 0.00 0.00 0.00 61.98 61.19 2wzi s VAL 132 Cb 0.00 -1.22 -0.01 0.00 0.00 0.00 0.00 36.38 35.15 2wzi s VAL 132 CO 0.00 0.41 0.14 0.54 0.00 0.00 0.00 175.10 176.19 2wzi s VAL 133 N 0.12 4.61 -0.99 2.92 0.11 -0.07 -0.44 120.40 126.66 2wzi s VAL 133 Ca -0.06 -0.35 -0.23 0.00 -2.93 0.00 0.00 61.98 58.41 2wzi s VAL 133 Cb -0.12 -3.32 0.05 0.00 -1.53 0.00 0.00 36.38 31.46 2wzi s VAL 133 CO 0.03 0.11 1.43 -0.70 -3.33 0.00 0.00 175.10 172.64 2wzi s GLU 134 N 1.62 3.55 -0.03 1.54 2.12 -0.24 -3.97 118.70 123.29 2wzi s GLU 134 Ca 0.05 -1.03 0.04 0.00 0.36 0.00 0.00 54.97 54.39 2wzi s GLU 134 Cb -0.17 -5.24 0.06 0.00 0.26 0.00 0.00 34.13 29.04 2wzi s GLU 134 CO 0.06 -2.20 0.91 0.41 -0.54 0.00 0.00 175.26 173.90 2wzi n GLY 135 N 6.74 0.83 3.97 -1.50 0.00 -1.26 -0.80 105.19 113.17 2wzi n GLY 135 Ca 0.30 -0.23 -0.22 0.00 0.00 0.00 0.00 46.02 45.87 2wzi n GLY 135 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2wzi s PHE 136 N -0.70 2.94 0.13 1.61 -0.12 -1.26 -4.49 117.98 116.08 2wzi s PHE 136 Ca 0.07 0.07 -0.11 0.00 -0.05 0.00 0.00 56.93 56.91 2wzi s PHE 136 Cb 0.06 -2.70 -0.06 0.00 -0.63 0.00 0.00 43.02 39.68 2wzi s PHE 136 CO 0.01 -0.81 0.47 0.71 -0.05 0.00 0.00 175.22 175.54 2wzi s TYR 137 N -2.76 3.55 0.00 3.49 2.02 -1.26 -1.55 117.35 120.84 2wzi s TYR 137 Ca 0.56 0.87 0.00 0.00 -0.37 0.00 0.00 57.07 58.12 2wzi s TYR 137 Cb -0.10 -2.23 0.00 0.00 -0.40 0.00 0.00 41.96 39.23 2wzi s TYR 137 CO 0.39 0.44 0.00 0.41 -1.57 0.00 0.00 175.55 175.22 2wzi n GLY 138 N 0.61 0.25 3.61 0.71 0.00 -1.26 -4.72 105.19 104.41 2wzi n GLY 138 Ca -0.05 -2.30 -0.43 0.00 0.00 0.00 0.00 46.02 43.24 2wzi n GLY 138 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wzi s THR 139 N -0.25 3.05 0.60 2.61 2.01 -1.26 -4.56 115.64 117.84 2wzi s THR 139 Ca 0.00 0.05 -0.18 0.00 0.31 0.00 0.00 61.69 61.87 2wzi s THR 139 Cb 0.00 -3.06 -0.05 0.00 0.01 0.00 0.00 72.50 69.40 2wzi s THR 139 CO 0.00 -0.03 0.86 -2.65 -0.69 0.00 0.00 174.62 172.11 2wzi n PRO 140 N 8.48 0.78 -1.67 4.92 -0.02 -1.26 -4.82 135.00 141.41 2wzi n PRO 140 Ca 0.27 0.31 -0.43 0.00 -2.02 0.00 0.00 63.50 61.63 2wzi n PRO 140 Cb 0.44 -2.06 -0.01 0.00 -0.02 0.00 0.00 33.50 31.85 2wzi n PRO 140 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 2wzi n TRP 141 N -1.77 2.03 -0.78 6.00 8.01 -1.26 -4.96 117.44 124.71 2wzi n TRP 141 Ca 0.13 0.59 -0.30 0.00 -1.31 0.00 0.00 57.50 56.61 2wzi n TRP 141 Cb 0.48 -2.38 0.17 0.00 -2.01 0.00 0.00 31.31 27.57 2wzi n TRP 141 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.69 175.14 2wzi s SER 142 N -0.35 2.85 0.15 -0.99 1.04 -1.26 -4.78 113.70 110.35 2wzi s SER 142 Ca 0.57 2.00 -0.16 0.00 0.48 0.00 0.00 55.95 58.83 2wzi s SER 142 Cb -0.60 -2.50 0.01 0.00 0.10 0.00 0.00 66.02 63.02 2wzi s SER 142 CO 0.61 -3.11 1.78 -0.74 0.98 0.00 0.00 173.24 172.76 2wzi h HIS 143 N -1.88 0.52 -0.66 5.02 2.76 -1.99 -0.63 115.15 118.29 2wzi h HIS 143 Ca -0.46 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 57.69 2wzi h HIS 143 Cb 1.27 -0.17 -0.03 0.00 1.55 0.00 0.00 27.41 30.03 2wzi h HIS 143 CO 0.47 0.36 0.34 1.96 -1.30 0.00 0.00 177.93 179.76 2wzi h GLN 144 N 0.52 0.92 -0.50 5.26 1.08 -2.00 -0.95 115.11 119.45 2wzi h GLN 144 Ca 0.14 -0.11 -0.02 0.00 -1.45 0.00 0.00 58.65 57.21 2wzi h GLN 144 Cb -0.01 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.22 2wzi h GLN 144 CO -0.03 0.70 0.22 0.00 -0.95 0.00 0.00 178.83 178.76 2wzi h ALA 145 N 1.45 0.65 -0.71 3.87 0.00 -1.80 -2.19 119.26 120.52 2wzi h ALA 145 Ca 0.23 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2wzi h ALA 145 Cb 0.06 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2wzi h ALA 145 CO -0.03 0.23 0.35 0.00 0.00 0.00 0.00 179.25 179.80 2wzi h ARG 146 N 0.66 1.01 -0.77 0.00 3.08 -0.65 -0.94 114.38 116.77 2wzi h ARG 146 Ca 0.17 -0.13 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 2wzi h ARG 146 Cb 0.16 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 29.99 2wzi h ARG 146 CO -0.02 0.77 0.34 -0.07 -1.07 0.00 0.00 179.97 179.93 2wzi h LEU 147 N 1.01 1.03 -0.30 3.04 3.38 -0.95 -2.12 115.31 120.41 2wzi h LEU 147 Ca 0.25 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 2wzi h LEU 147 Cb 0.09 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2wzi h LEU 147 CO -0.03 0.90 0.08 -1.28 0.09 0.00 0.00 178.44 178.20 2wzi h SER 148 N 1.10 0.44 -0.28 -0.43 0.87 -0.99 -3.06 113.55 111.20 2wzi h SER 148 Ca 0.26 -0.22 0.06 0.00 -1.23 0.00 0.00 61.79 60.67 2wzi h SER 148 Cb 0.16 -0.12 -0.06 0.00 -0.44 0.00 0.00 62.40 61.95 2wzi h SER 148 CO -0.03 0.54 -0.10 1.56 -0.53 0.00 0.00 176.83 178.27 2wzi h GLN 149 N 0.32 -0.05 -0.55 2.24 1.08 -0.98 -2.30 115.11 114.87 2wzi h GLN 149 Ca 0.09 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 2wzi h GLN 149 Cb 0.26 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.68 2wzi h GLN 149 CO -0.00 -0.03 0.36 -0.07 -0.95 0.00 0.00 178.83 178.14 2wzi h LEU 150 N -0.05 0.63 -0.63 1.46 3.38 -1.33 0.24 115.31 119.02 2wzi h LEU 150 Ca 0.14 -0.02 -0.14 0.00 0.09 0.00 0.00 57.88 57.96 2wzi h LEU 150 Cb 0.26 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2wzi h LEU 150 CO -0.32 0.46 -0.39 0.11 0.09 0.00 0.00 178.44 178.39 2wzi h LYS 151 N 0.75 0.63 -0.36 1.13 1.57 -1.41 -2.49 116.57 116.39 2wzi h LYS 151 Ca 0.20 -0.32 -0.08 0.00 -1.87 0.00 0.00 60.65 58.58 2wzi h LYS 151 Cb -0.08 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 2wzi h LYS 151 CO -0.04 0.92 -0.09 0.35 -0.57 0.00 0.00 179.45 180.02 2wzi h PHE 152 N 0.52 0.78 -0.61 -1.35 3.57 -0.56 -2.68 116.94 116.61 2wzi h PHE 152 Ca 0.05 -0.17 0.04 0.00 3.53 0.00 0.00 57.97 61.42 2wzi h PHE 152 Cb 0.91 -0.19 -0.04 0.00 2.79 0.00 0.00 35.95 39.42 2wzi h PHE 152 CO 0.04 0.85 0.36 1.88 -2.23 0.00 0.00 178.31 179.20 2wzi h TYR 153 N 0.49 0.66 -0.42 0.41 0.05 -0.43 -2.57 116.97 115.16 2wzi h TYR 153 Ca 0.09 0.02 0.04 0.00 0.05 0.00 0.00 58.73 58.93 2wzi h TYR 153 Cb 0.59 -0.21 -0.04 0.00 1.01 0.00 0.00 36.73 38.09 2wzi h TYR 153 CO 0.05 0.36 0.19 0.78 -1.05 0.00 0.00 178.16 178.49 2wzi h GLY 154 N 0.69 0.57 2.00 3.88 0.00 -1.33 -0.31 103.07 108.56 2wzi h GLY 154 Ca 0.26 -0.13 -0.03 0.00 0.00 0.00 0.00 47.33 47.43 2wzi h GLY 154 CO -0.13 0.08 -0.13 0.50 0.00 0.00 0.00 176.54 176.86 2wzi h LYS 155 N 0.39 0.00 -0.46 4.80 1.57 -1.19 -2.99 116.57 118.69 2wzi h LYS 155 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2wzi h LYS 155 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 2wzi h LYS 155 CO -0.15 0.13 0.00 0.09 -0.57 0.00 0.00 179.45 178.95 2wzi n ASN 156 N -3.68 3.30 -1.79 0.86 4.13 -0.82 -4.90 115.26 112.36 2wzi n ASN 156 Ca -0.02 -2.04 -0.15 0.00 1.68 0.00 0.00 54.58 54.04 2wzi n ASN 156 Cb 0.24 -0.32 -0.01 0.00 -1.54 0.00 0.00 39.78 38.16 2wzi n ASN 156 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2wzi n LYS 157 N 0.81 -1.39 -3.12 3.52 5.02 -0.38 -4.63 118.16 118.00 2wzi n LYS 157 Ca 0.16 0.74 -0.39 0.00 -2.02 0.00 0.00 58.31 56.80 2wzi n LYS 157 Cb 0.51 -5.10 -0.05 0.00 -0.02 0.00 0.00 35.03 30.37 2wzi n LYS 157 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2wzi s MET 158 N -4.81 4.39 0.00 1.97 -1.94 -0.27 -4.91 119.30 113.74 2wzi s MET 158 Ca 0.01 0.83 0.05 0.00 -1.71 0.00 0.00 55.69 54.87 2wzi s MET 158 Cb -0.01 -3.38 0.12 0.00 2.01 0.00 0.00 34.83 33.57 2wzi s MET 158 CO 0.02 0.25 1.04 0.27 -0.01 0.00 0.00 175.02 176.59 2wzi n ASN 159 N 3.11 2.25 -3.87 3.03 0.23 0.79 -4.31 115.26 116.49 2wzi n ASN 159 Ca -0.04 -1.87 -0.19 0.00 -0.53 0.00 0.00 54.58 51.94 2wzi n ASN 159 Cb 0.51 -0.09 -0.16 0.00 -2.08 0.00 0.00 39.78 37.96 2wzi n ASN 159 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 2wzi s THR 160 N -0.90 0.42 -0.21 5.53 2.01 -0.82 -0.41 115.64 121.25 2wzi s THR 160 Ca 0.10 -0.06 -0.02 0.00 0.31 0.00 0.00 61.69 62.02 2wzi s THR 160 Cb 0.05 -0.47 0.06 0.00 0.01 0.00 0.00 72.50 72.15 2wzi s THR 160 CO 0.07 0.20 0.01 -0.47 -0.69 0.00 0.00 174.62 173.74 2wzi s TYR 161 N 0.96 1.48 -0.32 4.92 5.04 -0.58 -2.24 117.35 126.61 2wzi s TYR 161 Ca -0.11 -1.18 -0.16 0.00 -2.44 0.00 0.00 57.07 53.19 2wzi s TYR 161 Cb -0.14 -1.23 -0.02 0.00 0.35 0.00 0.00 41.96 40.92 2wzi s TYR 161 CO -0.00 -0.67 0.40 0.42 -1.34 0.00 0.00 175.55 174.35 2wzi s ILE 162 N 1.70 5.14 -0.38 3.14 1.01 0.41 -0.01 121.20 132.21 2wzi s ILE 162 Ca -0.02 0.27 -0.23 0.00 0.00 0.00 0.00 60.65 60.68 2wzi s ILE 162 Cb -0.18 -3.81 0.01 0.00 0.01 0.00 0.00 42.46 38.49 2wzi s ILE 162 CO -0.08 -0.04 0.75 -0.47 0.00 0.00 0.00 174.94 175.10 2wzi s TYR 163 N 2.11 3.09 -0.39 3.97 5.04 0.40 -1.08 117.35 130.49 2wzi s TYR 163 Ca 0.14 0.41 0.10 0.00 -2.44 0.00 0.00 57.07 55.29 2wzi s TYR 163 Cb -0.16 -3.41 0.40 0.00 0.35 0.00 0.00 41.96 39.14 2wzi s TYR 163 CO 0.11 -0.77 1.31 0.41 -1.34 0.00 0.00 175.55 175.27 2wzi n GLY 164 N 4.67 1.37 3.68 8.97 0.00 0.02 -1.38 105.19 122.52 2wzi n GLY 164 Ca 0.02 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 2wzi n GLY 164 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wzi s PRO 165 N -0.22 4.17 0.57 1.61 0.04 -0.81 -4.10 135.00 136.26 2wzi s PRO 165 Ca 0.22 2.46 0.27 0.00 0.04 0.00 0.00 61.00 63.99 2wzi s PRO 165 Cb 0.41 -3.71 1.59 0.00 0.04 0.00 0.00 34.50 32.83 2wzi s PRO 165 CO -0.08 -0.82 2.12 0.87 0.04 0.00 0.00 177.00 179.14 2wzi h LYS 166 N 8.84 0.00 -0.51 4.56 1.79 -1.51 -1.76 116.57 127.99 2wzi h LYS 166 Ca -0.45 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.02 2wzi h LYS 166 Cb 1.21 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.86 2wzi h LYS 166 CO 0.94 0.00 0.00 -0.25 -1.08 0.00 0.00 179.45 179.06 2wzi n ASP 167 N -3.99 5.03 -4.60 0.86 8.00 -1.26 -4.70 116.55 115.89 2wzi n ASP 167 Ca 0.01 -2.83 -0.42 0.00 0.71 0.00 0.00 54.79 52.26 2wzi n ASP 167 Cb 0.29 -0.62 -0.04 0.00 -0.02 0.00 0.00 41.12 40.73 2wzi n ASP 167 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2wzi s ASP 168 N -1.10 6.66 0.46 -2.24 2.15 -0.66 -4.94 116.67 117.00 2wzi s ASP 168 Ca 0.50 0.57 0.31 0.00 0.43 0.00 0.00 52.55 54.36 2wzi s ASP 168 Cb 0.37 -2.44 1.24 0.00 -0.30 0.00 0.00 42.92 41.80 2wzi s ASP 168 CO 0.16 -0.77 1.90 1.55 -0.17 0.00 0.00 175.17 177.84 2wzi h PRO 169 N 8.37 0.00 -0.00 4.34 0.13 -1.88 -1.45 132.00 141.51 2wzi h PRO 169 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2wzi h PRO 169 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2wzi h PRO 169 CO 0.94 0.00 -0.11 0.66 -0.23 0.00 0.00 178.00 179.27 2wzi n TYR 170 N -2.83 0.00 -0.12 1.56 4.01 -1.26 -2.91 117.16 115.61 2wzi n TYR 170 Ca 0.01 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.54 2wzi n TYR 170 Cb 0.29 -0.18 -0.12 0.00 -0.31 0.00 0.00 39.34 39.02 2wzi n TYR 170 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 2wzi n HIS 171 N -0.95 0.14 -3.52 -0.72 -0.00 -0.58 -4.11 115.22 105.46 2wzi n HIS 171 Ca 0.14 0.04 0.00 0.00 0.46 0.00 0.00 57.72 58.36 2wzi n HIS 171 Cb 0.28 -1.02 0.00 0.00 -0.12 0.00 0.00 29.99 29.13 2wzi n HIS 171 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2wzi n SER 172 N -3.54 1.30 -4.83 0.26 2.88 -0.96 -0.03 113.62 108.70 2wzi n SER 172 Ca -0.46 -0.87 -0.33 0.00 -1.33 0.00 0.00 58.87 55.87 2wzi n SER 172 Cb 0.96 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 64.36 2wzi n SER 172 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wzi s ALA 173 N -2.00 3.16 -1.27 -1.46 0.00 -1.23 -1.39 121.76 117.57 2wzi s ALA 173 Ca 0.00 0.26 0.26 0.00 0.00 0.00 0.00 51.96 52.48 2wzi s ALA 173 Cb 0.00 -3.00 0.65 0.00 0.00 0.00 0.00 23.12 20.77 2wzi s ALA 173 CO 0.00 0.21 1.51 -0.35 0.00 0.00 0.00 175.76 177.13 2wzi n PRO 174 N -0.47 0.29 -0.11 0.00 -0.04 -1.26 -4.86 135.00 128.54 2wzi n PRO 174 Ca 0.05 -0.16 0.05 0.00 -0.04 0.00 0.00 63.50 63.40 2wzi n PRO 174 Cb 0.53 -1.50 0.15 0.00 -0.04 0.00 0.00 33.50 32.65 2wzi n PRO 174 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2wzi n ASN 175 N -1.21 1.25 0.10 3.54 3.02 -1.13 -3.45 115.26 117.37 2wzi n ASN 175 Ca 0.08 -1.95 0.17 0.00 -0.03 0.00 0.00 54.58 52.86 2wzi n ASN 175 Cb 0.34 -0.15 0.72 0.00 -0.61 0.00 0.00 39.78 40.08 2wzi n ASN 175 CO 0.00 0.00 0.00 4.11 -2.62 0.00 0.00 177.26 178.75 2wzi h TRP 176 N 1.39 0.00 0.00 3.10 5.08 -1.10 -0.01 115.95 124.42 2wzi h TRP 176 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2wzi h TRP 176 Cb 0.32 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.48 2wzi h TRP 176 CO 0.15 0.00 0.00 0.00 -1.28 0.00 0.00 178.44 177.31 2wzi h ARG 177 N 0.00 0.00 -5.54 0.12 3.08 -1.85 -3.45 114.38 106.74 2wzi h ARG 177 Ca 0.17 0.00 -0.64 0.00 0.07 0.00 0.00 59.98 59.57 2wzi h ARG 177 Cb 0.73 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.65 2wzi h ARG 177 CO -0.00 0.00 -0.54 -1.17 -1.07 0.00 0.00 179.97 177.19 2wzi s LEU 178 N -5.07 4.02 0.54 3.04 2.96 -0.02 -4.85 118.68 119.30 2wzi s LEU 178 Ca 0.03 0.25 -0.20 0.00 -0.22 0.00 0.00 54.13 53.99 2wzi s LEU 178 Cb 0.09 -1.99 -0.05 0.00 0.50 0.00 0.00 46.19 44.74 2wzi s LEU 178 CO 0.45 0.30 1.17 -2.16 -1.32 0.00 0.00 176.35 174.79 2wzi s PRO 179 N -0.37 3.32 0.38 0.98 0.04 -1.26 -4.89 135.00 133.19 2wzi s PRO 179 Ca 0.10 1.74 -0.26 0.00 0.04 0.00 0.00 61.00 62.62 2wzi s PRO 179 Cb -0.12 -2.08 -0.11 0.00 0.04 0.00 0.00 34.50 32.23 2wzi s PRO 179 CO 0.02 -0.91 1.18 0.66 0.04 0.00 0.00 177.00 177.98 2wzi n TYR 180 N -1.20 1.82 -0.62 0.56 4.01 -1.26 -4.97 117.16 115.50 2wzi n TYR 180 Ca 0.11 0.56 -0.29 0.00 -0.16 0.00 0.00 57.90 58.12 2wzi n TYR 180 Cb 0.50 -2.33 0.22 0.00 -0.31 0.00 0.00 39.34 37.41 2wzi n TYR 180 CO 0.00 0.00 0.00 -2.14 -0.46 0.00 0.00 176.86 174.26 2wzi s PRO 181 N -1.97 -0.12 0.19 -0.72 0.02 -1.26 -4.68 135.00 126.46 2wzi s PRO 181 Ca 0.59 1.13 -0.13 0.00 0.02 0.00 0.00 61.00 62.62 2wzi s PRO 181 Cb -0.56 -1.63 0.19 0.00 0.02 0.00 0.00 34.50 32.52 2wzi s PRO 181 CO 0.59 -3.27 1.73 -0.44 -0.33 0.00 0.00 177.00 175.28 2wzi h ASP 182 N -2.31 0.07 0.19 2.53 3.32 -1.99 -1.01 116.42 117.22 2wzi h ASP 182 Ca -0.54 0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.59 2wzi h ASP 182 Cb 1.31 0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.93 2wzi h ASP 182 CO 0.47 0.06 -0.19 0.50 -1.72 0.00 0.00 179.24 178.36 2wzi h LYS 183 N 0.28 -0.40 -0.66 3.56 1.63 -2.00 -1.37 116.57 117.60 2wzi h LYS 183 Ca 0.25 0.03 -0.03 0.00 -0.85 0.00 0.00 60.65 60.05 2wzi h LYS 183 Cb 0.32 0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 32.01 2wzi h LYS 183 CO -0.30 -0.27 0.29 0.93 -3.45 0.00 0.00 179.45 176.65 2wzi h GLU 184 N -0.42 0.95 -0.49 1.90 3.07 -1.87 -2.31 114.58 115.41 2wzi h GLU 184 Ca 0.00 -0.14 -0.07 0.00 -0.50 0.00 0.00 59.36 58.65 2wzi h GLU 184 Cb 0.39 -0.17 -0.02 0.00 -0.84 0.00 0.00 28.75 28.11 2wzi h GLU 184 CO -0.05 0.76 0.03 0.00 -1.40 0.00 0.00 179.01 178.36 2wzi h ALA 185 N 1.37 0.66 -0.45 3.43 0.00 -0.88 0.31 119.26 123.71 2wzi h ALA 185 Ca 0.23 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 2wzi h ALA 185 Cb 0.14 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2wzi h ALA 185 CO -0.02 0.43 0.03 0.00 0.00 0.00 0.00 179.25 179.69 2wzi h ALA 186 N 0.94 1.22 -0.01 0.00 0.00 -1.13 -0.40 119.26 119.88 2wzi h ALA 186 Ca 0.14 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2wzi h ALA 186 Cb 0.47 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2wzi h ALA 186 CO 0.02 0.52 0.00 1.96 0.00 0.00 0.00 179.25 181.75 2wzi h GLN 187 N 0.68 0.01 -0.94 0.00 4.20 -0.97 -1.71 115.11 116.37 2wzi h GLN 187 Ca 0.14 -0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.90 2wzi h GLN 187 Cb 0.37 -0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.09 2wzi h GLN 187 CO 0.01 0.28 0.60 -0.07 -0.67 0.00 0.00 178.83 178.98 2wzi h LEU 188 N -0.25 0.98 -0.18 1.46 3.38 -0.75 0.15 115.31 120.10 2wzi h LEU 188 Ca 0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 2wzi h LEU 188 Cb 0.27 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 2wzi h LEU 188 CO 0.00 0.64 -0.14 -0.61 0.09 0.00 0.00 178.44 178.43 2wzi h GLN 189 N 1.12 -0.14 -0.69 1.13 4.15 -1.00 -0.19 115.11 119.50 2wzi h GLN 189 Ca 0.39 0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.83 2wzi h GLN 189 Cb 0.10 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 27.79 2wzi h GLN 189 CO -0.15 -0.09 0.45 1.49 -1.93 0.00 0.00 178.83 178.60 2wzi h GLU 190 N -0.14 0.89 -0.93 1.69 4.81 -0.67 -1.52 114.58 118.71 2wzi h GLU 190 Ca 0.11 -0.05 0.11 0.00 -0.13 0.00 0.00 59.36 59.39 2wzi h GLU 190 Cb 0.30 -0.20 -0.07 0.00 0.63 0.00 0.00 28.75 29.41 2wzi h GLU 190 CO -0.26 0.59 0.60 -0.07 -0.73 0.00 0.00 179.01 179.13 2wzi h LEU 191 N 0.92 0.83 -0.27 1.64 3.38 0.09 -1.35 115.31 120.55 2wzi h LEU 191 Ca 0.26 0.03 -0.16 0.00 0.09 0.00 0.00 57.88 58.09 2wzi h LEU 191 Cb -0.09 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.52 2wzi h LEU 191 CO -0.06 0.47 -0.47 0.58 0.09 0.00 0.00 178.44 179.05 2wzi h VAL 192 N 0.91 1.29 0.12 1.22 2.07 -0.60 0.05 116.25 121.31 2wzi h VAL 192 Ca 0.44 -1.66 -0.01 0.00 0.82 0.00 0.00 66.70 66.29 2wzi h VAL 192 Cb 0.45 1.