#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x0x n LEU 5 N 0.00 -4.30 -4.85 1.20 0.00 -1.26 -4.46 117.00 103.33 2x0x n LEU 5 Ca 0.00 1.33 -0.33 0.00 0.00 0.00 0.00 56.01 57.02 2x0x n LEU 5 Cb 0.00 -2.23 -0.06 0.00 0.00 0.00 0.00 43.42 41.13 2x0x n LEU 5 CO 0.00 -2.03 0.35 -0.76 0.00 0.00 0.00 177.39 174.95 2x0x s LEU 6 N -0.35 4.11 -0.10 -1.96 1.43 -1.26 -2.22 118.68 118.33 2x0x s LEU 6 Ca -0.12 1.17 0.03 0.00 -1.03 0.00 0.00 54.13 54.19 2x0x s LEU 6 Cb 0.01 -3.92 0.00 0.00 0.03 0.00 0.00 46.19 42.32 2x0x s LEU 6 CO 0.32 -0.15 -0.21 -0.69 0.23 0.00 0.00 176.35 175.85 2x0x s VAL 7 N -1.90 1.89 -0.21 -1.59 1.01 0.52 -0.45 120.40 119.68 2x0x s VAL 7 Ca 0.51 -0.91 -0.20 0.00 0.00 0.00 0.00 61.98 61.38 2x0x s VAL 7 Cb -0.11 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 2x0x s VAL 7 CO 0.19 0.52 0.60 -0.89 0.00 0.00 0.00 175.10 175.52 2x0x s THR 8 N 0.52 5.03 0.73 3.92 2.01 -0.59 -1.78 115.64 125.48 2x0x s THR 8 Ca -0.15 1.12 -0.11 0.00 0.31 0.00 0.00 61.69 62.86 2x0x s THR 8 Cb -0.17 -3.92 0.03 0.00 0.01 0.00 0.00 72.50 68.45 2x0x s THR 8 CO 0.06 0.11 1.07 -0.54 -0.69 0.00 0.00 174.62 174.63 2x0x s LYS 9 N 1.95 2.62 0.28 4.92 3.01 -0.12 -2.32 119.74 130.08 2x0x s LYS 9 Ca 0.27 1.01 0.05 0.00 -1.01 0.00 0.00 55.97 56.29 2x0x s LYS 9 Cb -0.16 -1.95 0.39 0.00 -1.01 0.00 0.00 37.83 35.11 2x0x s LYS 9 CO 0.10 -1.34 1.67 0.07 0.51 0.00 0.00 175.35 176.35 2x0x h ARG 10 N -0.90 0.31 0.07 1.68 -0.00 -1.97 -3.03 114.38 110.53 2x0x h ARG 10 Ca -0.44 -0.15 0.02 0.00 -0.00 0.00 0.00 59.98 59.41 2x0x h ARG 10 Cb 1.22 0.00 -0.05 0.00 -0.00 0.00 0.00 29.97 31.14 2x0x h ARG 10 CO 0.55 0.68 -0.43 0.22 -0.00 0.00 0.00 179.97 180.99 2x0x h ASP 11 N 0.25 -1.27 0.00 0.08 1.82 -2.03 -3.48 116.42 111.79 2x0x h ASP 11 Ca 0.02 0.15 0.00 0.00 -0.39 0.00 0.00 57.03 56.81 2x0x h ASP 11 Cb 0.85 0.49 0.00 0.00 0.68 0.00 0.00 39.33 41.35 2x0x h ASP 11 CO 0.07 -0.48 0.00 0.61 -1.61 0.00 0.00 179.24 177.83 2x0x n GLY 12 N -1.46 2.17 3.99 -0.78 0.00 -1.15 -5.17 105.19 102.79 2x0x n GLY 12 Ca -0.07 -0.20 -0.24 0.00 0.00 0.00 0.00 46.02 45.52 2x0x n GLY 12 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2x0x s SER 13 N 0.00 4.39 0.86 1.61 1.04 -1.26 -4.47 113.70 115.86 2x0x s SER 13 Ca 0.00 -0.28 -0.08 0.00 0.48 0.00 0.00 55.95 56.08 2x0x s SER 13 Cb 0.00 -0.14 0.16 0.00 0.10 0.00 0.00 66.02 66.15 2x0x s SER 13 CO 0.00 -1.83 1.04 0.35 0.98 0.00 0.00 173.24 173.77 2x0x n THR 14 N -2.84 0.00 0.00 2.02 -2.24 -1.26 -0.94 114.28 109.02 2x0x n THR 14 Ca 0.14 -1.12 0.00 0.00 -2.27 0.00 0.00 64.05 60.80 2x0x n THR 14 Cb 0.60 -1.27 0.00 0.00 -2.10 0.00 0.00 70.33 67.56 2x0x n THR 14 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2x0x n GLU 15 N -3.08 0.00 -1.77 -0.78 2.13 -0.73 -4.83 120.64 111.58 2x0x n GLU 15 Ca 0.15 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.55 2x0x n GLU 15 Cb 0.52 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 32.20 2x0x n GLU 15 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2x0x s ARG 16 N -1.84 4.13 0.06 5.31 0.52 -1.26 -0.35 118.95 125.53 2x0x s ARG 16 Ca 0.00 2.57 -0.30 0.00 -0.52 0.00 0.00 55.73 57.48 2x0x s ARG 16 Cb 0.00 -3.06 -0.09 0.00 0.52 0.00 0.00 34.95 32.32 2x0x s ARG 16 CO 0.00 -0.69 1.89 -1.50 0.02 0.00 0.00 175.30 175.01 2x0x s ILE 17 N 0.72 2.87 -0.98 1.52 -1.16 -0.94 -4.84 121.20 118.40 2x0x s ILE 17 Ca 0.70 0.09 -0.15 0.00 -0.51 0.00 0.00 60.65 60.78 2x0x s ILE 17 Cb -0.48 -3.06 0.19 0.00 0.61 0.00 0.00 42.46 39.72 2x0x s ILE 17 CO 0.38 -0.00 1.07 0.21 -2.81 0.00 0.00 174.94 173.79 2x0x s ASN 18 N 3.65 6.87 0.48 4.50 3.84 -1.26 -4.85 114.94 128.17 2x0x s ASN 18 Ca 0.84 -2.68 0.26 0.00 0.21 0.00 0.00 52.86 51.50 2x0x s ASN 18 Cb -0.43 -2.31 1.17 0.00 -0.55 0.00 0.00 41.25 39.13 2x0x s ASN 18 CO 0.39 -0.73 1.94 -0.07 -2.79 0.00 0.00 177.10 175.84 2x0x h LEU 19 N 8.87 0.00 -0.14 3.21 3.38 -1.99 -2.15 115.31 126.48 2x0x h LEU 19 Ca 0.18 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.91 2x0x h LEU 19 Cb 0.98 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.74 2x0x h LEU 19 CO 1.01 0.17 -0.86 0.44 0.09 0.00 0.00 178.44 179.29 2x0x h ASP 20 N 0.00 0.86 -0.33 -0.43 3.32 -1.99 -1.83 116.42 116.03 2x0x h ASP 20 Ca -0.00 -0.61 -0.02 0.00 0.02 0.00 0.00 57.03 56.42 2x0x h ASP 20 Cb 0.57 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 2x0x h ASP 20 CO 0.02 1.40 0.12 0.50 -1.72 0.00 0.00 179.24 179.56 2x0x h LYS 21 N 0.45 0.51 -0.12 3.56 3.64 -1.89 -0.96 116.57 121.76 2x0x h LYS 21 Ca -0.07 -0.10 0.03 0.00 -1.27 0.00 0.00 60.65 59.24 2x0x h LYS 21 Cb 1.49 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 33.20 2x0x h LYS 21 CO 0.17 0.53 -0.09 0.82 -2.27 0.00 0.00 179.45 178.61 2x0x h ILE 22 N 0.38 0.73 -0.25 2.00 2.04 -1.42 -1.04 117.51 119.96 2x0x h ILE 22 Ca 0.11 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.96 2x0x h ILE 22 Cb 0.22 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 2x0x h ILE 22 CO -0.01 0.00 0.14 -0.74 0.00 0.00 0.00 178.15 177.54 2x0x h HIS 23 N -0.10 0.32 -0.06 1.37 2.76 -1.22 -1.65 115.15 116.56 2x0x h HIS 23 Ca 0.08 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.22 2x0x h HIS 23 Cb 0.21 -0.11 -0.00 0.00 1.55 0.00 0.00 27.41 29.07 2x0x h HIS 23 CO -0.21 0.22 -0.07 -0.09 -1.30 0.00 0.00 177.93 176.48 2x0x h ARG 24 N 0.34 0.16 -0.48 5.26 2.43 -0.42 -0.76 114.38 120.91 2x0x h ARG 24 Ca 0.09 -0.09 0.01 0.00 -0.81 0.00 0.00 59.98 59.19 2x0x h ARG 24 Cb 0.00 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.53 2x0x h ARG 24 CO -0.02 0.61 0.30 0.28 -1.51 0.00 0.00 179.97 179.63 2x0x h VAL 25 N -0.29 1.08 -0.78 0.20 2.07 -1.03 -0.95 116.25 116.56 2x0x h VAL 25 Ca 0.01 -0.20 -0.00 0.00 0.82 0.00 0.00 66.70 67.32 2x0x h VAL 25 Cb 0.59 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 30.75 2x0x h VAL 25 CO 0.02 0.11 0.47 -0.07 0.02 0.00 0.00 177.57 178.12 2x0x h LEU 26 N 0.60 0.93 -1.00 2.57 3.38 -1.29 -0.56 115.31 119.94 2x0x h LEU 26 Ca 0.18 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.11 2x0x h LEU 26 Cb -0.02 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.45 2x0x h LEU 26 CO -0.07 0.71 0.66 -0.78 0.09 0.00 0.00 178.44 179.06 2x0x h ASP 27 N 1.06 1.14 0.44 -0.43 1.82 -0.80 -1.14 116.42 118.52 2x0x h ASP 27 Ca 0.28 -0.03 -0.02 0.00 -0.39 0.00 0.00 57.03 56.87 2x0x h ASP 27 Cb -0.05 -0.28 -0.00 0.00 0.68 0.00 0.00 39.33 39.67 2x0x h ASP 27 CO -0.05 0.83 -0.26 -0.25 -1.61 0.00 0.00 179.24 177.89 2x0x h TRP 28 N 1.35 -0.69 -0.01 0.28 7.01 -0.54 -2.97 115.95 120.38 2x0x h TRP 28 Ca 0.37 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.36 2x0x h TRP 28 Cb -0.15 0.25 -0.00 0.00 -2.10 0.00 0.00 29.16 27.16 2x0x h TRP 28 CO -0.00 -0.41 0.03 0.00 -2.79 0.00 0.00 178.44 175.26 2x0x h ALA 29 N -0.15 1.31 0.00 2.65 0.00 -0.80 -1.46 119.26 120.81 2x0x h ALA 29 Ca -0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2x0x h ALA 29 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2x0x h ALA 29 CO 0.06 -0.03 -0.31 0.00 0.00 0.00 0.00 179.25 178.96 2x0x n ALA 30 N -2.20 2.75 -1.21 0.00 0.00 -0.46 -4.54 120.51 114.85 2x0x n ALA 30 Ca -0.03 -0.18 -0.55 0.00 0.00 0.00 0.00 53.44 52.69 2x0x n ALA 30 Cb 0.10 -1.30 -0.10 0.00 0.00 0.00 0.00 19.45 18.15 2x0x n ALA 30 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2x0x n GLU 31 N -1.91 0.00 -0.26 0.00 4.07 -0.55 -0.85 120.64 121.14 2x0x n GLU 31 Ca 0.05 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.15 2x0x n GLU 31 Cb 0.40 -1.34 0.00 0.00 -0.06 0.00 0.00 31.44 30.44 2x0x n GLU 31 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2x0x n GLY 32 N 6.03 1.80 3.85 8.31 0.00 -1.26 -5.02 105.19 118.90 2x0x n GLY 32 Ca 0.45 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.14 2x0x n GLY 32 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x0x s LEU 33 N 0.00 4.13 0.02 0.99 1.43 -0.03 -5.08 118.68 120.14 2x0x s LEU 33 Ca 0.00 1.23 0.07 0.00 -1.03 0.00 0.00 54.13 54.41 2x0x s LEU 33 Cb 0.00 -3.92 -0.03 0.00 0.03 0.00 0.00 46.19 42.27 2x0x s LEU 33 CO 0.00 -0.14 -0.21 -1.00 0.23 0.00 0.00 176.35 175.22 2x0x s HIS 34 N -1.88 2.47 -0.79 0.29 3.76 -1.26 -4.71 115.29 113.16 2x0x s HIS 34 Ca 0.51 -0.32 0.00 0.00 -0.15 0.00 0.00 55.06 55.10 2x0x s HIS 34 Cb -0.11 -1.47 0.00 0.00 1.11 0.00 0.00 32.58 32.11 2x0x s HIS 34 CO 0.18 0.16 0.00 -1.71 -0.85 0.00 0.00 174.74 172.52 2x0x n ASN 35 N 1.86 -3.36 -4.47 1.40 5.15 -1.26 -4.58 115.26 110.00 2x0x n ASN 35 Ca -0.16 0.07 -0.33 0.00 -0.60 0.00 0.00 54.58 53.55 2x0x n ASN 35 Cb 0.52 -2.31 -0.13 0.00 -0.53 0.00 0.00 39.78 37.33 2x0x n ASN 35 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2x0x s VAL 36 N -2.39 3.53 -0.36 3.44 -7.23 -1.26 -4.86 120.40 111.26 2x0x s VAL 36 Ca 0.00 -0.50 -0.09 0.00 -1.81 0.00 0.00 61.98 59.58 2x0x s VAL 36 Cb 0.00 -2.50 0.04 0.00 0.56 0.00 0.00 36.38 34.48 2x0x s VAL 36 CO 0.00 0.53 0.17 -0.55 -0.31 0.00 0.00 175.10 174.94 2x0x s SER 37 N 0.07 5.56 0.20 4.85 0.15 -1.26 -4.96 113.70 118.32 2x0x s SER 37 Ca -0.03 -1.10 -0.09 0.00 0.70 0.00 0.00 55.95 55.43 2x0x s SER 37 Cb -0.14 -1.96 0.14 0.00 -1.71 0.00 0.00 66.02 62.35 2x0x s SER 37 CO 0.03 -0.38 1.78 0.40 1.20 0.00 0.00 173.24 176.28 2x0x h ILE 38 N 6.02 1.25 -0.57 6.45 2.04 -1.99 -2.61 117.51 128.10 2x0x h ILE 38 Ca -0.24 -0.73 -0.05 0.00 1.00 0.00 0.00 64.86 64.84 2x0x h ILE 38 Cb 1.09 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 37.48 2x0x h ILE 38 CO 0.65 0.30 0.15 0.77 0.00 0.00 0.00 178.15 180.02 2x0x h SER 39 N 1.07 0.83 -0.90 1.72 4.64 -1.98 0.32 113.55 119.24 2x0x h SER 39 Ca 0.26 -0.15 -0.01 0.00 -0.47 0.00 0.00 61.79 61.42 2x0x h SER 39 Cb 0.16 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 61.99 2x0x h SER 39 CO -0.03 0.80 0.54 -0.61 -0.87 0.00 0.00 176.83 176.66 2x0x h GLN 40 N 0.85 1.23 -0.41 4.77 5.75 -1.94 0.27 115.11 125.64 2x0x h GLN 40 Ca 0.19 -0.12 -0.10 0.00 -0.15 0.00 0.00 58.65 58.47 2x0x h GLN 40 Cb 0.30 -0.25 -0.01 0.00 1.07 0.00 0.00 27.48 28.58 2x0x h GLN 40 CO -0.00 0.86 -0.14 0.28 -2.65 0.00 0.00 178.83 177.18 2x0x h VAL 41 N 1.24 1.28 -0.18 2.39 2.07 -0.99 -2.44 116.25 119.61 2x0x h VAL 41 Ca 0.32 -1.26 0.01 0.00 0.82 0.00 0.00 66.70 66.59 2x0x h VAL 41 Cb -0.04 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2x0x h VAL 41 CO -0.06 0.42 0.09 -0.33 0.02 0.00 0.00 177.57 177.71 2x0x h GLU 42 N 0.63 0.18 -0.41 1.57 5.08 -0.56 -2.06 114.58 119.01 2x0x h GLU 42 Ca 0.10 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.47 2x0x h GLU 42 Cb 0.69 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.87 2x0x h GLU 42 CO 0.05 0.12 0.24 -0.07 -1.00 0.00 0.00 179.01 178.35 2x0x h LEU 43 N 0.19 0.39 -0.81 1.33 3.38 -0.38 -0.27 115.31 119.14 2x0x h LEU 43 Ca 0.07 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.92 2x0x h LEU 43 Cb 0.02 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2x0x h LEU 43 CO -0.05 0.28 -0.56 0.03 0.09 0.00 0.00 178.44 178.23 2x0x h ARG 44 N 0.49 0.11 0.13 1.13 3.08 -1.43 -3.10 114.38 114.79 2x0x h ARG 44 Ca 0.16 -0.07 -0.34 0.00 0.07 0.00 0.00 59.98 59.81 2x0x h ARG 44 Cb 0.01 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 2x0x h ARG 44 CO -0.08 0.64 -1.81 0.66 -1.07 0.00 0.00 179.97 178.31 2x0x h SER 45 N 0.08 0.44 0.27 7.04 4.64 -1.27 -3.39 113.55 121.36 2x0x h SER 45 Ca -0.00 -0.91 -0.04 0.00 -0.47 0.00 0.00 61.79 60.37 2x0x h SER 45 Cb 1.01 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.95 2x0x h SER 45 CO 0.08 1.79 -0.20 0.45 -0.87 0.00 0.00 176.83 178.08 2x0x h HIS 46 N -0.04 0.00 0.00 4.77 3.86 -1.10 -1.80 115.15 120.84 2x0x h HIS 46 Ca -0.38 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 58.81 2x0x h HIS 46 Cb 1.97 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 30.43 2x0x h HIS 46 CO 0.09 0.20 -0.08 0.97 0.86 0.00 0.00 177.93 179.97 2x0x h ILE 47 N 0.00 0.53 -0.06 2.45 6.09 -1.73 -1.80 117.51 122.99 2x0x h ILE 47 Ca -0.00 -0.35 0.00 0.00 -1.37 0.00 0.00 64.86 63.14 2x0x h ILE 47 Cb 0.38 1.23 0.00 0.00 0.47 0.00 0.00 36.82 38.90 2x0x h ILE 47 CO 0.03 0.08 0.00 0.00 -3.07 0.00 0.00 178.15 175.18 2x0x n GLN 48 N -3.68 1.90 -2.72 2.19 6.02 -0.68 -4.91 117.38 115.50 2x0x n GLN 48 Ca -0.02 -1.32 -0.40 0.00 -0.01 0.00 0.00 57.00 55.25 2x0x n GLN 48 Cb 0.18 -1.46 -0.06 0.00 1.02 0.00 0.00 30.24 29.92 2x0x n GLN 48 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2x0x s PHE 49 N -1.94 3.93 0.20 1.08 0.08 -0.68 -5.06 117.98 115.59 2x0x s PHE 49 Ca 0.35 1.88 0.07 0.00 0.12 0.00 0.00 56.93 59.34 2x0x s PHE 49 Cb 0.20 -3.02 -0.05 0.00 -0.57 0.00 0.00 43.02 39.59 2x0x s PHE 49 CO 0.31 0.33 -0.12 1.52 -0.10 0.00 0.00 175.22 177.17 2x0x s TYR 50 N -0.96 1.62 0.04 0.36 -0.85 -1.26 -5.07 117.35 111.22 2x0x s TYR 50 Ca 0.42 -0.64 -0.30 0.00 -0.52 0.00 0.00 57.07 56.03 2x0x s TYR 50 Cb -0.26 -0.79 -0.08 0.00 0.38 0.00 0.00 41.96 41.21 2x0x s TYR 50 CO 0.32 0.27 1.69 0.34 -1.52 0.00 0.00 175.55 176.66 2x0x s ASP 51 N -3.29 6.60 0.00 -0.18 2.15 -1.26 -1.78 116.67 118.90 2x0x s ASP 51 Ca 0.22 2.45 0.00 0.00 0.43 0.00 0.00 52.55 55.65 2x0x s ASP 51 Cb 0.01 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.08 2x0x s ASP 51 CO 0.06 -0.92 0.00 0.61 -0.17 0.00 0.00 175.17 174.75 2x0x n GLY 52 N 4.10 0.75 3.67 2.66 0.00 0.41 -4.89 105.19 111.89 2x0x n GLY 52 Ca 0.17 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.72 2x0x n GLY 52 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2x0x n ILE 53 N -2.17 0.17 -1.36 -0.61 3.06 -0.74 -3.88 119.36 113.84 2x0x n ILE 53 Ca 0.00 -0.03 -0.35 0.00 -2.50 0.00 0.00 62.75 59.87 2x0x n ILE 53 Cb 0.00 -1.61 0.10 0.00 0.54 0.00 0.00 39.64 38.67 2x0x n ILE 53 CO 0.00 0.00 0.00 1.17 -2.50 0.00 0.00 176.55 175.22 2x0x n LYS 54 N 4.34 0.55 -0.10 9.51 3.00 -1.26 -1.54 118.16 132.66 2x0x n LYS 54 Ca 0.19 0.25 -0.12 0.00 -0.00 0.00 0.00 58.31 58.63 2x0x n LYS 54 Cb 0.28 -2.41 -0.04 0.00 0.00 0.00 0.00 35.03 32.86 2x0x n LYS 54 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 2x0x h THR 55 N -0.30 1.30 -0.95 3.15 2.02 -1.80 -2.48 112.91 113.85 2x0x h THR 55 Ca -0.48 -1.31 0.09 0.00 0.77 0.00 0.00 66.41 65.48 2x0x h THR 55 Cb 1.32 1.53 -0.07 0.00 -1.74 0.00 0.00 68.15 69.19 2x0x h THR 55 CO 0.48 0.41 0.61 0.77 0.37 0.00 0.00 175.52 178.17 2x0x h SER 56 N 0.36 0.91 -0.40 4.18 4.64 -1.93 -1.66 113.55 119.65 2x0x h SER 56 Ca 0.06 0.02 -0.11 0.00 -0.47 0.00 0.00 61.79 61.29 2x0x h SER 56 Cb 0.72 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.62 2x0x h SER 56 CO 0.05 0.55 -0.15 0.44 -0.87 0.00 0.00 176.83 176.85 2x0x h ASP 57 N 1.01 0.87 -0.56 4.97 3.32 -1.90 -0.25 116.42 123.88 2x0x h ASP 57 Ca 0.43 -0.29 0.01 0.00 0.02 0.00 0.00 57.03 57.20 2x0x h ASP 57 Cb 0.33 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.61 2x0x h ASP 57 CO -0.19 1.02 0.36 0.40 -1.72 0.00 0.00 179.24 179.12 2x0x h ILE 58 N 0.77 1.13 0.28 0.35 2.04 -0.91 0.57 117.51 121.74 2x0x h ILE 58 Ca 0.12 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 2x0x h ILE 58 Cb 0.67 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 2x0x h ILE 58 CO 0.05 0.13 -0.18 0.45 0.00 0.00 0.00 178.15 178.60 2x0x h HIS 59 N 0.74 -0.48 -0.78 1.37 3.86 -1.05 -1.98 115.15 116.82 2x0x h HIS 59 Ca 0.21 -0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.38 2x0x h HIS 59 Cb -0.07 0.17 -0.03 0.00 1.06 0.00 0.00 27.41 28.54 2x0x h HIS 59 CO -0.04 -0.29 0.33 0.93 0.86 0.00 0.00 177.93 179.73 2x0x h GLU 60 N -0.46 1.15 -0.29 2.45 5.08 -0.96 -1.28 114.58 120.28 2x0x h GLU 60 Ca -0.03 -0.20 0.04 0.00 -1.00 0.00 0.00 59.36 58.18 2x0x h GLU 60 Cb 0.38 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.40 2x0x h GLU 60 CO 0.02 0.92 0.04 1.15 -1.00 0.00 0.00 179.01 180.14 2x0x h THR 61 N 1.12 0.84 -0.03 1.13 2.02 -0.82 -1.05 112.91 116.12 2x0x h THR 61 Ca 0.26 -0.05 -0.16 0.00 0.77 0.00 0.00 66.41 67.24 2x0x h THR 61 Cb 0.19 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 2x0x h THR 61 CO -0.03 0.02 -0.70 0.16 0.37 0.00 0.00 175.52 175.35 2x0x h ILE 62 N 0.14 1.45 0.13 3.11 -2.65 -1.13 -1.76 117.51 116.79 2x0x h ILE 62 Ca 0.13 -2.27 -0.01 0.00 1.03 0.00 0.00 64.86 63.74 2x0x h ILE 62 Cb 0.15 2.21 0.00 0.00 -2.05 0.00 0.00 36.82 37.14 2x0x h ILE 62 CO -0.19 0.66 -0.06 0.40 0.03 0.00 0.00 178.15 178.98 2x0x h ILE 63 N 0.09 0.93 -0.45 0.16 2.04 -1.13 -1.94 117.51 117.20 2x0x h ILE 63 Ca -0.02 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.62 2x0x h ILE 63 Cb 1.24 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 38.36 2x0x h ILE 63 CO 0.10 0.05 0.21 0.50 0.00 0.00 0.00 178.15 179.01 2x0x h LYS 64 N -0.27 0.63 -0.43 2.37 3.64 -1.20 -0.31 116.57 121.01 2x0x h LYS 64 Ca -0.02 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.22 2x0x h LYS 64 Cb 0.22 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 2x0x h LYS 64 CO 0.03 0.50 0.00 0.00 -2.27 0.00 0.00 179.45 177.72 2x0x h ALA 65 N 1.60 0.57 -0.36 5.00 0.00 -1.12 0.40 119.26 125.34 2x0x h ALA 65 Ca 0.16 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2x0x h ALA 65 Cb 0.09 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2x0x h ALA 65 CO -0.02 0.36 0.14 0.00 0.00 0.00 0.00 179.25 179.72 2x0x h ALA 66 N 0.90 0.47 -0.91 0.00 0.00 -1.04 -3.19 119.26 115.50 2x0x h ALA 66 Ca 0.12 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.93 2x0x h ALA 66 Cb 0.48 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 2x0x h ALA 66 CO 0.02 0.09 0.60 0.00 0.00 0.00 0.00 179.25 179.96 2x0x h ALA 67 N 0.98 1.43 0.00 0.00 0.00 -0.76 -1.99 119.26 118.91 2x0x h ALA 67 Ca 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2x0x h ALA 67 Cb 0.21 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2x0x h ALA 67 CO -0.01 0.48 0.00 -0.44 0.00 0.00 0.00 179.25 179.28 2x0x h ASP 68 N 1.13 0.00 -0.21 0.00 3.32 -0.91 -2.51 116.42 117.24 2x0x h ASP 68 Ca 0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.41 2x0x h ASP 68 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 2x0x h ASP 68 CO -0.11 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.59 2x0x n LEU 69 N -2.83 2.31 -4.68 1.55 4.77 -0.75 -4.90 117.00 112.48 2x0x n LEU 69 Ca 0.00 -0.95 -0.42 0.00 -0.03 0.00 0.00 56.01 54.61 2x0x n LEU 69 Cb 0.22 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.15 2x0x n LEU 69 CO 0.23 0.47 1.34 -0.63 -1.33 0.00 0.00 177.39 177.47 2x0x s ILE 70 N -1.73 3.29 0.23 -0.08 1.01 -0.95 -4.82 121.20 118.16 2x0x s ILE 70 Ca 0.34 0.59 -0.14 0.00 0.00 0.00 0.00 60.65 61.44 2x0x s ILE 70 Cb 0.19 -3.38 0.00 0.00 0.01 0.00 0.00 42.46 39.29 2x0x s ILE 70 CO 0.29 -0.02 0.50 -0.94 0.00 0.00 0.00 174.94 174.76 2x0x s SER 71 N 2.83 -0.13 0.26 3.58 1.04 -1.21 -4.99 113.70 115.08 2x0x s SER 71 Ca 0.74 -0.80 -0.01 0.00 0.48 0.00 0.00 55.95 56.36 2x0x s SER 71 Cb -0.37 0.59 0.35 0.00 0.10 0.00 0.00 66.02 66.69 2x0x s SER 71 CO 0.31 -1.13 1.75 0.08 0.98 0.00 0.00 173.24 175.23 2x0x h ARG 72 N 2.24 0.72 -0.72 4.02 0.11 -1.94 -2.00 114.38 116.81 2x0x h ARG 72 Ca -0.26 -0.21 0.08 0.00 0.10 0.00 0.00 59.98 59.69 2x0x h ARG 72 Cb 1.25 -0.08 -0.05 0.00 1.11 0.00 0.00 29.97 32.21 2x0x h ARG 72 CO 0.35 0.78 0.47 -0.44 0.10 0.00 0.00 179.97 181.23 2x0x h ASP 73 N 0.67 0.61 -2.35 0.08 3.32 -1.97 -3.35 116.42 113.44 2x0x h ASP 73 Ca 0.12 0.01 -0.59 0.00 0.02 0.00 0.00 57.03 56.59 2x0x h ASP 73 Cb 0.50 -0.12 -0.38 0.00 0.22 0.00 0.00 39.33 39.55 2x0x h ASP 73 CO 0.03 0.38 -0.98 0.00 -1.72 0.00 0.00 179.24 176.94 2x0x n ALA 74 N -2.46 2.84 0.16 3.45 0.00 -0.98 -5.00 120.51 118.53 2x0x n ALA 74 Ca 0.11 -3.14 0.02 0.00 0.00 0.00 0.00 53.44 50.43 2x0x n ALA 74 Cb 0.28 -0.76 0.38 0.00 0.00 0.00 0.00 19.45 19.35 2x0x n ALA 74 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2x0x h PRO 75 N 5.52 0.12 0.00 0.00 0.11 -1.51 -3.19 132.00 133.05 2x0x h PRO 75 Ca 0.26 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.33 2x0x h PRO 75 Cb 0.91 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.00 2x0x h PRO 75 CO 0.38 0.37 0.00 -0.25 -0.21 0.00 0.00 178.00 178.29 2x0x n ASP 76 N -4.20 0.47 0.23 -2.05 9.92 -1.26 -0.71 116.55 118.94 2x0x n ASP 76 Ca -0.01 0.69 0.10 0.00 -0.53 0.00 0.00 54.79 55.04 2x0x n ASP 76 Cb 0.33 -0.76 0.67 0.00 -0.64 0.00 0.00 41.12 40.71 2x0x n ASP 76 CO 0.00 0.00 0.00 1.88 0.13 0.00 0.00 177.20 179.21 2x0x h TYR 77 N 0.00 0.00 -0.97 1.24 0.05 -1.87 -0.36 116.97 115.06 2x0x h TYR 77 Ca 0.00 0.00 0.24 0.00 0.05 0.00 0.00 58.73 59.02 2x0x h TYR 77 Cb 0.07 0.00 -0.12 0.00 1.01 0.00 0.00 36.73 37.69 2x0x h TYR 77 CO 0.00 0.00 0.53 1.96 -1.05 0.00 0.00 178.16 179.60 2x0x h GLN 78 N 0.00 0.52 0.06 4.88 4.20 -1.18 0.20 115.11 123.79 2x0x h GLN 78 Ca 0.03 -0.03 -0.31 0.00 0.06 0.00 0.00 58.65 58.40 2x0x h GLN 78 Cb 0.14 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 27.77 2x0x h GLN 78 CO -0.00 0.34 -1.73 1.88 -0.67 0.00 0.00 178.83 178.65 2x0x h TYR 79 N 0.53 0.24 -0.27 2.96 0.05 -1.35 0.36 116.97 119.49 2x0x h TYR 79 Ca 0.62 -0.17 0.04 0.00 0.05 0.00 0.00 58.73 59.26 2x0x h TYR 79 Cb 1.16 -0.01 -0.03 0.00 1.01 0.00 0.00 36.73 38.86 2x0x h TYR 79 CO -0.04 1.31 0.06 1.25 -1.05 0.00 0.00 178.16 179.69 2x0x h LEU 80 N 0.04 0.04 -0.62 3.88 5.85 -0.69 -1.78 115.31 122.02 2x0x h LEU 80 Ca -0.31 0.04 -0.12 0.00 0.84 0.00 0.00 57.88 58.33 2x0x h LEU 80 Cb 2.01 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 43.08 2x0x h LEU 80 CO 0.10 0.05 -0.25 0.00 -0.34 0.00 0.00 178.44 178.00 2x0x h ALA 81 N 1.19 0.81 0.04 1.25 0.00 -1.13 -2.72 119.26 118.70 2x0x h ALA 81 Ca 0.12 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2x0x h ALA 81 Cb 0.12 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2x0x h ALA 81 CO -0.16 0.65 -0.02 0.00 0.00 0.00 0.00 179.25 179.72 2x0x h ALA 82 N 1.01 -0.06 -0.72 0.00 0.00 -1.50 0.42 119.26 118.41 2x0x h ALA 82 Ca 0.09 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.00 2x0x h ALA 82 Cb 0.79 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 2x0x h ALA 82 CO 0.06 -0.52 0.45 0.00 0.00 0.00 0.00 179.25 179.25 2x0x h ARG 83 N -0.09 0.86 -0.35 0.00 3.08 -1.36 0.52 114.38 117.04 2x0x h ARG 83 Ca -0.01 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 2x0x h ARG 83 Cb 0.08 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 2x0x h ARG 83 CO 0.01 0.57 0.13 -0.07 -1.07 0.00 0.00 179.97 179.54 2x0x h LEU 84 N 0.89 0.49 -0.96 3.04 3.38 -1.24 0.33 115.31 121.24 2x0x h LEU 84 Ca 0.28 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 58.09 2x0x h LEU 84 Cb 0.00 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.58 2x0x h LEU 84 CO -0.10 0.53 0.63 0.00 0.09 0.00 0.00 178.44 179.59 2x0x h ALA 85 N 0.98 1.22 -0.12 1.53 0.00 0.46 -1.75 119.26 121.58 2x0x h ALA 85 Ca 0.12 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 2x0x h ALA 85 Cb 0.20 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2x0x h ALA 85 CO -0.01 0.62 0.06 0.82 0.00 0.00 0.00 179.25 180.74 2x0x h ILE 86 N 1.31 1.12 -0.41 0.00 1.08 0.30 -0.86 117.51 120.05 2x0x h ILE 86 Ca 0.35 -0.35 0.08 0.00 -0.39 0.00 0.00 64.86 64.55 2x0x h ILE 86 Cb -0.14 1.13 -0.08 0.00 -3.07 0.00 0.00 36.82 34.66 2x0x h ILE 86 CO -0.07 0.11 -0.09 0.15 -0.69 0.00 0.00 178.15 177.55 2x0x h PHE 87 N 0.07 -0.20 -0.50 1.37 3.57 -0.74 -1.07 116.94 119.45 2x0x h PHE 87 Ca 0.04 0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.51 2x0x h PHE 87 Cb 0.12 0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.99 2x0x h PHE 87 CO -0.03 -0.17 0.03 1.25 -2.23 0.00 0.00 178.31 177.17 2x0x h HIS 88 N 0.01 0.85 0.00 0.41 2.76 -1.16 -2.74 115.15 115.28 2x0x h HIS 88 Ca 0.20 -0.11 -0.10 0.00 -2.20 0.00 0.00 60.37 58.16 2x0x h HIS 88 Cb 0.30 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 29.01 2x0x h HIS 88 CO -0.35 0.77 -0.48 -0.07 -1.30 0.00 0.00 177.93 176.50 2x0x h LEU 89 N 0.76 0.00 0.68 0.26 3.38 -0.61 -1.68 115.31 118.11 2x0x h LEU 89 Ca 0.15 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 2x0x h LEU 89 Cb 0.41 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.17 2x0x h LEU 89 CO 0.01 0.48 -0.33 0.03 0.09 0.00 0.00 178.44 178.72 2x0x h ARG 90 N 0.00 -0.88 -0.56 1.13 2.47 -0.93 -2.29 114.38 113.32 2x0x h ARG 90 Ca -0.00 0.06 0.10 0.00 -1.26 0.00 0.00 59.98 58.87 2x0x h ARG 90 Cb 0.86 0.20 -0.08 0.00 -1.65 0.00 0.00 29.97 29.31 2x0x h ARG 90 CO 0.06 -0.56 0.14 0.87 0.56 0.00 0.00 179.97 181.05 2x0x h LYS 91 N -1.03 0.28 -0.08 0.04 1.57 -1.49 0.46 116.57 116.31 2x0x h LYS 91 Ca -0.09 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.69 2x0x h LYS 91 Cb 0.73 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.97 2x0x h LYS 91 CO 0.15 0.18 0.07 -0.22 -0.57 0.00 0.00 179.45 179.07 2x0x h LYS 92 N 0.29 0.00 0.00 3.15 3.64 -1.28 0.43 116.57 122.80 2x0x h LYS 92 Ca 0.29 0.00 -0.38 0.00 -1.27 0.00 0.00 60.65 59.29 2x0x h LYS 92 Cb 0.40 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.15 2x0x h LYS 92 CO -0.35 0.00 -2.43 0.00 -2.27 0.00 0.00 179.45 174.40 2x0x n ALA 93 N -2.48 1.47 0.06 5.00 0.00 -0.40 -4.58 120.51 119.58 2x0x n ALA 93 Ca -0.01 -1.17 0.01 0.00 0.00 0.00 0.00 53.44 52.27 2x0x n ALA 93 Cb 0.17 -0.12 -0.00 0.00 0.00 