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 2wzi h VAL 192 CO -0.20 0.54 -0.06 0.00 0.02 0.00 0.00 177.57 177.87 2wzi h ALA 193 N 0.67 -0.16 -0.73 1.67 0.00 -0.72 0.14 119.26 120.14 2wzi h ALA 193 Ca 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2wzi h ALA 193 Cb 1.07 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 2wzi h ALA 193 CO 0.11 -0.58 0.46 0.28 0.00 0.00 0.00 179.25 179.52 2wzi h VAL 194 N -0.18 1.20 -0.35 0.00 2.07 -1.26 -1.65 116.25 116.09 2wzi h VAL 194 Ca -0.02 -0.41 0.05 0.00 0.82 0.00 0.00 66.70 67.15 2wzi h VAL 194 Cb 0.14 0.16 -0.05 0.00 -1.52 0.00 0.00 31.29 30.02 2wzi h VAL 194 CO 0.03 0.20 0.07 0.00 0.02 0.00 0.00 177.57 177.88 2wzi h ALA 195 N 1.25 0.37 -0.99 1.67 0.00 -0.71 -2.46 119.26 118.38 2wzi h ALA 195 Ca 0.26 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.25 2wzi h ALA 195 Cb -0.07 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 2wzi h ALA 195 CO -0.05 -0.34 0.65 -0.91 0.00 0.00 0.00 179.25 178.60 2wzi h ASN 196 N 0.18 1.14 0.46 0.00 2.35 -0.13 0.22 115.58 119.81 2wzi h ASN 196 Ca 0.17 -0.03 -0.06 0.00 -0.55 0.00 0.00 56.30 55.82 2wzi h ASN 196 Cb 0.19 -0.29 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 2wzi h ASN 196 CO -0.22 0.83 -0.28 -0.33 -1.65 0.00 0.00 177.43 175.78 2wzi h GLU 197 N 1.35 0.00 -0.67 0.81 5.08 -1.00 -2.50 114.58 117.65 2wzi h GLU 197 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 2wzi h GLU 197 Cb -0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.10 2wzi h GLU 197 CO -0.08 0.28 0.00 0.09 -1.00 0.00 0.00 179.01 178.31 2wzi n ASN 198 N -3.86 3.85 -2.02 1.42 3.02 -0.91 -4.86 115.26 111.90 2wzi n ASN 198 Ca -0.02 -2.00 -0.17 0.00 -0.03 0.00 0.00 54.58 52.36 2wzi n ASN 198 Cb 0.37 -0.44 -0.00 0.00 -0.61 0.00 0.00 39.78 39.09 2wzi n ASN 198 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2wzi n GLU 199 N 1.59 -1.67 -3.95 3.52 -0.58 -0.68 -4.18 120.64 114.68 2wzi n GLU 199 Ca 0.23 0.82 -0.35 0.00 -0.42 0.00 0.00 57.16 57.45 2wzi n GLU 199 Cb 0.61 -5.28 -0.09 0.00 -0.57 0.00 0.00 31.44 26.11 2wzi n GLU 199 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2wzi s VAL 200 N -2.88 4.98 -0.28 2.62 1.01 -0.02 -4.61 120.40 121.22 2wzi s VAL 200 Ca 0.03 0.03 -0.29 0.00 0.00 0.00 0.00 61.98 61.75 2wzi s VAL 200 Cb -0.01 -3.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.12 2wzi s VAL 200 CO 0.03 0.48 1.57 -1.81 0.00 0.00 0.00 175.10 175.38 2wzi s ASP 201 N 0.12 6.33 -0.30 3.32 1.01 0.45 -3.93 116.67 123.67 2wzi s ASP 201 Ca 0.06 1.40 -0.29 0.00 0.71 0.00 0.00 52.55 54.43 2wzi s ASP 201 Cb -0.12 -2.53 0.01 0.00 1.01 0.00 0.00 42.92 41.28 2wzi s ASP 201 CO 0.00 -1.33 1.22 0.12 0.21 0.00 0.00 175.17 175.39 2wzi s PHE 202 N 5.40 2.85 -0.37 4.23 5.36 -1.26 -1.52 117.98 132.67 2wzi s PHE 202 Ca 0.69 0.98 -0.09 0.00 -0.96 0.00 0.00 56.93 57.55 2wzi s PHE 202 Cb -0.22 -3.82 0.04 0.00 -0.34 0.00 0.00 43.02 38.68 2wzi s PHE 202 CO 0.30 -1.39 0.17 0.08 -1.46 0.00 0.00 175.22 172.92 2wzi s VAL 203 N 4.07 4.24 -0.21 3.12 1.01 0.99 -3.60 120.40 130.02 2wzi s VAL 203 Ca 0.52 -1.02 -0.23 0.00 0.00 0.00 0.00 61.98 61.25 2wzi s VAL 203 Cb -0.15 -3.40 -0.02 0.00 0.00 0.00 0.00 36.38 32.81 2wzi s VAL 203 CO 0.20 -0.24 0.75 0.86 0.00 0.00 0.00 175.10 176.66 2wzi s TRP 204 N 1.48 3.36 0.20 5.22 -0.00 -0.48 -0.46 118.94 128.26 2wzi s TRP 204 Ca 0.01 1.07 0.04 0.00 -0.00 0.00 0.00 56.10 57.21 2wzi s TRP 204 Cb -0.20 -2.94 -0.03 0.00 -0.00 0.00 0.00 33.47 30.30 2wzi s TRP 204 CO 0.05 -0.28 0.30 0.00 -0.00 0.00 0.00 176.95 177.02 2wzi s ALA 205 N 2.33 3.89 0.08 5.86 0.00 -0.48 -1.62 121.76 131.83 2wzi s ALA 205 Ca 0.33 -1.16 0.05 0.00 0.00 0.00 0.00 51.96 51.18 2wzi s ALA 205 Cb -0.16 -1.69 -0.03 0.00 0.00 0.00 0.00 23.12 21.24 2wzi s ALA 205 CO 0.10 0.39 -0.14 -1.50 0.00 0.00 0.00 175.76 174.60 2wzi s ILE 206 N -1.87 1.18 -0.54 0.00 2.07 -0.24 -4.79 121.20 117.01 2wzi s ILE 206 Ca 0.34 -1.41 0.06 0.00 -1.41 0.00 0.00 60.65 58.23 2wzi s ILE 206 Cb -0.10 -1.20 0.21 0.00 0.13 0.00 0.00 42.46 41.51 2wzi s ILE 206 CO 0.28 -0.26 0.53 1.57 -1.91 0.00 0.00 174.94 175.15 2wzi n HIS 207 N 1.10 1.49 1.03 3.50 -0.00 0.96 -0.36 115.22 122.94 2wzi n HIS 207 Ca -0.20 -3.85 0.11 0.00 -0.00 0.00 0.00 57.72 53.78 2wzi n HIS 207 Cb 0.55 -0.33 0.03 0.00 -0.00 0.00 0.00 29.99 30.24 2wzi n HIS 207 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 2wzi n PRO 208 N 1.74 0.62 0.26 1.57 -0.04 -1.26 -3.54 135.00 134.35 2wzi n PRO 208 Ca 0.25 -0.49 0.14 0.00 -0.04 0.00 0.00 63.50 63.37 2wzi n PRO 208 Cb 0.44 -1.49 0.64 0.00 -0.04 0.00 0.00 33.50 33.05 2wzi n PRO 208 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2wzi h GLY 209 N 4.93 0.00 1.66 0.55 0.00 -1.91 -2.15 103.07 106.15 2wzi h GLY 209 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 2wzi h GLY 209 CO 0.00 0.00 -0.05 -1.61 0.00 0.00 0.00 176.54 174.88 2wzi h GLN 210 N 0.00 0.42 0.00 4.80 5.75 -1.85 -3.31 115.11 120.92 2wzi h GLN 210 Ca -0.00 -0.09 0.00 0.00 -0.15 0.00 0.00 58.65 58.41 2wzi h GLN 210 Cb 0.54 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.03 2wzi h GLN 210 CO 0.01 0.49 -0.05 -0.40 -2.65 0.00 0.00 178.83 176.23 2wzi n ASP 211 N -4.27 1.20 -4.77 -0.69 5.75 -1.17 -4.88 116.55 107.71 2wzi n ASP 211 Ca 0.01 -1.84 -0.41 0.00 -0.01 0.00 0.00 54.79 52.54 2wzi n ASP 211 Cb 0.26 -0.08 -0.01 0.00 -1.03 0.00 0.00 41.12 40.26 2wzi n ASP 211 CO 0.00 0.00 0.00 -0.51 -0.11 0.00 0.00 177.20 176.58 2wzi s ILE 212 N -0.84 2.19 -0.05 2.12 2.07 -0.82 -5.01 121.20 120.86 2wzi s ILE 212 Ca 0.05 0.19 -0.03 0.00 -1.41 0.00 0.00 60.65 59.44 2wzi s ILE 212 Cb 0.04 -3.12 -0.04 0.00 0.13 0.00 0.00 42.46 39.47 2wzi s ILE 212 CO 0.00 0.04 0.10 -0.54 -1.91 0.00 0.00 174.94 172.64 2wzi s LYS 213 N -1.90 3.24 -1.34 3.50 -0.14 -1.26 -4.67 119.74 117.17 2wzi s LYS 213 Ca 0.53 -0.33 -0.08 0.00 -1.36 0.00 0.00 55.97 54.73 2wzi s LYS 213 Cb -0.45 -2.99 0.12 0.00 -1.68 0.00 0.00 37.83 32.82 2wzi s LYS 213 CO 0.60 0.70 2.20 0.91 -0.76 0.00 0.00 175.35 179.01 2wzi n TRP 214 N 1.55 2.77 -4.42 3.18 5.03 -1.26 -4.59 117.44 119.70 2wzi n TRP 214 Ca -0.16 -2.84 -0.22 0.00 3.03 0.00 0.00 57.50 57.32 2wzi n TRP 214 Cb 0.54 -1.98 -0.09 0.00 -1.03 0.00 0.00 31.31 28.75 2wzi n TRP 214 CO 0.00 0.00 0.00 0.54 -0.03 0.00 0.00 177.69 178.20 2wzi s ASN 215 N 0.88 2.16 0.24 -0.99 2.20 -1.26 -5.07 114.94 113.10 2wzi s ASN 215 Ca 0.49 -1.58 -0.05 0.00 -0.94 0.00 0.00 52.86 50.78 2wzi s ASN 215 Cb 0.14 0.36 0.25 0.00 -2.00 0.00 0.00 41.25 40.00 2wzi s ASN 215 CO -0.05 -0.87 1.75 0.50 -2.94 0.00 0.00 177.10 175.49 2wzi h LYS 216 N 2.03 0.95 -0.19 3.55 3.64 -2.00 -2.88 116.57 121.67 2wzi h LYS 216 Ca -0.35 -0.24 0.04 0.00 -1.27 0.00 0.00 60.65 58.83 2wzi h LYS 216 Cb 1.26 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.92 2wzi h LYS 216 CO 0.56 0.89 -0.05 1.49 -2.27 0.00 0.00 179.45 180.07 2wzi h GLU 217 N 0.90 0.00 -0.10 1.90 4.81 -1.97 -1.59 114.58 118.53 2wzi h GLU 217 Ca 0.18 -0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.22 2wzi h GLU 217 Cb 0.40 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.78 2wzi h GLU 217 CO 0.01 0.00 -0.73 -0.44 -0.73 0.00 0.00 179.01 177.13 2wzi h ASP 218 N 0.00 0.58 0.07 1.04 5.19 -1.80 -2.07 116.42 119.43 2wzi h ASP 218 Ca 0.09 -0.38 0.01 0.00 -0.62 0.00 0.00 57.03 56.14 2wzi h ASP 218 Cb 0.14 -0.17 -0.02 0.00 0.18 0.00 0.00 39.33 39.46 2wzi h ASP 218 CO -0.20 1.13 -0.12 -0.09 -3.12 0.00 0.00 179.24 176.84 2wzi h ARG 219 N 0.34 -0.24 -0.89 3.56 2.43 -1.36 0.07 114.38 118.29 2wzi h ARG 219 Ca -0.03 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.17 2wzi h ARG 219 Cb 1.31 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 30.87 2wzi h ARG 219 CO 0.13 -0.16 0.59 -0.44 -1.51 0.00 0.00 179.97 178.58 2wzi h ASP 220 N -0.24 1.01 -0.59 -3.80 3.32 -1.29 0.19 116.42 115.01 2wzi h ASP 220 Ca 0.02 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 2wzi h ASP 220 Cb 0.26 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 2wzi h ASP 220 CO -0.07 0.72 0.27 -0.07 -1.72 0.00 0.00 179.24 178.38 2wzi h LEU 221 N 1.19 0.79 0.36 1.55 3.38 -1.16 0.58 115.31 122.00 2wzi h LEU 221 Ca 0.33 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 2wzi h LEU 221 Cb -0.11 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 2wzi h LEU 221 CO -0.08 0.71 -0.23 0.25 0.09 0.00 0.00 178.44 179.18 2wzi h LEU 222 N 0.81 -0.59 -0.81 1.67 6.46 -0.51 0.11 115.31 122.45 2wzi h LEU 222 Ca 0.20 0.04 0.05 0.00 -0.12 0.00 0.00 57.88 58.05 2wzi h LEU 222 Cb 0.14 0.18 -0.06 0.00 -0.73 0.00 0.00 40.66 40.19 2wzi h LEU 222 CO -0.02 -0.37 0.50 -0.07 -0.62 0.00 0.00 178.44 177.86 2wzi h LEU 223 N -0.58 0.80 -0.99 2.25 -0.00 -0.79 -0.56 115.31 115.46 2wzi h LEU 223 Ca -0.04 0.01 -0.00 0.00 -0.00 0.00 0.00 57.88 57.85 2wzi h LEU 223 Cb 0.48 -0.16 -0.05 0.00 -0.00 0.00 0.00 40.66 40.94 2wzi h LEU 223 CO 0.03 0.53 0.59 0.00 -0.00 0.00 0.00 178.44 179.59 2wzi h ALA 224 N 1.37 1.25 -0.49 1.53 0.00 0.39 0.10 119.26 123.40 2wzi h ALA 224 Ca 0.34 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 2wzi h ALA 224 Cb 0.11 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2wzi h ALA 224 CO -0.15 0.66 0.24 -0.22 0.00 0.00 0.00 179.25 179.78 2wzi h LYS 225 N 1.31 0.71 -0.79 0.00 1.63 -0.20 -1.18 116.57 118.05 2wzi h LYS 225 Ca 0.34 -0.10 -0.02 0.00 -0.85 0.00 0.00 60.65 60.03 2wzi h LYS 225 Cb -0.08 -0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 31.38 2wzi h LYS 225 CO -0.07 0.59 0.43 0.74 -3.45 0.00 0.00 179.45 177.69 2wzi h PHE 226 N 0.66 1.08 -0.50 1.91 -1.00 -0.69 -1.21 116.94 117.18 2wzi h PHE 226 Ca 0.17 -0.03 0.03 0.00 2.81 0.00 0.00 57.97 60.95 2wzi h PHE 226 Cb 0.11 -0.35 -0.04 0.00 3.61 0.00 0.00 35.95 39.28 2wzi h PHE 226 CO -0.01 0.76 0.29 1.49 -1.61 0.00 0.00 178.31 179.23 2wzi h GLU 227 N 1.09 0.56 -0.57 1.51 4.57 -0.53 0.21 114.58 121.41 2wzi h GLU 227 Ca 0.28 -0.03 0.06 0.00 -1.18 0.00 0.00 59.36 58.48 2wzi h GLU 227 Cb 0.03 -0.13 -0.05 0.00 -0.16 0.00 0.00 28.75 28.45 2wzi h GLU 227 CO -0.04 0.37 0.29 0.87 -1.18 0.00 0.00 179.01 179.31 2wzi h LYS 228 N 0.57 0.53 -0.70 1.92 1.79 -0.65 -1.39 116.57 118.65 2wzi h LYS 228 Ca 0.21 -0.03 -0.05 0.00 -2.18 0.00 0.00 60.65 58.60 2wzi h LYS 228 Cb 0.05 -0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 30.55 2wzi h LYS 228 CO -0.11 0.35 0.25 0.52 -1.08 0.00 0.00 179.45 179.38 2wzi h MET 229 N 0.54 1.07 -0.79 3.15 2.86 -0.72 -2.11 114.93 118.93 2wzi h MET 229 Ca 0.26 -0.21 0.11 0.00 -2.06 0.00 0.00 59.70 57.80 2wzi h MET 229 Cb 0.19 -0.16 -0.08 0.00 0.06 0.00 0.00 31.60 31.61 2wzi h MET 229 CO -0.19 0.90 0.42 -0.92 1.06 0.00 0.00 176.91 178.18 2wzi h TYR 230 N 1.01 0.75 -0.00 -0.22 3.20 -0.00 -1.85 116.97 119.86 2wzi h TYR 230 Ca 0.23 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.09 2wzi h TYR 230 Cb 0.26 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 2wzi h TYR 230 CO 0.02 0.26 -0.17 1.96 -1.64 0.00 0.00 178.16 178.59 2wzi h GLN 231 N 0.68 0.00 0.00 1.82 4.20 -0.62 -1.02 115.11 120.18 2wzi h GLN 231 Ca 0.40 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.11 2wzi h GLN 231 Cb 0.44 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.22 2wzi h GLN 231 CO -0.29 0.17 0.00 1.28 -0.67 0.00 0.00 178.83 179.33 2wzi n LEU 232 N -4.34 0.00 0.00 1.46 4.77 -0.76 -4.89 117.00 113.24 2wzi n LEU 232 Ca -0.02 0.34 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 2wzi n LEU 232 Cb 0.23 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 2wzi n LEU 232 CO 0.36 -0.11 0.00 0.61 -1.33 0.00 0.00 177.39 176.93 2wzi n GLY 233 N 0.50 0.72 3.76 -0.72 0.00 -0.39 -4.36 105.19 104.69 2wzi n GLY 233 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2wzi n GLY 233 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wzi s VAL 234 N -2.00 2.90 0.00 1.61 1.01 -0.81 -4.92 120.40 118.19 2wzi s VAL 234 Ca 0.00 0.86 0.00 0.00 0.00 0.00 0.00 61.98 62.84 2wzi s VAL 234 Cb 0.00 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.83 2wzi s VAL 234 CO 0.00 0.19 0.32 0.54 0.00 0.00 0.00 175.10 176.14 2wzi n ARG 235 N 1.32 0.05 -4.08 2.72 5.12 -1.26 -4.19 116.66 116.34 2wzi n ARG 235 Ca 0.02 -0.37 -0.13 0.00 -1.93 0.00 0.00 57.85 55.43 2wzi n ARG 235 Cb 0.42 -0.67 -0.12 0.00 -1.16 0.00 0.00 32.46 30.93 2wzi n ARG 235 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 2wzi s SER 236 N -0.10 0.81 -0.00 0.55 0.01 -1.24 -0.64 113.70 113.09 2wzi s SER 236 Ca 0.00 -0.47 -0.08 0.00 1.31 0.00 0.00 55.95 56.71 2wzi s SER 236 Cb 0.00 0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.25 2wzi s SER 236 CO 0.00 -0.16 0.15 -0.36 0.41 0.00 0.00 173.24 173.28 2wzi s PHE 237 N -1.17 0.01 0.02 2.43 0.08 -0.35 -1.38 117.98 117.62 2wzi s PHE 237 Ca -0.08 -0.06 -0.04 0.00 0.12 0.00 0.00 56.93 56.87 2wzi s PHE 237 Cb -0.09 -0.03 -0.01 0.00 -0.57 0.00 0.00 43.02 42.32 2wzi s PHE 237 CO 0.00 -0.27 0.06 0.00 -0.10 0.00 0.00 175.22 174.91 2wzi s ALA 238 N -1.25 -0.07 -0.15 5.36 0.00 -0.64 -1.40 121.76 123.61 2wzi s ALA 238 Ca -0.13 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 51.38 2wzi s ALA 238 Cb -0.07 0.17 0.02 0.00 0.00 0.00 0.00 23.12 23.24 2wzi s ALA 238 CO 0.02 -0.23 -0.14 0.08 0.00 0.00 0.00 175.76 175.48 2wzi s VAL 239 N -1.87 1.59 -0.16 0.00 1.01 -0.43 -1.07 120.40 119.46 2wzi s VAL 239 Ca -0.11 -0.64 -0.05 0.00 0.00 0.00 0.00 61.98 61.17 2wzi s VAL 239 Cb -0.06 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 2wzi s VAL 239 CO -0.01 0.46 0.01 -0.36 0.00 0.00 0.00 175.10 175.19 2wzi s PHE 240 N 1.48 3.13 -0.23 5.22 0.08 0.51 -1.98 117.98 126.20 2wzi s PHE 240 Ca 0.05 -0.10 0.11 0.00 0.12 0.00 0.00 56.93 57.11 2wzi s PHE 240 Cb -0.13 -1.99 0.44 0.00 -0.57 0.00 0.00 43.02 40.77 2wzi s PHE 240 CO -0.11 0.10 1.26 1.19 -0.10 0.00 0.00 175.22 177.56 2wzi n PHE 241 N 3.37 0.21 -2.90 0.36 3.72 -0.05 -4.03 117.46 118.14 2wzi n PHE 241 Ca -0.17 -1.53 -0.40 0.00 -0.05 0.00 0.00 57.45 55.30 2wzi n PHE 241 Cb 0.52 -0.29 -0.06 0.00 -0.94 0.00 0.00 39.48 38.71 2wzi n PHE 241 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 2wzi s ASP 242 N -3.12 7.46 -0.89 4.37 -4.77 -1.26 -3.27 116.67 115.19 2wzi s ASP 242 Ca 0.39 1.73 -0.01 0.00 -3.30 0.00 0.00 52.55 51.36 2wzi s ASP 242 Cb 0.38 -2.53 0.00 0.00 -1.09 0.00 0.00 42.92 39.67 2wzi s ASP 242 CO -0.06 0.17 0.75 0.59 0.70 0.00 0.00 175.17 177.32 2wzi n ASN 243 N 1.70 -2.50 -4.32 2.11 4.13 -1.26 -5.03 115.26 110.09 2wzi n ASN 243 Ca -0.04 -0.44 -0.17 0.00 1.68 0.00 0.00 54.58 55.61 2wzi n ASN 243 Cb 0.48 -3.87 -0.10 0.00 -1.54 0.00 0.00 39.78 34.75 2wzi n ASN 243 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 2wzi s ILE 244 N -3.26 0.92 0.22 2.41 -4.36 -1.26 -5.00 121.20 110.87 2wzi s ILE 244 Ca 0.06 -2.02 0.01 0.00 -0.26 0.00 0.00 60.65 58.45 2wzi s ILE 244 Cb -0.03 -2.37 -0.05 0.00 1.25 0.00 0.00 42.46 41.26 2wzi s ILE 244 CO 0.53 -0.29 0.07 -0.94 0.24 0.00 0.00 174.94 174.55 2wzi s SER 245 N -3.29 1.09 0.00 4.36 1.04 -1.26 -4.95 113.70 110.68 2wzi s SER 245 Ca 0.29 -1.31 0.00 0.00 0.48 0.00 0.00 55.95 55.41 2wzi s SER 245 Cb 0.06 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.35 2wzi s SER 245 CO 0.09 -0.69 0.00 0.61 0.98 0.00 0.00 173.24 174.23 2wzi n GLY 246 N -0.37 -1.05 0.24 7.32 0.00 -1.26 -4.42 105.19 105.64 2wzi n GLY 246 Ca -0.02 -1.49 0.09 0.00 0.00 0.00 0.00 46.02 44.60 2wzi n GLY 246 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2wzi h GLU 247 N 0.00 0.00 0.00 1.61 4.39 -1.92 -2.25 114.58 116.41 2wzi h GLU 247 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2wzi h GLU 247 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2wzi h GLU 247 CO 0.00 0.19 0.00 0.41 -1.16 0.00 0.00 179.01 178.45 2wzi n GLY 248 N -0.61 -0.57 0.70 -3.84 0.00 -1.25 -1.78 105.19 97.84 2wzi n GLY 248 Ca -0.02 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.10 2wzi n GLY 248 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wzi n THR 249 N -1.43 0.21 -2.03 2.61 -2.24 -0.85 -4.88 114.28 105.67 2wzi n THR 249 Ca 0.01 -0.42 -0.43 0.00 -2.27 0.00 0.00 64.05 60.94 2wzi n THR 249 Cb 0.04 0.62 -0.03 0.00 -2.10 0.00 0.00 70.33 68.87 2wzi n THR 249 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2wzi s ASN 250 N -1.68 6.17 0.25 3.42 3.84 -0.73 -4.92 114.94 121.29 2wzi s ASN 250 Ca 0.34 1.58 0.01 0.00 0.21 0.00 0.00 52.86 55.00 2wzi s ASN 250 Cb 0.19 -2.53 0.30 0.00 -0.55 0.00 0.00 41.25 38.66 2wzi s ASN 250 CO 0.29 -1.43 1.64 1.55 -2.79 0.00 0.00 177.10 176.36 2wzi h PRO 251 N 11.65 0.50 -0.57 0.43 0.13 -1.90 -1.04 132.00 141.20 2wzi h PRO 251 Ca -0.35 -0.23 -0.01 0.00 -0.87 0.00 0.00 66.00 64.54 2wzi h PRO 251 Cb 1.17 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.26 2wzi h PRO 251 CO 1.01 0.79 0.31 0.37 -0.23 0.00 0.00 178.00 180.25 2wzi h GLN 252 N 0.43 0.80 -0.30 0.86 4.15 -1.92 -1.08 115.11 118.05 2wzi h GLN 252 Ca 0.05 -0.10 -0.16 0.00 0.77 0.00 0.00 58.65 59.21 2wzi h GLN 252 Cb 0.82 -0.16 -0.00 0.00 0.21 0.00 0.00 27.48 28.35 2wzi h GLN 252 CO 0.07 0.62 -0.44 0.87 -1.93 0.00 0.00 178.83 178.02 2wzi h LYS 253 N 0.77 0.82 -0.11 1.69 1.79 -1.93 0.42 116.57 120.03 2wzi h LYS 253 Ca 0.20 -0.49 0.02 0.00 -2.18 0.00 0.00 60.65 58.21 2wzi h LYS 253 Cb 0.05 0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.73 2wzi h LYS 253 CO -0.03 1.12 -0.01 1.96 -1.08 0.00 0.00 179.45 181.40 2wzi h GLN 254 N 0.59 0.02 -0.16 3.15 4.20 -1.14 0.10 115.11 121.87 2wzi h GLN 254 Ca 0.03 -0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.77 2wzi h GLN 254 Cb 1.04 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.78 2wzi h GLN 254 CO 0.10 0.01 -0.01 0.00 -0.67 0.00 0.00 178.83 178.26 2wzi h ALA 255 N 1.10 0.13 -0.70 3.87 0.00 -0.99 -0.24 119.26 122.42 2wzi h ALA 255 Ca 0.05 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.07 2wzi h ALA 255 Cb 0.07 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 2wzi h ALA 255 CO -0.10 -0.45 0.41 0.93 0.00 0.00 0.00 179.25 180.03 2wzi h GLU 256 N 0.04 0.73 -0.11 0.00 5.08 -0.70 -0.09 114.58 119.53 2wzi h GLU 256 Ca 0.07 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2wzi h GLU 256 Cb 0.10 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.18 2wzi h GLU 256 CO -0.14 0.48 0.02 1.25 -1.00 0.00 0.00 179.01 179.63 2wzi h LEU 257 N 0.75 0.17 -0.93 1.33 5.85 -0.36 -0.28 115.31 121.84 2wzi h LEU 257 Ca 0.31 -0.25 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 2wzi h LEU 257 Cb 0.17 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 2wzi h LEU 257 CO -0.17 0.38 0.42 -0.07 -0.34 0.00 0.00 178.44 178.65 2wzi h LEU 258 N -0.05 1.06 -0.77 2.25 -0.00 -0.81 -0.92 115.31 116.08 2wzi h LEU 258 Ca 0.03 -0.11 -0.07 0.00 -0.00 0.00 0.00 57.88 57.73 2wzi h LEU 258 Cb 0.28 -0.27 -0.03 0.00 -0.00 0.00 0.00 40.66 40.64 2wzi h LEU 258 CO 0.00 0.88 0.12 0.78 -0.00 0.00 0.00 178.44 180.22 2wzi h ASN 259 N 1.17 1.00 -0.31 -0.43 2.35 -0.90 0.79 115.58 119.26 2wzi h ASN 259 Ca 0.29 -0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 2wzi h ASN 259 Cb 0.08 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 2wzi h ASN 259 CO -0.04 0.99 0.20 0.22 -1.65 0.00 0.00 177.43 177.15 2wzi h TYR 260 N 0.99 0.38 -0.54 1.19 3.20 -0.57 0.17 116.97 121.79 2wzi h TYR 260 Ca 0.20 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.10 2wzi h TYR 260 Cb 0.40 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.51 2wzi h TYR 260 CO 0.03 0.24 0.34 0.82 -1.64 0.00 0.00 178.16 177.95 2wzi h ILE 261 N 0.42 1.09 0.31 1.81 2.04 -0.87 0.21 117.51 122.51 2wzi h ILE 261 Ca 0.12 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.74 2wzi h ILE 261 Cb -0.04 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.37 2wzi h ILE 261 CO -0.03 0.12 -0.24 -0.78 0.00 0.00 0.00 178.15 177.22 2wzi h ASP 262 N 0.68 -0.64 -0.17 1.72 3.58 -0.54 0.73 116.42 121.80 2wzi h ASP 262 Ca 0.21 0.05 -0.22 0.00 0.42 0.00 0.00 57.03 57.49 2wzi h ASP 262 Cb -0.02 0.21 0.01 0.00 1.72 0.00 0.00 39.33 41.25 2wzi h ASP 262 CO -0.08 -0.37 -0.75 -0.33 -2.88 0.00 0.00 179.24 174.83 2wzi h GLU 263 N -0.56 0.81 -0.01 0.28 5.08 -0.34 0.28 114.58 120.13 2wzi h GLU 263 Ca -0.02 -0.64 0.00 0.00 -1.00 0.00 0.00 59.36 57.70 2wzi h GLU 263 Cb 0.49 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2wzi h GLU 263 CO -0.01 1.25 -0.50 1.63 -1.00 0.00 0.00 179.01 180.37 2wzi n LYS 264 N -3.95 0.65 0.05 2.33 4.76 0.70 -4.34 118.16 118.35 2wzi n LYS 264 Ca -0.07 -0.47 0.00 0.00 -2.87 0.00 0.00 58.31 54.90 2wzi n LYS 264 Cb 0.73 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 32.43 2wzi n LYS 264 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2wzi n PHE 265 N -0.76 -0.75 -0.24 2.13 7.35 -0.60 -4.71 117.46 119.89 2wzi n PHE 265 Ca 0.09 0.13 -0.03 0.00 -0.76 0.00 0.00 57.45 56.88 2wzi n PHE 265 Cb 0.38 0.42 0.16 0.00 0.35 0.00 0.00 39.48 40.79 2wzi n PHE 265 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2wzi h ALA 266 N 0.00 1.24 -0.03 3.13 0.00 -0.59 -1.52 119.26 121.49 2wzi h ALA 266 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2wzi h ALA 266 Cb 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.49 2wzi h ALA 266 CO 0.00 0.59 0.00 1.04 0.00 0.00 0.00 179.25 180.88 2wzi n GLN 267 N -4.33 1.68 -0.07 0.00 1.13 0.97 -4.10 117.38 112.66 2wzi n GLN 267 Ca 0.07 -0.99 -0.09 0.00 -1.94 0.00 0.00 57.00 54.05 2wzi n GLN 267 Cb 0.13 -1.47 -0.10 0.00 0.11 0.00 0.00 30.24 28.91 2wzi n GLN 267 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2wzi n VAL 268 N 0.21 0.96 -1.52 5.09 0.31 -0.80 -5.00 118.33 117.58 2wzi n VAL 268 Ca 0.19 -0.52 -0.33 0.00 -0.01 0.00 0.00 64.34 63.67 2wzi n VAL 268 Cb 0.36 -0.80 0.07 0.00 -0.91 0.00 0.00 33.84 32.56 2wzi n VAL 268 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2wzi s LYS 269 N -2.34 2.46 0.44 5.55 -0.14 -0.64 -4.96 119.74 120.12 2wzi s LYS 269 Ca -0.12 1.39 0.21 0.00 -1.36 0.00 0.00 55.97 56.09 2wzi s LYS 269 Cb 0.05 -1.91 1.03 0.00 -1.68 0.00 0.00 37.83 35.32 2wzi s LYS 269 CO 0.51 -1.51 1.91 -1.00 -0.76 0.00 0.00 175.35 174.49 2wzi h PRO 270 N -0.43 0.00 -0.23 -1.68 0.13 -1.92 -3.40 132.00 124.47 2wzi h PRO 270 Ca -0.46 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.44 2wzi h PRO 270 Cb 1.25 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.15 2wzi h PRO 270 CO 0.52 0.25 -0.59 -0.40 -0.23 0.00 0.00 178.00 177.55 2wzi n ASP 271 N -3.72 -0.65 -4.76 1.44 5.75 -1.26 -5.10 116.55 108.24 2wzi n ASP 271 Ca -0.01 -2.35 -0.39 0.00 -0.01 0.00 0.00 54.79 52.02 2wzi n ASP 271 Cb 0.36 0.41 -0.05 0.00 -1.03 0.00 0.00 41.12 40.81 2wzi n ASP 271 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2wzi s ILE 272 N -1.01 3.92 0.00 2.12 1.01 -1.26 -4.91 121.20 121.06 2wzi s ILE 272 Ca 0.19 1.80 0.00 0.00 0.00 0.00 0.00 60.65 62.65 2wzi s ILE 272 Cb 0.41 -4.10 0.00 0.00 0.01 0.00 0.00 42.46 38.79 2wzi s ILE 272 CO -0.07 0.33 0.00 0.59 0.00 0.00 0.00 174.94 175.79 2wzi n ASN 273 N 1.04 0.00 -4.83 3.58 5.03 0.19 -5.04 115.26 115.24 2wzi n ASN 273 Ca -0.00 0.00 -0.37 0.00 0.87 0.00 0.00 54.58 55.08 2wzi n ASN 273 Cb 0.47 -0.07 -0.06 0.00 -1.02 0.00 0.00 39.78 39.10 2wzi n ASN 273 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 2wzi s GLN 274 N -0.18 3.77 -0.13 3.52 -0.21 -1.26 -5.03 119.66 120.14 2wzi s GLN 274 Ca 0.00 0.00 0.01 0.00 0.02 0.00 0.00 55.36 55.39 2wzi s GLN 274 Cb 0.00 -3.26 0.02 0.00 1.00 0.00 0.00 33.01 30.77 2wzi s GLN 274 CO 0.00 0.61 -0.13 -1.17 -2.12 0.00 0.00 175.29 172.48 2wzi s LEU 275 N -0.62 1.61 -0.01 2.90 2.96 -1.26 -1.22 118.68 123.05 2wzi s LEU 275 Ca 0.16 -0.43 0.03 0.00 -0.22 0.00 0.00 54.13 53.67 2wzi s LEU 275 Cb -0.13 -1.08 -0.01 0.00 0.50 0.00 0.00 46.19 45.47 2wzi s LEU 275 CO 0.05 -0.04 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.25 2wzi s VAL 276 N 1.33 0.82 0.07 1.68 1.01 -0.49 -1.45 120.40 123.38 2wzi s VAL 276 Ca 0.00 -0.44 0.07 0.00 0.00 0.00 0.00 61.98 61.61 2wzi s VAL 276 Cb -0.14 -0.69 -0.03 0.00 0.00 0.00 0.00 36.38 35.53 2wzi s VAL 276 CO -0.07 0.23 -0.19 0.00 0.00 0.00 0.00 175.10 175.07 2wzi s MET 277 N -0.22 1.14 -0.21 2.72 0.23 0.04 -1.32 119.30 121.68 2wzi s MET 277 Ca 0.04 -1.02 -0.04 0.00 -1.03 0.00 0.00 55.69 53.63 2wzi s MET 277 Cb -0.04 -1.30 -0.01 0.00 -1.53 0.00 0.00 34.83 31.94 2wzi s MET 277 CO -0.00 0.31 -0.03 0.00 -2.03 0.00 0.00 175.02 173.27 2wzi s PRO 279 N 1.28 2.22 0.06 0.00 0.04 -1.26 -0.87 135.00 136.48 2wzi s PRO 279 Ca 0.04 0.62 -0.18 0.00 0.04 0.00 0.00 61.00 61.52 2wzi s PRO 279 Cb -0.14 -1.94 -0.12 0.00 0.04 0.00 0.00 34.50 32.34 2wzi s PRO 279 CO -0.01 -1.52 1.39 1.15 0.04 0.00 0.00 177.00 178.05 2wzi h THR 280 N -1.02 1.32 -1.13 1.26 2.02 -1.93 -3.33 112.91 110.11 2wzi h THR 280 Ca -0.47 -1.28 -0.62 0.00 0.77 0.00 0.00 66.41 64.81 2wzi h THR 280 Cb 1.26 1.71 -0.10 0.00 -1.74 0.00 0.00 68.15 69.28 2wzi h THR 280 CO 0.60 0.39 1.62 -1.61 0.37 0.00 0.00 175.52 176.88 2wzi s GLU 281 N -4.43 3.68 0.00 6.66 2.02 -1.26 -4.70 118.70 120.67 2wzi s GLU 281 Ca -0.14 -1.35 0.15 0.00 0.02 0.00 0.00 54.97 53.65 2wzi s GLU 281 Cb 0.07 -5.37 0.27 0.00 0.10 0.00 0.00 34.13 29.19 2wzi s GLU 281 CO 0.77 -2.20 1.17 2.48 0.02 0.00 0.00 175.26 177.51 2wzi n TYR 282 N 8.65 0.33 -3.57 1.61 0.18 -1.25 -4.89 117.16 118.22 2wzi n TYR 282 Ca 0.36 -0.26 -0.13 0.00 1.88 0.00 0.00 57.90 59.74 2wzi n TYR 282 Cb 0.50 -0.01 -0.05 0.00 -0.38 0.00 0.00 39.34 39.40 2wzi n TYR 282 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2wzi s ASN 283 N -1.12 -0.43 0.22 9.48 2.20 -1.26 -0.16 114.94 123.88 2wzi s ASN 283 Ca 0.25 0.10 -0.07 0.00 -0.94 0.00 0.00 52.86 52.19 2wzi s ASN 283 Cb 0.14 0.50 0.35 0.00 -2.00 0.00 0.00 41.25 40.25 2wzi s ASN 283 CO 0.20 -0.76 1.74 0.50 -2.94 0.00 0.00 177.10 175.84 2wzi h LYS 284 N 2.65 0.44 0.00 3.55 3.64 -0.98 -1.62 116.57 124.25 2wzi h LYS 284 Ca -0.32 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.02 2wzi h LYS 284 Cb 1.23 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.95 2wzi h LYS 284 CO 0.42 0.29 -0.06 0.66 -2.27 0.00 0.00 179.45 178.49 2wzi h SER 285 N 0.46 0.00 -0.20 4.20 4.64 -1.43 -2.05 113.55 119.16 2wzi h SER 285 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 2wzi h SER 285 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 2wzi h SER 285 CO -0.34 0.06 0.00 0.79 -0.87 0.00 0.00 176.83 176.48 2wzi n TRP 286 N -3.82 0.24 -3.87 4.77 7.02 -0.64 -4.91 117.44 116.23 2wzi n TRP 286 Ca -0.02 -0.12 -0.31 0.00 -1.02 0.00 0.00 57.50 56.02 2wzi n TRP 286 Cb 0.16 0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 29.01 2wzi n TRP 286 CO 0.00 0.00 0.00 -1.12 -2.02 0.00 0.00 177.69 174.55 2wzi s SER 287 N -1.73 6.39 -0.45 -0.99 0.01 -0.77 -4.58 113.70 111.58 2wzi s SER 287 Ca 0.34 0.34 -0.13 0.00 1.31 0.00 0.00 55.95 57.81 2wzi s SER 287 Cb 0.21 -1.99 0.08 0.00 0.21 0.00 0.00 66.02 64.53 2wzi s SER 287 CO 0.31 0.15 0.34 0.21 0.41 0.00 0.00 173.24 174.65 2wzi s ASN 288 N -2.47 5.92 0.61 2.44 3.84 -1.26 -4.94 114.94 119.08 2wzi s ASN 288 Ca 0.36 -1.42 0.33 0.00 0.21 0.00 0.00 52.86 52.34 2wzi s ASN 288 Cb -0.13 -2.09 1.88 0.00 -0.55 0.00 0.00 41.25 40.35 2wzi s ASN 288 CO 0.27 -0.60 2.19 -0.65 -2.79 0.00 0.00 177.10 175.52 2wzi h PRO 289 N 8.60 0.00 -0.56 0.43 0.11 -1.98 -0.21 132.00 138.39 2wzi h PRO 289 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2wzi h PRO 289 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2wzi h PRO 289 CO 0.83 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.71 2wzi n ASN 290 N -3.57 3.52 -4.75 -2.05 4.13 -1.26 -4.96 115.26 106.32 2wzi n ASN 290 Ca -0.01 -1.99 -0.25 0.00 1.68 0.00 0.00 54.58 54.01 2wzi n ASN 290 Cb 0.20 -0.37 -0.07 0.00 -1.54 0.00 0.00 39.78 38.00 2wzi n ASN 290 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 2wzi s GLY 291 N -1.04 2.38 0.00 7.41 0.00 -0.09 -5.04 107.32 110.94 2wzi s GLY 291 Ca 0.39 -1.98 0.22 0.00 0.00 0.00 0.00 44.72 43.34 2wzi s GLY 291 CO 0.27 -1.93 1.33 0.70 0.00 0.00 0.00 173.10 173.46 2wzi n ASN 292 N -1.27 3.27 0.10 1.64 5.03 -1.26 -4.56 115.26 118.20 2wzi n ASN 292 Ca -0.02 -1.96 -0.13 0.00 0.87 0.00 0.00 54.58 53.34 2wzi n ASN 292 Cb 0.65 -0.19 -0.07 0.00 -1.02 0.00 0.00 39.78 39.14 2wzi n ASN 292 CO 0.00 0.00 0.00 0.22 -1.83 0.00 0.00 177.26 175.65 2wzi h TYR 293 N 4.22 -0.18 0.00 3.10 3.20 -1.96 -1.24 116.97 124.11 2wzi h TYR 293 Ca 0.00 -0.00 -0.21 0.00 3.14 0.00 0.00 58.73 61.66 2wzi h TYR 293 Cb 0.94 0.06 -0.03 0.00 1.54 0.00 0.00 36.73 39.24 2wzi h TYR 293 CO 0.19 -0.11 -1.03 -0.07 -1.64 0.00 0.00 178.16 175.50 2wzi h LEU 294 N -0.18 0.00 -1.21 2.82 3.38 -1.90 -2.87 115.31 115.35 2wzi h LEU 294 Ca -0.01 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 2wzi h LEU 294 Cb 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2wzi h LEU 294 CO 0.01 0.97 -0.35 0.71 0.09 0.00 0.00 178.44 179.87 2wzi h THR 295 N 0.00 1.01 -0.25 0.22 1.35 -1.71 -1.57 112.91 111.96 2wzi h THR 295 Ca -0.03 -1.31 -0.20 0.00 -0.55 0.00 0.00 66.41 64.32 2wzi h THR 295 Cb 1.77 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 69.94 2wzi h THR 295 CO 0.12 0.34 -0.61 0.74 -0.25 0.00 0.00 175.52 175.86 2wzi h THR 296 N 0.00 1.27 -0.18 6.82 2.02 -1.08 -1.53 112.91 120.24 2wzi h THR 296 Ca -0.00 -1.79 -0.02 0.00 0.77 0.00 0.00 66.41 65.37 2wzi h THR 296 Cb 0.73 1.72 -0.01 0.00 -1.74 0.00 0.00 68.15 68.85 2wzi h THR 296 CO 0.05 0.58 0.05 -0.07 0.37 0.00 0.00 175.52 176.49 2wzi h LEU 297 N 0.63 0.27 -1.08 2.58 3.38 -1.31 -0.78 115.31 119.00 2wzi h LEU 297 Ca -0.00 -0.22 0.07 0.00 0.09 0.00 0.00 57.88 57.81 2wzi h LEU 297 Cb 1.22 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.84 2wzi h LEU 297 CO 0.13 0.42 0.62 1.23 0.09 0.00 0.00 178.44 180.93 2wzi h GLY 298 N 0.10 1.42 1.32 0.83 0.00 -1.24 -1.30 103.07 104.20 2wzi h GLY 298 Ca 0.06 -0.44 -0.32 0.00 0.00 0.00 0.00 47.33 46.62 2wzi h GLY 298 CO 0.00 0.31 -1.45 -0.55 0.00 0.00 0.00 176.54 174.85 2wzi h ASP 299 N 1.09 0.71 0.17 0.19 3.32 -1.23 -3.41 116.42 117.26 2wzi h ASP 299 Ca 0.41 -0.79 -0.35 0.00 0.02 0.00 0.00 57.03 56.32 2wzi h ASP 299 Cb 0.20 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 39.47 2wzi h ASP 299 CO -0.16 1.62 -2.11 0.29 -1.72 0.00 0.00 179.24 177.16 2wzi n LYS 300 N -3.65 0.69 -1.89 3.56 4.76 -0.30 -4.91 118.16 116.42 2wzi n LYS 300 Ca -0.16 0.19 -0.42 0.00 -2.87 0.00 0.00 58.31 55.06 2wzi n LYS 300 Cb 1.08 -1.65 -0.03 0.00 -1.84 0.00 0.00 35.03 32.59 2wzi n LYS 300 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2wzi s LEU 301 N -6.38 4.37 0.35 -0.35 1.43 -0.50 -4.94 118.68 112.67 2wzi s LEU 301 Ca -0.18 2.62 -0.26 0.00 -1.03 0.00 0.00 54.13 55.28 2wzi s LEU 301 Cb 0.07 -3.58 -0.13 0.00 0.03 0.00 0.00 46.19 42.58 2wzi s LEU 301 CO 0.76 -0.87 0.96 0.59 0.23 0.00 0.00 176.35 178.01 2wzi n ASN 302 N 4.58 1.05 0.19 2.29 3.02 -1.26 -4.87 115.26 120.26 2wzi n ASN 302 Ca 0.15 1.10 0.14 0.00 -0.03 0.00 0.00 54.58 55.94 2wzi n ASN 302 Cb 0.39 -1.29 0.63 0.00 -0.61 0.00 0.00 39.78 38.89 2wzi n ASN 302 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2wzi h PRO 303 N 1.70 0.00 -0.00 3.52 0.13 -1.97 -2.35 132.00 133.03 2wzi h PRO 303 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2wzi h PRO 303 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 2wzi h PRO 303 CO 0.58 0.00 -0.24 -1.13 -0.23 0.00 0.00 178.00 176.98 2wzi n SER 304 N -2.48 0.42 -4.68 1.44 3.41 -1.26 -4.84 113.62 105.64 2wzi n SER 304 Ca 0.00 -0.22 -0.42 0.00 -0.26 0.00 0.00 58.87 57.97 2wzi n SER 304 Cb 0.17 -0.04 -0.04 0.00 -0.26 0.00 0.00 64.21 64.05 2wzi n SER 304 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2wzi s ILE 305 N -2.80 4.85 0.38 -1.33 1.01 -0.89 -4.63 121.20 117.79 2wzi s ILE 305 Ca 0.18 1.77 -0.24 0.00 0.00 0.00 0.00 60.65 62.36 2wzi s ILE 305 Cb 0.19 -4.19 -0.09 0.00 0.01 0.00 0.00 42.46 38.37 2wzi s ILE 305 CO 0.58 0.02 1.01 -1.10 0.00 0.00 0.00 174.94 175.44 2wzi s GLN 306 N 2.11 4.30 -0.12 2.79 -1.52 -0.52 -4.94 119.66 121.75 2wzi s GLN 306 Ca 0.41 1.42 0.02 0.00 -1.95 0.00 0.00 55.36 55.27 2wzi s GLN 306 Cb -0.17 -2.58 0.01 0.00 -0.22 0.00 0.00 33.01 30.05 2wzi s GLN 306 CO 0.14 -0.01 -0.18 0.42 -0.25 0.00 0.00 175.29 175.41 2wzi s ILE 307 N -1.70 1.74 0.48 1.08 1.01 -1.26 -0.78 121.20 121.77 2wzi s ILE 307 Ca 0.56 -0.79 -0.06 0.00 0.00 0.00 0.00 60.65 60.36 2wzi s ILE 307 Cb -0.20 -1.56 -0.04 0.00 0.01 0.00 0.00 42.46 40.67 2wzi s ILE 307 CO 0.25 0.49 0.80 -0.04 0.00 0.00 0.00 174.94 176.44 2wzi s MET 308 N 0.91 3.56 -0.24 2.79 -1.94 -0.40 -1.28 119.30 122.70 2wzi s MET 308 Ca -0.07 0.25 -0.18 0.00 -1.71 0.00 0.00 55.69 53.98 2wzi s MET 308 Cb -0.15 -2.36 0.07 0.00 2.01 0.00 0.00 34.83 34.39 2wzi s MET 308 CO -0.02 -0.21 0.62 -0.46 -0.01 0.00 0.00 175.02 174.94 2wzi s TRP 309 N -2.74 -0.82 -2.01 -0.03 -0.11 -0.93 -4.35 118.94 107.94 2wzi s TRP 309 Ca 0.48 1.80 0.16 0.00 1.22 0.00 0.00 56.10 59.77 2wzi s TRP 309 Cb -0.10 0.40 0.16 0.00 -1.50 0.00 0.00 33.47 32.42 2wzi s TRP 309 CO 0.44 -0.41 1.05 0.25 -4.62 0.00 0.00 176.95 173.66 2wzi n THR 310 N 3.58 0.08 0.00 5.86 -2.24 0.77 0.43 114.28 122.76 2wzi n THR 310 Ca -0.18 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.06 2wzi n THR 310 Cb 0.57 1.28 0.00 0.00 -2.10 0.00 0.00 70.33 70.08 2wzi n THR 310 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wzi n GLY 311 N 0.94 0.24 0.15 3.38 0.00 -1.26 -3.90 105.19 104.74 2wzi n GLY 311 Ca 0.10 -1.91 0.13 0.00 0.00 0.00 0.00 46.02 44.34 2wzi n GLY 311 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2wzi h ASP 312 N 0.00 0.00 -5.32 1.61 3.32 -1.91 0.04 116.42 114.16 2wzi h ASP 312 Ca 0.00 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 2wzi h ASP 312 Cb 0.00 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.44 2wzi h ASP 312 CO 0.00 0.00 -0.28 -0.13 -1.72 0.00 0.00 179.24 177.11 2wzi s ARG 313 N -3.15 1.37 0.22 3.56 0.52 -1.26 -1.19 118.95 119.02 2wzi s ARG 313 Ca 0.09 -1.31 -0.08 0.00 -0.52 0.00 0.00 55.73 53.91 2wzi s ARG 313 Cb 0.10 0.40 0.36 0.00 0.52 0.00 0.00 34.95 36.32 2wzi s ARG 313 CO 0.62 -0.53 1.68 0.28 0.02 0.00 0.00 175.30 177.37 2wzi h VAL 314 N 2.41 0.54 -3.74 3.52 2.07 -1.89 -3.34 116.25 115.81 2wzi h VAL 314 Ca -0.30 -0.07 -0.68 0.00 0.82 0.00 0.00 66.70 66.47 2wzi h VAL 314 Cb 1.24 0.31 -0.34 0.00 -1.52 0.00 0.00 31.29 30.98 2wzi h VAL 314 CO 0.43 0.04 -0.75 -0.63 0.02 0.00 0.00 177.57 176.68 2wzi s ILE 315 N -6.10 2.68 0.18 4.57 -1.09 -1.26 -4.68 121.20 115.49 2wzi s ILE 315 Ca -0.13 -1.40 -0.23 0.00 -2.23 0.00 0.00 60.65 56.66 2wzi s ILE 315 Cb 0.19 -2.51 0.06 0.00 -1.58 0.00 0.00 42.46 38.62 2wzi s ILE 315 CO 0.74 -0.01 0.69 -0.94 -1.23 0.00 0.00 174.94 174.19 2wzi s SER 316 N 1.22 -0.43 0.24 3.58 1.04 -1.25 -4.81 113.70 113.29 2wzi s SER 316 Ca -0.05 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.16 2wzi s SER 316 Cb -0.19 0.62 -0.04 0.00 0.10 0.00 0.00 66.02 66.51 2wzi s SER 316 CO -0.03 -1.06 0.43 -1.81 0.98 0.00 0.00 173.24 171.75 2wzi s ASP 317 N -2.79 6.36 -0.22 7.02 1.01 -1.26 -4.63 116.67 122.15 2wzi s ASP 317 Ca 0.05 0.39 -0.17 0.00 0.71 0.00 0.00 52.55 53.54 2wzi s ASP 317 Cb -0.03 -2.00 -0.04 0.00 1.01 0.00 0.00 42.92 41.87 2wzi s ASP 317 CO -0.05 -0.11 0.44 -0.63 0.21 0.00 0.00 175.17 175.02 2wzi s ILE 318 N -1.99 5.15 0.26 0.77 -1.09 -1.26 -4.66 121.20 118.38 2wzi s ILE 318 Ca 0.39 0.76 0.08 0.00 -2.23 0.00 0.00 60.65 59.65 2wzi s ILE 318 Cb -0.10 -3.76 -0.04 0.00 -1.58 0.00 0.00 42.46 36.97 2wzi s ILE 318 CO 0.31 0.19 0.10 0.42 -1.23 0.00 0.00 174.94 174.73 2wzi s THR 319 N 1.67 3.87 0.12 2.92 -4.23 -1.26 -1.22 115.64 117.51 2wzi s THR 319 Ca 0.20 -1.67 -0.19 0.00 -1.18 0.00 0.00 61.69 58.85 2wzi s THR 319 Cb -0.15 -3.10 -0.06 0.00 1.34 0.00 0.00 72.50 70.53 2wzi s THR 319 CO 0.09 -0.35 1.74 -0.09 -0.54 0.00 0.00 174.62 175.47 2wzi h ARG 320 N 1.68 0.32 -0.71 3.99 2.43 -1.97 -0.03 114.38 120.10 2wzi h ARG 320 Ca -0.46 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 58.67 2wzi h ARG 320 Cb 1.24 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.69 2wzi h ARG 320 CO 0.61 0.26 0.40 -0.44 -1.51 0.00 0.00 179.97 179.28 2wzi h ASP 321 N 0.29 0.86 -0.06 -3.80 3.32 -1.99 -1.41 116.42 113.63 2wzi h ASP 321 Ca 0.09 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 2wzi h ASP 321 Cb 0.02 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.35 2wzi h ASP 321 CO -0.02 0.68 -0.03 1.23 -1.72 0.00 0.00 179.24 179.39 2wzi h GLY 322 N 1.02 0.13 2.00 2.75 0.00 -1.86 -2.45 103.07 104.67 2wzi h GLY 322 Ca 0.25 -0.12 -0.10 0.00 0.00 0.00 0.00 47.33 47.36 2wzi h GLY 322 CO -0.04 0.11 -0.47 1.19 0.00 0.00 0.00 176.54 177.32 2wzi h ILE 323 N -0.26 1.29 -0.55 2.60 2.10 -0.95 -2.77 117.51 118.98 2wzi h ILE 323 Ca 0.01 -1.65 0.03 0.00 1.08 0.00 0.00 64.86 64.33 2wzi h ILE 323 Cb 0.46 1.90 -0.04 0.00 -1.09 0.00 0.00 36.82 38.06 2wzi h ILE 323 CO 0.01 0.46 0.33 0.28 -1.08 0.00 0.00 178.15 178.15 2wzi h SER 324 N 0.00 0.53 -0.29 2.19 0.02 -1.20 -0.56 113.55 114.23 2wzi h SER 324 Ca -0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2wzi h SER 324 Cb 0.86 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.28 2wzi h SER 324 CO 0.06 0.37 0.18 -0.25 -1.14 0.00 0.00 176.83 176.06 2wzi h TRP 325 N 0.65 0.38 -0.07 3.45 7.01 -1.15 -1.86 115.95 124.36 2wzi h TRP 325 Ca 0.22 0.00 -0.03 0.00 2.11 0.00 0.00 58.89 61.20 2wzi h TRP 325 Cb 0.03 -0.13 -0.00 0.00 -2.10 0.00 0.00 29.16 26.96 