0.00 0.00 19.45 19.50 2x0x n ALA 93 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2x0x n TYR 94 N -3.08 0.00 -0.35 0.00 4.01 0.15 -4.88 117.16 113.01 2x0x n TYR 94 Ca -0.41 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.33 2x0x n TYR 94 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.07 2x0x n TYR 94 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2x0x n GLY 95 N 0.64 1.21 3.65 2.72 0.00 0.14 -4.92 105.19 108.62 2x0x n GLY 95 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2x0x n GLY 95 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2x0x s GLN 96 N -0.19 1.67 -0.02 1.61 -2.07 -1.26 -4.88 119.66 114.53 2x0x s GLN 96 Ca 0.00 -1.25 -0.18 0.00 -1.82 0.00 0.00 55.36 52.11 2x0x s GLN 96 Cb 0.00 0.51 -0.10 0.00 -1.09 0.00 0.00 33.01 32.33 2x0x s GLN 96 CO 0.00 -0.72 0.76 0.35 -1.32 0.00 0.00 175.29 174.36 2x0x h PHE 97 N 2.18 -0.59 -2.91 9.60 3.57 -1.91 -3.26 116.94 123.61 2x0x h PHE 97 Ca -0.25 -0.01 -0.54 0.00 3.53 0.00 0.00 57.97 60.70 2x0x h PHE 97 Cb 1.25 0.20 0.01 0.00 2.79 0.00 0.00 35.95 40.19 2x0x h PHE 97 CO 0.55 -0.37 0.82 -1.21 -2.23 0.00 0.00 178.31 175.88 2x0x s GLU 98 N -3.65 4.28 0.85 1.11 0.41 -1.26 -4.84 118.70 115.60 2x0x s GLU 98 Ca -0.09 2.04 -0.11 0.00 -0.41 0.00 0.00 54.97 56.39 2x0x s GLU 98 Cb 0.01 -3.49 0.11 0.00 -1.78 0.00 0.00 34.13 28.97 2x0x s GLU 98 CO 0.28 -0.56 1.15 -2.14 -0.49 0.00 0.00 175.26 173.50 2x0x s PRO 99 N 2.09 1.48 1.11 0.39 0.02 -1.26 -5.03 135.00 133.79 2x0x s PRO 99 Ca 0.65 1.53 -0.15 0.00 0.02 0.00 0.00 61.00 63.05 2x0x s PRO 99 Cb -0.34 -1.78 0.24 0.00 0.02 0.00 0.00 34.50 32.64 2x0x s PRO 99 CO 0.28 -2.29 1.09 -1.25 -0.33 0.00 0.00 177.00 174.50 2x0x s PRO 100 N -4.54 -0.45 0.50 5.54 0.04 -1.26 -4.98 135.00 129.85 2x0x s PRO 100 Ca 0.67 0.28 -0.23 0.00 0.04 0.00 0.00 61.00 61.76 2x0x s PRO 100 Cb -0.23 -1.65 -0.07 0.00 0.04 0.00 0.00 34.50 32.59 2x0x s PRO 100 CO 0.55 -3.27 1.39 0.00 0.04 0.00 0.00 177.00 175.71 2x0x s ALA 101 N -2.93 3.03 0.20 8.56 0.00 -1.26 -4.83 121.76 124.53 2x0x s ALA 101 Ca 0.68 1.40 -0.11 0.00 0.00 0.00 0.00 51.96 53.93 2x0x s ALA 101 Cb -0.16 -3.58 0.25 0.00 0.00 0.00 0.00 23.12 19.63 2x0x s ALA 101 CO 0.58 -1.28 1.74 1.25 0.00 0.00 0.00 175.76 178.04 2x0x h LEU 102 N 1.89 0.19 -0.17 0.00 5.85 -1.94 -0.74 115.31 120.39 2x0x h LEU 102 Ca -0.51 0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.31 2x0x h LEU 102 Cb 1.28 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.36 2x0x h LEU 102 CO 0.59 0.12 0.04 0.22 -0.34 0.00 0.00 178.44 179.07 2x0x h TYR 103 N 0.38 0.07 -0.60 1.25 3.20 -1.91 -0.36 116.97 118.98 2x0x h TYR 103 Ca 0.29 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.16 2x0x h TYR 103 Cb 0.35 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.58 2x0x h TYR 103 CO -0.17 0.03 0.37 -0.44 -1.64 0.00 0.00 178.16 176.31 2x0x h ASP 104 N 0.11 0.72 -0.10 -2.11 3.32 -1.84 -1.01 116.42 115.52 2x0x h ASP 104 Ca 0.07 -0.05 0.03 0.00 0.02 0.00 0.00 57.03 57.10 2x0x h ASP 104 Cb 0.06 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.40 2x0x h ASP 104 CO -0.09 0.56 -0.10 -0.74 -1.72 0.00 0.00 179.24 177.14 2x0x h HIS 105 N 0.82 -0.25 -0.26 4.55 2.76 -0.83 -2.47 115.15 119.46 2x0x h HIS 105 Ca 0.22 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.38 2x0x h HIS 105 Cb -0.04 0.13 -0.01 0.00 1.55 0.00 0.00 27.41 29.04 2x0x h HIS 105 CO -0.02 -0.15 0.07 0.28 -1.30 0.00 0.00 177.93 176.80 2x0x h VAL 106 N -0.13 1.21 -0.41 5.26 2.07 -0.75 -1.07 116.25 122.44 2x0x h VAL 106 Ca 0.07 -0.68 0.07 0.00 0.82 0.00 0.00 66.70 66.98 2x0x h VAL 106 Cb 0.23 1.16 -0.06 0.00 -1.52 0.00 0.00 31.29 31.10 2x0x h VAL 106 CO -0.17 0.22 0.06 0.58 0.02 0.00 0.00 177.57 178.28 2x0x h VAL 107 N 0.25 0.77 -0.49 2.57 2.07 -1.20 0.15 116.25 120.37 2x0x h VAL 107 Ca 0.08 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.54 2x0x h VAL 107 Cb 0.27 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 2x0x h VAL 107 CO -0.00 0.03 0.30 0.50 0.02 0.00 0.00 177.57 178.42 2x0x h LYS 108 N 0.19 0.66 -0.19 1.57 3.64 -1.31 -1.63 116.57 119.50 2x0x h LYS 108 Ca 0.20 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.43 2x0x h LYS 108 Cb 0.25 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 2x0x h LYS 108 CO -0.27 0.48 -0.27 0.52 -2.27 0.00 0.00 179.45 177.64 2x0x h MET 109 N 0.65 0.36 -0.26 1.90 2.86 -0.51 -1.61 114.93 118.33 2x0x h MET 109 Ca 0.18 -0.13 -0.15 0.00 -2.06 0.00 0.00 59.70 57.53 2x0x h MET 109 Cb -0.01 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.63 2x0x h MET 109 CO -0.03 0.60 -0.43 0.28 1.06 0.00 0.00 176.91 178.39 2x0x h VAL 110 N 0.32 1.30 -0.79 -2.22 2.07 -0.62 -0.35 116.25 115.96 2x0x h VAL 110 Ca 0.05 -1.63 0.10 0.00 0.82 0.00 0.00 66.70 66.04 2x0x h VAL 110 Cb 0.65 1.69 -0.08 0.00 -1.52 0.00 0.00 31.29 32.03 2x0x h VAL 110 CO 0.05 0.52 0.43 -0.33 0.02 0.00 0.00 177.57 178.26 2x0x h GLU 111 N 0.50 0.68 0.00 1.57 5.08 -1.04 -1.93 114.58 119.44 2x0x h GLU 111 Ca 0.02 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2x0x h GLU 111 Cb 1.03 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.13 2x0x h GLU 111 CO 0.10 0.45 0.00 -1.33 -1.00 0.00 0.00 179.01 177.23 2x0x n MET 112 N -4.80 0.10 -1.15 2.33 2.81 -0.63 -4.89 117.12 110.89 2x0x n MET 112 Ca 0.13 0.11 -0.05 0.00 -1.81 0.00 0.00 57.70 56.08 2x0x n MET 112 Cb 0.30 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 31.28 2x0x n MET 112 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2x0x n GLY 113 N 0.68 0.77 0.09 3.03 0.00 -0.73 -4.91 105.19 104.12 2x0x n GLY 113 Ca 0.07 -0.54 -0.05 0.00 0.00 0.00 0.00 46.02 45.50 2x0x n GLY 113 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2x0x n LYS 114 N -2.49 0.64 -4.18 1.61 4.76 -0.19 -4.81 118.16 113.49 2x0x n LYS 114 Ca -0.05 0.21 -0.22 0.00 -2.87 0.00 0.00 58.31 55.37 2x0x n LYS 114 Cb 0.22 -1.75 -0.06 0.00 -1.84 0.00 0.00 35.03 31.60 2x0x n LYS 114 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2x0x s TYR 115 N -2.75 2.92 -0.00 2.13 2.02 -0.90 -4.49 117.35 116.29 2x0x s TYR 115 Ca -0.05 -0.17 -0.30 0.00 -0.37 0.00 0.00 57.07 56.18 2x0x s TYR 115 Cb 0.08 -1.34 -0.04 0.00 -0.40 0.00 0.00 41.96 40.26 2x0x s TYR 115 CO 0.82 0.55 1.17 0.34 -1.57 0.00 0.00 175.55 176.86 2x0x s ASP 116 N -3.78 7.10 0.60 2.29 -1.08 0.02 -4.52 116.67 117.31 2x0x s ASP 116 Ca 0.33 1.88 0.30 0.00 -0.52 0.00 0.00 52.55 54.53 2x0x s ASP 116 Cb -0.07 -2.57 1.67 0.00 -1.46 0.00 0.00 42.92 40.50 2x0x s ASP 116 CO 0.23 -0.50 2.07 -0.55 0.52 0.00 0.00 175.17 176.95 2x0x h ASN 117 N 7.10 0.00 -0.04 -0.34 7.08 -1.90 -2.58 115.58 124.90 2x0x h ASN 117 Ca -0.38 0.00 0.01 0.00 -3.08 0.00 0.00 56.30 52.85 2x0x h ASN 117 Cb 1.19 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 37.43 2x0x h ASN 117 CO 0.84 0.00 0.04 1.12 -2.08 0.00 0.00 177.43 177.34 2x0x h HIS 118 N 0.00 0.00 -0.99 4.14 2.07 -1.97 -0.67 115.15 117.72 2x0x h HIS 118 Ca 0.09 0.00 0.03 0.00 -2.85 0.00 0.00 60.37 57.64 2x0x h HIS 118 Cb 0.56 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.49 2x0x h HIS 118 CO 0.00 0.00 0.65 -0.07 -3.07 0.00 0.00 177.93 175.44 2x0x h LEU 119 N 0.00 1.10 -0.47 6.12 3.38 -1.85 0.18 115.31 123.77 2x0x h LEU 119 Ca 0.02 -0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 2x0x h LEU 119 Cb 0.09 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2x0x h LEU 119 CO -0.00 0.77 -0.70 -0.07 0.09 0.00 0.00 178.44 178.53 2x0x h LEU 120 N 1.28 0.39 -0.61 1.67 3.38 -1.33 -2.66 115.31 117.43 2x0x h LEU 120 Ca 0.38 -0.25 -0.12 0.00 0.09 0.00 0.00 57.88 57.98 2x0x h LEU 120 Cb -0.06 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 2x0x h LEU 120 CO -0.11 0.97 -0.18 -0.33 0.09 0.00 0.00 178.44 178.89 2x0x h GLU 121 N 0.23 0.92 0.00 1.13 5.08 -1.24 -3.34 114.58 117.35 2x0x h GLU 121 Ca -0.02 -0.36 -0.11 0.00 -1.00 0.00 0.00 59.36 57.86 2x0x h GLU 121 Cb 1.26 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.44 2x0x h GLU 121 CO 0.12 1.01 -0.95 -0.44 -1.00 0.00 0.00 179.01 177.75 2x0x h ASP 122 N 0.80 0.00 -4.10 1.42 3.32 -0.64 -3.46 116.42 113.75 2x0x h ASP 122 Ca 0.12 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.64 2x0x h ASP 122 Cb 0.72 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.06 2x0x h ASP 122 CO 0.06 0.44 -0.81 -0.31 -1.72 0.00 0.00 179.24 176.90 2x0x s TYR 123 N -3.01 1.69 0.32 4.55 1.51 -1.01 -5.07 117.35 116.34 2x0x s TYR 123 Ca 0.00 -0.44 -0.03 0.00 -1.01 0.00 0.00 57.07 55.59 2x0x s TYR 123 Cb 0.08 -0.91 -0.04 0.00 -0.11 0.00 0.00 41.96 40.98 2x0x s TYR 123 CO 0.78 0.20 0.57 0.95 -1.11 0.00 0.00 175.55 176.94 2x0x s THR 124 N -1.40 5.04 0.30 -0.71 -4.23 -1.26 -4.67 115.64 108.71 2x0x s THR 124 Ca 0.07 -0.10 0.05 0.00 -1.18 0.00 0.00 61.69 60.54 2x0x s THR 124 Cb -0.09 -3.78 0.31 0.00 1.34 0.00 0.00 72.50 70.28 2x0x s THR 124 CO 0.04 -0.44 1.66 -0.08 -0.54 0.00 0.00 174.62 175.27 2x0x h GLU 125 N 1.28 0.27 -0.17 3.99 4.81 -1.98 0.11 114.58 122.88 2x0x h GLU 125 Ca -0.48 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 58.65 2x0x h GLU 125 Cb 1.20 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 2x0x h GLU 125 CO 0.64 0.18 -0.26 0.93 -0.73 0.00 0.00 179.01 179.77 2x0x h GLU 126 N 0.28 0.32 -0.28 1.92 3.07 -1.98 -0.54 114.58 117.36 2x0x h GLU 126 Ca 0.60 -0.11 -0.12 0.00 -0.50 0.00 0.00 59.36 59.23 2x0x h GLU 126 Cb 1.23 -0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 29.11 2x0x h GLU 126 CO -0.62 0.56 -0.29 0.93 -1.40 0.00 0.00 179.01 178.20 2x0x h GLU 127 N 0.29 0.69 -0.95 2.33 5.08 -1.22 -1.41 114.58 119.40 2x0x h GLU 127 Ca 0.04 -0.37 0.04 0.00 -1.00 0.00 0.00 59.36 58.07 2x0x h GLU 127 Cb 0.61 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.82 2x0x h GLU 127 CO 0.04 0.98 0.62 0.74 -1.00 0.00 0.00 179.01 180.39 2x0x h PHE 128 N 0.44 1.16 -0.77 4.33 0.04 -0.96 0.22 116.94 121.40 2x0x h PHE 128 Ca 0.04 0.03 0.01 0.00 2.80 0.00 0.00 57.97 60.85 2x0x h PHE 128 Cb 0.85 -0.39 -0.04 0.00 2.20 0.00 0.00 35.95 38.58 2x0x h PHE 128 CO 0.07 0.66 0.51 0.87 -0.60 0.00 0.00 178.31 179.82 2x0x h LYS 129 N 1.19 1.02 -0.17 1.51 1.57 -1.00 -0.54 116.57 120.15 2x0x h LYS 129 Ca 0.38 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 59.05 2x0x h LYS 129 Cb 0.01 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.09 2x0x h LYS 129 CO -0.13 0.68 -0.08 0.37 -0.57 0.00 0.00 179.45 179.72 2x0x h GLN 130 N 1.04 0.35 -0.99 3.15 4.15 -0.50 -2.96 115.11 119.35 2x0x h GLN 130 Ca 0.28 -0.15 0.12 0.00 0.77 0.00 0.00 58.65 59.67 2x0x h GLN 130 Cb -0.12 -0.01 -0.08 0.00 0.21 0.00 0.00 27.48 27.48 2x0x h GLN 130 CO -0.06 0.66 0.63 0.52 -1.93 0.00 0.00 178.83 178.65 2x0x h MET 131 N 0.03 0.93 0.00 1.69 2.86 -0.48 -1.74 114.93 118.22 2x0x h MET 131 Ca 0.04 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2x0x h MET 131 Cb 0.56 -0.21 -0.00 0.00 0.06 0.00 0.00 31.60 32.01 2x0x h MET 131 CO 0.02 0.61 -0.01 0.22 1.06 0.00 0.00 176.91 178.82 2x0x h ASP 132 N 0.95 0.00 1.73 1.22 3.58 -0.92 -1.04 116.42 121.94 2x0x h ASP 132 Ca 0.49 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.94 2x0x h ASP 132 Cb 0.53 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.58 2x0x h ASP 132 CO -0.26 0.01 -0.16 0.71 -2.88 0.00 0.00 179.24 176.65 2x0x h THR 133 N 0.00 0.00 0.01 2.25 1.35 -1.26 -3.24 112.91 112.02 2x0x h THR 133 Ca -0.00 -0.89 -0.25 0.00 -0.55 0.00 0.00 66.41 64.72 2x0x h THR 133 Cb 0.05 1.81 0.01 0.00 -1.73 0.00 0.00 68.15 68.29 2x0x h THR 133 CO 0.00 0.00 -1.01 -0.26 -0.25 0.00 0.00 175.52 174.00 2x0x h PHE 134 N 0.00 0.77 -2.99 4.73 0.04 -1.21 -3.46 116.94 114.82 2x0x h PHE 134 Ca 0.00 -0.43 -0.53 0.00 2.80 0.00 0.00 57.97 59.81 2x0x h PHE 134 Cb 0.95 -0.08 0.08 0.00 2.20 0.00 0.00 35.95 39.09 2x0x h PHE 134 CO 0.00 1.26 0.91 -0.89 -0.60 0.00 0.00 178.31 179.00 2x0x n ILE 135 N -3.77 0.62 -3.95 -0.55 5.41 -1.14 -5.00 119.36 110.98 2x0x n ILE 135 Ca -0.09 -0.16 -0.31 0.00 1.00 0.00 0.00 62.75 63.20 2x0x n ILE 135 Cb 0.87 -1.94 -0.15 0.00 -0.71 0.00 0.00 39.64 37.71 2x0x n ILE 135 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2x0x s ASP 136 N 0.74 4.58 0.59 4.38 2.15 -1.26 -5.00 116.67 122.85 2x0x s ASP 136 Ca 0.69 -2.10 0.36 0.00 0.43 0.00 0.00 52.55 51.93 2x0x s ASP 136 Cb -0.51 -1.46 1.78 0.00 -0.30 0.00 0.00 42.92 42.42 2x0x s ASP 136 CO 0.42 -0.38 2.15 0.45 -0.17 0.00 0.00 175.17 177.64 2x0x h HIS 137 N 7.64 0.00 0.00 -5.34 3.86 -1.97 -1.85 115.15 117.49 2x0x h HIS 137 Ca -0.06 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 2x0x h HIS 137 Cb 1.01 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.48 2x0x h HIS 137 CO 0.44 0.03 0.00 -0.25 0.86 0.00 0.00 177.93 179.01 2x0x n ASP 138 N -3.21 0.00 0.12 2.45 9.92 -1.26 -1.92 116.55 122.65 2x0x n ASP 138 Ca -0.01 0.19 0.12 0.00 -0.53 0.00 0.00 54.79 54.55 2x0x n ASP 138 Cb 0.21 -0.36 0.47 0.00 -0.64 0.00 0.00 41.12 40.80 2x0x n ASP 138 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2x0x n ARG 139 N -1.36 0.20 0.29 -1.24 1.74 -0.70 -1.83 116.66 113.76 2x0x n ARG 139 Ca 0.07 0.38 0.14 0.00 -0.77 0.00 0.00 57.85 57.67 2x0x n ARG 139 Cb 0.17 -1.85 0.85 0.00 -1.02 0.00 0.00 32.46 30.61 2x0x n ARG 139 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 2x0x h ASP 140 N 0.00 0.00 0.34 0.55 3.32 -1.60 -2.27 116.42 116.75 2x0x h ASP 140 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2x0x h ASP 140 Cb 0.