2wzi h TRP 325 CO -0.06 0.27 -0.06 0.97 -2.79 0.00 0.00 178.44 176.76 2wzi h ILE 326 N 0.38 1.36 -0.91 2.65 6.09 -1.42 -3.30 117.51 122.36 2wzi h ILE 326 Ca 0.11 -1.19 0.14 0.00 -1.37 0.00 0.00 64.86 62.54 2wzi h ILE 326 Cb -0.01 2.00 -0.07 0.00 0.47 0.00 0.00 36.82 39.21 2wzi h ILE 326 CO -0.02 0.33 0.59 0.78 -3.07 0.00 0.00 178.15 176.76 2wzi h ASN 327 N -0.25 0.70 0.64 2.19 2.35 -0.99 -0.50 115.58 119.72 2wzi h ASN 327 Ca 0.01 0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.78 2wzi h ASN 327 Cb 0.56 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.83 2wzi h ASN 327 CO 0.02 0.35 -0.12 -0.08 -1.65 0.00 0.00 177.43 175.94 2wzi h GLU 328 N 0.74 0.00 0.03 0.81 4.81 -1.42 -1.13 114.58 118.42 2wzi h GLU 328 Ca 0.46 0.00 -0.35 0.00 -0.13 0.00 0.00 59.36 59.34 2wzi h GLU 328 Cb 0.70 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.02 2wzi h GLU 328 CO -0.22 0.12 -2.15 0.54 -0.73 0.00 0.00 179.01 176.57 2wzi n ARG 329 N -3.41 0.68 0.01 1.92 1.74 -0.31 -4.28 116.66 113.01 2wzi n ARG 329 Ca -0.01 0.17 0.12 0.00 -0.77 0.00 0.00 57.85 57.36 2wzi n ARG 329 Cb 0.30 -1.63 0.22 0.00 -1.02 0.00 0.00 32.46 30.32 2wzi n ARG 329 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 2wzi n ILE 330 N -3.10 0.05 -2.27 0.55 -5.35 -0.56 -4.05 119.36 104.65 2wzi n ILE 330 Ca -0.31 -0.05 -0.16 0.00 -0.27 0.00 0.00 62.75 61.96 2wzi n ILE 330 Cb 1.07 0.22 -0.01 0.00 -1.74 0.00 0.00 39.64 39.18 2wzi n ILE 330 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2wzi n LYS 331 N -1.60 -1.27 -3.62 6.28 4.76 -0.43 -4.28 118.16 118.00 2wzi n LYS 331 Ca 0.05 0.79 -0.07 0.00 -2.87 0.00 0.00 58.31 56.21 2wzi n LYS 331 Cb 0.35 -5.17 -0.02 0.00 -1.84 0.00 0.00 35.03 28.36 2wzi n LYS 331 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2wzi s ARG 332 N -4.73 1.17 -0.04 1.97 1.70 -1.23 -5.08 118.95 112.69 2wzi s ARG 332 Ca 0.00 -0.55 -0.30 0.00 -0.47 0.00 0.00 55.73 54.41 2wzi s ARG 332 Cb 0.00 0.46 -0.04 0.00 -0.57 0.00 0.00 34.95 34.80 2wzi s ARG 332 CO 0.00 -0.52 1.27 -2.14 -1.08 0.00 0.00 175.30 172.82 2wzi s PRO 333 N -3.41 4.33 0.58 3.89 0.02 -1.26 -4.49 135.00 134.67 2wzi s PRO 333 Ca 0.07 1.76 -0.20 0.00 0.02 0.00 0.00 61.00 62.66 2wzi s PRO 333 Cb -0.02 -3.57 -0.04 0.00 0.02 0.00 0.00 34.50 30.89 2wzi s PRO 333 CO -0.04 -0.49 1.16 0.00 -0.33 0.00 0.00 177.00 177.30 2wzi n ALA 334 N 5.29 0.83 -3.24 -1.55 0.00 -1.23 -3.65 120.51 116.96 2wzi n ALA 334 Ca 0.12 0.06 -0.44 0.00 0.00 0.00 0.00 53.44 53.17 2wzi n ALA 334 Cb 0.45 -2.23 -0.06 0.00 0.00 0.00 0.00 19.45 17.61 2wzi n ALA 334 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2wzi s TYR 335 N -1.40 3.28 0.13 0.00 5.04 -0.40 -0.96 117.35 123.04 2wzi s TYR 335 Ca 0.75 -1.31 -0.31 0.00 -2.44 0.00 0.00 57.07 53.76 2wzi s TYR 335 Cb -0.42 -3.55 -0.09 0.00 0.35 0.00 0.00 41.96 38.26 2wzi s TYR 335 CO 0.47 -0.95 1.48 0.42 -1.34 0.00 0.00 175.55 175.63 2wzi s ILE 336 N 1.56 2.99 -0.67 3.14 -1.09 0.21 -2.19 121.20 125.15 2wzi s ILE 336 Ca 0.04 0.70 -0.05 0.00 -2.23 0.00 0.00 60.65 59.10 2wzi s ILE 336 Cb -0.28 -3.45 0.17 0.00 -1.58 0.00 0.00 42.46 37.33 2wzi s ILE 336 CO 0.03 0.05 0.52 0.86 -1.23 0.00 0.00 174.94 175.17 2wzi s TRP 337 N 1.20 3.49 -0.34 3.97 -0.11 0.17 -0.90 118.94 126.42 2wzi s TRP 337 Ca 0.67 -2.55 -0.24 0.00 1.22 0.00 0.00 56.10 55.20 2wzi s TRP 337 Cb -0.40 -3.34 0.01 0.00 -1.50 0.00 0.00 33.47 28.24 2wzi s TRP 337 CO 0.31 -0.87 0.85 -0.46 -4.62 0.00 0.00 176.95 172.15 2wzi s TRP 338 N -0.02 3.14 -1.51 5.86 -0.00 0.14 -4.16 118.94 122.40 2wzi s TRP 338 Ca 0.17 0.75 -0.09 0.00 -0.00 0.00 0.00 56.10 56.93 2wzi s TRP 338 Cb -0.18 -3.43 -0.07 0.00 -0.00 0.00 0.00 33.47 29.79 2wzi s TRP 338 CO -0.05 -0.70 2.94 0.09 -0.00 0.00 0.00 176.95 179.23 2wzi n ASN 339 N 6.48 8.51 -3.69 5.86 3.02 -1.26 -1.42 115.26 132.77 2wzi n ASN 339 Ca 0.05 -2.63 -0.11 0.00 -0.03 0.00 0.00 54.58 51.85 2wzi n ASN 339 Cb 0.48 -1.53 -0.09 0.00 -0.61 0.00 0.00 39.78 38.03 2wzi n ASN 339 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2wzi s PHE 340 N 1.71 -0.66 -0.57 3.10 5.36 -1.23 -4.38 117.98 121.31 2wzi s PHE 340 Ca 0.68 1.47 0.08 0.00 -0.96 0.00 0.00 56.93 58.20 2wzi s PHE 340 Cb 0.19 0.29 0.46 0.00 -0.34 0.00 0.00 43.02 43.62 2wzi s PHE 340 CO -0.06 -0.34 1.20 -0.35 -1.46 0.00 0.00 175.22 174.22 2wzi n PRO 341 N 3.52 3.17 -1.53 10.12 -0.04 -1.16 -4.19 135.00 144.90 2wzi n PRO 341 Ca -0.18 -1.76 -0.53 0.00 -0.04 0.00 0.00 63.50 60.99 2wzi n PRO 341 Cb 0.56 -1.93 -0.06 0.00 -0.04 0.00 0.00 33.50 32.04 2wzi n PRO 341 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2wzi n VAL 342 N 0.34 0.61 -1.55 0.52 3.14 0.18 -4.20 118.33 117.38 2wzi n VAL 342 Ca 0.16 -0.15 0.05 0.00 -2.96 0.00 0.00 64.34 61.44 2wzi n VAL 342 Cb 0.79 -0.42 0.08 0.00 -1.06 0.00 0.00 33.84 33.23 2wzi n VAL 342 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 2wzi n SER 343 N 1.91 1.28 0.00 6.55 3.41 -1.26 -4.82 113.62 120.69 2wzi n SER 343 Ca 0.18 -2.63 0.08 0.00 -0.26 0.00 0.00 58.87 56.24 2wzi n SER 343 Cb 0.18 -0.33 0.37 0.00 -0.26 0.00 0.00 64.21 64.17 2wzi n SER 343 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2wzi n ASP 344 N -0.74 0.00 -0.23 4.04 5.68 -1.26 -1.70 116.55 122.33 2wzi n ASP 344 Ca 0.09 0.24 0.04 0.00 -0.50 0.00 0.00 54.79 54.66 2wzi n ASP 344 Cb 0.69 -0.37 0.01 0.00 -1.14 0.00 0.00 41.12 40.31 2wzi n ASP 344 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2wzi n TYR 345 N -1.37 0.00 -3.16 2.11 4.11 -1.26 -4.60 117.16 112.98 2wzi n TYR 345 Ca 0.06 0.00 -0.19 0.00 -0.00 0.00 0.00 57.90 57.77 2wzi n TYR 345 Cb 0.15 0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 39.45 2wzi n TYR 345 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.86 178.19 2wzi n VAL 346 N -0.03 0.21 0.34 -3.48 0.24 -0.69 -4.95 118.33 109.97 2wzi n VAL 346 Ca 0.04 -4.69 0.15 0.00 -2.04 0.00 0.00 64.34 57.79 2wzi n VAL 346 Cb 0.18 -0.47 0.60 0.00 -1.47 0.00 0.00 33.84 32.69 2wzi n VAL 346 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 2wzi h ARG 347 N 3.04 0.00 0.00 7.34 3.08 -1.66 -1.20 114.38 124.97 2wzi h ARG 347 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2wzi h ARG 347 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.96 2wzi h ARG 347 CO 0.54 0.00 0.00 -0.40 -1.07 0.00 0.00 179.97 179.04 2wzi n ASP 348 N -2.67 0.00 -4.43 7.04 5.68 -1.02 -4.85 116.55 116.29 2wzi n ASP 348 Ca 0.01 -0.84 -0.32 0.00 -0.50 0.00 0.00 54.79 53.15 2wzi n ASP 348 Cb 0.26 -0.01 -0.13 0.00 -1.14 0.00 0.00 41.12 40.10 2wzi n ASP 348 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 2wzi s HIS 349 N -2.01 2.57 -0.07 2.11 3.76 -0.46 -0.75 115.29 120.43 2wzi s HIS 349 Ca 0.41 -0.26 -0.13 0.00 -0.15 0.00 0.00 55.06 54.93 2wzi s HIS 349 Cb 0.19 -1.53 -0.05 0.00 1.11 0.00 0.00 32.58 32.30 2wzi s HIS 349 CO 0.32 0.17 0.33 -0.51 -0.85 0.00 0.00 174.74 174.20 2wzi s LEU 350 N -1.00 4.39 -0.65 0.89 1.43 -1.26 -4.97 118.68 117.50 2wzi s LEU 350 Ca 0.12 0.74 -0.03 0.00 -1.03 0.00 0.00 54.13 53.93 2wzi s LEU 350 Cb -0.10 -2.44 0.17 0.00 0.03 0.00 0.00 46.19 43.85 2wzi s LEU 350 CO 0.02 0.26 0.48 -0.76 0.23 0.00 0.00 176.35 176.58 2wzi s LEU 351 N -0.56 5.33 -0.03 1.79 1.43 -1.26 -3.89 118.68 121.50 2wzi s LEU 351 Ca 0.20 -2.91 0.11 0.00 -1.03 0.00 0.00 54.13 50.51 2wzi s LEU 351 Cb -0.15 -1.88 0.34 0.00 0.03 0.00 0.00 46.19 44.53 2wzi s LEU 351 CO 0.09 -0.37 1.28 0.18 0.23 0.00 0.00 176.35 177.76 2wzi n LEU 352 N 3.43 3.06 -4.90 1.79 4.77 0.09 -4.88 117.00 120.35 2wzi n LEU 352 Ca 0.09 -2.18 -0.29 0.00 -0.03 0.00 0.00 56.01 53.60 2wzi n LEU 352 Cb 0.38 -0.28 0.15 0.00 -2.33 0.00 0.00 43.42 41.34 2wzi n LEU 352 CO 0.34 0.71 0.83 -0.83 -1.33 0.00 0.00 177.39 177.11 2wzi s GLY 353 N -1.16 1.69 0.82 -0.72 0.00 -1.25 -4.78 107.32 101.91 2wzi s GLY 353 Ca 0.26 -0.95 -0.12 0.00 0.00 0.00 0.00 44.72 43.90 2wzi s GLY 353 CO 0.14 -0.29 1.17 2.56 0.00 0.00 0.00 173.10 176.67 2wzi s PRO 354 N -5.73 1.66 -0.19 2.90 0.04 -1.26 -4.73 135.00 127.69 2wzi s PRO 354 Ca 0.69 1.60 -0.24 0.00 0.04 0.00 0.00 61.00 63.09 2wzi s PRO 354 Cb -0.07 -1.79 -0.01 0.00 0.04 0.00 0.00 34.50 32.66 2wzi s PRO 354 CO 0.52 -2.16 0.79 0.08 0.04 0.00 0.00 177.00 176.26 2wzi s VAL 355 N -2.38 4.90 0.28 -0.36 1.01 -1.26 -5.04 120.40 117.54 2wzi s VAL 355 Ca 0.69 1.53 -0.18 0.00 0.00 0.00 0.00 61.98 64.02 2wzi s VAL 355 Cb -0.25 -4.09 0.02 0.00 0.00 0.00 0.00 36.38 32.06 2wzi s VAL 355 CO 0.52 0.02 0.67 -0.72 0.00 0.00 0.00 175.10 175.59 2wzi s TYR 356 N 2.29 -0.02 0.00 5.22 -0.85 -1.26 -4.72 117.35 118.02 2wzi s TYR 356 Ca 0.35 -0.44 0.00 0.00 -0.52 0.00 0.00 57.07 56.47 2wzi s TYR 356 Cb -0.16 0.60 0.00 0.00 0.38 0.00 0.00 41.96 42.78 2wzi s TYR 356 CO 0.11 -1.22 0.00 0.41 -1.52 0.00 0.00 175.55 173.33 2wzi n GLY 357 N -0.45 1.99 3.74 5.49 0.00 -1.26 -4.99 105.19 109.71 2wzi n GLY 357 Ca -0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 2wzi n GLY 357 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wzi s ASN 358 N -1.57 7.15 0.26 1.61 0.01 -1.26 -4.32 114.94 116.82 2wzi s ASN 358 Ca 0.00 1.38 -0.31 0.00 -0.71 0.00 0.00 52.86 53.22 2wzi s ASN 358 Cb 0.00 -2.45 -0.12 0.00 0.41 0.00 0.00 41.25 39.09 2wzi s ASN 358 CO 0.00 0.01 1.62 -0.67 -1.51 0.00 0.00 177.10 176.55 2wzi n ASP 359 N 2.94 3.80 -0.99 -1.22 -0.08 -0.36 -4.90 116.55 115.73 2wzi n ASP 359 Ca -0.03 1.12 0.11 0.00 -1.51 0.00 0.00 54.79 54.48 2wzi n ASP 359 Cb 0.50 -1.57 0.26 0.00 2.34 0.00 0.00 41.12 42.66 2wzi n ASP 359 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 2wzi n THR 360 N 2.76 0.47 0.09 5.18 -2.24 -1.26 -4.29 114.28 115.00 2wzi n THR 360 Ca 0.11 -0.65 0.03 0.00 -2.27 0.00 0.00 64.05 61.28 2wzi n THR 360 Cb 0.35 0.73 0.06 0.00 -2.10 0.00 0.00 70.33 69.37 2wzi n THR 360 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2wzi n THR 361 N 1.14 0.48 -1.12 4.28 -2.24 -1.26 -3.54 114.28 112.01 2wzi n THR 361 Ca 0.19 -0.74 0.06 0.00 -2.27 0.00 0.00 64.05 61.28 2wzi n THR 361 Cb 0.52 0.83 0.23 0.00 -2.10 0.00 0.00 70.33 69.81 2wzi n THR 361 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 2wzi n ILE 362 N 0.25 2.30 -0.31 2.28 -5.35 -1.26 -4.72 119.36 112.55 2wzi n ILE 362 Ca 0.05 -2.15 0.11 0.00 -0.27 0.00 0.00 62.75 60.49 2wzi n ILE 362 Cb 0.26 -0.27 0.28 0.00 -1.74 0.00 0.00 39.64 38.16 2wzi n ILE 362 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2wzi h ALA 363 N 1.35 1.41 0.00 -1.28 0.00 -1.89 -0.60 119.26 118.25 2wzi h ALA 363 Ca 0.06 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2wzi h ALA 363 Cb 1.44 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.28 2wzi h ALA 363 CO 0.23 -0.21 0.00 1.63 0.00 0.00 0.00 179.25 180.90 2wzi n LYS 364 N -4.94 0.17 -0.16 0.00 5.02 -1.26 -2.19 118.16 114.80 2wzi n LYS 364 Ca 0.20 0.52 0.12 0.00 -2.02 0.00 0.00 58.31 57.13 2wzi n LYS 364 Cb 0.56 -1.90 0.22 0.00 -0.02 0.00 0.00 35.03 33.89 2wzi n LYS 364 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2wzi n GLU 365 N -2.23 2.44 -4.34 1.97 -0.58 -0.23 -4.88 120.64 112.78 2wzi n GLU 365 Ca 0.01 -2.17 -0.20 0.00 -0.42 0.00 0.00 57.16 54.38 2wzi n GLU 365 Cb 0.14 -1.50 -0.15 0.00 -0.57 0.00 0.00 31.44 29.35 2wzi n GLU 365 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wzi s MET 366 N -1.58 0.90 0.08 3.49 0.23 -0.93 -3.48 119.30 118.00 2wzi s MET 366 Ca 0.37 -0.27 0.24 0.00 -1.03 0.00 0.00 55.69 55.00 2wzi s MET 366 Cb 0.22 -0.84 0.21 0.00 -1.53 0.00 0.00 34.83 32.89 2wzi s MET 366 CO 0.31 0.09 1.19 -1.13 -2.03 0.00 0.00 175.02 173.45 2wzi n SER 367 N 3.35 0.65 -3.47 -1.18 3.41 -0.14 -4.63 113.62 111.62 2wzi n SER 367 Ca -0.19 -0.05 -0.13 0.00 -0.26 0.00 0.00 58.87 58.24 2wzi n SER 367 Cb 0.54 0.46 -0.03 0.00 -0.26 0.00 0.00 64.21 64.92 2wzi n SER 367 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2wzi s GLY 368 N -3.63 -0.57 -0.20 5.00 0.00 -1.24 -2.49 107.32 104.19 2wzi s GLY 368 Ca 0.05 0.88 -0.04 0.00 0.00 0.00 0.00 44.72 45.61 2wzi s GLY 368 CO 0.76 0.45 0.22 -0.12 0.00 0.00 0.00 173.10 174.40 2wzi s PHE 369 N -2.83 -0.26 0.08 1.90 5.36 0.37 0.64 117.98 123.24 2wzi s PHE 369 Ca -0.02 0.20 0.10 0.00 -0.96 0.00 0.00 56.93 56.25 2wzi s PHE 369 Cb -0.01 -0.38 -0.03 0.00 -0.34 0.00 0.00 43.02 42.26 2wzi s PHE 369 CO -0.05 -0.60 -0.26 0.14 -1.46 0.00 0.00 175.22 172.99 2wzi s VAL 370 N 2.32 2.11 -0.17 3.12 -7.23 -0.08 -2.37 120.40 118.11 2wzi s VAL 370 Ca 0.07 -1.51 -0.15 0.00 -1.81 0.00 0.00 61.98 58.58 2wzi s VAL 370 Cb -0.16 -1.84 -0.04 0.00 0.56 0.00 0.00 36.38 34.90 2wzi s VAL 370 CO -0.12 0.23 0.33 0.28 -0.31 0.00 0.00 175.10 175.51 2wzi s THR 371 N -0.91 5.28 -0.45 5.32 -1.32 -0.27 0.27 115.64 123.55 2wzi s THR 371 Ca 0.12 0.61 -0.18 0.00 -1.21 0.00 0.00 61.69 61.02 2wzi s THR 371 Cb -0.10 -3.67 0.04 0.00 -1.51 0.00 0.00 72.50 67.26 2wzi s THR 371 CO 0.03 0.35 0.53 0.21 -2.21 0.00 0.00 174.62 173.54 2wzi s ASN 372 N 0.62 6.23 0.72 8.08 2.47 -0.50 -0.89 114.94 131.66 2wzi s ASN 372 Ca 0.18 -0.71 -0.03 0.00 0.42 0.00 0.00 52.86 52.72 2wzi s ASN 372 Cb -0.14 -2.26 0.12 0.00 -1.45 0.00 0.00 41.25 37.52 2wzi s ASN 372 CO 0.05 -0.71 0.76 -0.81 -3.72 0.00 0.00 177.10 172.67 2wzi n PRO 373 N 5.87 -0.13 -1.97 0.43 -0.04 -1.25 -0.65 135.00 137.26 2wzi n PRO 373 Ca -0.06 -1.82 -0.32 0.00 -0.04 0.00 0.00 63.50 61.26 2wzi n PRO 373 Cb 0.47 -0.58 0.01 0.00 -0.04 0.00 0.00 33.50 33.36 2wzi n PRO 373 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2wzi s MET 374 N -4.48 3.37 0.39 0.54 -1.94 -1.26 -3.59 119.30 112.33 2wzi s MET 374 Ca 0.48 1.05 0.26 0.00 -1.71 0.00 0.00 55.69 55.77 2wzi s MET 374 Cb -0.02 -2.05 1.40 0.00 2.01 0.00 0.00 34.83 36.17 2wzi s MET 374 CO 0.33 -0.76 1.78 1.05 -0.01 0.00 0.00 175.02 177.41 2wzi h GLU 375 N 0.17 0.00 -5.37 2.03 4.11 -1.91 -3.37 114.58 110.24 2wzi h GLU 375 Ca -0.46 0.00 -0.64 0.00 0.07 0.00 0.00 59.36 58.33 2wzi h GLU 375 Cb 1.21 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.31 2wzi h GLU 375 CO 0.58 0.00 0.44 -1.01 0.07 0.00 0.00 179.01 179.09 2wzi s HIS 376 N -3.66 2.78 -0.05 2.06 3.76 -1.26 -4.73 115.29 114.18 2wzi s HIS 376 Ca -0.03 -0.51 -0.25 0.00 -0.15 0.00 0.00 55.06 54.12 2wzi s HIS 376 Cb 0.07 -4.14 -0.22 0.00 1.11 0.00 0.00 32.58 29.41 2wzi s HIS 376 CO 0.23 -1.49 1.10 0.00 -0.85 0.00 0.00 174.74 173.74 2wzi h ALA 377 N 9.41 0.03 -0.65 -1.40 0.00 -1.97 -2.43 119.26 122.26 2wzi h ALA 377 Ca -0.28 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.20 2wzi h ALA 377 Cb 1.08 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 2wzi h ALA 377 CO 1.13 -0.06 0.22 0.93 0.00 0.00 0.00 179.25 181.47 2wzi h GLU 378 N -0.54 1.00 0.00 0.00 4.39 -1.92 -2.39 114.58 115.12 2wzi h GLU 378 Ca -0.01 -0.21 -0.01 0.00 0.34 0.00 0.00 59.36 59.48 2wzi h GLU 378 Cb 0.78 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 29.28 2wzi h GLU 378 CO 0.02 0.87 -0.03 0.77 -1.16 0.00 0.00 179.01 179.48 2wzi h SER 379 N 0.93 0.00 1.05 1.42 0.02 -1.90 -0.94 113.55 114.13 2wzi h SER 379 Ca 0.21 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 2wzi h SER 379 Cb 0.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.82 2wzi h SER 379 CO -0.01 0.03 0.00 -1.20 -1.14 0.00 0.00 176.83 174.51 2wzi n SER 380 N -4.33 0.47 0.24 3.07 7.64 -0.90 -3.36 113.62 116.46 2wzi n SER 380 Ca -0.03 0.57 0.17 0.00 1.01 0.00 0.00 58.87 60.59 2wzi n SER 380 Cb 0.12 -0.69 0.74 0.00 -1.01 0.00 0.00 64.21 63.37 2wzi n SER 380 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2wzi h LYS 381 N 0.00 0.00 0.17 1.43 1.57 -1.14 -1.14 116.57 117.46 2wzi h LYS 381 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2wzi h LYS 381 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 2wzi h LYS 381 CO 0.00 0.00 -0.08 0.82 -0.57 0.00 0.00 179.45 179.62 2wzi h ILE 382 N 0.00 0.92 -0.16 1.86 2.04 -1.76 -1.91 117.51 118.50 2wzi h ILE 382 Ca 0.00 -0.44 -0.17 0.00 1.00 0.00 0.00 64.86 65.25 2wzi h ILE 382 Cb 0.32 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 2wzi h ILE 382 CO 0.00 0.10 -0.60 0.00 0.00 0.00 0.00 178.15 177.65 2wzi h ALA 383 N 0.34 0.66 -0.41 1.87 0.00 -1.72 -2.95 119.26 117.05 2wzi h ALA 383 Ca -0.02 -0.54 -0.08 0.00 0.00 0.00 0.00 54.91 54.27 2wzi h ALA 383 Cb 0.34 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2wzi h ALA 383 CO 0.04 0.70 -0.05 0.82 0.00 0.00 0.00 179.25 180.76 2wzi h ILE 384 N 0.39 1.27 -0.94 0.00 2.04 -1.21 0.43 117.51 119.49 2wzi h ILE 384 Ca -0.00 -1.12 0.01 0.00 1.00 0.00 0.00 64.86 64.75 2wzi h ILE 384 Cb 1.16 1.16 -0.05 0.00 -0.74 0.00 0.00 36.82 38.35 2wzi h ILE 384 CO 0.11 0.38 0.62 0.22 0.00 0.00 0.00 178.15 179.48 2wzi h TYR 385 N 0.58 1.19 -0.25 1.37 3.20 -1.39 -0.27 116.97 121.40 2wzi h TYR 385 Ca 0.11 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 61.91 2wzi h TYR 385 Cb 0.56 -0.40 -0.00 0.00 1.54 0.00 0.00 36.73 38.43 2wzi h TYR 385 CO 0.04 0.75 -0.23 0.77 -1.64 0.00 0.00 178.16 177.86 2wzi h SER 386 N 1.28 0.63 -0.94 -2.11 0.02 -1.20 -2.14 113.55 109.09 2wzi h SER 386 Ca 0.34 -0.47 0.05 0.00 -0.84 0.00 0.00 61.79 60.88 2wzi h SER 386 Cb -0.14 -0.18 -0.06 0.00 0.14 0.00 0.00 62.40 62.16 2wzi h SER 386 CO -0.07 0.97 0.61 0.58 -1.14 0.00 0.00 176.83 177.77 2wzi h VAL 387 N 0.30 1.11 -0.72 2.27 2.07 0.05 -0.44 116.25 120.89 2wzi h VAL 387 Ca 0.04 -0.39 0.03 0.00 0.82 0.00 0.00 66.70 67.20 2wzi h VAL 387 Cb 0.78 -0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.39 2wzi h VAL 387 CO 0.06 0.21 0.46 0.00 0.02 0.00 0.00 177.57 178.31 2wzi h ALA 388 N 1.41 0.94 -0.22 1.67 0.00 -0.78 0.49 119.26 122.77 2wzi h ALA 388 Ca 0.39 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.25 2wzi h ALA 388 Cb 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2wzi h ALA 388 CO -0.15 0.25 0.04 1.03 0.00 0.00 0.00 179.25 180.42 2wzi h SER 389 N 0.90 0.35 0.04 0.00 0.87 -0.98 -2.35 113.55 112.38 2wzi h SER 389 Ca 0.29 -0.26 -0.00 0.00 -1.23 0.00 0.00 61.79 60.59 2wzi h SER 389 Cb -0.00 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 61.87 2wzi h SER 389 CO -0.10 0.52 -0.02 0.22 -0.53 0.00 0.00 176.83 176.92 2wzi h TYR 390 N 0.17 -0.05 -0.20 2.24 3.20 -0.63 -2.18 116.97 119.51 2wzi h TYR 390 Ca 0.07 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.85 2wzi h TYR 390 Cb 0.32 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 2wzi h TYR 390 CO 0.02 0.04 -0.27 0.00 -1.64 0.00 0.00 178.16 176.32 2wzi h ALA 391 N 0.82 1.17 -0.02 1.82 0.00 -0.92 -0.74 119.26 121.39 2wzi h ALA 391 Ca -0.01 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.53 2wzi h ALA 391 Cb 0.12 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2wzi h ALA 391 CO 0.01 0.53 -0.14 2.35 0.00 0.00 0.00 179.25 182.01 2wzi h TRP 392 N 0.34 0.18 -2.38 0.00 2.91 -1.39 -3.05 115.95 112.56 2wzi h TRP 392 Ca 0.05 -0.08 -0.59 0.00 1.13 0.00 0.00 58.89 59.40 2wzi h TRP 392 Cb 0.65 -0.03 -0.39 0.00 -0.51 0.00 0.00 29.16 28.88 2wzi h TRP 392 CO 0.02 0.80 -0.90 -1.71 -1.03 0.00 0.00 178.44 175.61 2wzi n ASN 393 N -4.62 0.73 -0.11 2.65 2.85 -0.83 -0.62 115.26 115.32 2wzi n ASN 393 Ca -0.09 -2.71 -0.03 0.00 -0.11 0.00 0.00 54.58 51.64 2wzi n ASN 393 Cb 0.41 -0.62 0.18 0.00 1.24 0.00 0.00 39.78 40.99 2wzi n ASN 393 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2wzi h PRO 394 N 5.02 0.78 -0.96 1.20 0.13 -1.33 -2.73 132.00 134.12 2wzi h PRO 394 Ca 0.19 -0.19 0.18 0.00 -0.87 0.00 0.00 66.00 65.32 2wzi h PRO 394 Cb 0.85 -0.10 -0.09 0.00 0.13 0.00 0.00 31.00 31.79 2wzi h PRO 394 CO 0.50 0.76 0.61 0.00 -0.23 0.00 0.00 178.00 179.63 2wzi h ALA 395 N 1.31 1.86 -0.71 -0.56 0.00 -1.86 -0.36 119.26 118.94 2wzi h ALA 395 Ca 0.15 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2wzi h ALA 395 Cb 0.38 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2wzi h ALA 395 CO 0.01 -0.17 0.00 1.63 0.00 0.00 0.00 179.25 180.72 2wzi n LYS 396 N -4.63 3.10 -1.91 0.00 5.02 -1.08 -4.99 118.16 113.67 2wzi n LYS 396 Ca 0.21 -2.76 -0.42 0.00 -2.02 0.00 0.00 58.31 53.31 2wzi n LYS 396 Cb 0.58 -1.69 -0.03 0.00 -0.02 0.00 0.00 35.03 33.87 2wzi n LYS 396 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 2wzi s TYR 397 N -1.30 2.26 -0.34 2.13 5.04 -0.15 -4.95 117.35 120.03 2wzi s TYR 397 Ca 0.50 0.23 0.02 0.00 -2.44 0.00 0.00 57.07 55.38 2wzi s TYR 397 Cb 0.28 -3.99 0.09 0.00 0.35 0.00 0.00 41.96 38.70 2wzi s TYR 397 CO 0.31 -4.03 0.06 0.34 -1.34 0.00 0.00 175.55 170.89 2wzi s ASP 398 N 2.72 4.86 0.08 4.32 -1.08 -1.26 -5.03 116.67 121.27 2wzi s ASP 398 Ca 0.75 -1.96 -0.28 0.00 -0.52 0.00 0.00 52.55 50.54 2wzi s ASP 398 Cb -0.39 -1.68 -0.12 0.00 -1.46 0.00 0.00 42.92 39.28 2wzi s ASP 398 CO 0.33 -0.39 1.44 0.74 0.52 0.00 0.00 175.17 177.81 2wzi h THR 399 N 6.56 0.00 -0.15 1.71 2.02 -1.93 -2.12 112.91 119.01 2wzi h THR 399 Ca -0.09 0.00 -0.22 0.00 0.77 0.00 0.00 66.41 66.86 2wzi h THR 399 Cb 1.03 0.00 0.01 0.00 -1.74 0.00 0.00 68.15 67.45 2wzi h THR 399 CO 0.56 0.00 -0.78 -0.50 0.37 0.00 0.00 175.52 175.17 2wzi h TRP 400 N -0.60 1.03 -0.70 3.16 4.06 -1.96 -2.46 115.95 118.48 2wzi h TRP 400 Ca -0.00 -0.46 -0.05 0.00 2.06 0.00 0.00 58.89 60.45 2wzi h TRP 400 Cb 0.61 -0.16 -0.03 0.00 -1.00 0.00 0.00 29.16 28.58 2wzi h TRP 400 CO -0.43 1.28 0.26 0.37 -3.56 0.00 0.00 178.44 176.36 2wzi h GLN 401 N 0.52 1.05 -0.24 0.49 5.75 -1.99 -1.20 115.11 119.49 2wzi h GLN 401 Ca -0.05 -0.19 -0.10 0.00 -0.15 0.00 0.00 58.65 58.16 2wzi h GLN 401 Cb 1.40 -0.17 -0.00 0.00 1.07 0.00 0.00 27.48 29.78 2wzi h GLN 401 CO 0.16 0.87 -0.24 1.15 -2.65 0.00 0.00 178.83 178.12 2wzi h THR 402 N 1.03 1.32 -0.35 2.39 2.02 -1.38 0.98 112.91 118.91 2wzi h THR 402 Ca 0.23 -1.41 0.08 0.00 0.77 0.00 0.00 66.41 66.08 2wzi h THR 402 Cb 0.23 1.69 -0.08 0.00 -1.74 0.00 0.00 68.15 68.25 2wzi h THR 402 CO -0.02 0.44 -0.19 -0.25 0.37 0.00 0.00 175.52 175.87 2wzi h TRP 403 N 0.29 -0.48 -0.43 3.16 7.01 -1.31 0.28 115.95 124.47 2wzi h TRP 403 Ca 0.04 0.04 0.04 0.00 2.11 0.00 0.00 58.89 61.12 2wzi h TRP 403 Cb 0.80 0.26 -0.04 0.00 -2.10 0.00 0.00 29.16 28.09 2wzi h TRP 403 CO 0.08 -0.27 0.20 0.87 -2.79 0.00 0.00 178.44 176.53 2wzi h LYS 404 N -0.14 0.40 -0.81 2.65 1.57 -1.03 -2.14 116.57 117.08 2wzi h LYS 404 Ca 0.18 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 2wzi h LYS 404 Cb 0.41 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.59 2wzi h LYS 404 CO -0.43 0.27 0.48 -0.44 -0.57 0.00 0.00 179.45 178.75 2wzi h ASP 405 N 0.41 0.98 -0.42 0.86 3.32 -0.36 -1.70 116.42 119.51 2wzi h ASP 405 Ca 0.19 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 2wzi h ASP 405 Cb 0.11 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 2wzi h ASP 405 CO -0.14 0.76 0.22 0.00 -1.72 0.00 0.00 179.24 178.36 2wzi h ALA 406 N 1.26 0.54 -0.66 3.45 0.00 -0.25 -1.48 119.26 122.11 2wzi h ALA 406 Ca 0.29 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 2wzi h ALA 406 Cb -0.03 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2wzi h ALA 406 CO -0.05 0.07 0.22 0.82 0.00 0.00 0.00 179.25 180.31 2wzi h ILE 407 N 0.54 1.25 0.00 0.00 2.04 -1.12 0.10 117.51 120.32 2wzi h ILE 407 Ca 0.15 -0.83 -0.10 0.00 1.00 0.00 0.00 64.86 65.07 2wzi h ILE 407 Cb 0.07 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 2wzi h ILE 407 CO -0.02 0.32 -0.49 -0.09 0.00 0.00 0.00 178.15 177.87 2wzi h ARG 408 N 0.95 0.00 -0.11 2.37 2.43 -1.22 0.83 114.38 119.63 2wzi h ARG 408 Ca 0.22 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.33 2wzi h ARG 408 Cb 0.27 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.82 2wzi h ARG 408 CO -0.01 0.49 -0.17 1.15 -1.51 0.00 0.00 179.97 179.93 2wzi h THR 409 N 0.00 1.38 -0.16 0.20 2.02 -0.81 -2.80 112.91 112.74 2wzi h THR 409 Ca -0.00 -1.40 -0.20 0.00 0.77 0.00 0.00 66.41 65.58 2wzi h THR 409 Cb 0.92 2.04 0.00 0.00 -1.74 0.00 0.00 68.15 69.37 2wzi h THR 409 CO 0.06 0.40 -0.70 0.40 0.37 0.00 0.00 175.52 176.06 2wzi h ILE 410 N -0.12 1.31 -1.86 3.11 2.04 -0.62 -3.40 117.51 117.97 2wzi h ILE 410 Ca 0.01 -1.96 -0.50 0.00 1.00 0.00 0.00 64.86 63.41 2wzi h ILE 410 Cb 0.73 1.94 -0.38 0.00 -0.74 0.00 0.00 36.82 38.36 2wzi h ILE 410 CO 0.04 0.61 -1.11 -0.11 0.00 0.00 0.00 178.15 177.58 2wzi n LEU 411 N -3.92 0.31 0.06 1.44 7.94 0.27 -4.85 117.00 118.24 2wzi n LEU 411 Ca -0.05 -4.77 0.10 0.00 -1.11 0.00 0.00 56.01 50.17 2wzi n LEU 411 Cb 0.70 0.70 0.55 0.00 0.53 0.00 0.00 43.42 45.90 2wzi n LEU 411 CO 0.50 2.18 1.14 1.55 -1.11 0.00 0.00 177.39 181.66 2wzi h PRO 412 N 3.46 0.26 0.00 1.96 0.13 -1.67 -0.04 132.00 136.10 2wzi h PRO 412 Ca 0.07 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 2wzi h PRO 412 Cb 0.94 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.01 2wzi h PRO 412 CO 0.46 0.17 0.00 0.66 -0.23 0.00 0.00 178.00 179.06 2wzi h SER 413 N 0.26 0.00 -0.27 1.44 4.64 -1.93 -3.33 113.55 114.37 2wzi h SER 413 Ca 0.15 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.25 2wzi h SER 413 Cb 0.27 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 62.09 2wzi h SER 413 CO -0.03 0.00 -0.70 0.00 -0.87 0.00 0.00 176.83 175.23 2wzi n ALA 414 N -1.80 2.65 -0.05 5.18 0.00 -0.33 -4.99 120.51 121.16 2wzi n ALA 414 Ca 0.03 -1.91 -0.09 0.00 0.00 0.00 0.00 53.44 51.46 2wzi n ALA 414 Cb 0.27 -0.88 -0.02 0.00 0.00 0.00 0.00 19.45 18.82 2wzi n ALA 414 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wzi h ALA 415 N 1.93 0.27 -0.68 0.00 0.00 -1.19 -0.42 119.26 119.17 2wzi h ALA 415 Ca -0.28 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.59 2wzi h ALA 415 Cb 1.28 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 2wzi h ALA 415 CO 0.03 -0.29 0.26 0.93 0.00 0.00 0.00 179.25 180.19 2wzi h GLU 416 N 0.25 1.02 -0.47 0.00 5.08 -1.92 0.37 114.58 118.91 2wzi h GLU 416 Ca 0.09 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2wzi h GLU 416 Cb 0.02 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 2wzi h GLU 416 CO -0.06 0.85 0.29 0.93 -1.00 0.00 0.00 179.01 180.02 2wzi h GLU 417 N 0.96 0.63 -0.26 2.33 3.07 -1.88 -0.59 114.58 118.85 2wzi h GLU 417 Ca 0.22 -0.05 -0.12 0.00 -0.50 0.00 0.00 59.36 58.91 2wzi h GLU 417 Cb 0.22 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 2wzi h GLU 417 CO -0.02 0.45 -0.34 1.25 -1.40 0.00 0.00 179.01 178.95 2wzi h LEU 418 N 0.62 0.58 -0.42 1.33 5.85 -0.34 -1.97 115.31 120.96 2wzi h LEU 418 Ca 0.17 -0.24 0.05 0.00 0.84 0.00 0.00 57.88 58.70 2wzi h LEU 418 Cb -0.02 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 2wzi h LEU 418 CO -0.03 0.88 0.17 -0.33 -0.34 0.00 0.00 178.44 178.79 2wzi h GLU 419 N 0.47 0.33 0.02 1.25 5.08 0.08 0.38 114.58 122.19 2wzi h GLU 419 Ca 0.05 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2wzi h GLU 419 Cb 0.82 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 2wzi h GLU 419 CO 0.07 0.22 -0.08 0.00 -1.00 0.00 0.00 179.01 178.21 2wzi h PHE 421 N -0.16 0.25 -0.86 0.00 3.57 -1.10 -3.05 116.94 115.60 2wzi h PHE 421 Ca 0.03 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 2wzi h PHE 421 Cb 0.19 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 2wzi h PHE 421 CO -0.14 0.17 0.49 0.00 -2.23 0.00 0.00 178.31 176.59 2wzi h ALA 422 N 1.06 1.10 0.00 2.41 0.00 0.01 -2.96 119.26 120.88 2wzi h ALA 422 Ca 0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2wzi h ALA 422 Cb -0.02 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.43 2wzi h ALA 422 CO -0.01 0.59 -0.09 1.98 0.00 0.00 0.00 179.25 181.71 2wzi h MET 423 N 1.19 0.00 -0.48 0.00 1.85 -0.62 -1.74 114.93 115.13 2wzi h MET 423 Ca 0.30 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.39 2wzi h MET 423 Cb 0.00 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.03 2wzi h MET 423 CO -0.05 0.09 0.00 0.72 -0.40 0.00 0.00 176.91 177.27 2wzi n HIS 424 N -3.84 1.11 -3.27 1.39 8.25 -1.14 -2.10 115.22 115.62 2wzi n HIS 424 Ca -0.02 -0.65 -0.25 0.00 -0.26 0.00 0.00 57.72 56.53 2wzi n HIS 424 Cb 0.19 -0.21 -0.08 0.00 1.12 0.00 0.00 29.99 31.01 2wzi n HIS 424 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2wzi n ASN 425 N 0.57 0.05 0.00 0.41 3.02 -0.65 -1.53 115.26 117.12 2wzi n ASN 425 Ca 0.21 -2.60 0.00 0.00 -0.03 0.00 0.00 54.58 52.16 2wzi n ASN 425 Cb 0.78 -0.61 0.00 0.00 -0.61 0.00 0.00 39.78 39.34 2wzi n ASN 425 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2wzi n SER 426 N 1.90 0.06 -4.89 6.41 3.41 -1.25 -0.73 113.62 118.53 2wzi n SER 426 Ca 0.24 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.56 2wzi n SER 426 Cb 0.51 0.01 0.03 0.00 -0.26 0.00 0.00 64.21 64.49 2wzi n SER 426 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2wzi s ASP 427 N -0.85 5.80 -0.01 4.04 2.15 -1.26 -4.61 116.67 121.94 2wzi s ASP 427 Ca 0.00 1.07 0.21 0.00 0.43 0.00 0.00 52.55 54.26 2wzi s ASP 427 Cb 0.00 -2.06 -0.25 0.00 -0.30 0.00 0.00 42.92 40.31 2wzi s ASP 427 CO 0.00 -1.04 0.78 0.18 -0.17 0.00 0.00 175.17 174.92 2wzi n LEU 428 N -2.73 0.75 -0.98 -1.34 4.32 -1.26 -4.85 117.00 110.91 2wzi n LEU 428 Ca 0.05 -0.38 0.13 0.00 -0.02 0.00 0.00 56.01 55.79 2wzi n LEU 428 Cb 0.56 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.32 2wzi n LEU 428 CO 0.56 0.19 -0.25 0.61 -1.22 0.00 0.00 177.39 177.28 2wzi n GLY 429 N 1.44 -2.06 3.71 -0.72 0.00 -1.26 -4.84 105.19 101.46 2wzi n GLY 429 Ca 0.02 -1.25 -0.41 0.00 0.00 0.00 0.00 46.02 44.38 2wzi n GLY 429 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2wzi n PRO 430 N -3.46 1.93 -3.45 1.61 -0.02 -1.26 -4.92 135.00 125.42 2wzi n PRO 430 Ca -0.01 0.69 -0.12 0.00 -2.02 0.00 0.00 63.50 62.04 2wzi n PRO 430 Cb 0.45 -2.42 -0.03 0.00 -0.02 0.00 0.00 33.50 31.48 2wzi n PRO 430 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2wzi s ASN 431 N -0.57 -0.54 0.27 2.55 2.20 -1.26 -5.05 114.94 112.54 2wzi s ASN 431 Ca 0.62 0.01 0.22 0.00 -0.94 0.00 0.00 52.86 52.77 2wzi s ASN 431 Cb -0.49 0.58 1.02 0.00 -2.00 0.00 0.00 41.25 40.36 2wzi s ASN 431 CO 0.57 -0.94 1.66 0.61 -2.94 0.00 0.00 177.10 176.07 2wzi n GLY 432 N -0.28 -1.08 0.00 0.45 0.00 -1.26 -2.35 105.19 100.67 2wzi n GLY 432 Ca -0.17 0.13 0.12 0.00 0.00 0.00 0.00 46.02 46.10 2wzi n GLY 432 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2wzi n HIS 433 N -2.21 0.02 -1.49 1.61 8.25 -1.26 -4.96 115.22 115.19 2wzi n HIS 433 Ca 0.01 0.01 -0.14 0.00 -0.26 0.00 0.00 57.72 57.33 2wzi n HIS 433 Cb 0.14 -0.25 -0.06 0.00 1.12 0.00 0.00 29.99 30.94 2wzi n HIS 433 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wzi n GLY 434 N 1.49 1.37 3.74 -1.41 0.00 -0.99 -4.80 105.19 104.59 2wzi n GLY 434 Ca 0.05 -0.34 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 2wzi n GLY 434 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2wzi s TYR 435 N -2.55 3.42 0.15 1.61 5.04 -1.26 -5.04 117.35 118.72 2wzi s TYR 435 Ca 0.00 0.33 0.03 0.00 -2.44 0.00 0.00 57.07 54.98 2wzi s TYR 435 Cb 0.00 -2.11 -0.05 0.00 0.35 0.00 0.00 41.96 40.16 2wzi s TYR 435 CO 0.00 0.35 -0.04 1.03 -1.34 0.00 0.00 175.55 175.55 2wzi s ARG 436 N 0.12 1.06 0.04 4.97 1.81 -1.26 -4.69 118.95 121.00 2wzi s ARG 436 Ca 0.09 -1.48 0.01 0.00 -1.72 0.00 0.00 55.73 52.63 2wzi s ARG 436 Cb -0.11 -0.38 -0.03 0.00 -0.45 0.00 0.00 34.95 33.98 2wzi s ARG 436 CO -0.01 -0.05 -0.06 1.03 -0.68 0.00 0.00 175.30 175.53 2wzi s ARG 437 N -3.85 0.52 0.79 3.54 1.81 -1.26 -4.97 118.95 115.53 2wzi s ARG 437 Ca 0.20 -0.82 -0.11 0.00 -1.72 0.00 0.00 55.73 53.28 2wzi s ARG 437 Cb 0.05 -0.16 0.07 0.00 -0.45 0.00 0.00 34.95 34.46 2wzi s ARG 437 CO 0.01 0.01 1.10 -1.21 -0.68 0.00 0.00 175.30 174.54 2wzi s GLU 438 N -1.96 2.10 -0.25 3.54 2.02 -1.26 -4.22 118.70 118.66 2wzi s GLU 438 Ca -0.08 1.25 -0.26 0.00 0.02 0.00 0.00 54.97 55.90 2wzi s GLU 438 Cb -0.07 -1.87 0.08 0.00 0.10 0.00 0.00 34.13 32.36 2wzi s GLU 438 CO -0.01 -1.77 0.76 -2.00 0.02 0.00 0.00 175.26 172.25 2wzi s GLU 439 N -4.80 0.82 -1.44 1.61 2.12 -1.26 -4.21 118.70 111.53 2wzi s GLU 439 Ca 0.62 0.88 -0.03 0.00 0.36 0.00 0.00 54.97 56.81 2wzi s GLU 439 Cb -0.18 0.40 0.01 0.00 0.26 0.00 0.00 34.13 34.62 2wzi s GLU 439 CO 0.55 -0.12 0.23 0.43 -0.54 0.00 0.00 175.26 175.81 2wzi n SER 440 N 2.45 -5.06 0.23 -1.70 7.64 -0.89 -4.74 113.62 111.54 2wzi n SER 440 Ca -0.14 -0.08 0.06 0.00 1.01 0.00 0.00 58.87 59.72 2wzi n SER 440 Cb 0.55 -4.19 0.52 0.00 -1.01 0.00 0.00 64.21 60.08 2wzi n SER 440 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2wzi h MET 441 N -0.49 0.00 -0.24 1.43 2.86 -1.93 -2.15 114.93 114.41 2wzi h MET 441 Ca -0.44 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.26 2wzi h MET 441 Cb 1.31 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.91 2wzi h MET 441 CO 0.50 0.17 -0.19 -0.44 1.06 0.00 0.00 176.91 178.01 2wzi h ASP 442 N 0.00 -0.63 0.17 1.22 3.32 -1.98 -3.08 116.42 115.45 2wzi h ASP 442 Ca -0.00 0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.17 2wzi h ASP 442 Cb 0.32 0.31 0.00 0.00 0.22 0.00 0.00 39.33 40.18 2wzi h ASP 442 CO 0.02 -0.23 -0.43 2.30 -1.72 0.00 0.00 179.24 179.18 2wzi n ILE 443 N -5.35 0.00 -0.20 0.35 -5.35 -1.02 -4.43 119.36 103.37 2wzi n ILE 443 Ca -0.01 -0.14 -0.00 0.00 -0.27 0.00 0.00 62.75 62.33 2wzi n ILE 443 Cb 0.26 0.70 0.10 0.00 -1.74 0.00 0.00 39.64 38.96 2wzi n ILE 443 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 2wzi h GLN 444 N 1.31 0.34 -0.46 6.28 -0.00 -1.30 -0.05 115.11 121.23 2wzi h GLN 444 Ca 0.00 -0.02 -0.13 0.00 -0.00 0.00 0.00 58.65 58.50 2wzi h GLN 444 Cb 0.58 -0.08 -0.01 0.00 0.00 0.00 0.00 27.48 27.97 2wzi h GLN 444 CO 0.00 0.23 -0.23 -1.35 0.00 0.00 0.00 178.83 177.48 2wzi h PRO 445 N 0.35 0.97 -0.86 -2.39 0.11 -1.77 0.01 132.00 128.41 2wzi h PRO 445 Ca 0.30 -0.43 0.00 0.00 0.11 0.00 0.00 66.00 65.99 2wzi h PRO 445 Cb 0.39 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 31.44 2wzi h PRO 445 CO -0.33 1.09 0.54 0.00 -0.21 0.00 0.00 178.00 179.10 2wzi h ALA 446 N 0.85 1.09 0.52 -0.75 0.00 -1.75 -1.38 119.26 117.84 2wzi h ALA 446 Ca 0.10 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2wzi h ALA 446 Cb 0.81 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2wzi h ALA 446 CO 0.07 0.53 -0.27 0.00 0.00 0.00 0.00 179.25 179.58 2wzi h ALA 447 N 1.29 -0.73 -0.89 0.00 0.00 -0.84 -1.97 119.26 116.12 2wzi h ALA 447 Ca 0.31 -0.15 0.09 0.00 0.00 0.00 0.00 54.91 55.15 2wzi h ALA 447 Cb -0.08 0.30 -0.07 0.00 0.00 0.00 0.00 17.79 17.94 2wzi h ALA 447 CO -0.06 -0.91 0.54 1.49 0.00 0.00 0.00 179.25 180.31 2wzi h GLU 448 N -0.73 0.90 -0.15 0.00 4.81 -0.79 -1.36 114.58 117.27 2wzi h GLU 448 Ca -0.07 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.07 2wzi h GLU 448 Cb 0.57 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.74 2wzi h GLU 448 CO 0.10 0.60 -0.04 0.00 -0.73 0.00 0.00 179.01 178.94 2wzi h ARG 449 N 0.93 0.29 -0.27 1.92 3.08 -1.25 -1.78 114.38 117.29 2wzi h ARG 449 Ca 0.42 -0.11 0.04 0.00 0.07 0.00 0.00 59.98 60.40 2wzi h ARG 449 Cb 0.32 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.32 2wzi h ARG 449 CO -0.22 0.58 0.03 0.35 -1.07 0.00 0.00 179.97 179.64 2wzi h PHE 450 N -0.03 0.05 -0.16 3.04 3.57 -0.90 -0.86 116.94 121.65 2wzi h PHE 450 Ca 0.04 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.52 2wzi h PHE 450 Cb 0.48 0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.24 2wzi h PHE 450 CO 0.06 -0.01 -0.05 1.25 -2.23 0.00 0.00 178.31 177.33 2wzi h LEU 451 N 0.12 0.31 -0.32 0.59 5.85 -1.27 -0.32 115.31 120.29 2wzi h LEU 451 Ca 0.13 -0.38 0.05 0.00 0.84 0.00 0.00 57.88 58.52 2wzi h LEU 451 Cb 0.15 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 2wzi h LEU 451 CO -0.19 0.62 0.05 0.50 -0.34 0.00 0.00 178.44 179.08 2wzi h LYS 452 N 0.01 0.15 -0.00 1.25 3.64 -1.19 0.12 116.57 120.54 2wzi h LYS 452 Ca 0.04 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.43 2wzi h LYS 452 Cb 0.49 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.25 2wzi h LYS 452 CO 0.02 0.10 -0.13 0.00 -2.27 0.00 0.00 179.45 177.16 2wzi h ALA 453 N 1.24 -0.15 -0.51 5.00 0.00 -1.14 -2.94 119.26 120.77 2wzi h ALA 453 Ca 0.15 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2wzi h ALA 453 Cb 0.17 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2wzi h ALA 453 CO -0.21 -0.62 0.13 0.35 0.00 0.00 0.00 179.25 178.90 2wzi h PHE 454 N -0.22 0.84 -0.87 0.00 3.57 -0.74 -1.59 116.94 117.93 2wzi h PHE 454 Ca 0.05 -0.10 -0.02 0.00 3.53 0.00 0.00 57.97 61.43 2wzi h PHE 454 Cb 0.28 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 