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 2x0x h ASP 140 CO 0.00 0.02 0.00 0.23 -1.72 0.00 0.00 179.24 177.77 2x0x n MET 141 N -3.90 0.45 0.00 3.56 2.81 -0.76 -3.28 117.12 116.00 2x0x n MET 141 Ca -0.03 0.05 0.11 0.00 -1.81 0.00 0.00 57.70 56.01 2x0x n MET 141 Cb 0.11 -1.50 -0.04 0.00 -0.71 0.00 0.00 33.22 31.08 2x0x n MET 141 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2x0x n THR 142 N -1.21 0.00 -2.40 2.03 -2.24 -0.85 -4.90 114.28 104.70 2x0x n THR 142 Ca 0.13 -0.19 -0.38 0.00 -2.27 0.00 0.00 64.05 61.34 2x0x n THR 142 Cb 0.16 1.19 -0.03 0.00 -2.10 0.00 0.00 70.33 69.55 2x0x n THR 142 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2x0x s PHE 143 N -2.60 3.18 0.64 4.78 0.08 -1.20 -5.03 117.98 117.83 2x0x s PHE 143 Ca 0.15 1.60 -0.07 0.00 0.12 0.00 0.00 56.93 58.74 2x0x s PHE 143 Cb 0.17 -3.28 0.03 0.00 -0.57 0.00 0.00 43.02 39.37 2x0x s PHE 143 CO 0.65 -1.00 0.96 -1.54 -0.10 0.00 0.00 175.22 174.19 2x0x s SER 144 N -1.28 5.29 0.13 1.36 1.04 -1.26 -4.69 113.70 114.29 2x0x s SER 144 Ca 0.56 0.66 -0.19 0.00 0.48 0.00 0.00 55.95 57.46 2x0x s SER 144 Cb -0.28 -1.50 -0.03 0.00 0.10 0.00 0.00 66.02 64.31 2x0x s SER 144 CO 0.35 -1.29 1.74 0.22 0.98 0.00 0.00 173.24 175.23 2x0x h TYR 145 N -0.38 0.08 -0.95 5.02 3.20 -1.26 -1.76 116.97 120.92 2x0x h TYR 145 Ca -0.45 0.01 0.10 0.00 3.14 0.00 0.00 58.73 61.53 2x0x h TYR 145 Cb 1.28 -0.00 -0.08 0.00 1.54 0.00 0.00 36.73 39.47 2x0x h TYR 145 CO 0.42 0.03 0.58 0.00 -1.64 0.00 0.00 178.16 177.56 2x0x h ALA 146 N 1.15 1.38 -0.00 1.82 0.00 -1.86 -1.43 119.26 120.32 2x0x h ALA 146 Ca 0.10 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.05 2x0x h ALA 146 Cb 0.09 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 2x0x h ALA 146 CO -0.12 0.24 -0.21 0.00 0.00 0.00 0.00 179.25 179.15 2x0x h ALA 147 N 1.49 -0.28 -0.98 0.00 0.00 -1.47 -1.33 119.26 116.69 2x0x h ALA 147 Ca 0.45 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.38 2x0x h ALA 147 Cb 0.37 0.38 -0.05 0.00 0.00 0.00 0.00 17.79 18.49 2x0x h ALA 147 CO -0.24 -0.71 0.65 0.28 0.00 0.00 0.00 179.25 179.23 2x0x h VAL 148 N -0.34 1.23 -0.66 0.00 2.07 -0.91 -0.13 116.25 117.49 2x0x h VAL 148 Ca 0.06 -0.45 -0.03 0.00 0.82 0.00 0.00 66.70 67.11 2x0x h VAL 148 Cb 0.42 -0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 29.97 2x0x h VAL 148 CO -0.20 0.24 0.31 0.11 0.02 0.00 0.00 177.57 178.05 2x0x h LYS 149 N 1.30 0.95 -0.31 1.57 6.56 -1.09 0.37 116.57 125.93 2x0x h LYS 149 Ca 0.37 -0.13 -0.08 0.00 -1.06 0.00 0.00 60.65 59.75 2x0x h LYS 149 Cb -0.10 -0.17 -0.01 0.00 -0.57 0.00 0.00 32.23 31.37 2x0x h LYS 149 CO -0.09 0.74 -0.13 1.96 -2.06 0.00 0.00 179.45 179.87 2x0x h GLN 150 N 0.94 0.63 -0.10 3.15 1.08 -0.16 -1.39 115.11 119.26 2x0x h GLN 150 Ca 0.23 -0.27 -0.00 0.00 -1.45 0.00 0.00 58.65 57.16 2x0x h GLN 150 Cb 0.11 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.52 2x0x h GLN 150 CO -0.03 0.84 0.06 -0.07 -0.95 0.00 0.00 178.83 178.69 2x0x h LEU 151 N 0.39 0.12 -1.04 1.46 3.38 -0.87 0.13 115.31 118.89 2x0x h LEU 151 Ca 0.07 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2x0x h LEU 151 Cb 0.64 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.32 2x0x h LEU 151 CO 0.04 0.13 0.56 -0.08 0.09 0.00 0.00 178.44 179.18 2x0x h GLU 152 N 0.10 1.22 0.00 1.13 4.81 -0.97 0.13 114.58 121.00 2x0x h GLU 152 Ca 0.04 -0.10 -0.25 0.00 -0.13 0.00 0.00 59.36 58.92 2x0x h GLU 152 Cb 0.03 -0.26 -0.04 0.00 0.63 0.00 0.00 28.75 29.11 2x0x h GLU 152 CO -0.01 0.84 -1.52 0.78 -0.73 0.00 0.00 179.01 178.38 2x0x h GLY 153 N 1.25 0.00 0.00 1.92 0.00 -1.07 -3.44 103.07 101.73 2x0x h GLY 153 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.66 2x0x h GLY 153 CO -0.06 0.00 -0.92 0.28 0.00 0.00 0.00 176.54 175.84 2x0x n LYS 154 N -3.07 1.65 -0.10 4.80 5.02 0.44 -4.98 118.16 121.92 2x0x n LYS 154 Ca -0.13 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.01 2x0x n LYS 154 Cb 0.99 -0.96 -0.06 0.00 -0.02 0.00 0.00 35.03 34.98 2x0x n LYS 154 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2x0x n TYR 155 N -2.18 0.30 -2.06 2.13 4.02 -0.58 -4.71 117.16 114.09 2x0x n TYR 155 Ca 0.00 0.13 -0.42 0.00 -0.01 0.00 0.00 57.90 57.60 2x0x n TYR 155 Cb 0.46 -0.76 -0.03 0.00 -0.02 0.00 0.00 39.34 38.99 2x0x n TYR 155 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2x0x s LEU 156 N -7.86 4.38 0.30 7.72 1.43 0.34 -4.40 118.68 120.60 2x0x s LEU 156 Ca -0.29 2.50 -0.30 0.00 -1.03 0.00 0.00 54.13 55.01 2x0x s LEU 156 Cb 0.07 -3.60 -0.12 0.00 0.03 0.00 0.00 46.19 42.57 2x0x s LEU 156 CO 0.42 -0.71 1.57 0.52 0.23 0.00 0.00 176.35 178.39 2x0x n VAL 157 N 3.52 1.18 -3.56 -1.59 0.31 -1.26 -4.90 118.33 112.02 2x0x n VAL 157 Ca 0.11 -0.29 -0.08 0.00 -0.01 0.00 0.00 64.34 64.07 2x0x n VAL 157 Cb 0.41 -1.94 -0.02 0.00 -0.91 0.00 0.00 33.84 31.37 2x0x n VAL 157 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2x0x s GLN 158 N -0.76 0.99 -0.27 5.55 -2.07 -1.26 -1.54 119.66 120.30 2x0x s GLN 158 Ca 0.62 -0.42 -0.13 0.00 -1.82 0.00 0.00 55.36 53.61 2x0x s GLN 158 Cb -0.50 0.42 -0.04 0.00 -1.09 0.00 0.00 33.01 31.79 2x0x s GLN 158 CO 0.51 -0.44 0.27 1.21 -1.32 0.00 0.00 175.29 175.52 2x0x s ASN 159 N -2.63 6.13 0.16 12.60 3.84 0.88 -4.98 114.94 130.93 2x0x s ASN 159 Ca 0.06 0.13 -0.08 0.00 0.21 0.00 0.00 52.86 53.18 2x0x s ASN 159 Cb -0.01 -2.16 0.01 0.00 -0.55 0.00 0.00 41.25 38.53 2x0x s ASN 159 CO -0.06 -0.10 1.45 0.03 -2.79 0.00 0.00 177.10 175.63 2x0x h ARG 160 N 8.25 0.74 -0.53 0.43 2.47 -1.94 0.75 114.38 124.55 2x0x h ARG 160 Ca -0.34 -0.46 -0.08 0.00 -1.26 0.00 0.00 59.98 57.84 2x0x h ARG 160 Cb 1.18 0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 29.53 2x0x h ARG 160 CO 0.59 1.09 0.02 0.28 0.56 0.00 0.00 179.97 182.51 2x0x h VAL 161 N 0.57 1.26 -0.02 2.04 2.07 -1.98 -3.29 116.25 116.90 2x0x h VAL 161 Ca 0.01 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.47 2x0x h VAL 161 Cb 1.12 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 2x0x h VAL 161 CO 0.11 0.38 -0.27 0.35 0.02 0.00 0.00 177.57 178.16 2x0x n THR 162 N -4.31 0.00 -0.52 2.57 -2.24 -1.22 -4.97 114.28 103.59 2x0x n THR 162 Ca 0.02 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 2x0x n THR 162 Cb 0.31 1.32 0.00 0.00 -2.10 0.00 0.00 70.33 69.86 2x0x n THR 162 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x0x n GLY 163 N 1.30 0.70 3.71 3.38 0.00 0.25 -4.97 105.19 109.55 2x0x n GLY 163 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2x0x n GLY 163 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2x0x s GLU 164 N -0.40 4.20 -0.17 1.61 2.12 -1.16 -4.79 118.70 120.11 2x0x s GLU 164 Ca 0.00 2.39 -0.06 0.00 0.36 0.00 0.00 54.97 57.66 2x0x s GLU 164 Cb 0.00 -3.23 -0.04 0.00 0.26 0.00 0.00 34.13 31.12 2x0x s GLU 164 CO 0.00 -0.65 0.04 0.42 -0.54 0.00 0.00 175.26 174.53 2x0x s ILE 165 N 1.43 4.62 -0.37 -3.70 1.01 -1.26 -0.09 121.20 122.85 2x0x s ILE 165 Ca 0.71 -0.10 0.16 0.00 0.00 0.00 0.00 60.65 61.42 2x0x s ILE 165 Cb -0.44 -3.06 -0.21 0.00 0.01 0.00 0.00 42.46 38.76 2x0x s ILE 165 CO 0.32 0.48 0.50 -1.22 0.00 0.00 0.00 174.94 175.02 2x0x n TYR 166 N 3.36 0.00 -4.21 3.97 4.01 -0.59 -3.84 117.16 119.86 2x0x n TYR 166 Ca -0.17 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.44 2x0x n TYR 166 Cb 0.52 -0.19 -0.10 0.00 -0.31 0.00 0.00 39.34 39.27 2x0x n TYR 166 CO 0.00 0.00 0.00 -1.83 -0.46 0.00 0.00 176.86 174.57 2x0x s GLU 167 N -2.80 1.29 0.42 -0.72 -1.05 -1.24 -4.93 118.70 109.66 2x0x s GLU 167 Ca -0.00 -1.69 0.07 0.00 -0.15 0.00 0.00 54.97 53.20 2x0x s GLU 167 Cb 0.11 0.28 -0.06 0.00 -0.44 0.00 0.00 34.13 34.02 2x0x s GLU 167 CO 0.65 -0.43 0.10 -1.54 0.95 0.00 0.00 175.26 174.99 2x0x s SER 168 N -3.19 4.16 0.24 0.83 1.04 -1.26 -4.87 113.70 110.66 2x0x s SER 168 Ca 0.39 -1.26 -0.06 0.00 0.48 0.00 0.00 55.95 55.51 2x0x s SER 168 Cb 0.06 -0.35 0.29 0.00 0.10 0.00 0.00 66.02 66.12 2x0x s SER 168 CO 0.14 -0.54 1.89 0.00 0.98 0.00 0.00 173.24 175.72 2x0x h ALA 169 N 1.56 1.22 0.00 5.32 0.00 -2.00 -2.63 119.26 122.73 2x0x h ALA 169 Ca -0.43 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.36 2x0x h ALA 169 Cb 1.25 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2x0x h ALA 169 CO 0.75 0.48 -0.36 1.96 0.00 0.00 0.00 179.25 182.08 2x0x h GLN 170 N 1.18 0.00 -0.17 0.00 1.08 -1.93 -1.79 115.11 113.48 2x0x h GLN 170 Ca 0.37 0.00 -0.19 0.00 -1.45 0.00 0.00 58.65 57.38 2x0x h GLN 170 Cb -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.42 2x0x h GLN 170 CO -0.12 0.36 -0.66 0.74 -0.95 0.00 0.00 178.83 178.20 2x0x h PHE 171 N 0.00 0.87 0.04 2.96 0.04 -1.91 -1.87 116.94 117.06 2x0x h PHE 171 Ca -0.00 -0.35 0.02 0.00 2.80 0.00 0.00 57.97 60.44 2x0x h PHE 171 Cb 0.80 -0.15 -0.04 0.00 2.20 0.00 0.00 35.95 38.77 2x0x h PHE 171 CO 0.00 1.14 -0.22 1.25 -0.60 0.00 0.00 178.31 179.88 2x0x h LEU 172 N 0.48 -0.63 -0.32 1.54 6.46 -1.11 -1.98 115.31 119.75 2x0x h LEU 172 Ca -0.02 0.08 -0.06 0.00 -0.12 0.00 0.00 57.88 57.76 2x0x h LEU 172 Cb 1.25 0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 41.43 2x0x h LEU 172 CO 0.13 -0.29 -0.05 1.88 -0.62 0.00 0.00 178.44 179.49 2x0x h TYR 173 N -0.37 0.66 -0.58 1.25 0.05 -1.27 -1.01 116.97 115.70 2x0x h TYR 173 Ca 0.05 -0.13 -0.08 0.00 0.05 0.00 0.00 58.73 58.62 2x0x h TYR 173 Cb 0.43 -0.16 -0.02 0.00 1.01 0.00 0.00 36.73 37.98 2x0x h TYR 173 CO -0.24 0.75 0.05 0.97 -1.05 0.00 0.00 178.16 178.64 2x0x h ILE 174 N 0.37 1.25 0.04 -2.88 6.09 -1.39 -2.45 117.51 118.55 2x0x h ILE 174 Ca 0.08 -1.02 -0.23 0.00 -1.37 0.00 0.00 64.86 62.32 2x0x h ILE 174 Cb 0.52 0.75 -0.01 0.00 0.47 0.00 0.00 36.82 38.55 2x0x h ILE 174 CO 0.03 0.37 -1.01 -0.07 -3.07 0.00 0.00 178.15 174.40 2x0x h LEU 175 N 0.89 0.30 -0.07 2.19 3.38 -1.16 0.12 115.31 120.96 2x0x h LEU 175 Ca 0.17 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.90 2x0x h LEU 175 Cb 0.45 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 2x0x h LEU 175 CO 0.02 1.14 -0.10 0.58 0.09 0.00 0.00 178.44 180.16 2x0x h VAL 176 N 0.09 0.72 -0.12 1.22 2.07 -1.20 -0.00 116.25 119.03 2x0x h VAL 176 Ca -0.07 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.49 2x0x h VAL 176 Cb 1.70 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 32.14 2x0x h VAL 176 CO 0.16 0.00 -0.14 0.00 0.02 0.00 0.00 177.57 177.60 2x0x h ALA 177 N 0.89 -0.07 -0.97 1.67 0.00 -1.30 -1.45 119.26 118.03 2x0x h ALA 177 Ca 0.06 0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.09 2x0x h ALA 177 Cb 0.23 0.29 -0.07 0.00 0.00 0.00 0.00 17.79 18.25 2x0x h ALA 177 CO -0.16 -0.60 0.62 0.00 0.00 0.00 0.00 179.25 179.12 2x0x h ALA 178 N 0.87 1.35 -0.13 0.00 0.00 -0.64 -2.36 119.26 118.35 2x0x h ALA 178 Ca 0.09 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2x0x h ALA 178 Cb 0.31 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2x0x h ALA 178 CO -0.23 0.40 -0.09 0.00 0.00 0.00 0.00 179.25 179.33 2x0x h LEU 180 N -0.06 0.49 -3.03 0.00 3.38 -1.15 -3.03 115.31 111.91 2x0x h LEU 180 Ca 0.03 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2x0x h LEU 180 Cb 0.58 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2x0x h LEU 180 CO 0.02 0.73 0.00 0.49 0.09 0.00 0.00 178.44 179.77 2x0x n PHE 181 N -4.13 1.39 -0.03 1.13 3.01 -0.90 -4.65 117.46 113.27 2x0x n PHE 181 Ca -0.00 -0.58 -0.01 0.00 1.01 0.00 0.00 57.45 57.87 2x0x n PHE 181 Cb 0.40 -0.18 0.26 0.00 -0.01 0.00 0.00 39.48 39.95 2x0x n PHE 181 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2x0x h SER 182 N 4.22 0.57 -0.01 4.37 4.64 -1.31 -2.20 113.55 123.83 2x0x h SER 182 Ca 0.00 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 2x0x h SER 182 Cb 1.35 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2x0x h SER 