38.74 2wzi h PHE 454 CO -0.19 0.74 0.45 0.87 -2.23 0.00 0.00 178.31 177.95 2wzi h LYS 455 N 0.69 1.23 -0.06 1.11 1.57 -0.76 -3.09 116.57 117.26 2wzi h LYS 455 Ca 0.16 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wzi h LYS 455 Cb 0.32 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.40 2wzi h LYS 455 CO -0.00 0.92 0.00 -0.85 -0.57 0.00 0.00 179.45 178.95 2wzi n GLU 456 N -4.32 1.86 -0.43 3.15 0.28 -1.11 -4.93 120.64 115.13 2wzi n GLU 456 Ca 0.09 -1.25 0.00 0.00 -0.16 0.00 0.00 57.16 55.83 2wzi n GLU 456 Cb 0.12 -1.46 0.00 0.00 1.43 0.00 0.00 31.44 31.53 2wzi n GLU 456 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2wzi n GLY 457 N 1.22 0.77 3.91 -1.84 0.00 -1.07 -5.07 105.19 103.11 2wzi n GLY 457 Ca 0.18 -0.09 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 2wzi n GLY 457 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wzi s LYS 458 N -0.62 3.60 0.06 1.61 1.02 -0.62 -5.04 119.74 119.75 2wzi s LYS 458 Ca 0.00 -0.08 -0.31 0.00 0.02 0.00 0.00 55.97 55.60 2wzi s LYS 458 Cb 0.00 -2.69 -0.07 0.00 -0.52 0.00 0.00 37.83 34.55 2wzi s LYS 458 CO 0.00 0.26 1.37 -0.80 -0.92 0.00 0.00 175.35 175.26 2wzi s ASN 459 N -3.17 6.87 0.57 2.83 -0.87 -1.26 -3.96 114.94 115.95 2wzi s ASN 459 Ca 0.42 2.19 -0.10 0.00 -1.57 0.00 0.00 52.86 53.81 2wzi s ASN 459 Cb -0.11 -2.57 -0.04 0.00 -0.02 0.00 0.00 41.25 38.50 2wzi s ASN 459 CO 0.30 -0.65 0.96 -0.72 -2.57 0.00 0.00 177.10 174.42 2wzi s TYR 460 N 1.62 3.59 0.10 2.20 -0.85 -1.26 -4.94 117.35 117.82 2wzi s TYR 460 Ca 0.63 1.20 -0.30 0.00 -0.52 0.00 0.00 57.07 58.08 2wzi s TYR 460 Cb -0.34 -2.63 -0.07 0.00 0.38 0.00 0.00 41.96 39.31 2wzi s TYR 460 CO 0.29 -0.55 1.21 0.34 -1.52 0.00 0.00 175.55 175.31 2wzi s ASP 461 N -4.02 7.08 0.27 -0.18 -1.08 -1.26 -4.92 116.67 112.55 2wzi s ASP 461 Ca 0.54 2.10 -0.00 0.00 -0.52 0.00 0.00 52.55 54.66 2wzi s ASP 461 Cb -0.11 -2.59 0.54 0.00 -1.46 0.00 0.00 42.92 39.31 2wzi s ASP 461 CO 0.49 -0.44 1.78 0.50 0.52 0.00 0.00 175.17 178.02 2wzi h LYS 462 N 6.30 0.67 -0.65 4.34 3.64 -2.00 -1.63 116.57 127.26 2wzi h LYS 462 Ca -0.43 -0.04 0.03 0.00 -1.27 0.00 0.00 60.65 58.95 2wzi h LYS 462 Cb 1.21 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.85 2wzi h LYS 462 CO 0.79 0.45 0.43 0.00 -2.27 0.00 0.00 179.45 178.85 2wzi h ALA 463 N 1.55 1.64 -0.26 5.00 0.00 -1.99 -0.54 119.26 124.66 2wzi h ALA 463 Ca 0.47 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.23 2wzi h ALA 463 Cb 0.63 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2wzi h ALA 463 CO -0.34 0.30 -0.31 -0.44 0.00 0.00 0.00 179.25 178.45 2wzi h ASP 464 N 0.78 0.72 -0.67 0.00 3.32 -1.66 -1.07 116.42 117.83 2wzi h ASP 464 Ca 0.26 -0.49 0.05 0.00 0.02 0.00 0.00 57.03 56.86 2wzi h ASP 464 Cb 0.06 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 39.35 2wzi h ASP 464 CO -0.07 1.07 0.39 0.15 -1.72 0.00 0.00 179.24 179.06 2wzi h PHE 465 N 0.39 0.72 -0.23 4.55 3.57 -1.05 -1.49 116.94 123.40 2wzi h PHE 465 Ca 0.03 0.02 -0.15 0.00 3.53 0.00 0.00 57.97 61.41 2wzi h PHE 465 Cb 0.89 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 2wzi h PHE 465 CO 0.08 0.36 -0.46 0.93 -2.23 0.00 0.00 178.31 176.99 2wzi h GLU 466 N 0.73 0.61 -0.25 1.11 5.08 -1.04 -1.36 114.58 119.45 2wzi h GLU 466 Ca 0.29 -0.34 0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2wzi h GLU 466 Cb 0.14 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2wzi h GLU 466 CO -0.16 0.94 0.10 1.15 -1.00 0.00 0.00 179.01 180.04 2wzi h THR 467 N 0.49 0.96 -0.52 1.13 2.02 -0.90 0.64 112.91 116.72 2wzi h THR 467 Ca 0.03 -0.08 0.01 0.00 0.77 0.00 0.00 66.41 67.14 2wzi h THR 467 Cb 0.99 0.71 -0.03 0.00 -1.74 0.00 0.00 68.15 68.08 2wzi h THR 467 CO 0.09 0.04 0.33 -0.07 0.37 0.00 0.00 175.52 176.29 2wzi h LEU 468 N 0.23 0.56 -0.24 2.58 3.38 -1.09 -1.75 115.31 118.98 2wzi h LEU 468 Ca 0.11 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.09 2wzi h LEU 468 Cb 0.06 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2wzi h LEU 468 CO -0.10 0.40 0.09 1.56 0.09 0.00 0.00 178.44 180.49 2wzi h GLN 469 N 0.67 0.20 -0.87 1.13 4.20 -0.93 -2.22 115.11 117.30 2wzi h GLN 469 Ca 0.20 -0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.92 2wzi h GLN 469 Cb -0.04 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 27.65 2wzi h GLN 469 CO -0.06 0.13 0.56 -0.92 -0.67 0.00 0.00 178.83 177.88 2wzi h TYR 470 N 0.21 1.06 0.15 2.96 3.20 -0.76 -1.72 116.97 122.07 2wzi h TYR 470 Ca 0.10 0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.01 2wzi h TYR 470 Cb 0.06 -0.35 -0.02 0.00 1.54 0.00 0.00 36.73 37.95 2wzi h TYR 470 CO -0.12 0.63 -0.22 1.15 -1.64 0.00 0.00 178.16 177.96 2wzi h THR 471 N 1.12 0.51 -0.79 1.81 2.02 -1.08 -0.55 112.91 115.94 2wzi h THR 471 Ca 0.34 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.53 2wzi h THR 471 Cb -0.04 0.51 -0.04 0.00 -1.74 0.00 0.00 68.15 66.83 2wzi h THR 471 CO -0.10 0.00 0.51 -0.26 0.37 0.00 0.00 175.52 176.04 2wzi h PHE 472 N -0.44 0.97 -0.88 3.16 0.04 -1.15 0.49 116.94 119.13 2wzi h PHE 472 Ca 0.02 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.80 2wzi h PHE 472 Cb 0.44 -0.33 -0.04 0.00 2.20 0.00 0.00 35.95 38.22 2wzi h PHE 472 CO -0.19 0.59 0.51 1.49 -0.60 0.00 0.00 178.31 180.11 2wzi h GLU 473 N 1.03 1.21 -0.27 1.51 4.81 -1.14 -1.86 114.58 119.87 2wzi h GLU 473 Ca 0.30 -0.12 -0.19 0.00 -0.13 0.00 0.00 59.36 59.22 2wzi h GLU 473 Cb -0.07 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.07 2wzi h GLU 473 CO -0.08 0.86 -0.56 -0.09 -0.73 0.00 0.00 179.01 178.41 2wzi h ARG 474 N 1.22 0.84 -0.75 1.92 9.65 -0.23 -2.38 114.38 124.64 2wzi h ARG 474 Ca 0.31 -0.54 0.09 0.00 -1.10 0.00 0.00 59.98 58.74 2wzi h ARG 474 Cb -0.02 0.07 -0.07 0.00 -1.39 0.00 0.00 29.97 28.56 2wzi h ARG 474 CO -0.06 1.17 0.40 0.52 2.80 0.00 0.00 179.97 184.81 2wzi h MET 475 N 0.64 0.65 -0.22 0.20 2.86 -0.66 -0.26 114.93 118.14 2wzi h MET 475 Ca 0.01 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 2wzi h MET 475 Cb 1.17 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.67 2wzi h MET 475 CO 0.12 0.43 0.02 0.87 1.06 0.00 0.00 176.91 179.41 2wzi h LYS 476 N 0.67 0.37 -0.09 1.72 1.57 -1.19 0.52 116.57 120.15 2wzi h LYS 476 Ca 0.37 -0.11 0.03 0.00 -1.87 0.00 0.00 60.65 59.07 2wzi h LYS 476 Cb 0.37 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.61 2wzi h LYS 476 CO -0.26 0.54 -0.11 0.93 -0.57 0.00 0.00 179.45 179.98 2wzi h GLU 477 N 0.15 -0.14 -0.06 3.15 5.08 -1.09 -1.98 114.58 119.70 2wzi h GLU 477 Ca 0.06 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.45 2wzi h GLU 477 Cb 0.36 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 2wzi h GLU 477 CO 0.01 -0.09 -0.07 0.77 -1.00 0.00 0.00 179.01 178.63 2wzi h SER 478 N -0.14 -0.21 -0.11 1.42 0.02 -0.94 -1.71 113.55 111.88 2wzi h SER 478 Ca 0.07 0.04 0.04 0.00 -0.84 0.00 0.00 61.79 61.10 2wzi h SER 478 Cb 0.24 0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.84 2wzi h SER 478 CO -0.18 -0.10 -0.13 0.00 -1.14 0.00 0.00 176.83 175.28 2wzi h ALA 479 N 0.95 -0.06 -0.40 3.77 0.00 -0.75 -0.05 119.26 122.72 2wzi h ALA 479 Ca 0.05 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2wzi h ALA 479 Cb 0.16 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2wzi h ALA 479 CO -0.11 -0.59 -0.12 -0.44 0.00 0.00 0.00 179.25 177.99 2wzi h ASP 480 N -0.17 0.70 -0.30 0.00 3.32 -1.27 -1.33 116.42 117.38 2wzi h ASP 480 Ca 0.09 -0.21 -0.10 0.00 0.02 0.00 0.00 57.03 56.83 2wzi h ASP 480 Cb 0.29 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 2wzi h ASP 480 CO -0.21 0.85 -0.21 0.40 -1.72 0.00 0.00 179.24 178.34 2wzi h ILE 481 N 0.65 1.30 -0.69 0.35 2.04 -1.18 -3.09 117.51 116.88 2wzi h ILE 481 Ca 0.11 -1.35 -0.05 0.00 1.00 0.00 0.00 64.86 64.57 2wzi h ILE 481 Cb 0.58 1.52 -0.03 0.00 -0.74 0.00 0.00 36.82 38.15 2wzi h ILE 481 CO 0.04 0.43 0.25 -0.07 0.00 0.00 0.00 178.15 178.80 2wzi h LEU 482 N 0.42 0.97 -1.27 1.44 3.38 -0.83 -2.61 115.31 116.81 2wzi h LEU 482 Ca 0.06 -0.19 0.14 0.00 0.09 0.00 0.00 57.88 57.98 2wzi h LEU 482 Cb 0.76 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 41.19 2wzi h LEU 482 CO 0.06 0.90 0.57 -0.07 0.09 0.00 0.00 178.44 179.99 2wzi h LEU 483 N 0.99 0.67 -1.69 1.67 3.38 -1.25 -2.52 115.31 116.57 2wzi h LEU 483 Ca 0.23 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2wzi h LEU 483 Cb 0.25 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2wzi h LEU 483 CO -0.01 0.34 0.00 0.23 0.09 0.00 0.00 178.44 179.09 2wzi n MET 484 N -4.56 2.15 -2.32 1.13 2.81 -1.02 -4.94 117.12 110.36 2wzi n MET 484 Ca 0.17 -1.68 -0.42 0.00 -1.81 0.00 0.00 57.70 53.96 2wzi n MET 484 Cb 0.45 -1.47 -0.03 0.00 -0.71 0.00 0.00 33.22 31.47 2wzi n MET 484 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 2wzi s ASN 485 N -1.89 6.96 0.00 7.83 3.84 -0.95 -4.92 114.94 125.81 2wzi s ASN 485 Ca 0.32 2.08 0.11 0.00 0.21 0.00 0.00 52.86 55.59 2wzi s ASN 485 Cb 0.20 -2.57 0.29 0.00 -0.55 0.00 0.00 41.25 38.62 2wzi s ASN 485 CO 0.31 -0.58 1.22 0.35 -2.79 0.00 0.00 177.10 175.60 2wzi n THR 486 N 4.18 0.88 0.09 -5.21 -2.24 -1.26 -4.64 114.28 106.08 2wzi n THR 486 Ca 0.11 -0.94 -0.17 0.00 -2.27 0.00 0.00 64.05 60.77 2wzi n THR 486 Cb 0.45 0.59 -0.10 0.00 -2.10 0.00 0.00 70.33 69.16 2wzi n THR 486 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2wzi h GLU 487 N 2.13 0.44 -2.70 -0.78 4.81 -1.99 -3.36 114.58 113.12 2wzi h GLU 487 Ca 0.00 -0.58 -0.60 0.00 -0.13 0.00 0.00 59.36 58.04 2wzi h GLU 487 Cb 0.71 0.19 -0.40 0.00 0.63 0.00 0.00 28.75 29.89 2wzi h GLU 487 CO 0.00 1.23 -0.80 1.21 -0.73 0.00 0.00 179.01 179.92 2wzi s ASN 488 N -7.22 2.94 0.23 1.04 3.84 -1.26 -4.98 114.94 109.52 2wzi s ASN 488 Ca -0.06 -3.25 -0.08 0.00 0.21 0.00 0.00 52.86 49.67 2wzi s ASN 488 Cb 0.07 -0.93 0.21 0.00 -0.55 0.00 0.00 41.25 40.06 2wzi s ASN 488 CO 0.89 -0.16 1.90 0.11 -2.79 0.00 0.00 177.10 177.06 2wzi h LYS 489 N 5.74 1.14 -0.77 0.43 1.57 -1.83 -2.70 116.57 120.15 2wzi h LYS 489 Ca 0.18 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 2wzi h LYS 489 Cb 0.86 -0.26 -0.04 0.00 0.08 0.00 0.00 32.23 32.88 2wzi h LYS 489 CO 0.50 0.75 0.42 -1.35 -0.57 0.00 0.00 179.45 179.21 2wzi h PRO 490 N 1.17 1.07 -0.40 3.15 0.11 -1.96 -0.70 132.00 134.44 2wzi h PRO 490 Ca 0.32 -0.12 0.01 0.00 0.11 0.00 0.00 66.00 66.32 2wzi h PRO 490 Cb -0.12 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 30.75 2wzi h PRO 490 CO -0.07 0.79 0.26 1.25 -0.21 0.00 0.00 178.00 180.01 2wzi h LEU 491 N 1.08 0.44 -0.60 2.35 5.85 -1.91 -2.16 115.31 120.36 2wzi h LEU 491 Ca 0.27 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.94 2wzi h LEU 491 Cb 0.03 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 2wzi h LEU 491 CO -0.04 0.32 0.21 0.40 -0.34 0.00 0.00 178.44 178.99 2wzi h ILE 492 N 0.53 1.24 -0.46 4.05 1.08 -0.96 -1.87 117.51 121.12 2wzi h ILE 492 Ca 0.15 -0.78 0.08 0.00 -0.39 0.00 0.00 64.86 63.93 2wzi h ILE 492 Cb -0.05 0.61 -0.07 0.00 -3.07 0.00 0.00 36.82 34.24 2wzi h ILE 492 CO -0.04 0.30 0.03 0.58 -0.69 0.00 0.00 178.15 178.32 2wzi h VAL 493 N 0.85 0.67 -0.28 1.67 2.07 -1.08 0.25 116.25 120.41 2wzi h VAL 493 Ca 0.20 -0.05 0.01 0.00 0.82 0.00 0.00 66.70 67.68 2wzi h VAL 493 Cb 0.25 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 2wzi h VAL 493 CO -0.01 0.03 0.16 -0.33 0.02 0.00 0.00 177.57 177.44 2wzi h GLU 494 N 0.14 0.33 0.00 1.57 5.08 -0.71 -3.23 114.58 117.76 2wzi h GLU 494 Ca 0.23 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2wzi h GLU 494 Cb 0.33 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2wzi h GLU 494 CO -0.36 0.22 -0.77 0.44 -1.00 0.00 0.00 179.01 177.54 2wzi n ILE 495 N -4.93 0.20 -0.32 3.13 -5.35 -0.77 -4.55 119.36 106.78 2wzi n ILE 495 Ca -0.02 -0.20 0.09 0.00 -0.27 0.00 0.00 62.75 62.36 2wzi n ILE 495 Cb 0.04 0.11 0.21 0.00 -1.74 0.00 0.00 39.64 38.26 2wzi n ILE 495 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2wzi h THR 496 N 0.00 0.13 -0.74 7.28 2.02 -0.96 0.12 112.91 120.75 2wzi h THR 496 Ca 0.00 -0.01 -0.05 0.00 0.77 0.00 0.00 66.41 67.12 2wzi h THR 496 Cb 0.68 0.09 -0.03 0.00 -1.74 0.00 0.00 68.15 67.15 2wzi h THR 496 CO 0.00 0.01 0.27 -0.65 0.37 0.00 0.00 175.52 175.51 2wzi h PRO 497 N 0.04 1.13 -0.52 6.66 0.11 -1.83 -1.09 132.00 136.49 2wzi h PRO 497 Ca 0.50 -0.22 -0.08 0.00 0.11 0.00 0.00 66.00 66.31 2wzi h PRO 497 Cb 0.93 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.84 2wzi h PRO 497 CO -0.86 0.94 -0.01 -1.49 -0.21 0.00 0.00 178.00 176.37 2wzi h TRP 498 N 1.09 0.94 -0.85 0.65 6.55 -1.37 -2.18 115.95 120.78 2wzi h TRP 498 Ca 0.25 -0.14 0.01 0.00 0.95 0.00 0.00 58.89 59.95 2wzi h TRP 498 Cb 0.25 -0.25 -0.04 0.00 -0.86 0.00 0.00 29.16 28.26 2wzi h TRP 498 CO 0.02 0.86 0.56 0.28 -1.05 0.00 0.00 178.44 179.11 2wzi h VAL 499 N 0.81 1.22 -0.38 1.49 2.07 -0.40 0.17 116.25 121.23 2wzi h VAL 499 Ca 0.15 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 67.24 2wzi h VAL 499 Cb 0.49 -0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 2wzi h VAL 499 CO 0.02 0.21 0.12 0.45 0.02 0.00 0.00 177.57 178.39 2wzi h HIS 500 N 1.15 0.62 -0.71 1.57 3.86 -1.09 -1.51 115.15 119.04 2wzi h HIS 500 Ca 0.31 -0.06 -0.06 0.00 -1.16 0.00 0.00 60.37 59.40 2wzi h HIS 500 Cb -0.13 -0.18 -0.03 0.00 1.06 0.00 0.00 27.41 28.13 2wzi h HIS 500 CO -0.01 0.59 0.21 0.37 0.86 0.00 0.00 177.93 179.94 2wzi h GLN 501 N 0.47 1.10 -0.33 2.45 5.75 -1.11 -1.78 115.11 121.66 2wzi h GLN 501 Ca 0.12 -0.24 -0.03 0.00 -0.15 0.00 0.00 58.65 58.36 2wzi h GLN 501 Cb 0.26 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.64 2wzi h GLN 501 CO -0.00 0.95 0.10 0.35 -2.65 0.00 0.00 178.83 177.57 2wzi h PHE 502 N 1.06 0.53 -0.11 3.99 3.57 -0.87 -0.79 116.94 124.32 2wzi h PHE 502 Ca 0.23 -0.06 0.03 0.00 3.53 0.00 0.00 57.97 61.70 2wzi h PHE 502 Cb 0.31 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.87 2wzi h PHE 502 CO 0.02 0.54 -0.08 -0.22 -2.23 0.00 0.00 178.31 176.34 2wzi h LYS 503 N 0.37 -0.08 -0.59 1.11 3.64 -1.15 -2.00 116.57 117.87 2wzi h LYS 503 Ca 0.10 0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.59 2wzi h LYS 503 Cb 0.26 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.02 2wzi h LYS 503 CO -0.00 -0.05 0.19 -0.07 -2.27 0.00 0.00 179.45 177.25 2wzi h LEU 504 N -0.09 0.16 -0.39 5.20 3.38 -1.19 -1.27 115.31 121.11 2wzi h LEU 504 Ca 0.07 0.09 0.08 0.00 0.09 0.00 0.00 57.88 58.20 2wzi h LEU 504 Cb 0.19 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 40.95 2wzi h LEU 504 CO -0.16 0.10 -0.10 0.74 0.09 0.00 0.00 178.44 179.10 2wzi h THR 505 N 0.36 0.60 -0.38 0.22 2.02 -0.92 0.50 112.91 115.30 2wzi h THR 505 Ca 0.30 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.47 2wzi h THR 505 Cb 0.39 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 2wzi h THR 505 CO -0.33 0.00 0.18 0.00 0.37 0.00 0.00 175.52 175.74 2wzi h ALA 506 N 1.38 0.49 -0.67 6.16 0.00 -0.57 -0.29 119.26 125.76 2wzi h ALA 506 Ca 0.19 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.04 2wzi h ALA 506 Cb 0.29 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 2wzi h ALA 506 CO -0.41 0.06 0.38 0.93 0.00 0.00 0.00 179.25 180.21 2wzi h GLU 507 N 0.47 0.68 -0.47 0.00 5.08 -1.06 -1.71 114.58 117.57 2wzi h GLU 507 Ca 0.13 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2wzi h GLU 507 Cb 0.13 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2wzi h GLU 507 CO -0.02 0.45 0.24 1.98 -1.00 0.00 0.00 179.01 180.66 2wzi h MET 508 N 0.70 0.66 -0.37 2.33 4.05 -0.38 -1.85 114.93 120.08 2wzi h MET 508 Ca 0.30 -0.09 0.06 0.00 -0.28 0.00 0.00 59.70 59.69 2wzi h MET 508 Cb 0.18 -0.12 -0.05 0.00 -0.80 0.00 0.00 31.60 30.80 2wzi h MET 508 CO -0.18 0.55 0.04 0.78 0.23 0.00 0.00 176.91 178.32 2wzi h GLY 509 N 0.61 0.40 0.70 1.39 0.00 -0.77 0.13 103.07 105.53 2wzi h GLY 509 Ca 0.16 0.01 0.04 0.00 0.00 0.00 0.00 47.33 47.55 2wzi h GLY 509 CO -0.02 -0.06 0.16 0.83 0.00 0.00 0.00 176.54 177.45 2wzi h GLU 510 N 0.15 0.32 -0.45 4.80 5.08 -1.07 -0.80 114.58 122.62 2wzi h GLU 510 Ca 0.18 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.44 2wzi h GLU 510 Cb 0.23 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2wzi h GLU 510 CO -0.27 0.21 -0.04 0.93 -1.00 0.00 0.00 179.01 178.85 2wzi h GLU 511 N 0.33 0.81 -0.54 2.33 4.39 -0.99 -1.18 114.58 119.74 2wzi h GLU 511 Ca 0.18 -0.28 -0.03 0.00 0.34 0.00 0.00 59.36 59.57 2wzi h GLU 511 Cb 0.14 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.70 2wzi h GLU 511 CO -0.16 0.89 0.22 0.28 -1.16 0.00 0.00 179.01 179.08 2wzi h VAL 512 N 0.65 1.20 -0.11 3.13 2.07 -0.78 -1.36 116.25 121.05 2wzi h VAL 512 Ca 0.12 -0.61 -0.12 0.00 0.82 0.00 0.00 66.70 66.92 2wzi h VAL 512 Cb 0.55 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 2wzi h VAL 512 CO 0.03 0.24 -0.45 -0.07 0.02 0.00 0.00 177.57 177.34 2wzi h LEU 513 N 0.77 0.28 -0.95 2.57 3.38 -0.85 -2.19 115.31 118.33 2wzi h LEU 513 Ca 0.19 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 2wzi h LEU 513 Cb 0.15 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2wzi h LEU 513 CO -0.02 0.70 -0.03 0.11 0.09 0.00 0.00 178.44 179.30 2wzi h LYS 514 N 0.22 0.74 -0.75 1.13 1.57 -0.56 -1.68 116.57 117.23 2wzi h LYS 514 Ca 0.01 -0.20 0.03 0.00 -1.87 0.00 0.00 60.65 58.62 2wzi h LYS 514 Cb 0.89 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.08 2wzi h LYS 514 CO 0.07 0.77 0.50 0.52 -0.57 0.00 0.00 179.45 180.73 2wzi h MET 515 N 0.69 0.92 -0.34 3.15 2.86 -0.80 0.72 114.93 122.12 2wzi h MET 515 Ca 0.13 -0.06 -0.11 0.00 -2.06 0.00 0.00 59.70 57.61 2wzi h MET 515 Cb 0.46 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 2wzi h MET 515 CO 0.02 0.61 -0.20 0.28 1.06 0.00 0.00 176.91 178.68 2wzi h VAL 516 N 0.95 1.29 0.13 -2.22 2.07 -0.86 -3.08 116.25 114.53 2wzi h VAL 516 Ca 0.29 -1.33 -0.01 0.00 0.82 0.00 0.00 66.70 66.47 2wzi h VAL 516 Cb -0.01 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 2wzi h VAL 516 CO -0.08 0.44 -0.06 -0.33 0.02 0.00 0.00 177.57 177.56 2wzi h GLU 517 N 0.51 -0.16 0.00 1.57 5.08 -0.99 -3.46 114.58 117.12 2wzi h GLU 517 Ca 0.07 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2wzi h GLU 517 Cb 0.75 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.04 2wzi h GLU 517 CO 0.06 0.06 0.00 0.41 -1.00 0.00 0.00 179.01 178.54 2wzi n GLY 518 N -0.61 1.90 7.00 -3.84 0.00 0.25 -4.93 105.19 104.95 2wzi n GLY 518 Ca -0.09 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.72 2wzi n GLY 518 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wzi n ARG 519 N 0.00 0.00 -3.35 1.61 1.74 -1.26 -3.71 116.66 111.68 2wzi n ARG 519 Ca 0.00 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.87 2wzi n ARG 519 Cb 0.00 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 31.45 2wzi n ARG 519 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2wzi s ASN 520 N -4.00 5.09 0.12 0.55 2.20 -1.26 -4.97 114.94 112.67 2wzi s ASN 520 Ca 0.00 -0.83 -0.23 0.00 -0.94 0.00 0.00 52.86 50.86 2wzi s ASN 520 Cb 0.00 -0.08 -0.04 0.00 -2.00 0.00 0.00 41.25 39.13 2wzi s ASN 520 CO 0.00 -1.01 1.67 -0.08 -2.94 0.00 0.00 177.10 174.75 2wzi h GLU 521 N 0.61 -0.20 -0.89 3.55 4.81 -2.00 -1.94 114.58 118.52 2wzi h GLU 521 Ca -0.36 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 2wzi h GLU 521 Cb 1.28 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.67 2wzi h GLU 521 CO 0.49 -0.13 0.57 1.03 -0.73 0.00 0.00 179.01 180.24 2wzi h SER 522 N -0.20 1.04 -0.29 1.04 0.87 -1.96 -1.23 113.55 112.81 2wzi h SER 522 Ca 0.08 -0.04 -0.15 0.00 -1.23 0.00 0.00 61.79 60.45 2wzi h SER 522 Cb 0.31 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.01 2wzi h SER 522 CO -0.20 0.77 -0.39 0.22 -0.53 0.00 0.00 176.83 176.70 2wzi h TYR 523 N 1.22 0.95 -0.46 2.24 3.20 -1.80 -2.06 116.97 120.25 2wzi h TYR 523 Ca 0.32 -0.31 0.04 0.00 3.14 0.00 0.00 58.73 61.92 2wzi h TYR 523 Cb -0.11 -0.19 -0.04 0.00 1.54 0.00 0.00 36.73 37.93 2wzi h TYR 523 CO 0.00 1.10 0.24 0.35 -1.64 0.00 0.00 178.16 178.20 2wzi h PHE 524 N 0.53 0.43 -0.68 -3.82 3.57 -1.00 -1.33 116.94 114.65 2wzi h PHE 524 Ca 0.03 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 2wzi h PHE 524 Cb 0.98 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.56 2wzi h PHE 524 CO 0.07 0.22 0.26 -0.07 -2.23 0.00 0.00 178.31 176.56 2wzi h LEU 525 N 0.47 0.93 -0.47 0.59 3.38 -1.12 0.13 115.31 119.21 2wzi h LEU 525 Ca 0.20 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2wzi h LEU 525 Cb 0.10 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2wzi h LEU 525 CO -0.14 0.84 0.26 0.03 0.09 0.00 0.00 178.44 179.52 2wzi h ARG 526 N 0.99 0.66 -0.34 1.13 3.08 -0.93 -1.17 114.38 117.80 2wzi h ARG 526 Ca 0.23 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 60.18 2wzi h ARG 526 Cb 0.21 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 2wzi h ARG 526 CO -0.02 0.52 0.15 0.87 -1.07 0.00 0.00 179.97 180.42 2wzi h LYS 527 N 0.63 0.51 -0.44 0.04 1.79 -0.66 -1.27 116.57 117.16 2wzi h LYS 527 Ca 0.17 -0.09 0.05 0.00 -2.18 0.00 0.00 60.65 58.60 2wzi h LYS 527 Cb 0.06 -0.08 -0.05 0.00 -1.58 0.00 0.00 32.23 30.57 2wzi h LYS 527 CO -0.03 0.49 0.18 -0.92 -1.08 0.00 0.00 179.45 178.09 2wzi h TYR 528 N 0.41 0.32 -0.31 -1.35 3.20 -0.65 -0.72 116.97 117.87 2wzi h TYR 528 Ca 0.12 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.94 2wzi h TYR 528 Cb 0.16 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 2wzi h TYR 528 CO -0.01 0.13 -0.11 -0.91 -1.64 0.00 0.00 178.16 175.63 2wzi h ASN 529 N 0.36 0.50 -0.45 -2.11 -0.26 -1.03 -2.00 115.58 110.58 2wzi h ASN 529 Ca 0.20 -0.13 -0.06 0.00 -0.56 0.00 0.00 56.30 55.76 2wzi h ASN 529 Cb 0.17 -0.13 -0.02 0.00 -1.06 0.00 0.00 38.32 37.28 2wzi h ASN 529 CO -0.19 0.64 0.05 -0.74 -1.06 0.00 0.00 177.43 176.14 2wzi h HIS 530 N 0.48 0.82 -0.33 1.19 2.76 -0.55 -2.30 115.15 117.22 2wzi h HIS 530 Ca 0.09 -0.12 0.03 0.00 -2.20 0.00 0.00 60.37 58.17 2wzi h HIS 530 Cb 0.48 -0.22 -0.03 0.00 1.55 0.00 0.00 27.41 29.18 2wzi h HIS 530 CO 0.02 0.78 0.13 0.28 -1.30 0.00 0.00 177.93 177.84 2wzi h VAL 531 N 0.62 0.94 -0.69 5.26 2.07 -0.89 -0.51 116.25 123.05 2wzi h VAL 531 Ca 0.14 -0.10 0.07 0.00 0.82 0.00 0.00 66.70 67.63 2wzi h VAL 531 Cb 0.42 0.63 -0.06 0.00 -1.52 0.00 0.00 31.29 30.75 2wzi h VAL 531 CO 0.01 0.05 0.37 0.11 0.02 0.00 0.00 177.57 178.13 2wzi h LYS 532 N 0.29 0.64 -0.61 1.57 1.79 -1.27 0.84 116.57 119.82 2wzi h LYS 532 Ca 0.14 -0.04 -0.03 0.00 -2.18 0.00 0.00 60.65 58.55 2wzi h LYS 532 Cb 0.09 -0.14 -0.03 0.00 -1.58 0.00 0.00 32.23 30.57 2wzi h LYS 532 CO -0.13 0.42 0.27 0.00 -1.08 0.00 0.00 179.45 178.94 2wzi h ALA 533 N 1.38 0.79 -0.45 3.86 0.00 -1.08 -1.59 119.26 122.17 2wzi h ALA 533 Ca 0.32 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 2wzi h ALA 533 Cb 0.26 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2wzi h ALA 533 CO -0.22 0.38 -0.07 -0.07 0.00 0.00 0.00 179.25 179.27 2wzi h LEU 534 N 0.84 0.76 -0.38 0.00 3.38 -0.48 -1.03 115.31 118.41 2wzi h LEU 534 Ca 0.21 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.99 2wzi h LEU 534 Cb 0.16 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 2wzi h LEU 534 CO -0.02 0.87 0.20 1.56 0.09 0.00 0.00 178.44 181.14 2wzi h GLN 535 N 0.72 0.40 -0.92 1.13 4.20 -0.58 -1.21 115.11 118.84 2wzi h GLN 535 Ca 0.13 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.82 2wzi h GLN 535 Cb 0.54 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.18 2wzi h GLN 535 CO 0.03 0.26 0.58 1.96 -0.67 0.00 0.00 178.83 180.99 2wzi h GLN 536 N 0.41 1.23 -0.82 1.46 4.20 -1.06 -0.88 115.11 119.64 2wzi h GLN 536 Ca 0.16 -0.09 -0.04 0.00 0.06 0.00 0.00 58.65 58.73 2wzi h GLN 536 Cb 0.04 -0.27 -0.04 0.00 0.30 0.00 0.00 27.48 27.52 2wzi h GLN 536 CO -0.09 0.84 0.36 1.96 -0.67 0.00 0.00 178.83 181.22 2wzi h GLN 537 N 1.26 1.21 -0.34 1.46 4.20 -0.80 -0.57 115.11 121.52 2wzi h GLN 537 Ca 0.33 -0.20 -0.05 0.00 0.06 0.00 0.00 58.65 58.80 2wzi h GLN 537 Cb -0.10 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.46 2wzi h GLN 537 CO -0.07 0.95 0.02 0.52 -0.67 0.00 0.00 178.83 179.59 2wzi h MET 538 N 1.18 0.58 -0.91 1.46 2.86 -0.69 -1.85 114.93 117.57 2wzi h MET 538 Ca 0.28 -0.17 0.15 0.00 -2.06 0.00 0.00 59.70 57.89 2wzi h MET 538 Cb 0.17 -0.06 -0.09 0.00 0.06 0.00 0.00 31.60 31.68 2wzi h MET 538 CO -0.03 0.69 0.51 0.35 1.06 0.00 0.00 176.91 179.49 2wzi h PHE 539 N 0.39 0.90 -0.40 -0.22 3.57 -0.92 -0.17 116.94 120.09 2wzi h PHE 539 Ca 0.10 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 2wzi h PHE 539 Cb 0.41 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 2wzi h PHE 539 CO 0.03 0.24 0.13 -0.92 -2.23 0.00 0.00 178.31 175.56 2wzi h TYR 540 N 0.72 0.65 -0.21 0.41 3.20 -0.51 -0.18 116.97 121.04 2wzi h TYR 540 Ca 0.49 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 62.30 2wzi h TYR 540 Cb 0.67 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.74 2wzi h TYR 540 CO -0.06 0.60 0.13 0.82 -1.64 0.00 0.00 178.16 178.02 2wzi h ILE 541 N 0.51 1.08 0.00 1.81 2.04 -0.86 -1.32 117.51 120.76 2wzi h ILE 541 Ca 0.13 -0.18 -0.00 0.00 1.00 0.00 0.00 64.86 65.81 2wzi h ILE 541 Cb 0.26 0.82 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 2wzi h ILE 541 CO -0.00 0.07 -0.01 -0.78 0.00 0.00 0.00 178.15 177.42 2wzi h ASP 542 N 0.26 0.00 0.23 1.72 3.58 -0.64 0.46 116.42 122.03 2wzi h ASP 542 Ca 0.08 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.53 2wzi h ASP 542 Cb 0.01 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.06 2wzi h ASP 542 CO -0.01 0.01 -1.31 0.00 -2.88 0.00 0.00 179.24 175.05 2wzi n GLN 543 N -3.76 0.35 -0.03 0.28 1.13 -0.12 -3.80 117.38 111.44 2wzi n GLN 543 Ca -0.03 -0.06 -0.01 0.00 -1.94 0.00 0.00 57.00 54.96 2wzi n GLN 543 Cb 0.10 -1.56 -0.06 0.00 0.11 0.00 0.00 30.24 28.83 2wzi n GLN 543 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2wzi n THR 544 N -1.97 0.34 -3.76 5.09 -2.24 -0.53 -4.93 114.28 106.28 2wzi n THR 544 Ca 0.01 -0.27 -0.33 0.00 -2.27 0.00 0.00 64.05 61.19 2wzi n THR 544 Cb 0.46 -0.46 -0.05 0.00 -2.10 0.00 0.00 70.33 68.18 2wzi n THR 544 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2wzi s SER 545 N -3.58 6.48 -1.28 3.42 0.01 0.10 -4.55 113.70 114.28 2wzi s SER 545 Ca -0.03 0.53 -0.02 0.00 1.31 0.00 0.00 55.95 57.73 2wzi s SER 545 Cb 0.03 -2.07 -0.00 0.00 0.21 0.00 0.00 66.02 64.18 2wzi s SER 545 CO 0.30 0.19 0.71 -3.20 0.41 0.00 0.00 173.24 171.65 2wzi n ASN 546 N 0.73 -1.82 -3.72 2.44 5.15 -1.26 -3.22 115.26 113.55 2wzi n ASN 546 Ca -0.08 -0.84 -0.42 0.00 -0.60 0.00 0.00 54.58 52.64 2wzi n ASN 546 Cb 0.52 -4.02 -0.00 0.00 -0.53 0.00 0.00 39.78 35.75 2wzi n ASN 546 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2wzi n GLN 547 N -4.21 3.57 -2.06 1.20 1.13 -1.26 -0.94 117.38 114.81 2wzi n GLN 547 Ca -0.27 -3.15 -0.29 0.00 -1.94 0.00 0.00 57.00 51.35 2wzi n GLN 547 Cb 0.67 -2.97 0.03 0.00 0.11 0.00 0.00 30.24 28.08 2wzi n GLN 547 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2wzi s ASN 548 N 1.51 5.71 0.00 1.08 2.20 -1.26 -4.97 114.94 119.22 2wzi s ASN 548 Ca 0.46 1.08 0.22 0.00 -0.94 0.00 0.00 52.86 53.69 2wzi s ASN 548 Cb 0.13 -2.02 1.17 0.00 -2.00 0.00 0.00 41.25 38.52 2wzi s ASN 548 CO -0.04 -1.11 1.71 -2.65 -2.94 0.00 0.00 177.10 172.06 2wzi n PRO 549 N -2.80 0.42 -0.00 3.55 -0.02 -1.26 -3.67 135.00 131.22 2wzi n PRO 549 Ca 0.06 0.06 -0.04 0.00 -2.02 0.00 0.00 63.50 61.56 2wzi n PRO 549 Cb 0.56 -1.50 -0.01 0.00 -0.02 0.00 0.00 33.50 32.53 2wzi n PRO 549 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2wzi n TYR 550 N -1.21 0.00 -3.47 6.00 4.01 -1.26 -4.86 117.16 116.37 2wzi n TYR 550 Ca 0.12 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.60 2wzi n TYR 550 Cb 0.15 -0.18 -0.09 0.00 -0.31 0.00 0.00 39.34 38.91 2wzi n TYR 550 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2wzi n GLN 551 N -3.68 1.23 -1.91 -0.72 3.00 -1.26 -5.01 117.38 109.03 2wzi n GLN 551 Ca -0.07 -3.84 -0.35 0.00 -0.01 0.00 0.00 57.00 52.74 2wzi n GLN 551 Cb 0.26 -1.83 0.04 0.00 0.00 0.00 0.00 30.24 28.70 2wzi n GLN 551 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 2wzi s PRO 552 N -1.18 2.86 0.00 -1.09 0.04 -1.24 -2.45 135.00 131.93 2wzi s PRO 552 Ca 0.33 1.72 0.00 0.00 0.04 0.00 0.00 61.00 63.09 2wzi s PRO 552 Cb 0.08 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.69 2wzi s PRO 552 CO -0.13 -1.27 0.00 0.41 0.04 0.00 0.00 177.00 176.05 2wzi n GLY 553 N 0.28 -1.26 2.59 0.56 0.00 -0.12 -4.79 105.19 102.46 2wzi n GLY 553 Ca 0.13 -2.11 -0.28 0.00 0.00 0.00 0.00 46.02 43.76 2wzi n GLY 553 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wzi s VAL 554 N 0.00 0.07 -0.05 1.61 1.01 -1.26 -4.34 120.40 117.45 2wzi s VAL 554 Ca 0.00 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.26 2wzi s VAL 554 Cb 0.00 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 2wzi s VAL 554 CO 0.00 -0.60 0.07 -0.54 0.00 0.00 0.00 175.10 174.03 2wzi s LYS 555 N 2.04 3.10 0.05 2.72 -0.14 0.07 -4.71 119.74 122.87 2wzi s LYS 555 Ca 0.07 -0.40 -0.16 0.00 -1.36 0.00 0.00 55.97 54.12 2wzi s LYS 555 Cb -0.16 -2.90 0.03 0.00 -1.68 0.00 0.00 37.83 33.12 2wzi s LYS 555 CO -0.28 0.69 0.36 -0.08 -0.76 0.00 0.00 175.35 175.28 2wzi s THR 556 N -1.08 0.07 -1.56 2.17 -1.32 -1.26 -4.52 115.64 108.14 2wzi s THR 556 Ca 0.19 -0.57 -0.08 0.00 -1.21 0.00 0.00 61.69 60.02 2wzi s THR 556 Cb -0.12 -0.95 0.07 0.00 -1.51 0.00 0.00 72.50 69.99 2wzi s THR 556 CO 0.09 -0.31 0.53 0.00 -2.21 0.00 0.00 174.62 172.71 2wzi n ALA 557 N 0.51 -1.67 0.09 11.08 0.00 -0.58 -4.77 120.51 125.17 2wzi n ALA 557 Ca -0.18 -0.17 0.02 0.00 0.00 0.00 0.00 53.44 53.10 2wzi n ALA 557 Cb 0.60 -2.27 -0.02 0.00 0.00 0.00 0.00 19.45 17.75 2wzi n ALA 557 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2wzi h THR 558 N -1.67 0.64 0.14 0.00 1.35 -1.92 -0.84 112.91 110.62 2wzi h THR 558 Ca -0.62 -2.03 -0.25 0.00 -0.55 0.00 0.00 66.41 62.96 2wzi h THR 558 Cb 1.38 2.19 0.03 0.00 -1.73 0.00 0.00 68.15 70.02 2wzi h THR 558 CO 0.71 0.37 -1.05 -0.09 -0.25 0.00 0.00 175.52 175.21 2wzi h ARG 559 N 0.00 0.47 0.00 4.72 2.43 -1.92 -3.39 114.38 116.68 2wzi h ARG 559 Ca -0.07 -0.69 0.00 0.00 -0.81 0.00 0.00 59.98 58.41 2wzi h ARG 559 Cb 1.44 0.24 0.00 0.00 -0.42 0.00 0.00 29.97 31.23 2wzi h ARG 559 CO 0.05 1.31 -0.54 0.28 -1.51 0.00 0.00 179.97 179.56 2wzi n VAL 560 N -3.96 0.21 -0.07 0.20 0.31 -1.26 -4.78 118.33 108.98 2wzi n VAL 560 Ca -0.14 0.07 -0.11 0.00 -0.01 0.00 0.00 64.34 64.15 2wzi n VAL 560 Cb 0.91 -1.23 -0.04 0.00 -0.91 0.00 0.00 33.84 32.57 2wzi n VAL 560 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2wzi h ILE 561 N 0.00 1.22 -0.10 2.52 2.04 -1.84 -2.31 117.51 119.04 2wzi h ILE 561 Ca 0.00 -0.71 -0.09 0.00 1.00 0.00 0.00 64.86 65.05 2wzi h ILE 561 Cb 0.54 1.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 2wzi h ILE 561 CO 0.00 0.22 -0.29 0.50 0.00 0.00 0.00 178.15 178.58 2wzi h LYS 562 N 0.16 0.37 -0.62 2.37 1.63 -1.40 -2.07 116.57 117.01 2wzi h LYS 562 Ca 0.07 -0.27 0.08 0.00 -0.85 0.00 0.00 60.65 59.68 2wzi h LYS 562 Cb 0.30 0.04 -0.06 0.00 -0.60 0.00 0.00 32.23 31.91 2wzi h LYS 562 CO 0.00 0.89 0.28 -1.35 -3.45 0.00 0.00 179.45 175.82 2wzi h PRO 563 N -0.08 0.50 -0.02 1.90 0.11 -1.76 0.19 132.00 132.84 2wzi h PRO 563 Ca -0.01 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 66.10 2wzi h PRO 563 Cb 0.91 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 31.87 2wzi h PRO 563 CO 0.06 0.33 -0.18 1.25 -0.21 0.00 0.00 178.00 179.25 2wzi h LEU 564 N 0.51 -0.54 -0.51 2.35 5.85 -1.39 0.13 115.31 121.71 2wzi h LEU 564 Ca 0.30 0.08 0.07 0.00 0.84 0.00 0.00 57.88 59.16 2wzi h LEU 564 Cb 0.29 0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.50 2wzi h LEU 564 CO -0.25 -0.25 0.20 0.40 -0.34 0.00 0.00 178.44 178.20 2wzi h ILE 565 N -0.29 0.85 -0.38 4.05 2.04 -0.96 -0.94 117.51 121.88 2wzi h ILE 565 Ca 0.06 -0.13 -0.07 0.00 1.00 0.00 0.00 64.86 65.72 2wzi h ILE 565 Cb 0.37 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 2wzi h ILE 565 CO -0.19 0.07 -0.05 0.44 0.00 0.00 0.00 178.15 178.42 2wzi h ASP 566 N 0.38 0.70 0.23 1.72 3.32 -0.59 -0.91 116.42 121.26 2wzi h ASP 566 Ca 0.24 -0.34 -0.17 0.00 0.02 0.00 0.00 57.03 56.78 2wzi h ASP 566 Cb 0.25 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 2wzi h ASP 566 CO -0.23 0.87 -0.67 0.03 -1.72 0.00 0.00 179.24 177.51 2wzi h ARG 567 N 0.51 0.41 -0.37 3.56 3.08 -0.58 -1.30 114.38 119.69 2wzi h ARG 567 Ca 0.10 -0.31 -0.06 0.00 0.07 0.00 0.00 59.98 59.78 2wzi h ARG 567 Cb 0.54 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 2wzi h ARG 567 CO 0.03 0.94 -0.02 1.15 -1.07 0.00 0.00 179.97 180.99 2wzi h THR 568 N 0.29 1.26 0.09 2.04 2.02 -1.14 -1.90 112.91 115.58 2wzi h THR 568 Ca -0.02 -1.03 0.02 0.00 0.77 0.00 0.00 66.41 66.15 2wzi h THR 568 Cb 1.23 1.20 -0.03 0.00 -1.74 0.00 0.00 68.15 68.81 2wzi h THR 568 CO 0.12 0.34 -0.22 0.15 0.37 0.00 0.00 175.52 176.28 2wzi h PHE 569 N 0.47 -0.59 -0.96 3.16 3.57 -0.97 -0.97 116.94 120.66 2wzi h PHE 569 Ca 0.10 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.67 2wzi h PHE 569 Cb 0.50 0.25 -0.06 0.00 2.79 0.00 0.00 35.95 39.42 2wzi h PHE 569 CO 0.04 -0.32 0.62 0.00 -2.23 0.00 0.00 178.31 176.43 2wzi h ALA 570 N 0.39 1.42 0.13 2.41 0.00 -1.19 -1.84 119.26 120.58 2wzi h ALA 570 Ca 0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2wzi h ALA 570 Cb 0.44 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2wzi h ALA 570 CO -0.14 0.46 -0.06 1.15 0.00 0.00 0.00 179.25 180.66 2wzi h THR 571 N 1.15 1.05 -0.24 0.00 2.02 -1.12 -2.05 112.91 113.72 2wzi h THR 571 Ca 0.40 -0.91 -0.05 0.00 0.77 0.00 0.00 66.41 66.62 2wzi h THR 571 Cb 0.10 1.59 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 2wzi h THR 571 CO -0.14 0.21 -0.06 1.62 0.37 0.00 0.00 175.52 177.52 2wzi h VAL 572 N -0.62 1.18 -0.46 3.16 3.04 -1.01 -1.04 116.25 120.50 2wzi h VAL 572 Ca -0.02 -0.75 -0.06 0.00 -1.01 0.00 0.00 66.70 64.86 2wzi h VAL 572 Cb 0.48 1.07 -0.02 0.00 -2.01 0.00 0.00 31.29 30.81 2wzi h VAL 572 CO 0.03 0.25 0.05 0.58 -1.01 0.00 0.00 177.57 177.46 2wzi h VAL 573 N 0.35 1.25 -0.41 1.51 2.07 -1.38 -1.10 116.25 118.55 2wzi h VAL 573 Ca 0.08 -0.97 0.05 0.00 0.82 0.00 0.00 66.70 66.68 2wzi h VAL 573 Cb 0.34 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 31.04 2wzi h VAL 573 CO 0.01 0.34 0.15 0.50 0.02 0.00 0.00 177.57 178.59 2wzi h LYS 574 N 0.64 0.30 -0.57 1.57 3.64 -0.48 -0.10 116.57 121.56 2wzi h LYS 574 Ca 0.14 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.40 2wzi h LYS 574 Cb 0.43 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 2wzi h LYS 574 CO 0.01 0.20 -0.01 0.74 -2.27 0.00 0.00 179.45 178.12 2wzi h PHE 575 N 0.31 1.12 -0.46 1.91 0.04 -1.09 -1.36 116.94 117.41 2wzi h PHE 575 Ca 0.19 -0.20 -0.00 0.00 2.80 0.00 0.00 57.97 60.76 2wzi h PHE 575 Cb 0.17 -0.29 -0.02 0.00 2.20 0.00 0.00 35.95 38.01 2wzi h PHE 575 CO -0.15 1.00 0.28 0.35 -0.60 0.00 0.00 178.31 179.20 2wzi h PHE 576 N 0.91 0.60 -0.96 -0.55 3.57 -0.86 0.17 116.94 119.83 2wzi h PHE 576 Ca 0.16 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.68 2wzi h PHE 576 Cb 0.57 -0.20 -0.05 0.00 2.79 0.00 0.00 35.95 39.06 2wzi h PHE 576 CO 0.04 0.42 0.63 -0.91 -2.23 0.00 0.00 178.31 176.26 2wzi h ASN 577 N 0.62 1.08 -0.04 0.41 2.35 -0.82 0.10 115.58 119.28 2wzi h ASN 577 Ca 0.17 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.89 2wzi h ASN 577 Cb -0.01 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.09 2wzi h ASN 577 CO -0.03 0.77 -0.00 1.56 -1.65 0.00 0.00 177.43 178.07 2wzi h GLN 578 N 1.27 0.07 -0.40 0.81 4.20 -0.78 -1.40 115.11 118.88 2wzi h GLN 578 Ca 0.36 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 59.01 2wzi h GLN 578 Cb -0.10 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 2wzi h GLN 578 CO -0.09 0.37 0.09 -0.22 -0.67 0.00 0.00 178.83 178.31 2wzi h LYS 579 N -0.25 0.64 -0.59 1.46 3.64 -0.47 -3.18 116.57 117.82 2wzi h LYS 579 Ca 0.01 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2wzi h LYS 579 Cb 0.34 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 2wzi h LYS 579 CO 0.00 0.67 0.00 1.19 -2.27 0.00 0.00 179.45 179.04 2wzi n PHE 580 N -4.56 1.10 -3.82 1.91 3.72 0.34 -4.95 117.46 111.20 