182 CO 0.18 0.63 0.00 0.59 -0.87 0.00 0.00 176.83 177.35 2x0x n ASN 183 N -4.27 0.05 -4.82 4.97 5.03 -1.26 -4.88 115.26 110.08 2x0x n ASN 183 Ca 0.02 -1.71 -0.33 0.00 0.87 0.00 0.00 54.58 53.43 2x0x n ASN 183 Cb 0.25 -0.00 -0.06 0.00 -1.02 0.00 0.00 39.78 38.95 2x0x n ASN 183 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 2x0x s TYR 184 N -1.99 3.29 0.67 3.10 1.51 -0.83 -5.02 117.35 118.08 2x0x s TYR 184 Ca 0.14 1.59 -0.15 0.00 -1.01 0.00 0.00 57.07 57.64 2x0x s TYR 184 Cb 0.07 -2.87 0.01 0.00 -0.11 0.00 0.00 41.96 39.06 2x0x s TYR 184 CO 0.11 -0.23 1.12 -1.25 -1.11 0.00 0.00 175.55 174.19 2x0x s PRO 185 N -3.32 2.68 0.57 -1.71 0.04 -1.26 -4.62 135.00 127.39 2x0x s PRO 185 Ca 0.62 1.44 0.27 0.00 0.04 0.00 0.00 61.00 63.37 2x0x s PRO 185 Cb -0.10 -1.93 1.60 0.00 0.04 0.00 0.00 34.50 34.11 2x0x s PRO 185 CO 0.16 -1.35 2.11 0.00 0.04 0.00 0.00 177.00 177.97 2x0x h ARG 186 N -0.05 0.00 0.00 4.56 2.47 -1.97 0.29 114.38 119.69 2x0x h ARG 186 Ca -0.47 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.18 2x0x h ARG 186 Cb 1.25 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.56 2x0x h ARG 186 CO 0.53 0.00 -0.37 1.05 0.56 0.00 0.00 179.97 181.75 2x0x h GLU 187 N 0.00 0.00 0.00 0.04 9.09 -2.05 -3.35 114.58 118.31 2x0x h GLU 187 Ca 0.08 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.47 2x0x h GLU 187 Cb 0.43 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.52 2x0x h GLU 187 CO -0.00 0.37 -1.20 0.25 0.05 0.00 0.00 179.01 178.47 2x0x n THR 188 N -3.89 0.08 -0.06 -1.06 -2.24 -0.59 -4.88 114.28 101.63 2x0x n THR 188 Ca -0.01 -0.11 -0.08 0.00 -2.27 0.00 0.00 64.05 61.58 2x0x n THR 188 Cb 0.43 0.02 -0.05 0.00 -2.10 0.00 0.00 70.33 68.62 2x0x n THR 188 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2x0x h ARG 189 N 0.00 -0.23 0.00 -0.78 2.43 -1.12 -0.91 114.38 113.77 2x0x h ARG 189 Ca -0.03 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2x0x h ARG 189 Cb 0.50 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 2x0x h ARG 189 CO 0.00 -0.15 0.00 1.28 -1.51 0.00 0.00 179.97 179.59 2x0x n LEU 190 N -4.14 0.54 0.04 3.80 4.77 -1.26 -1.36 117.00 119.40 2x0x n LEU 190 Ca -0.02 0.65 -0.20 0.00 -0.03 0.00 0.00 56.01 56.41 2x0x n LEU 190 Cb 0.19 -0.60 -0.11 0.00 -2.33 0.00 0.00 43.42 40.57 2x0x n LEU 190 CO 0.01 -0.57 0.08 -0.61 -1.33 0.00 0.00 177.39 174.97 2x0x h GLN 191 N 0.00 0.64 0.03 3.23 4.15 -1.53 -1.95 115.11 119.68 2x0x h GLN 191 Ca 0.00 -0.72 -0.00 0.00 0.77 0.00 0.00 58.65 58.70 2x0x h GLN 191 Cb 0.29 0.21 0.00 0.00 0.21 0.00 0.00 27.48 28.19 2x0x h GLN 191 CO 0.00 1.30 -0.02 1.88 -1.93 0.00 0.00 178.83 180.06 2x0x h TYR 192 N 0.27 -0.04 -0.39 3.99 0.05 -0.69 -1.60 116.97 118.56 2x0x h TYR 192 Ca -0.13 -0.00 0.08 0.00 0.05 0.00 0.00 58.73 58.73 2x0x h TYR 192 Cb 1.67 0.01 -0.09 0.00 1.01 0.00 0.00 36.73 39.34 2x0x h TYR 192 CO 0.12 0.07 -0.28 0.28 -1.05 0.00 0.00 178.16 177.30 2x0x h VAL 193 N -0.15 0.29 -0.23 -2.88 2.07 -1.30 0.23 116.25 114.28 2x0x h VAL 193 Ca -0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.52 2x0x h VAL 193 Cb 0.13 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 2x0x h VAL 193 CO 0.01 0.00 0.15 0.50 0.02 0.00 0.00 177.57 178.24 2x0x h LYS 194 N -0.21 0.29 -0.39 1.57 3.64 -1.30 -0.39 116.57 119.76 2x0x h LYS 194 Ca 0.18 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.45 2x0x h LYS 194 Cb 0.51 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 2x0x h LYS 194 CO -0.51 0.19 -0.14 0.00 -2.27 0.00 0.00 179.45 176.72 2x0x h ARG 195 N 0.30 0.72 -0.08 1.90 3.08 -0.81 -0.93 114.38 118.55 2x0x h ARG 195 Ca 0.09 -0.24 -0.10 0.00 0.07 0.00 0.00 59.98 59.80 2x0x h ARG 195 Cb -0.02 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 29.97 2x0x h ARG 195 CO -0.03 0.82 -0.33 0.35 -1.07 0.00 0.00 179.97 179.71 2x0x h PHE 196 N 0.65 0.49 -0.63 3.04 3.57 -0.45 -1.90 116.94 121.71 2x0x h PHE 196 Ca 0.11 -0.21 0.13 0.00 3.53 0.00 0.00 57.97 61.53 2x0x h PHE 196 Cb 0.60 -0.08 -0.10 0.00 2.79 0.00 0.00 35.95 39.16 2x0x h PHE 196 CO 0.03 0.95 0.03 -0.92 -2.23 0.00 0.00 178.31 176.16 2x0x h TYR 197 N -0.10 0.01 -0.74 0.41 3.20 -0.99 -0.83 116.97 117.93 2x0x h TYR 197 Ca -0.02 0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.84 2x0x h TYR 197 Cb 0.98 0.09 -0.03 0.00 1.54 0.00 0.00 36.73 39.31 2x0x h TYR 197 CO 0.12 -0.15 0.23 -0.44 -1.64 0.00 0.00 178.16 176.29 2x0x h ASP 198 N 0.14 1.06 -0.22 -2.11 3.32 -1.10 -0.71 116.42 116.80 2x0x h ASP 198 Ca 0.33 -0.20 -0.04 0.00 0.02 0.00 0.00 57.03 57.15 2x0x h ASP 198 Cb 0.54 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 2x0x h ASP 198 CO -0.52 0.98 -0.02 0.00 -1.72 0.00 0.00 179.24 177.97 2x0x h ALA 199 N 1.15 0.30 -0.01 3.45 0.00 -0.52 -2.58 119.26 121.05 2x0x h ALA 199 Ca 0.24 -0.23 -0.26 0.00 0.00 0.00 0.00 54.91 54.66 2x0x h ALA 199 Cb 0.30 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.03 2x0x h ALA 199 CO -0.01 0.05 -1.01 -0.39 0.00 0.00 0.00 179.25 177.89 2x0x h VAL 200 N 0.15 1.28 0.00 0.00 -1.51 -1.14 0.24 116.25 115.27 2x0x h VAL 200 Ca 0.06 -2.21 0.00 0.00 -1.23 0.00 0.00 66.70 63.32 2x0x h VAL 200 Cb 0.44 2.35 0.00 0.00 -2.13 0.00 0.00 31.29 31.95 2x0x h VAL 200 CO 0.02 0.69 0.00 0.77 -1.23 0.00 0.00 177.57 177.81 2x0x h SER 201 N 0.40 0.00 -0.34 4.19 4.64 -1.21 -1.80 113.55 119.43 2x0x h SER 201 Ca -0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 2x0x h SER 201 Cb 1.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.75 2x0x h SER 201 CO 0.20 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.51 2x0x n THR 202 N -2.54 1.94 -1.06 2.95 -2.24 -0.97 -4.99 114.28 107.37 2x0x n THR 202 Ca 0.02 -1.56 -0.02 0.00 -2.27 0.00 0.00 64.05 60.22 2x0x n THR 202 Cb 0.27 -0.02 -0.01 0.00 -2.10 0.00 0.00 70.33 68.48 2x0x n THR 202 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2x0x n PHE 203 N -0.02 0.00 0.13 4.78 3.72 -0.68 -4.89 117.46 120.49 2x0x n PHE 203 Ca 0.20 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.58 2x0x n PHE 203 Cb 0.79 -0.98 0.16 0.00 -0.94 0.00 0.00 39.48 38.51 2x0x n PHE 203 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2x0x h LYS 204 N 0.47 0.04 -5.25 -1.08 1.57 -1.18 -3.39 116.57 107.75 2x0x h LYS 204 Ca -0.04 -0.03 -0.60 0.00 -1.87 0.00 0.00 60.65 58.12 2x0x h LYS 204 Cb 0.42 0.00 -0.32 0.00 0.08 0.00 0.00 32.23 32.41 2x0x h LYS 204 CO 0.06 0.65 -0.85 0.42 -0.57 0.00 0.00 179.45 179.15 2x0x s ILE 205 N -3.62 1.60 -0.12 1.86 1.01 -1.12 -1.26 121.20 119.54 2x0x s ILE 205 Ca -0.02 -0.79 -0.03 0.00 0.00 0.00 0.00 60.65 59.81 2x0x s ILE 205 Cb 0.13 -1.39 -0.03 0.00 0.01 0.00 0.00 42.46 41.17 2x0x s ILE 205 CO 0.77 0.46 0.01 -0.44 0.00 0.00 0.00 174.94 175.73 2x0x s SER 206 N 0.22 5.23 0.05 3.58 0.01 0.02 -4.42 113.70 118.39 2x0x s SER 206 Ca -0.10 0.07 0.06 0.00 1.31 0.00 0.00 55.95 57.30 2x0x s SER 206 Cb -0.14 -1.66 -0.04 0.00 0.21 0.00 0.00 66.02 64.40 2x0x s SER 206 CO 0.04 0.29 -0.12 -0.76 0.41 0.00 0.00 173.24 173.10 2x0x s LEU 207 N -0.34 2.91 0.85 2.44 1.43 -1.26 -2.04 118.68 122.67 2x0x s LEU 207 Ca 0.07 -0.33 -0.10 0.00 -1.03 0.00 0.00 54.13 52.73 2x0x s LEU 207 Cb -0.12 -1.70 0.11 0.00 0.03 0.00 0.00 46.19 44.50 2x0x s LEU 207 CO 0.02 0.24 1.11 -2.16 0.23 0.00 0.00 176.35 175.79 2x0x s PRO 208 N -1.69 1.57 0.19 1.29 0.04 -1.26 -4.75 135.00 130.40 2x0x s PRO 208 Ca 0.17 1.29 -0.11 0.00 0.04 0.00 0.00 61.00 62.39 2x0x s PRO 208 Cb -0.11 -1.81 0.20 0.00 0.04 0.00 0.00 34.50 32.83 2x0x s PRO 208 CO 0.09 -2.16 1.76 1.15 0.04 0.00 0.00 177.00 177.88 2x0x h THR 209 N -1.51 0.86 -0.16 1.26 2.02 -1.98 -1.70 112.91 111.70 2x0x h THR 209 Ca -0.44 -0.15 -0.01 0.00 0.77 0.00 0.00 66.41 66.58 2x0x h THR 209 Cb 1.25 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.03 2x0x h THR 209 CO 0.47 0.08 0.06 -0.65 0.37 0.00 0.00 175.52 175.85 2x0x h PRO 210 N 0.44 0.21 0.17 6.66 0.11 -1.92 -0.85 132.00 136.83 2x0x h PRO 210 Ca 0.26 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.35 2x0x h PRO 210 Cb 0.26 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.32 2x0x h PRO 210 CO -0.23 0.18 -0.08 0.82 -0.21 0.00 0.00 178.00 178.48 2x0x h ILE 211 N 0.21 0.86 -0.58 4.15 2.04 -1.66 -1.97 117.51 120.57 2x0x h ILE 211 Ca 0.06 -1.06 0.12 0.00 1.00 0.00 0.00 64.86 64.98 2x0x h ILE 211 Cb 0.05 1.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 2x0x h ILE 211 CO -0.01 0.21 0.40 0.24 0.00 0.00 0.00 178.15 178.99 2x0x h MET 212 N -0.82 0.24 0.00 2.37 2.86 -1.10 0.01 114.93 118.48 2x0x h MET 212 Ca -0.02 -0.01 -0.12 0.00 -2.06 0.00 0.00 59.70 57.48 2x0x h MET 212 Cb 0.52 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.11 2x0x h MET 212 CO 0.04 0.16 -1.68 -1.13 1.06 0.00 0.00 176.91 175.36 2x0x n SER 213 N -4.44 0.45 -0.05 1.22 3.41 -0.34 -4.70 113.62 109.16 2x0x n SER 213 Ca 0.10 0.19 -0.06 0.00 -0.26 0.00 0.00 58.87 58.84 2x0x n SER 213 Cb 0.47 0.91 -0.08 0.00 -0.26 0.00 0.00 64.21 65.26 2x0x n SER 213 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2x0x n GLY 214 N 1.38 -0.42 3.59 5.00 0.00 -0.74 -4.85 105.19 109.14 2x0x n GLY 214 Ca -0.10 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 2x0x n GLY 214 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x0x s VAL 215 N -2.25 3.82 0.00 1.61 1.01 -0.05 -1.43 120.40 123.10 2x0x s VAL 215 Ca -0.08 0.77 0.00 0.00 0.00 0.00 0.00 61.98 62.67 2x0x s VAL 215 Cb 0.03 -4.29 0.00 0.00 0.00 0.00 0.00 36.38 32.12 2x0x s VAL 215 CO 0.39 -0.94 0.00 -2.11 0.00 0.00 0.00 175.10 172.44 2x0x n ARG 216 N 8.39 0.00 -3.61 2.72 1.85 -1.26 -3.98 116.66 120.77 2x0x n ARG 216 Ca 0.15 0.00 -0.20 0.00 -1.00 0.00 0.00 57.85 56.80 2x0x n ARG 216 Cb 0.49 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 31.88 2x0x n ARG 216 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 2x0x s THR 217 N -0.84 3.73 -0.58 8.89 -4.23 -0.52 -0.80 115.64 121.29 2x0x s THR 217 Ca 0.00 -1.18 0.08 0.00 -1.18 0.00 0.00 61.69 59.41 2x0x s THR 217 Cb 0.00 -3.27 0.08 0.00 1.34 0.00 0.00 72.50 70.64 2x0x s THR 217 CO 0.00 -0.15 1.20 -2.65 -0.54 0.00 0.00 174.62 172.48 2x0x n PRO 218 N -1.53 0.05 -2.32 3.99 -0.02 -1.26 -4.45 135.00 129.47 2x0x n PRO 218 Ca -0.00 0.52 -0.33 0.00 -2.02 0.00 0.00 63.50 61.66 2x0x n PRO 218 Cb 0.59 -1.74 -0.02 0.00 -0.02 0.00 0.00 33.50 32.31 2x0x n PRO 218 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2x0x s THR 219 N -3.13 4.07 -0.07 3.45 -1.32 -1.26 -4.97 115.64 112.41 2x0x s THR 219 Ca -0.01 1.07 0.10 0.00 -1.21 0.00 0.00 61.69 61.65 2x0x s THR 219 Cb 0.02 -3.52 0.16 0.00 -1.51 0.00 0.00 72.50 67.66 2x0x s THR 219 CO 0.07 -0.49 1.05 0.54 -2.21 0.00 0.00 174.62 173.58 2x0x n ARG 220 N -1.56 1.37 -2.96 7.08 5.12 -1.26 -4.90 116.66 119.55 2x0x n ARG 220 Ca 0.08 -1.94 -0.44 0.00 -1.93 0.00 0.00 57.85 53.62 2x0x n ARG 220 Cb 0.53 -1.16 -0.03 0.00 -1.16 0.00 0.00 32.46 30.64 2x0x n ARG 220 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2x0x s GLN 221 N -1.80 3.30 0.00 5.56 -0.21 -1.26 -0.76 119.66 124.49 2x0x s GLN 221 Ca 0.17 -1.36 0.00 0.00 0.02 0.00 0.00 55.36 54.19 2x0x s GLN 221 Cb 0.15 -4.50 0.00 0.00 1.00 0.00 0.00 33.01 29.66 2x0x s GLN 221 CO 0.02 -1.72 0.17 1.19 -2.12 0.00 0.00 175.29 172.83 2x0x n PHE 222 N 6.80 0.00 -2.77 0.91 3.72 -1.26 -4.94 117.46 119.91 2x0x n PHE 222 Ca 0.06 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.03 2x0x n PHE 222 Cb 0.46 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.97 2x0x n PHE 222 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2x0x s SER 223 N -0.45 6.68 0.00 4.37 0.01 -1.26 -4.77 113.70 118.28 2x0x s SER 223 Ca 0.00 0.56 0.12 0.00 1.31 0.00 0.00 55.95 57.94 2x0x s SER 223 Cb 0.00 -2.48 0.24 0.00 0.21 0.00 0.00 66.02 63.99 2x0x s SER 223 CO 0.00 -0.92 1.13 -1.54 0.41 0.00 0.00 173.24 172.32 2x0x n SER 224 N 6.93 2.63 -3.40 2.44 3.41 -1.26 -4.33 113.62 120.03 2x0x n SER 224 Ca 0.08 -1.80 -0.17 0.00 -0.26 0.00 0.00 58.87 56.72 2x0x n SER 224 Cb 0.48 -0.15 -0.10 0.00 -0.26 0.00 0.00 64.21 64.18 2x0x n SER 224 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2x0x s VAL 226 N 2.37 1.50 -0.20 0.00 -7.23 -0.69 -3.06 120.40 113.09 2x0x s VAL 226 Ca 0.09 -0.97 0.01 0.00 -1.81 0.00 0.00 61.98 59.31 2x0x s VAL 226 Cb -0.14 -1.28 0.04 0.00 0.56 0.00 0.00 36.38 35.56 2x0x s VAL 226 CO -0.31 0.29 -0.13 -0.76 -0.31 0.00 0.00 175.10 173.88 2x0x s LEU 227 N -0.79 2.38 -0.11 1.32 1.02 0.32 -0.72 118.68 122.10 2x0x s LEU 227 Ca 0.07 -0.88 0.01 0.00 0.02 0.00 0.00 54.13 53.35 2x0x s LEU 227 Cb -0.08 -1.33 -0.01 0.00 0.02 0.00 0.00 46.19 44.79 2x0x s LEU 227 CO 0.00 -0.11 -0.16 -0.63 0.02 0.00 0.00 176.35 175.47 2x0x s ILE 228 N 1.34 2.81 -0.21 -0.59 1.01 -0.36 -1.34 121.20 123.85 2x0x s ILE 228 Ca -0.01 -0.76 -0.07 0.00 0.00 0.00 0.00 60.65 59.81 2x0x s ILE 228 Cb -0.16 -2.14 -0.03 0.00 0.01 0.00 0.00 42.46 40.13 2x0x s ILE 228 CO -0.09 0.54 0.06 -0.70 0.00 0.00 0.00 174.94 174.75 2x0x s GLU 229 N 0.19 3.81 -0.02 2.79 2.12 -1.26 -1.10 118.70 125.22 2x0x s GLU 229 Ca -0.09 -0.42 -0.21 0.00 0.36 0.00 0.00 54.97 54.61 2x0x s GLU 229 Cb -0.16 -3.25 -0.05 0.00 0.26 0.00 0.00 34.13 30.94 2x0x s GLU 229 CO 0.06 0.05 0.59 0.00 -0.54 0.00 0.00 175.26 175.42 2x0x s GLY 231 N -0.02 1.43 -1.41 0.00 0.00 -1.26 -4.57 107.32 101.49 2x0x s GLY 231 Ca 0.31 -0.81 -0.14 0.00 0.00 0.00 0.00 44.72 44.08 2x0x s GLY 231 CO 0.17 -0.70 2.29 1.34 0.00 0.00 0.00 173.10 176.20 2x0x n ASP 232 N -1.99 4.34 -3.46 1.64 2.03 -1.26 -4.27 116.55 113.58 2x0x n ASP 232 Ca -0.02 -2.79 -0.12 0.00 0.52 0.00 0.00 54.79 52.38 2x0x n ASP 232 Cb 0.56 -1.59 -0.03 0.00 -0.72 0.00 0.00 41.12 39.34 2x0x n ASP 232 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2x0x s SER 233 N 3.23 -0.52 0.26 1.67 1.04 -1.26 -4.97 113.70 113.16 2x0x s SER 233 Ca 0.50 0.09 -0.02 0.00 0.48 0.00 0.00 55.95 57.01 2x0x s SER 233 Cb 0.14 0.53 0.35 0.00 0.10 0.00 0.00 66.02 67.15 2x0x s SER 233 CO -0.07 -0.83 1.77 -0.07 0.98 0.00 0.00 173.24 175.02 2x0x h LEU 234 N 2.12 0.75 -0.85 2.42 3.38 -1.99 -0.85 115.31 120.29 2x0x h LEU 234 Ca -0.30 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.48 2x0x h LEU 234 Cb 1.27 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.78 2x0x h LEU 234 CO 0.36 0.81 0.46 0.44 0.09 0.00 0.00 178.44 180.60 2x0x h ASP 235 N 0.73 1.07 -0.14 -0.43 3.32 -1.95 0.40 116.42 119.43 2x0x h ASP 235 Ca 0.15 -0.11 -0.19 0.00 0.02 0.00 0.00 57.03 56.90 2x0x h ASP 235 Cb 0.43 -0.27 0.01 0.00 0.22 0.00 0.00 39.33 39.72 2x0x h ASP 235 CO 0.02 0.87 -0.64 -1.28 -1.72 0.00 0.00 179.24 176.48 2x0x h SER 236 N 1.19 0.80 -0.72 6.45 0.87 -1.64 -1.80 113.55 118.70 2x0x h SER 236 Ca 0.30 -0.63 0.00 0.00 -1.23 0.00 0.00 61.79 60.23 2x0x h SER 236 Cb 0.04 -0.24 -0.04 0.00 -0.44 0.00 0.00 62.40 61.73 2x0x h SER 236 CO -0.05 1.30 0.46 0.40 -0.53 0.00 0.00 176.83 178.42 2x0x h ILE 237 N 0.36 1.19 -0.59 2.23 2.04 -1.01 0.19 117.51 121.92 2x0x h ILE 237 Ca -0.04 -0.37 -0.04 0.00 1.00 0.00 0.00 64.86 65.40 2x0x h ILE 237 Cb 1.28 0.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.49 2x0x h ILE 237 CO 0.13 0.19 0.20 0.78 0.00 0.00 0.00 178.15 179.46 2x0x h ASN 238 N 0.97 0.85 -0.27 1.72 2.35 -0.93 -1.47 115.58 118.80 2x0x h ASN 238 Ca 0.26 -0.19 -0.03 0.00 -0.55 0.00 0.00 56.30 55.79 2x0x h ASN 238 Cb -0.09 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.05 2x0x h ASN 238 CO -0.05 0.81 0.06 0.00 -1.65 0.00 0.00 177.43 176.60 2x0x h ALA 239 N 1.07 0.35 -0.08 -0.83 0.00 -0.97 -0.86 119.26 117.93 2x0x h ALA 239 Ca 0.19 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.97 2x0x h ALA 239 Cb 0.26 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2x0x h ALA 239 CO -0.01 0.01 -0.15 1.15 0.00 0.00 0.00 179.25 180.25 2x0x h THR 240 N 0.26 0.61 -0.72 0.00 2.02 -0.57 -0.76 112.91 113.75 2x0x h THR 240 Ca 0.08 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.28 2x0x h THR 240 Cb 0.29 0.61 -0.04 0.00 -1.74 0.00 0.00 68.15 67.27 2x0x h THR 240 CO 0.00 0.00 0.47 -1.28 0.37 0.00 0.00 175.52 175.08 2x0x h SER 241 N -0.21 0.81 -0.24 4.18 0.87 -1.17 -0.59 113.55 117.20 2x0x h SER 241 Ca 0.08 -0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.62 2x0x h SER 241 Cb 0.32 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 2x0x h SER 241 CO -0.21 0.58 0.15 0.28 -0.53 0.00 0.00 176.83 177.10 2x0x h SER 242 N 0.95 0.28 -0.86 6.23 0.02 -0.84 -2.06 113.55 117.28 2x0x h SER 242 Ca 0.27 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 2x0x h SER 242 Cb -0.08 -0.07 -0.04 0.00 0.14 0.00 0.00 62.40 62.35 2x0x h SER 242 CO -0.07 0.24 0.55 0.00 -1.14 0.00 0.00 176.83 176.41 2x0x h ALA 243 N 1.06 1.10 -0.34 3.77 0.00 -0.88 -1.92 119.26 122.04 2x0x h ALA 243 Ca 0.09 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2x0x h ALA 243 Cb 0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 2x0x h ALA 243 CO -0.02 0.53 0.21 0.82 0.00 0.00 0.00 179.25 180.79 2x0x h ILE 244 N 1.18 1.06 -0.46 0.00 2.04 -0.96 -1.59 117.51 118.77 2x0x h ILE 244 Ca 0.31 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 66.02 2x0x h ILE 244 Cb -0.10 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.55 2x0x h ILE 244 CO -0.06 0.08 0.27 0.58 0.00 0.00 0.00 178.15 179.01 2x0x h VAL 245 N 0.43 1.15 -0.23 1.67 2.07 -1.07 0.18 116.25 120.45 2x0x h VAL 245 Ca 0.13 -0.36 0.02 0.00 0.82 0.00 0.00 66.70 67.31 2x0x h VAL 245 Cb -0.02 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 2x0x h VAL 245 CO -0.05 0.15 0.07 0.11 0.02 0.00 0.00 177.57 177.88 2x0x h LYS 246 N 0.60 0.17 -0.15 1.57 1.79 -1.27 -1.83 116.57 117.45 2x0x h LYS 246 Ca 0.16 -0.01 -0.22 0.00 -2.18 0.00 0.00 60.65 58.41 2x0x h LYS 246 Cb 0.02 -0.04 0.01 0.00 -1.58 0.00 0.00 32.23 30.64 2x0x h LYS 246 CO -0.03 0.11 -0.76 1.88 -1.08 0.00 0.00 179.45 179.57 2x0x h TYR 247 N 0.17 1.01 0.00 -1.35 0.05 -0.94 -3.08 116.97 112.83 2x0x h TYR 247 Ca 0.10 -0.44 -0.07 0.00 0.05 0.00 0.00 58.73 58.37 2x0x h TYR 247 Cb 0.07 -0.16 -0.01 0.00 1.01 0.00 0.00 36.73 37.64 2x0x h TYR 247 CO -0.13 1.27 -0.33 -0.39 -1.05 0.00 0.00 178.16 177.53 2x0x h VAL 248 N 0.52 1.02 0.00 -2.88 -1.51 -0.66 -1.96 116.25 110.77 2x0x h VAL 248 Ca -0.05 -1.22 -0.00 0.00 -1.23 0.00 0.00 66.70 64.20 2x0x h VAL 248 Cb 1.38 1.70 -0.00 0.00 -2.13 0.00 0.00 31.29 32.25 2x0x h VAL 248 CO 0.15 0.32 -0.01 0.77 -1.23 0.00 0.00 177.57 177.58 2x0x h SER 249 N 0.00 0.00 -0.65 4.19 4.64 -1.24 -0.19 113.55 120.30 2x0x h SER 249 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2x0x h SER 249 Cb 0.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 2x0x h SER 249 CO 0.04 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 176.01 2x0x n GLN 250 N -3.92 3.66 -1.11 4.77 6.02 -0.78 -4.96 117.38 121.05 2x0x n GLN 250 Ca -0.03 -2.83 -0.04 0.00 -0.01 0.00 0.00 57.00 54.09 2x0x n GLN 250 Cb 0.09 -1.88 -0.02 0.00 1.02 0.00 0.00 30.24 29.46 2x0x n GLN 250 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2x0x n ARG 251 N 1.17 -0.31 -2.44 -1.09 5.12 -0.08 -4.94 116.66 114.08 2x0x n ARG 251 Ca 0.26 0.59 -0.38 0.00 -1.93 0.00 0.00 57.85 56.38 2x0x n ARG 251 Cb 0.87 -4.23 -0.04 0.00 -1.16 0.00 0.00 32.46 27.90 2x0x n ARG 251 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2x0x s ALA 252 N -2.12 3.23 0.34 7.54 0.00 -0.93 -4.90 121.76 124.93 2x0x s ALA 252 Ca 0.00 0.86 -0.24 0.00 0.00 0.00 0.00 51.96 52.57 2x0x s ALA 252 Cb 0.00 -3.33 -0.10 0.00 0.00 0.00 0.00 23.12 19.69 2x0x s ALA 252 CO 0.00 -0.29 0.93 0.20 0.00 0.00 0.00 175.76 176.60 2x0x s GLY 253 N -1.17 2.68 -0.03 0.00 0.00 -0.47 -4.46 107.32 103.87 2x0x s GLY 253 Ca 0.52 0.47 0.06 0.00 0.00 0.00 0.00 44.72 45.77 2x0x s GLY 253 CO 0.36 0.86 -0.21 -0.42 0.00 0.00 0.00 173.10 173.69 2x0x s ILE 254 N -1.76 1.70 -0.19 0.90 -1.09 -0.50 -1.70 121.20 118.55 2x0x s ILE 254 Ca 0.53 -0.90 -0.04 0.00 -2.23 0.00 0.00 60.65 58.01 2x0x s ILE 254 Cb -0.16 -1.43 -0.02 0.00 -1.58 0.00 0.00 42.46 39.27 2x0x s ILE 254 CO 0.21 0.48 -0.03 -0.83 -1.23 0.00 0.00 174.94 173.53 2x0x s GLY 255 N -0.33 1.66 -0.18 6.18 0.00 0.10 -1.53 107.32 113.21 2x0x s GLY 255 Ca 0.04 -1.02 -0.00 0.00 0.00 0.00 0.00 44.72 43.73 2x0x s GLY 255 CO 0.01 0.22 -0.14 -0.42 0.00 0.00 0.00 173.10 172.77 2x0x s ILE 256 N 1.03 2.66 -0.39 0.90 1.01 0.21 -1.22 121.20 125.39 2x0x s ILE 256 Ca 0.01 -0.75 -0.19 0.00 0.00 0.00 0.00 60.65 59.71 2x0x s ILE 256 Cb -0.15 -2.15 0.01 0.00 0.01 0.00 0.00 42.46 40.19 2x0x s ILE 256 CO 0.01 0.50 0.57 0.21 0.00 0.00 0.00 174.94 176.22 2x0x s ASN 257 N 1.09 6.32 -0.02 3.58 2.47 -0.26 -0.67 114.94 127.46 2x0x s ASN 257 Ca 0.00 -0.21 0.03 0.00 0.42 0.00 0.00 52.86 53.10 2x0x s ASN 257 Cb -0.14 -2.29 0.05 0.00 -1.45 0.00 0.00 41.25 37.42 2x0x s ASN 257 CO -0.04 -0.62 1.02 0.00 -3.72 0.00 0.00 177.10 173.73 2x0x n ALA 258 N 5.96 2.03 0.24 1.71 0.00 -1.02 -0.00 120.51 129.41 2x0x n ALA 258 Ca -0.03 -1.27 0.15 0.00 0.00 0.00 0.00 53.44 52.29 2x0x n ALA 258 Cb 0.48 -0.07 0.80 0.00 0.00 0.00 0.00 19.45 20.67 2x0x n ALA 258 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2x0x h GLY 259 N 0.00 0.00 1.59 0.00 0.00 -1.82 -2.38 103.07 100.46 2x0x h GLY 259 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2x0x h GLY 259 CO 0.00 0.00 -0.35 3.21 0.00 0.00 0.00 176.54 179.40 2x0x h ARG 260 N 0.00 0.00 -6.61 4.80 3.08 -1.87 -3.45 114.38 110.34 2x0x h ARG 260 Ca 0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.52 2x0x h ARG 260 Cb 0.03 0.00 0.05 0.00 0.08 0.00 0.00 29.97 30.14 2x0x h ARG 260 CO 0.00 0.00 1.04 -0.89 -1.07 0.00 0.00 179.97 179.05 2x0x n ILE 261 N -2.54 0.11 -1.69 2.04 5.41 -0.90 -4.44 119.36 117.35 2x0x n ILE 261 Ca 0.03 -0.02 -0.34 0.00 1.00 0.00 0.00 62.75 63.43 2x0x n ILE 261 Cb 0.48 -2.02 0.06 0.00 -0.71 0.00 0.00 39.64 37.45 2x0x n ILE 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2x0x s ARG 262 N 1.64 2.63 0.52 0.38 1.70 -1.26 -4.79 118.95 119.77 2x0x s ARG 262 Ca 0.77 1.52 -0.19 0.00 -0.47 0.00 0.00 55.73 57.36 2x0x s ARG 262 Cb -0.50 -1.92 -0.07 0.00 -0.57 0.00 0.00 34.95 31.89 2x0x s ARG 262 CO 0.34 -1.41 1.07 0.00 -1.08 0.00 0.00 175.30 174.22 2x0x s ALA 263 N -2.19 2.79 -0.27 7.88 0.00 -1.26 -4.07 121.76 124.63 2x0x s ALA 263 Ca 0.70 0.62 -0.37 0.00 0.00 0.00 0.00 51.96 52.90 2x0x s ALA 263 Cb -0.23 -3.28 -0.17 0.00 0.00 0.00 0.00 23.12 19.44 2x0x s ALA 263 CO 0.42 -0.54 1.19 -0.11 0.00 0.00 0.00 175.76 176.71 2x0x n LEU 264 N -1.29 0.66 0.00 0.00 7.94 -1.23 -2.14 117.00 120.93 2x0x n LEU 264 Ca 0.10 0.99 0.00 0.00 -1.11 0.00 0.00 56.01 55.99 2x0x n LEU 264 Cb 0.52 -0.75 0.00 0.00 0.53 0.00 0.00 43.42 43.72 2x0x n LEU 264 CO 0.42 -1.02 0.00 0.61 -1.11 0.00 0.00 177.39 176.29 2x0x n GLY 265 N 2.62 0.37 3.77 -3.96 0.00 0.84 -4.93 105.19 103.90 2x0x n GLY 265 Ca 0.23 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.87 2x0x n GLY 265 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2x0x s SER 266 N -1.97 6.26 0.00 1.61 0.01 -0.91 -4.99 113.70 113.70 2x0x s SER 266 Ca 0.00 2.35 0.00 0.00 1.31 0.00 0.00 55.95 59.61 2x0x s SER 266 Cb 0.00 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.62 2x0x s SER 266 CO 0.00 -0.86 0.01 -2.65 0.41 0.00 0.00 173.24 170.14 2x0x n PRO 267 N -0.30 0.00 0.00 12.44 -0.02 -1.26 -4.24 135.00 141.62 2x0x n PRO 267 Ca 0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 2x0x n PRO 267 Cb 0.47 -0.76 0.00 0.00 -0.02 0.00 0.00 33.50 33.19 2x0x n PRO 267 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2x0x n PHE 274 N -0.26 0.00 -0.28 6.00 3.72 -1.26 -5.13 117.46 120.25 2x0x n PHE 274 Ca 0.00 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.50 2x0x n PHE 274 Cb 0.01 -0.05 0.25 0.00 -0.94 0.00 0.00 39.48 38.74 2x0x n PHE 274 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2x0x h HIS 275 N 0.00 0.32 -0.00 1.38 2.76 -1.80 -0.08 115.15 117.73 2x0x h HIS 275 Ca 0.00 0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.22 2x0x h HIS 275 Cb 0.00 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 28.95 2x0x h HIS 275 CO 0.00 -0.16 -0.09 0.25 -1.30 0.00 0.00 177.93 176.64 2x0x n THR 276 N -5.20 0.00 0.00 6.26 -2.24 -1.26 -0.11 114.28 111.73 2x0x n THR 276 Ca 0.19 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 2x0x n THR 276 Cb 0.59 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 2x0x n THR 276 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x0x n GLY 277 N 1.32 0.51 0.18 3.38 0.00 -0.04 -4.69 105.19 105.83 2x0x n GLY 277 Ca 0.13 -2.12 -0.11 0.00 0.00 0.00 0.00 46.02 43.91 2x0x n GLY 277 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x0x h ILE 279 N 0.30 1.05 -0.61 0.00 2.04 -1.96 0.01 117.51 118.33 2x0x h ILE 279 Ca 0.07 -0.18 0.11 0.00 1.00 0.00 0.00 64.86 65.87 2x0x h ILE 279 Cb 0.51 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 37.05 2x0x h ILE 279 CO 0.02 0.09 0.41 -0.65 0.00 0.00 0.00 178.15 178.03 2x0x h PRO 280 N 0.52 0.35 -0.07 2.37 0.11 -1.86 -0.44 132.00 132.97 2x0x h PRO 280 Ca 0.17 -0.02 -0.19 0.00 0.11 0.00 0.00 66.00 66.06 2x0x h PRO 280 Cb -0.00 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.03 2x0x h PRO 280 CO -0.07 0.23 -0.76 0.74 -0.21 0.00 0.00 178.00 177.92 2x0x h PHE 