2wzi n PHE 580 Ca -0.01 -0.57 -0.30 0.00 -0.05 0.00 0.00 57.45 56.52 2wzi n PHE 580 Cb 0.21 -0.13 -0.01 0.00 -0.94 0.00 0.00 39.48 38.61 2wzi n PHE 580 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2wzi n ASN 581 N 1.06 -3.86 -5.02 4.37 4.05 -0.62 -4.97 115.26 110.28 2wzi n ASN 581 Ca 0.22 -0.72 -0.19 0.00 0.45 0.00 0.00 54.58 54.35 2wzi n ASN 581 Cb 0.72 -3.15 0.04 0.00 1.23 0.00 0.00 39.78 38.62 2wzi n ASN 581 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2wzi s ALA 582 N -3.15 4.61 -0.34 5.20 0.00 -0.66 -5.03 121.76 122.39 2wzi s ALA 582 Ca 0.60 -1.92 0.16 0.00 0.00 0.00 0.00 51.96 50.80 2wzi s ALA 582 Cb -0.32 -1.50 0.45 0.00 0.00 0.00 0.00 23.12 21.76 2wzi s ALA 582 CO 0.74 -0.59 0.99 0.72 0.00 0.00 0.00 175.76 177.62 2wzi n HIS 583 N -2.04 1.59 -2.02 0.00 8.25 -1.26 -4.63 115.22 115.11 2wzi n HIS 583 Ca 0.12 -2.82 -0.39 0.00 -0.26 0.00 0.00 57.72 54.37 2wzi n HIS 583 Cb 0.61 -0.32 0.01 0.00 1.12 0.00 0.00 29.99 31.40 2wzi n HIS 583 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2wzi s LEU 584 N -3.23 4.09 -0.04 2.41 1.43 -1.26 -4.96 118.68 117.11 2wzi s LEU 584 Ca 0.31 2.62 -0.30 0.00 -1.03 0.00 0.00 54.13 55.73 2wzi s LEU 584 Cb 0.44 -4.06 -0.04 0.00 0.03 0.00 0.00 46.19 42.57 2wzi s LEU 584 CO -0.01 -1.04 1.21 -0.62 0.23 0.00 0.00 176.35 176.12 2wzi s ASP 585 N -0.90 7.05 0.00 2.29 -1.08 -1.26 -4.96 116.67 117.82 2wzi s ASP 585 Ca 0.62 1.85 0.25 0.00 -0.52 0.00 0.00 52.55 54.74 2wzi s ASP 585 Cb -0.37 -2.56 0.38 0.00 -1.46 0.00 0.00 42.92 38.91 2wzi s ASP 585 CO 0.46 -0.57 1.36 0.00 0.52 0.00 0.00 175.17 176.94 2wzi n ALA 586 N 5.04 2.63 -1.77 3.66 0.00 -1.26 -4.99 120.51 123.82 2wzi n ALA 586 Ca 0.11 -0.62 -0.37 0.00 0.00 0.00 0.00 53.44 52.55 2wzi n ALA 586 Cb 0.46 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 19.02 2wzi n ALA 586 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2wzi s THR 587 N -2.07 2.84 -0.41 0.00 -4.23 -1.26 -4.38 115.64 106.12 2wzi s THR 587 Ca 0.29 0.62 0.12 0.00 -1.18 0.00 0.00 61.69 61.54 2wzi s THR 587 Cb 0.20 -3.31 -0.15 0.00 1.34 0.00 0.00 72.50 70.58 2wzi s THR 587 CO 0.35 -0.01 0.44 0.35 -0.54 0.00 0.00 174.62 175.21 2wzi n THR 588 N -0.67 0.00 -4.95 3.99 -2.24 -1.26 -4.89 114.28 104.26 2wzi n THR 588 Ca 0.08 -0.24 -0.32 0.00 -2.27 0.00 0.00 64.05 61.30 2wzi n THR 588 Cb 0.47 0.77 -0.14 0.00 -2.10 0.00 0.00 70.33 69.33 2wzi n THR 588 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2wzi s ASP 589 N -2.52 3.84 0.21 3.42 1.01 -1.26 -4.95 116.67 116.41 2wzi s ASP 589 Ca 0.02 -0.28 -0.30 0.00 0.71 0.00 0.00 52.55 52.70 2wzi s ASP 589 Cb 0.09 -0.94 -0.10 0.00 1.01 0.00 0.00 42.92 42.98 2wzi s ASP 589 CO 0.50 0.30 1.44 -0.47 0.21 0.00 0.00 175.17 177.16 2wzi s TYR 590 N -0.46 3.08 -0.09 4.23 5.04 -1.26 -5.01 117.35 122.88 2wzi s TYR 590 Ca 0.06 0.97 -0.03 0.00 -2.44 0.00 0.00 57.07 55.63 2wzi s TYR 590 Cb -0.12 -3.80 0.04 0.00 0.35 0.00 0.00 41.96 38.43 2wzi s TYR 590 CO 0.02 -2.69 0.06 1.41 -1.34 0.00 0.00 175.55 173.01 2wzi s MET 591 N 0.08 0.12 0.31 4.97 -2.45 -1.26 -4.91 119.30 116.16 2wzi s MET 591 Ca 0.61 0.17 0.16 0.00 -1.25 0.00 0.00 55.69 55.39 2wzi s MET 591 Cb -0.41 -1.00 0.15 0.00 1.25 0.00 0.00 34.83 34.82 2wzi s MET 591 CO 0.39 -0.42 1.49 -1.00 1.05 0.00 0.00 175.02 176.53 2wzi h PRO 592 N 8.40 0.00 -6.38 4.11 0.13 -1.99 -3.44 132.00 132.84 2wzi h PRO 592 Ca -0.14 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.44 2wzi h PRO 592 Cb 1.13 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.22 2wzi h PRO 592 CO 0.21 0.43 -0.12 -1.01 -0.23 0.00 0.00 178.00 177.28 2wzi s HIS 593 N -3.04 3.49 0.13 1.56 3.76 -1.26 -4.25 115.29 115.68 2wzi s HIS 593 Ca 0.04 0.92 0.05 0.00 -0.15 0.00 0.00 55.06 55.92 2wzi s HIS 593 Cb 0.07 -2.28 -0.04 0.00 1.11 0.00 0.00 32.58 31.44 2wzi s HIS 593 CO 0.73 0.34 0.07 0.15 -0.85 0.00 0.00 174.74 175.18 2wzi s LYS 594 N -2.50 2.75 0.00 1.40 1.02 0.38 -4.98 119.74 117.81 2wzi s LYS 594 Ca 0.43 -0.85 0.00 0.00 0.02 0.00 0.00 55.97 55.58 2wzi s LYS 594 Cb -0.12 -2.60 0.00 0.00 -0.52 0.00 0.00 37.83 34.58 2wzi s LYS 594 CO 0.20 0.51 0.00 -0.12 -0.92 0.00 0.00 175.35 175.03 2wzi n MET 595 N 0.09 0.00 -1.72 1.68 0.00 -1.26 -0.20 117.12 115.72 2wzi n MET 595 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.61 2wzi n MET 595 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.75 2wzi n MET 595 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 2wzi n LEU 605 N 0.00 -2.19 -4.72 -0.89 4.77 -1.26 -4.94 117.00 107.78 2wzi n LEU 605 Ca 0.00 1.84 -0.42 0.00 -0.03 0.00 0.00 56.01 57.41 2wzi n LEU 605 Cb 0.00 -2.11 -0.03 0.00 -2.33 0.00 0.00 43.42 38.95 2wzi n LEU 605 CO 0.00 -0.91 0.97 -2.16 -1.33 0.00 0.00 177.39 173.96 2wzi s PRO 606 N -0.28 4.39 0.68 3.23 0.04 -1.26 -4.82 135.00 136.97 2wzi s PRO 606 Ca 0.00 1.93 -0.16 0.00 0.04 0.00 0.00 61.00 62.81 2wzi s PRO 606 Cb 0.00 -3.28 0.01 0.00 0.04 0.00 0.00 34.50 31.27 2wzi s PRO 606 CO 0.00 -0.32 1.18 -0.51 0.04 0.00 0.00 177.00 177.39 2wzi s LEU 607 N 0.88 3.41 0.09 -3.56 1.43 -1.26 -0.77 118.68 118.90 2wzi s LEU 607 Ca 0.61 2.25 0.05 0.00 -1.03 0.00 0.00 54.13 56.01 2wzi s LEU 607 Cb -0.33 -4.58 -0.03 0.00 0.03 0.00 0.00 46.19 41.27 2wzi s LEU 607 CO 0.31 -1.94 -0.14 -1.10 0.23 0.00 0.00 176.35 173.71 2wzi s GLN 608 N -3.85 0.87 -0.16 1.70 -0.21 0.30 -4.80 119.66 113.51 2wzi s GLN 608 Ca 0.73 -1.05 0.01 0.00 0.02 0.00 0.00 55.36 55.06 2wzi s GLN 608 Cb -0.27 -0.81 0.02 0.00 1.00 0.00 0.00 33.01 32.95 2wzi s GLN 608 CO 0.42 0.17 -0.18 0.08 -2.12 0.00 0.00 175.29 173.65 2wzi s VAL 609 N -1.64 1.86 -0.09 1.09 1.01 -1.26 -0.81 120.40 120.55 2wzi s VAL 609 Ca 0.02 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 2wzi s VAL 609 Cb -0.08 -1.70 0.03 0.00 0.00 0.00 0.00 36.38 34.63 2wzi s VAL 609 CO 0.02 0.51 -0.03 -0.54 0.00 0.00 0.00 175.10 175.06 2wzi s LYS 610 N 1.27 0.95 3.17 2.72 -0.14 -0.70 -4.99 119.74 122.03 2wzi s LYS 610 Ca 0.03 -0.05 0.00 0.00 -1.36 0.00 0.00 55.97 54.59 2wzi s LYS 610 Cb -0.13 -1.25 0.00 0.00 -1.68 0.00 0.00 37.83 34.77 2wzi s LYS 610 CO -0.10 -0.30 0.00 0.00 -0.76 0.00 0.00 175.35 174.19 2wzi n ALA 611 N 5.07 0.00 -0.15 5.17 0.00 -1.26 -0.43 120.51 128.91 2wzi n ALA 611 Ca -0.09 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.38 2wzi n ALA 611 Cb 0.50 0.00 0.23 0.00 0.00 0.00 0.00 19.45 20.18 2wzi n ALA 611 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2wzi n ASN 612 N 2.63 3.83 -4.79 0.00 6.94 -1.26 -4.89 115.26 117.71 2wzi n ASN 612 Ca 0.00 -2.59 -0.35 0.00 -0.02 0.00 0.00 54.58 51.62 2wzi n ASN 612 Cb 0.00 -0.62 -0.07 0.00 -2.36 0.00 0.00 39.78 36.73 2wzi n ASN 612 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2wzi s ARG 613 N -2.05 3.19 -0.17 -3.83 0.52 0.43 -1.46 118.95 115.58 2wzi s ARG 613 Ca 0.33 -0.31 0.00 0.00 -0.52 0.00 0.00 55.73 55.23 2wzi s ARG 613 Cb 0.25 -2.97 0.03 0.00 0.52 0.00 0.00 34.95 32.78 2wzi s ARG 613 CO 0.09 0.72 -0.12 0.08 0.02 0.00 0.00 175.30 176.09 2wzi s VAL 614 N -1.02 1.57 0.08 3.52 1.01 0.55 -1.71 120.40 124.40 2wzi s VAL 614 Ca 0.16 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.38 2wzi s VAL 614 Cb -0.12 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 2wzi s VAL 614 CO 0.06 0.32 -0.07 -1.48 0.00 0.00 0.00 175.10 173.92 2wzi s LEU 615 N 1.46 2.42 -0.15 3.92 0.05 0.01 -0.87 118.68 125.51 2wzi s LEU 615 Ca 0.02 -0.85 -0.19 0.00 0.05 0.00 0.00 54.13 53.16 2wzi s LEU 615 Cb -0.14 -0.13 -0.04 0.00 -2.05 0.00 0.00 46.19 43.83 2wzi s LEU 615 CO -0.09 -0.36 0.53 -0.63 -0.55 0.00 0.00 176.35 175.25 2wzi s ILE 616 N -2.81 5.12 0.08 1.48 1.01 -1.09 0.11 121.20 125.10 2wzi s ILE 616 Ca 0.05 1.03 -0.36 0.00 0.00 0.00 0.00 60.65 61.37 2wzi s ILE 616 Cb -0.00 -3.86 -0.16 0.00 0.01 0.00 0.00 42.46 38.44 2wzi s ILE 616 CO -0.03 0.23 1.42 -1.20 0.00 0.00 0.00 174.94 175.37 2wzi n SER 617 N 4.28 2.03 -4.57 3.58 7.64 0.05 -4.58 113.62 122.06 2wzi n SER 617 Ca -0.05 1.11 -0.31 0.00 1.01 0.00 0.00 58.87 60.63 2wzi n SER 617 Cb 0.51 -1.24 -0.05 0.00 -1.01 0.00 0.00 64.21 62.42 2wzi n SER 617 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 2wzi s PRO 618 N 0.80 2.80 0.13 1.43 0.02 -1.26 -4.82 135.00 134.11 2wzi s PRO 618 Ca 0.84 -0.85 -0.18 0.00 0.02 0.00 0.00 61.00 60.83 2wzi s PRO 618 Cb -0.90 -5.21 -0.11 0.00 0.02 0.00 0.00 34.50 28.31 2wzi s PRO 618 CO 0.46 -3.32 0.34 -1.91 -0.33 0.00 0.00 177.00 172.23 2wzi n GLU 632 N 8.63 0.00 -4.92 5.54 2.13 -1.26 -5.07 120.64 125.69 2wzi n GLU 632 Ca 0.42 0.00 -0.32 0.00 0.66 0.00 0.00 57.16 57.92 2wzi n GLU 632 Cb 0.47 -0.66 -0.17 0.00 0.27 0.00 0.00 31.44 31.36 2wzi n GLU 632 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 2wzi s ILE 633 N -0.66 1.99 -0.28 6.31 1.01 0.16 -4.40 121.20 125.33 2wzi s ILE 633 Ca 0.42 -0.96 -0.03 0.00 0.00 0.00 0.00 60.65 60.08 2wzi s ILE 633 Cb -0.61 -1.74 0.03 0.00 0.01 0.00 0.00 42.46 40.15 2wzi s ILE 633 CO 0.37 0.54 -0.01 -0.70 0.00 0.00 0.00 174.94 175.14 2wzi s GLU 634 N 0.59 2.72 0.62 2.79 2.12 0.72 -1.27 118.70 126.98 2wzi s GLU 634 Ca -0.13 -1.07 -0.14 0.00 0.36 0.00 0.00 54.97 53.98 2wzi s GLU 634 Cb -0.17 -3.14 -0.03 0.00 0.26 0.00 0.00 34.13 31.05 2wzi s GLU 634 CO 0.04 -0.50 1.05 -0.51 -0.54 0.00 0.00 175.26 174.79 2wzi s LEU 635 N 1.33 3.39 0.00 2.70 1.43 -0.14 -0.47 118.68 126.92 2wzi s LEU 635 Ca -0.01 1.71 0.13 0.00 -1.03 0.00 0.00 54.13 54.92 2wzi s LEU 635 Cb -0.18 -4.52 0.55 0.00 0.03 0.00 0.00 46.19 42.07 2wzi s LEU 635 CO -0.02 -1.16 1.40 -0.90 0.23 0.00 0.00 176.35 175.90 2wzi n ASP 636 N -2.34 0.00 -3.56 2.29 5.75 -1.26 -4.83 116.55 112.60 2wzi n ASP 636 Ca 0.08 0.46 -0.08 0.00 -0.01 0.00 0.00 54.79 55.24 2wzi n ASP 636 Cb 0.53 -0.48 -0.01 0.00 -1.03 0.00 0.00 41.12 40.14 2wzi n ASP 636 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2wzi s ALA 637 N -2.96 -1.04 -0.00 2.12 0.00 -1.26 -5.11 121.76 113.51 2wzi s ALA 637 Ca 0.07 -0.47 -0.30 0.00 0.00 0.00 0.00 51.96 51.26 2wzi s ALA 637 Cb 0.08 0.80 -0.04 0.00 0.00 0.00 0.00 23.12 23.97 2wzi s ALA 637 CO 0.23 -1.02 1.07 0.42 0.00 0.00 0.00 175.76 176.46 2wzi s ILE 638 N -3.41 4.55 0.12 0.00 1.01 -1.26 -4.42 121.20 117.78 2wzi s ILE 638 Ca 0.13 1.83 0.07 0.00 0.00 0.00 0.00 60.65 62.68 2wzi s ILE 638 Cb -0.06 -4.17 -0.04 0.00 0.01 0.00 0.00 42.46 38.20 2wzi s ILE 638 CO 0.09 0.11 -0.17 -0.31 0.00 0.00 0.00 174.94 174.66 2wzi s TYR 639 N 1.29 1.55 0.10 3.97 2.02 0.38 -4.90 117.35 121.77 2wzi s TYR 639 Ca 0.54 -0.49 -0.31 0.00 -0.37 0.00 0.00 57.07 56.44 2wzi s TYR 639 Cb -0.24 -0.82 -0.08 0.00 -0.40 0.00 0.00 41.96 40.43 2wzi s TYR 639 CO 0.26 0.19 1.37 -2.14 -1.57 0.00 0.00 175.55 173.65 2wzi s PRO 640 N -2.38 4.33 0.14 -1.71 0.02 -1.26 0.22 135.00 134.37 2wzi s PRO 640 Ca 0.08 2.03 -0.22 0.00 0.02 0.00 0.00 61.00 62.91 2wzi s PRO 640 Cb -0.07 -3.27 -0.08 0.00 0.02 0.00 0.00 34.50 31.10 2wzi s PRO 640 CO 0.04 -0.42 0.70 0.20 -0.33 0.00 0.00 177.00 177.19 2wzi s GLY 641 N 1.12 2.79 -0.19 0.52 0.00 -0.05 -1.32 107.32 110.20 2wzi s GLY 641 Ca 0.64 0.22 -0.15 0.00 0.00 0.00 0.00 44.72 45.43 2wzi s GLY 641 CO 0.30 0.68 -0.19 1.18 0.00 0.00 0.00 173.10 175.06 2wzi n GLU 642 N 1.52 0.52 -3.84 2.90 -0.58 0.10 -1.87 120.64 119.39 2wzi n GLU 642 Ca -0.07 0.39 -0.05 0.00 -0.42 0.00 0.00 57.16 57.01 2wzi n GLU 642 Cb 0.50 -1.58 0.02 0.00 -0.57 0.00 0.00 31.44 29.80 2wzi n GLU 642 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2wzi s ASN 643 N -6.35 -0.02 -0.03 1.62 4.22 -1.14 -0.73 114.94 112.51 2wzi s ASN 643 Ca -0.27 -0.82 0.03 0.00 -2.14 0.00 0.00 52.86 49.66 2wzi s ASN 643 Cb 0.06 0.63 0.00 0.00 1.28 0.00 0.00 41.25 43.22 2wzi s ASN 643 CO 0.41 -1.25 -0.12 -0.63 -2.04 0.00 0.00 177.10 173.46 2wzi s ILE 644 N -2.36 1.03 -0.06 0.54 1.01 -0.89 -0.92 121.20 119.55 2wzi s ILE 644 Ca 0.18 -0.50 0.03 0.00 0.00 0.00 0.00 60.65 60.36 2wzi s ILE 644 Cb -0.04 -0.90 0.01 0.00 0.01 0.00 0.00 42.46 41.55 2wzi s ILE 644 CO 0.07 0.31 -0.13 -1.10 0.00 0.00 0.00 174.94 174.09 2wzi s GLN 645 N 0.11 1.68 0.01 2.79 -0.21 0.13 -2.44 119.66 121.72 2wzi s GLN 645 Ca -0.03 -0.45 0.02 0.00 0.02 0.00 0.00 55.36 54.92 2wzi s GLN 645 Cb -0.09 -1.41 -0.01 0.00 1.00 0.00 0.00 33.01 32.50 2wzi s GLN 645 CO 0.01 0.08 -0.06 0.42 -2.12 0.00 0.00 175.29 173.62 2wzi s ILE 646 N 0.49 0.45 -0.44 1.08 1.01 -1.26 0.11 121.20 122.63 2wzi s ILE 646 Ca -0.12 -0.41 0.07 0.00 0.00 0.00 0.00 60.65 60.20 2wzi s ILE 646 Cb -0.14 -0.41 0.24 0.00 0.01 0.00 0.00 42.46 42.15 2wzi s ILE 646 CO 0.03 0.02 0.69 -3.20 0.00 0.00 0.00 174.94 172.48 2wzi n ASN 647 N 2.64 -1.45 -3.87 3.58 2.85 -0.50 -4.88 115.26 113.62 2wzi n ASN 647 Ca -0.15 -2.96 -0.11 0.00 -0.11 0.00 0.00 54.58 51.25 2wzi n ASN 647 Cb 0.57 0.61 -0.10 0.00 1.24 0.00 0.00 39.78 42.11 2wzi n ASN 647 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 2wzi s SER 681 N -1.21 0.04 -0.18 1.20 1.04 -1.26 -0.35 113.70 112.97 2wzi s SER 681 Ca 0.33 -0.25 -0.07 0.00 0.48 0.00 0.00 55.95 56.44 2wzi s SER 681 Cb 0.18 0.22 0.08 0.00 0.10 0.00 0.00 66.02 66.60 2wzi s SER 681 CO -0.17 -0.41 0.39 0.00 0.98 0.00 0.00 173.24 174.03 2wzi s ALA 682 N -1.64 -1.04 0.54 5.32 0.00 -1.02 -5.00 121.76 118.92 2wzi s ALA 682 Ca -0.13 1.42 -0.20 0.00 0.00 0.00 0.00 51.96 53.05 2wzi s ALA 682 Cb -0.06 -1.20 -0.05 0.00 0.00 0.00 0.00 23.12 21.80 2wzi s ALA 682 CO 0.00 -0.65 1.20 0.20 0.00 0.00 0.00 175.76 176.52 2wzi s GLY 683 N 2.35 2.75 0.00 0.00 0.00 -1.26 -2.09 107.32 109.07 2wzi s GLY 683 Ca -0.03 0.99 0.08 0.00 0.00 0.00 0.00 44.72 45.76 2wzi s GLY 683 CO -0.12 1.41 0.82 1.04 0.00 0.00 0.00 173.10 176.24 2wzi n LEU 684 N -1.17 1.81 -2.91 0.66 4.77 0.09 -4.92 117.00 115.34 2wzi n LEU 684 Ca 0.11 -1.15 -0.17 0.00 -0.03 0.00 0.00 56.01 54.77 2wzi n LEU 684 Cb 0.49 -0.02 -0.00 0.00 -2.33 0.00 0.00 43.42 41.55 2wzi n LEU 684 CO 0.46 0.38 -0.08 0.00 -1.33 0.00 0.00 177.39 176.82 2wzi n GLN 685 N 0.41 -2.92 -1.77 3.23 1.13 -1.26 -1.37 117.38 114.83 2wzi n GLN 685 Ca 0.05 0.51 -0.16 0.00 -1.94 0.00 0.00 57.00 55.46 2wzi n GLN 685 Cb 0.22 -5.16 -0.04 0.00 0.11 0.00 0.00 30.24 25.37 2wzi n GLN 685 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2wzi n LYS 686 N -3.27 -1.15 -2.05 -1.09 4.76 -0.78 -4.96 118.16 109.62 2wzi n LYS 686 Ca -0.07 0.94 -0.39 0.00 -2.87 0.00 0.00 58.31 55.92 2wzi n LYS 686 Cb 0.57 -5.18 0.00 0.00 -1.84 0.00 0.00 35.03 28.58 2wzi n LYS 686 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2wzi s ALA 687 N -2.65 3.11 0.17 7.82 0.00 -0.47 -4.32 121.76 125.41 2wzi s ALA 687 Ca 0.00 1.18 -0.32 0.00 0.00 0.00 0.00 51.96 52.81 2wzi s ALA 687 Cb 0.00 -3.48 -0.12 0.00 0.00 0.00 0.00 23.12 19.52 2wzi s ALA 687 CO 0.00 -0.89 1.72 -2.30 0.00 0.00 0.00 175.76 174.29 2wzi n PRO 688 N -0.24 2.62 -3.97 0.00 -0.02 -1.26 -0.87 135.00 131.26 2wzi n PRO 688 Ca 0.06 0.95 -0.16 0.00 -2.02 0.00 0.00 63.50 62.33 2wzi n PRO 688 Cb 0.45 -2.79 -0.15 0.00 -0.02 0.00 0.00 33.50 30.99 2wzi n PRO 688 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2wzi s VAL 689 N 1.51 0.19 0.00 -1.45 0.11 0.13 -4.87 120.40 116.02 2wzi s VAL 689 Ca 0.78 -0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.82 2wzi s VAL 689 Cb -0.55 -0.23 0.00 0.00 -1.53 0.00 0.00 36.38 34.07 2wzi s VAL 689 CO 0.35 0.11 0.00 1.17 -3.33 0.00 0.00 175.10 173.40 2wzi n LYS 690 N 3.63 0.68 -4.75 1.54 4.81 -1.26 -0.47 118.16 122.34 2wzi n LYS 690 Ca -0.21 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 56.90 2wzi n LYS 690 Cb 0.54 -0.69 -0.13 0.00 0.02 0.00 0.00 35.03 34.77 2wzi n LYS 690 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 2wzi s PHE 691 N -1.39 2.82 0.00 5.64 0.08 -1.26 -0.97 117.98 122.91 2wzi s PHE 691 Ca 0.00 -0.27 0.00 0.00 0.12 0.00 0.00 56.93 56.78 2wzi s PHE 691 Cb 0.00 -1.74 0.00 0.00 -0.57 0.00 0.00 43.02 40.71 2wzi s PHE 691 CO 0.00 0.08 0.00 0.28 -0.10 0.00 0.00 175.22 175.48 2wzi n VAL 692 N 2.76 0.00 0.00 -0.44 0.31 -0.39 -4.99 118.33 115.58 2wzi n VAL 692 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 2wzi n VAL 692 Cb 0.53 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.46 2wzi n VAL 692 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wzi n GLN 708 N 0.00 0.00 -2.94 5.55 10.64 0.52 0.39 117.38 131.54 2wzi n GLN 708 Ca 0.00 0.00 -0.01 0.00 -1.83 0.00 0.00 57.00 55.16 2wzi n GLN 708 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 2wzi n GLN 708 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.06 175.35 2wzi s PHE 709 N 0.00 -1.34 -0.20 2.61 5.36 -1.22 -1.41 117.98 121.78 2wzi s PHE 709 Ca 0.00 -0.07 -0.01 0.00 -0.96 0.00 0.00 56.93 55.89 2wzi s PHE 709 Cb 0.00 0.25 0.01 0.00 -0.34 0.00 0.00 43.02 42.95 2wzi s PHE 709 CO 0.00 -0.97 -0.13 0.08 -1.46 0.00 0.00 175.22 172.74 2wzi s VAL 710 N 1.46 2.57 -0.22 3.12 1.01 0.29 -2.68 120.40 125.96 2wzi s VAL 710 Ca 0.21 -0.83 -0.14 0.00 0.00 0.00 0.00 61.98 61.22 2wzi s VAL 710 Cb 0.00 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 2wzi s VAL 710 CO -0.08 0.44 0.31 -0.22 0.00 0.00 0.00 175.10 175.55 2wzi s LEU 711 N 1.35 4.13 -0.14 3.92 2.96 -0.05 0.19 118.68 131.04 2wzi s LEU 711 Ca 0.04 0.35 -0.08 0.00 -0.22 0.00 0.00 54.13 54.23 2wzi s LEU 711 Cb -0.14 -2.36 -0.04 0.00 0.50 0.00 0.00 46.19 44.15 2wzi s LEU 711 CO -0.09 -0.03 0.13 -0.89 -1.32 0.00 0.00 176.35 174.15 2wzi s THR 712 N 1.27 5.38 0.28 3.68 2.01 -0.10 -0.33 115.64 127.83 2wzi s THR 712 Ca 0.15 0.17 0.04 0.00 0.31 0.00 0.00 61.69 62.35 2wzi s THR 712 Cb -0.14 -3.38 -0.06 0.00 0.01 0.00 0.00 72.50 68.93 2wzi s THR 712 CO 0.07 0.56 0.03 0.27 -0.69 0.00 0.00 174.62 174.85 2wzi s ILE 713 N -0.56 1.13 -0.09 1.82 -4.36 -0.54 0.01 121.20 118.62 2wzi s ILE 713 Ca 0.12 -2.03 -0.22 0.00 -0.26 0.00 0.00 60.65 58.26 2wzi s ILE 713 Cb -0.12 -2.58 -0.04 0.00 1.25 0.00 0.00 42.46 40.98 2wzi s ILE 713 CO 0.02 -0.15 0.66 -0.70 0.24 0.00 0.00 174.94 175.01 2wzi s GLU 714 N -3.87 4.40 0.00 0.37 2.12 -0.43 -4.74 118.70 116.54 2wzi s GLU 714 Ca 0.33 0.79 0.00 0.00 0.36 0.00 0.00 54.97 56.44 2wzi s GLU 714 Cb 0.07 -3.46 0.00 0.00 0.26 0.00 0.00 34.13 31.00 2wzi s GLU 714 CO 0.12 0.04 0.00 1.63 -0.54 0.00 0.00 175.26 176.51