281 N 0.36 0.57 -0.74 0.65 0.04 -1.24 -2.59 116.94 113.99 2x0x h PHE 281 Ca 0.29 -0.26 -0.04 0.00 2.80 0.00 0.00 57.97 60.76 2x0x h PHE 281 Cb 0.65 -0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.68 2x0x h PHE 281 CO -0.00 1.03 0.32 1.88 -0.60 0.00 0.00 178.31 180.94 2x0x h TYR 282 N 0.28 1.10 -0.87 -0.55 -1.99 -0.40 -0.15 116.97 114.39 2x0x h TYR 282 Ca -0.04 -0.07 0.06 0.00 2.00 0.00 0.00 58.73 60.68 2x0x h TYR 282 Cb 1.35 -0.33 -0.06 0.00 2.00 0.00 0.00 36.73 39.69 2x0x h TYR 282 CO 0.05 0.83 0.54 0.87 -0.00 0.00 0.00 178.16 180.45 2x0x h LYS 283 N 1.05 0.97 -0.31 4.88 1.57 -1.09 0.41 116.57 124.05 2x0x h LYS 283 Ca 0.25 -0.06 -0.12 0.00 -1.87 0.00 0.00 60.65 58.86 2x0x h LYS 283 Cb 0.17 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 2x0x h LYS 283 CO -0.03 0.64 -0.29 1.25 -0.57 0.00 0.00 179.45 180.46 2x0x h HIS 284 N 1.00 0.73 -0.56 -1.35 2.76 -0.99 -2.03 115.15 114.71 2x0x h HIS 284 Ca 0.38 -0.18 -0.09 0.00 -2.20 0.00 0.00 60.37 58.28 2x0x h HIS 284 Cb 0.15 -0.17 -0.02 0.00 1.55 0.00 0.00 27.41 28.92 2x0x h HIS 284 CO -0.03 0.85 -0.01 0.74 -1.30 0.00 0.00 177.93 178.19 2x0x h PHE 285 N 0.55 1.08 -0.64 5.26 0.04 -0.50 -1.72 116.94 121.00 2x0x h PHE 285 Ca 0.07 -0.19 0.02 0.00 2.80 0.00 0.00 57.97 60.67 2x0x h PHE 285 Cb 0.77 -0.28 -0.04 0.00 2.20 0.00 0.00 35.95 38.60 2x0x h PHE 285 CO 0.03 0.98 0.41 0.37 -0.60 0.00 0.00 178.31 179.50 2x0x h GLN 286 N 0.87 0.79 -0.01 1.51 4.15 -0.70 0.80 115.11 122.52 2x0x h GLN 286 Ca 0.16 -0.05 -0.12 0.00 0.77 0.00 0.00 58.65 59.41 2x0x h GLN 286 Cb 0.55 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 28.05 2x0x h GLN 286 CO 0.03 0.53 -0.54 1.79 -1.93 0.00 0.00 178.83 178.71 2x0x h THR 287 N 0.82 1.38 -0.16 2.39 1.35 -1.32 -1.09 112.91 116.28 2x0x h THR 287 Ca 0.25 -1.84 -0.01 0.00 -0.55 0.00 0.00 66.41 64.26 2x0x h THR 287 Cb -0.03 1.98 -0.01 0.00 -1.73 0.00 0.00 68.15 68.37 2x0x h THR 287 CO -0.08 0.53 0.08 0.00 -0.25 0.00 0.00 175.52 175.79 2x0x h ALA 288 N 1.43 0.20 -0.85 6.62 0.00 -0.81 0.67 119.26 126.53 2x0x h ALA 288 Ca -0.00 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.90 2x0x h ALA 288 Cb 0.96 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.63 2x0x h ALA 288 CO 0.07 -0.24 0.55 0.28 0.00 0.00 0.00 179.25 179.91 2x0x h VAL 289 N 0.14 1.05 -0.12 0.00 2.07 -0.54 -2.59 116.25 116.25 2x0x h VAL 289 Ca 0.05 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.25 2x0x h VAL 289 Cb 0.11 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 29.91 2x0x h VAL 289 CO -0.01 0.17 0.00 0.29 0.02 0.00 0.00 177.57 178.04 2x0x n LYS 290 N -4.49 2.29 -0.14 1.57 4.01 -0.44 -4.45 118.16 116.52 2x0x n LYS 290 Ca 0.13 -1.99 0.28 0.00 -0.51 0.00 0.00 58.31 56.22 2x0x n LYS 290 Cb 0.21 -1.46 0.70 0.00 -0.51 0.00 0.00 35.03 33.97 2x0x n LYS 290 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 2x0x h SER 291 N 4.52 0.00 -0.31 4.39 4.64 -0.44 -1.85 113.55 124.49 2x0x h SER 291 Ca 0.00 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.11 2x0x h SER 291 Cb 0.97 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 62.90 2x0x h SER 291 CO 0.00 0.00 -0.51 0.00 -0.87 0.00 0.00 176.83 175.45 2x0x s SER 293 N -3.22 4.04 0.00 0.00 0.01 -0.70 -4.85 113.70 108.97 2x0x s SER 293 Ca 0.44 -0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.34 2x0x s SER 293 Cb 0.39 -1.63 0.00 0.00 0.21 0.00 0.00 66.02 64.99 2x0x s SER 293 CO -0.03 0.12 0.00 1.67 0.41 0.00 0.00 173.24 175.42 2x0x n GLN 294 N 3.83 0.00 -2.96 12.44 -0.06 -1.17 -2.07 117.38 127.38 2x0x n GLN 294 Ca -0.18 0.00 -0.15 0.00 -2.00 0.00 0.00 57.00 54.67 2x0x n GLN 294 Cb 0.52 0.00 -0.01 0.00 -4.06 0.00 0.00 30.24 26.70 2x0x n GLN 294 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2x0x n GLY 295 N -0.14 2.88 2.09 1.69 0.00 -1.26 -4.98 105.19 105.47 2x0x n GLY 295 Ca 0.00 -1.58 -0.00 0.00 0.00 0.00 0.00 46.02 44.44 2x0x n GLY 295 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x0x n GLY 296 N 0.12 0.45 0.00 -0.02 0.00 -0.88 -4.76 105.19 100.10 2x0x n GLY 296 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2x0x n GLY 296 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2x0x n VAL 297 N -2.91 0.00 -2.71 1.61 0.24 -1.26 -4.96 118.33 108.34 2x0x n VAL 297 Ca -0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.88 2x0x n VAL 297 Cb 0.05 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.38 2x0x n VAL 297 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 2x0x s ARG 298 N -1.00 3.17 0.00 7.34 3.52 -1.26 -4.74 118.95 125.99 2x0x s ARG 298 Ca 0.00 -0.50 0.00 0.00 -0.13 0.00 0.00 55.73 55.10 2x0x s ARG 298 Cb 0.00 -4.19 0.00 0.00 -1.56 0.00 0.00 34.95 29.20 2x0x s ARG 298 CO 0.00 -1.93 0.00 0.41 -0.81 0.00 0.00 175.30 172.97 2x0x n GLY 299 N 5.33 1.69 1.72 8.12 0.00 -1.26 -3.04 105.19 117.75 2x0x n GLY 299 Ca -0.00 -1.99 -0.01 0.00 0.00 0.00 0.00 46.02 44.02 2x0x n GLY 299 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x0x n GLY 300 N 1.65 -4.23 2.96 -0.02 0.00 -1.26 -4.78 105.19 99.51 2x0x n GLY 300 Ca 0.00 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.81 2x0x n GLY 300 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x0x s ALA 301 N -0.29 0.36 0.03 4.61 0.00 -1.26 -4.74 121.76 120.45 2x0x s ALA 301 Ca -0.03 -0.30 -0.09 0.00 0.00 0.00 0.00 51.96 51.54 2x0x s ALA 301 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.08 2x0x s ALA 301 CO 0.08 0.05 0.19 0.00 0.00 0.00 0.00 175.76 176.08 2x0x s ALA 302 N -0.39 -0.38 -0.07 0.00 0.00 -1.26 -1.42 121.76 118.24 2x0x s ALA 302 Ca -0.01 -0.21 0.04 0.00 0.00 0.00 0.00 51.96 51.78 2x0x s ALA 302 Cb -0.03 0.23 -0.00 0.00 0.00 0.00 0.00 23.12 23.31 2x0x s ALA 302 CO -0.00 -0.32 -0.21 0.99 0.00 0.00 0.00 175.76 176.22 2x0x s THR 303 N -2.21 1.80 -0.07 0.00 2.01 -0.58 -1.52 115.64 115.06 2x0x s THR 303 Ca -0.08 -0.90 0.01 0.00 0.31 0.00 0.00 61.69 61.04 2x0x s THR 303 Cb -0.03 -1.56 -0.03 0.00 0.01 0.00 0.00 72.50 70.90 2x0x s THR 303 CO -0.02 0.50 -0.08 -0.22 -0.69 0.00 0.00 174.62 174.11 2x0x s LEU 304 N 0.20 3.09 -0.05 4.42 0.20 -0.10 -0.62 118.68 125.83 2x0x s LEU 304 Ca -0.12 -0.06 0.04 0.00 0.69 0.00 0.00 54.13 54.68 2x0x s LEU 304 Cb -0.15 -1.67 -0.03 0.00 -0.43 0.00 0.00 46.19 43.91 2x0x s LEU 304 CO 0.06 0.35 -0.14 -0.36 -0.29 0.00 0.00 176.35 175.97 2x0x s PHE 305 N -0.75 2.71 0.01 5.38 0.40 0.16 -0.56 117.98 125.33 2x0x s PHE 305 Ca 0.12 -0.15 -0.18 0.00 -0.60 0.00 0.00 56.93 56.11 2x0x s PHE 305 Cb -0.11 -1.63 0.03 0.00 0.51 0.00 0.00 43.02 41.83 2x0x s PHE 305 CO 0.01 0.20 0.40 1.52 0.70 0.00 0.00 175.22 178.06 2x0x s TYR 306 N -0.75 -0.28 0.40 0.36 -0.85 -0.86 -2.44 117.35 112.94 2x0x s TYR 306 Ca 0.12 0.34 -0.24 0.00 -0.52 0.00 0.00 57.07 56.77 2x0x s TYR 306 Cb -0.11 0.19 -0.09 0.00 0.38 0.00 0.00 41.96 42.34 2x0x s TYR 306 CO 0.01 -0.51 1.04 -1.25 -1.52 0.00 0.00 175.55 173.32 2x0x s PRO 307 N -1.92 4.15 0.59 -3.49 0.04 -1.26 -1.01 135.00 132.11 2x0x s PRO 307 Ca -0.09 1.48 0.30 0.00 0.04 0.00 0.00 61.00 62.73 2x0x s PRO 307 Cb -0.02 -2.50 1.77 0.00 0.04 0.00 0.00 34.50 33.78 2x0x s PRO 307 CO 0.01 -0.15 2.19 1.98 0.04 0.00 0.00 177.00 181.08 2x0x h MET 308 N 2.43 0.00 -0.19 4.56 1.85 -1.35 -2.56 114.93 119.67 2x0x h MET 308 Ca -0.48 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.61 2x0x h MET 308 Cb 1.21 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.24 2x0x h MET 308 CO 0.62 0.00 0.00 -2.67 -0.40 0.00 0.00 176.91 174.46 2x0x n TRP 309 N -3.81 0.24 -1.85 1.39 4.27 -1.26 -4.83 117.44 111.59 2x0x n TRP 309 Ca -0.01 -0.12 -0.41 0.00 -3.89 0.00 0.00 57.50 53.07 2x0x n TRP 309 Cb 0.18 0.00 -0.00 0.00 -1.36 0.00 0.00 31.31 30.13 2x0x n TRP 309 CO 0.00 0.00 0.00 -1.58 -2.29 0.00 0.00 177.69 173.82 2x0x s HIS 310 N -1.76 2.63 0.40 -2.67 2.46 -0.97 -0.70 115.29 114.68 2x0x s HIS 310 Ca 0.33 1.23 0.11 0.00 0.47 0.00 0.00 55.06 57.19 2x0x s HIS 310 Cb 0.18 -3.95 0.91 0.00 -0.13 0.00 0.00 32.58 29.59 2x0x s HIS 310 CO 0.27 -2.80 1.93 1.25 -2.47 0.00 0.00 174.74 172.92 2x0x h LEU 311 N 2.93 0.52 -1.31 8.88 5.85 -1.20 -1.34 115.31 129.64 2x0x h LEU 311 Ca -0.51 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.23 2x0x h LEU 311 Cb 1.24 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.18 2x0x h LEU 311 CO 0.64 0.30 0.00 -0.62 -0.34 0.00 0.00 178.44 178.41 2x0x n GLU 312 N -4.49 1.83 -0.33 1.25 1.02 -1.26 -4.64 120.64 114.02 2x0x n GLU 312 Ca 0.13 -1.28 0.15 0.00 -0.02 0.00 0.00 57.16 56.13 2x0x n GLU 312 Cb 0.40 -1.33 0.37 0.00 -0.02 0.00 0.00 31.44 30.86 2x0x n GLU 312 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 2x0x h VAL 313 N 2.24 0.69 -0.48 2.62 3.04 -1.56 -1.08 116.25 121.71 2x0x h VAL 313 Ca 0.00 -0.23 -0.06 0.00 -1.01 0.00 0.00 66.70 65.40 2x0x h VAL 313 Cb 0.50 -0.04 -0.02 0.00 -2.01 0.00 0.00 31.29 29.72 2x0x h VAL 313 CO 0.00 0.12 0.07 -0.33 -1.01 0.00 0.00 177.57 176.42 2x0x h GLU 314 N 0.67 0.75 -0.14 4.17 5.08 -1.84 0.20 114.58 123.46 2x0x h GLU 314 Ca 0.56 -0.16 -0.21 0.00 -1.00 0.00 0.00 59.36 58.54 2x0x h GLU 314 Cb 1.00 -0.11 0.01 0.00 0.50 0.00 0.00 28.75 30.15 2x0x h GLU 314 CO -0.34 0.71 -0.76 0.77 -1.00 0.00 0.00 179.01 178.40 2x0x h SER 315 N 0.72 0.86 -0.63 1.42 0.02 -1.60 -3.32 113.55 111.01 2x0x h SER 315 Ca 0.15 -0.56 -0.06 0.00 -0.84 0.00 0.00 61.79 60.49 2x0x h SER 315 Cb 0.34 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.60 2x0x h SER 315 CO 0.01 1.35 0.16 -0.07 -1.14 0.00 0.00 176.83 177.13 2x0x h LEU 316 N 0.50 0.94 -1.96 5.07 3.38 -0.75 -3.15 115.31 119.34 2x0x h LEU 316 Ca -0.05 -0.23 0.11 0.00 0.09 0.00 0.00 57.88 57.81 2x0x h LEU 316 Cb 1.38 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 2x0x h LEU 316 CO 0.15 0.93 0.30 -0.07 0.09 0.00 0.00 178.44 179.83 2x0x h LEU 317 N 0.92 0.04 -2.69 1.67 4.07 -0.72 -2.78 115.31 115.82 2x0x h LEU 317 Ca 0.20 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.16 2x0x h LEU 317 Cb 0.35 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.08 2x0x h LEU 317 CO 0.00 0.03 0.00 1.33 -1.08 0.00 0.00 178.44 178.72 2x0x n VAL 318 N -4.43 0.90 0.17 1.22 0.24 -1.19 -4.64 118.33 110.61 2x0x n VAL 318 Ca 0.07 -0.95 0.18 0.00 -2.04 0.00 0.00 64.34 61.60 2x0x n VAL 318 Cb 0.46 0.59 0.80 0.00 -1.47 0.00 0.00 33.84 34.22 2x0x n VAL 318 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2x0x h LEU 319 N 3.80 0.00 -2.91 1.34 3.38 -1.54 -1.84 115.31 117.54 2x0x h LEU 319 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2x0x h LEU 319 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2x0x h LEU 319 CO 0.00 0.00 0.00 2.29 0.09 0.00 0.00 178.44 180.82 2x0x n LYS 320 N -3.71 2.91 -1.65 1.13 2.85 -1.26 -0.87 118.16 117.56 2x0x n LYS 320 Ca 0.04 -2.27 -0.49 0.00 -1.05 0.00 0.00 58.31 54.54 2x0x n LYS 320 Cb 0.45 -1.40 -0.05 0.00 -0.65 0.00 0.00 35.03 33.37 2x0x n LYS 320 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2x0x n ASN 321 N 0.64 2.64 -0.02 -5.58 3.02 -0.70 -4.90 115.26 110.37 2x0x n ASN 321 Ca 0.15 1.08 0.01 0.00 -0.03 0.00 0.00 54.58 55.79 2x0x n ASN 321 Cb 0.53 -1.32 0.33 0.00 -0.61 0.00 0.00 39.78 38.71 2x0x n ASN 321 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 2x0x h ASN 322 N 6.08 0.53 -3.36 6.41 -0.26 -1.94 -3.41 115.58 119.63 2x0x h ASN 322 Ca -0.46 -0.06 -0.57 0.00 -0.56 0.00 0.00 56.30 54.64 2x0x h ASN 322 Cb 1.29 -0.14 -0.07 0.00 -1.06 0.00 0.00 38.32 38.34 2x0x h ASN 322 CO 0.87 0.50 0.17 -0.60 -1.06 0.00 0.00 177.43 177.30 2x0x s ARG 323 N -5.24 4.35 0.00 0.81 3.52 -1.26 -4.99 118.95 116.13 2x0x s ARG 323 Ca -0.08 0.84 0.00 0.00 -0.13 0.00 0.00 55.73 56.36 2x0x s ARG 323 Cb 0.16 -3.51 0.00 0.00 -1.56 0.00 0.00 34.95 30.04 2x0x s ARG 323 CO 0.76 -0.10 0.00 0.41 -0.81 0.00 0.00 175.30 175.55 2x0x n GLY 324 N 3.36 3.02 3.80 8.12 0.00 -1.26 -5.09 105.19 117.13 2x0x n GLY 324 Ca 0.00 -1.41 -0.35 0.00 0.00 0.00 0.00 46.02 44.26 2x0x n GLY 324 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x0x s VAL 325 N -2.00 4.03 0.51 1.61 0.11 -1.26 -4.96 120.40 118.44 2x0x s VAL 325 Ca 0.00 1.43 0.32 0.00 -2.93 0.00 0.00 61.98 60.80 2x0x s VAL 325 Cb 0.00 -3.68 0.35 0.00 -1.53 0.00 0.00 36.38 31.52 2x0x s VAL 325 CO 0.00 -0.11 2.19 -0.08 -3.33 0.00 0.00 175.10 173.78 2x0x h GLU 326 N 2.29 0.00 -0.48 1.54 4.57 -2.00 -0.43 114.58 120.07 2x0x h GLU 326 Ca -0.48 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 2x0x h GLU 326 Cb 1.20 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.79 2x0x h GLU 326 CO 0.62 0.05 0.00 0.41 -1.18 0.00 0.00 179.01 178.91 2x0x n GLY 327 N -0.95 1.24 0.23 1.92 0.00 -1.26 -3.39 105.19 102.98 2x0x n GLY 327 Ca -0.02 -0.52 0.02 0.00 0.00 0.00 0.00 46.02 45.50 2x0x n GLY 327 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2x0x n ASN 328 N 0.90 2.12 -4.02 1.61 5.03 -0.17 -4.92 115.26 115.81 2x0x n ASN 328 Ca 0.16 -1.81 -0.23 0.00 0.87 0.00 0.00 54.58 53.57 2x0x n ASN 328 Cb 0.40 -0.07 -0.16 0.00 -1.02 0.00 0.00 39.78 38.94 2x0x n ASN 328 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2x0x s ARG 329 N -0.85 1.45 -0.48 3.52 1.81 -1.22 -4.51 118.95 118.68 2x0x s ARG 329 Ca 0.08 -0.39 0.04 0.00 -1.72 0.00 0.00 55.73 53.74 2x0x s ARG 329 Cb 0.04 -1.25 0.17 0.00 -0.45 0.00 0.00 34.95 33.46 2x0x s ARG 329 CO 0.06 0.08 0.37 0.08 -0.68 0.00 0.00 175.30 175.21 2x0x s VAL 330 N 0.47 0.95 -0.64 3.52 1.01 -0.05 -4.98 120.40 120.68 2x0x s VAL 330 Ca -0.10 -3.03 0.25 0.00 0.00 0.00 0.00 61.98 59.10 2x0x s VAL 330 Cb -0.13 -1.65 0.14 0.00 0.00 0.00 0.00 36.38 34.74 2x0x s VAL 330 CO 0.02 -1.18 1.47 0.03 0.00 0.00 0.00 175.10 175.45 2x0x h ARG 331 N 5.60 0.00 -0.54 2.72 3.08 -1.91 -3.36 114.38 119.98 2x0x h ARG 331 Ca 0.24 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 60.03 2x0x h ARG 331 Cb 0.87 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 30.77 2x0x h ARG 331 CO 0.45 0.00 0.14 0.72 -1.07 0.00 0.00 179.97 180.22 2x0x n HIS 332 N -2.25 1.69 -4.31 3.04 8.25 -1.26 -4.85 115.22 115.53 2x0x n HIS 332 Ca 0.04 -1.57 -0.20 0.00 -0.26 0.00 0.00 57.72 55.73 2x0x n HIS 332 Cb 0.45 -0.61 -0.11 0.00 1.12 0.00 0.00 29.99 30.84 2x0x n HIS 332 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2x0x s MET 333 N -3.21 1.22 0.49 -0.41 -1.94 -1.26 -4.76 119.30 109.43 2x0x s MET 333 Ca 0.48 -1.39 0.04 0.00 -1.71 0.00 0.00 55.69 53.11 2x0x s MET 333 Cb 0.42 -1.18 0.02 0.00 2.01 0.00 0.00 34.83 36.10 2x0x s MET 333 CO 0.04 0.23 0.69 -0.51 -0.01 0.00 0.00 175.02 175.46 2x0x s ASP 334 N -2.71 5.48 0.03 3.03 1.01 -0.58 -4.94 116.67 117.98 2x0x s ASP 334 Ca 0.15 -0.12 0.03 0.00 0.71 0.00 0.00 52.55 53.32 2x0x s ASP 334 Cb -0.05 -0.89 -0.02 0.00 1.01 0.00 0.00 42.92 42.98 2x0x s ASP 334 CO 0.06 -0.95 -0.09 -0.31 0.21 0.00 0.00 175.17 174.09 2x0x s TYR 335 N -2.58 0.83 -0.22 4.23 2.02 -1.03 -0.92 117.35 119.68 2x0x s TYR 335 Ca 0.55 -0.32 0.01 0.00 -0.37 0.00 0.00 57.07 56.94 2x0x s TYR 335 Cb -0.10 -0.50 0.05 0.00 -0.40 0.00 0.00 41.96 41.01 2x0x s TYR 335 CO 0.36 -0.02 -0.08 0.20 -1.57 0.00 0.00 175.55 174.45 2x0x s GLY 336 N -0.95 1.30 -0.13 0.71 0.00 0.27 0.66 107.32 109.17 2x0x s GLY 336 Ca -0.02 -1.31 -0.22 0.00 0.00 0.00 0.00 44.72 43.18 2x0x s GLY 336 CO 0.00 0.81 0.65 0.14 0.00 0.00 0.00 173.10 174.70 2x0x s VAL 337 N 1.38 5.05 -0.20 1.40 1.01 0.14 -2.03 120.40 127.14 2x0x s VAL 337 Ca -0.04 1.28 -0.14 0.00 0.00 0.00 0.00 61.98 63.07 2x0x s VAL 337 Cb -0.18 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.19 2x0x s VAL 337 CO -0.07 0.19 0.33 -1.10 0.00 0.00 0.00 175.10 174.46 2x0x s GLN 338 N 1.31 4.17 0.05 2.72 -0.21 -0.18 -0.81 119.66 126.72 2x0x s GLN 338 Ca 0.32 0.09 0.04 0.00 0.02 0.00 0.00 55.36 55.84 2x0x s GLN 338 Cb -0.16 -3.52 -0.02 0.00 1.00 0.00 0.00 33.01 30.30 2x0x s GLN 338 CO 0.13 0.03 -0.12 0.42 -2.12 0.00 0.00 175.29 173.63 2x0x s ILE 339 N 1.11 0.91 0.30 1.08 1.01 -0.23 -0.87 121.20 124.51 2x0x s ILE 339 Ca 0.16 -1.10 0.03 0.00 0.00 0.00 0.00 60.65 59.75 2x0x s ILE 339 Cb -0.14 -0.88 -0.01 0.00 0.01 0.00 0.00 42.46 41.43 2x0x s ILE 339 CO 0.07 -0.19 0.11 -0.46 0.00 0.00 0.00 174.94 174.47 2x0x n ASN 340 N 1.60 1.15 -0.19 3.58 6.94 -1.26 -1.01 115.26 126.06 2x0x n ASN 340 Ca -0.20 -2.57 -0.02 0.00 -0.02 0.00 0.00 54.58 51.77 2x0x n ASN 340 Cb 0.55 0.75 0.08 0.00 -2.36 0.00 0.00 39.78 38.80 2x0x n ASN 340 CO 0.00 0.00 0.00 0.50 -1.03 0.00 0.00 177.26 176.73 2x0x h LYS 341 N 0.00 0.47 -0.64 -3.83 3.64 -1.99 -2.68 116.57 111.55 2x0x h LYS 341 Ca -0.23 -0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.22 2x0x h LYS 341 Cb 0.88 -0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 32.52 2x0x h LYS 341 CO 0.36 0.31 0.26 1.25 -2.27 0.00 0.00 179.45 179.37 2x0x h LEU 342 N 0.49 0.29 -0.42 5.20 5.85 -1.97 0.36 115.31 125.11 2x0x h LEU 342 Ca 0.27 0.07 0.04 0.00 0.84 0.00 0.00 57.88 59.10 2x0x h LEU 342 Cb 0.25 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 2x0x h LEU 342 CO -0.23 0.17 0.20 0.24 -0.34 0.00 0.00 178.44 178.48 2x0x h MET 343 N 0.46 0.39 -0.38 1.25 2.86 -1.90 -1.91 114.93 115.70 2x0x h MET 343 Ca 0.32 -0.02 -0.08 0.00 -2.06 0.00 0.00 59.70 57.86 2x0x h MET 343 Cb 0.38 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 2x0x h MET 343 CO -0.29 0.26 -0.10 1.88 1.06 0.00 0.00 176.91 179.71 2x0x h TYR 344 N 0.40 0.70 -0.78 -0.22 0.05 -1.15 -2.76 116.97 113.22 2x0x h TYR 344 Ca 0.18 -0.11 -0.04 0.00 0.05 0.00 0.00 58.73 58.81 2x0x h TYR 344 Cb 0.11 -0.19 -0.03 0.00 1.01 0.00 0.00 36.73 37.62 2x0x h TYR 344 CO -0.11 0.73 0.33 1.15 -1.05 0.00 0.00 178.16 179.21 2x0x h THR 345 N 0.60 1.26 -0.68 -2.88 2.02 -0.44 -1.46 112.91 111.32 2x0x h THR 345 Ca 0.11 -0.78 0.01 0.00 0.77 0.00 0.00 66.41 66.52 2x0x h THR 345 Cb 0.53 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.21 2x0x h THR 345 CO 0.03 0.32 0.45 0.03 0.37 0.00 0.00 175.52 176.72 2x0x h ARG 346 N 1.12 0.88 0.41 6.66 2.47 -1.10 -0.93 114.38 123.88 2x0x h ARG 346 Ca 0.26 -0.05 -0.02 0.00 -1.26 0.00 0.00 59.98 58.91 2x0x h ARG 346 Cb 0.19 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 28.31 2x0x h ARG 346 CO -0.03 0.58 -0.20 1.25 0.56 0.00 0.00 179.97 182.14 2x0x h LEU 347 N 0.90 -0.47 -0.62 3.04 5.85 -1.12 -0.32 115.31 122.58 2x0x h LEU 347 Ca 0.25 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 2x0x h LEU 347 Cb -0.07 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 2x0x h LEU 347 CO -0.06 -0.26 0.28 -0.07 -0.34 0.00 0.00 178.44 177.99 2x0x h LEU 348 N -0.64 0.82 -0.08 2.25 3.38 -0.94 -2.21 115.31 117.88 2x0x h LEU 348 Ca -0.06 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.77 2x0x h LEU 348 Cb 0.47 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2x0x h LEU 348 CO 0.09 0.74 0.00 0.29 0.09 0.00 0.00 178.44 179.65 2x0x n LYS 349 N -4.49 1.06 -2.49 1.13 5.02 -0.39 -4.91 118.16 113.10 2x0x n LYS 349 Ca 0.04 -0.08 -0.20 0.00 -2.02 0.00 0.00 58.31 56.05 2x0x n LYS 349 Cb 0.14 -1.46 -0.00 0.00 -0.02 0.00 0.00 35.03 33.68 2x0x n LYS 349 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2x0x n GLY 350 N 0.98 -0.43 0.38 0.72 0.00 -0.83 -5.00 105.19 101.00 2x0x n GLY 350 Ca 0.22 -0.04 -0.02 0.00 0.00 0.00 0.00 46.02 46.18 2x0x n GLY 350 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2x0x n GLU 351 N -3.05 0.80 -3.58 1.61 1.02 -0.17 -4.94 120.64 112.33 2x0x n GLU 351 Ca -0.21 -0.29 -0.24 0.00 -0.02 0.00 0.00 57.16 56.40 2x0x n GLU 351 Cb 0.66 -0.04 -0.02 0.00 -0.02 0.00 0.00 31.44 32.02 2x0x n GLU 351 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2x0x s ASP 352 N -1.37 6.33 -0.14 1.62 -0.00 -1.26 -2.17 116.67 119.67 2x0x s ASP 352 Ca 0.06 0.36 -0.00 0.00 -0.00 0.00 0.00 52.55 52.97 2x0x s ASP 352 Cb -0.00 -1.99 -0.01 0.00 -0.00 0.00 0.00 42.92 40.92 2x0x s ASP 352 CO 0.04 -0.18 -0.14 -0.63 -0.00 0.00 0.00 175.17 174.26 2x0x s ILE 353 N -2.13 2.90 -0.01 0.77 1.01 -0.16 -4.73 121.20 118.85 2x0x s ILE 353 Ca 0.38 -0.70 -0.17 0.00 0.00 0.00 0.00 60.65 60.16 2x0x s ILE 353 Cb -0.10 -2.22 -0.06 0.00 0.01 0.00 0.00 42.46 40.10 2x0x s ILE 353 CO 0.33 0.52 0.49 -0.89 0.00 0.00 0.00 174.94 175.38 2x0x s THR 354 N 0.58 4.98 -0.11 2.92 2.01 -1.26 -1.81 115.64 122.95 2x0x s THR 354 Ca -0.08 1.01 -0.04 0.00 0.31 0.00 0.00 61.69 62.89 2x0x s THR 354 Cb -0.16 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.51 2x0x s THR 354 CO 0.03 0.49 0.06 -0.76 -0.69 0.00 0.00 174.62 173.76 2x0x s LEU 355 N -0.58 3.92 0.07 4.42 1.43 0.17 -4.85 118.68 123.26 2x0x s LEU 355 Ca 0.26 0.26 0.04 0.00 -1.03 0.00 0.00 54.13 53.66 2x0x s LEU 355 Cb -0.17 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 44.09 2x0x s LEU 355 CO 0.15 0.37 -0.11 -0.36 0.23 0.00 0.00 176.35 176.63 2x0x s PHE 356 N -0.80 0.98 0.13 0.29 0.08 0.12 -2.19 117.98 116.60 2x0x s PHE 356 Ca 0.13 -0.54 -0.30 0.00 0.12 0.00 0.00 56.93 56.34 2x0x s PHE 356 Cb -0.12 -0.56 -0.07 0.00 -0.57 0.00 0.00 43.02 41.71 2x0x s PHE 356 CO 0.03 -0.01 1.14 0.45 -0.10 0.00 0.00 175.22 176.72 2x0x s SER 357 N -1.92 7.19 0.53 1.36 0.15 -1.26 -0.70 113.70 119.04 2x0x s SER 357 Ca -0.02 2.06 0.23 0.00 0.70 0.00 0.00 55.95 58.92 2x0x s SER 357 Cb -0.08 -2.59 1.37 0.00 -1.71 0.00 0.00 66.02 63.01 2x0x s SER 357 CO 0.01 -0.32 2.03 -0.65 1.20 0.00 0.00 173.24 175.51 2x0x h PRO 358 N 5.74 0.00 0.00 5.44 0.11 -1.87 -2.08 132.00 139.35 2x0x h PRO 358 Ca -0.43 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.66 2x0x h PRO 358 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2x0x h PRO 358 CO 0.75 0.00 -0.08 0.66 -0.21 0.00 0.00 178.00 179.13 2x0x h SER 359 N 0.00 0.00 0.05 -2.05 4.64 -1.92 -3.07 113.55 111.20 2x0x h SER 359 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 2x0x h SER 359 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 2x0x h SER 359 CO -0.00 0.08 -0.19 0.47 -0.87 0.00 0.00 176.83 176.31 2x0x n ASP 360 N -3.56 1.81 -3.50 4.97 8.00 -0.78 -4.79 116.55 118.70 2x0x n ASP 360 Ca -0.02 -1.43 -0.27 0.00 0.71 0.00 0.00 54.79 53.78 2x0x n ASP 360 Cb 0.20 0.16 -0.10 0.00 -0.02 0.00 0.00 41.12 41.36 2x0x n ASP 360 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2x0x n VAL 361 N 0.13 0.06 -1.67 2.53 0.24 -1.16 -4.96 118.33 113.50 2x0x n VAL 361 Ca 0.14 -4.12 -0.49 0.00 -2.04 0.00 0.00 64.34 57.83 2x0x n VAL 361 Cb 0.43 -1.90 -0.05 0.00 -1.47 0.00 0.00 33.84 30.85 2x0x n VAL 361 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 2x0x n PRO 362 N 2.13 1.94 0.00 7.34 -0.02 -1.26 -1.78 135.00 143.34 2x0x n PRO 362 Ca 0.26 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 2x0x n PRO 362 Cb 0.44 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 2x0x n PRO 362 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2x0x n GLY 363 N 3.69 2.89 0.05 -1.23 0.00 -1.26 -4.89 105.19 104.44 2x0x n GLY 363 Ca 0.20 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.10 2x0x n GLY 363 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2x0x h LEU 364 N 0.00 0.03 -0.27 0.99 6.46 -1.72 -1.83 115.31 118.96 2x0x h LEU 364 Ca 0.00 -0.08 0.01 0.00 -0.12 0.00 0.00 57.88 57.69 2x0x h LEU 364 Cb 0.00 -0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 39.91 2x0x h LEU 364 CO 0.00 0.10 0.17 0.22 -0.62 0.00 0.00 178.44 178.31 2x0x h TYR 365 N -0.05 0.32 -0.43 1.25 3.20 -1.91 -0.63 116.97 118.72 2x0x h TYR 365 Ca 0.01 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.89 2x0x h TYR 365 Cb 0.08 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.22 2x0x h TYR 365 CO -0.05 0.20 0.28 -0.44 -1.64 0.00 0.00 178.16 176.51 2x0x h ASP 366 N 0.35 0.49 0.49 -2.11 3.45 -1.94 -2.76 116.42 114.40 2x0x h ASP 366 Ca 0.10 -0.01 -0.08 0.00 0.43 0.00 0.00 57.03 57.47 2x0x h ASP 366 Cb -0.02 -0.12 -0.01 0.00 -0.56 0.00 0.00 39.33 38.61 2x0x h ASP 366 CO -0.04 0.36 -0.36 0.00 -1.57 0.00 0.00 179.24 177.63 2x0x h ALA 367 N 1.16 1.25 -0.86 3.45 0.00 -1.05 -2.09 119.26 121.12 2x0x h ALA 367 Ca 0.16 -0.33 0.07 0.00 0.00 0.00 0.00 54.91 54.81 2x0x h ALA 367 Cb -0.07 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.61 2x0x h ALA 367 CO -0.03 0.45 0.56 0.35 0.00 0.00 0.00 179.25 180.57 2x0x h PHE 368 N 0.00 0.97 0.04 0.00 3.57 -0.81 -1.36 116.94 119.35 2x0x h PHE 368 Ca -0.00 0.03 -0.28 0.00 3.53 0.00 0.00 57.97 61.24 2x0x h PHE 368 Cb 0.70 -0.32 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 2x0x h PHE 368 CO 0.00 0.50 -1.52 1.19 -2.23 0.00 0.00 178.31 176.25 2x0x n PHE 369 N -4.49 1.07 0.13 0.41 3.72 -1.07 -4.53 117.46 112.70 2x0x n PHE 369 Ca 0.13 0.38 0.11 0.00 -0.05 0.00 0.00 57.45 58.02 2x0x n PHE 369 Cb 0.22 -1.12 -0.01 0.00 -0.94 0.00 0.00 39.48 37.63 2x0x n PHE 369 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2x0x n ALA 370 N -3.31 2.59 -3.15 4.37 0.00 -0.81 -4.65 120.51 115.55 2x0x n ALA 370 Ca -0.33 -0.26 0.04 0.00 0.00 0.00 0.00 53.44 52.89 2x0x n ALA 370 Cb 0.80 -1.08 -0.00 0.00 0.00 0.00 0.00 19.45 19.17 2x0x n ALA 370 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2x0x s ASP 371 N -5.19 -1.50 0.37 0.00 -1.08 -0.52 -4.70 116.67 104.04 2x0x s ASP 371 Ca -0.01 -0.00 0.17 0.00 -0.52 0.00 0.00 52.55 52.19 2x0x s ASP 371 Cb 0.10 1.94 0.69 0.00 -1.46 0.00 0.00 42.92 44.19 2x0x s ASP 371 CO 0.80 -0.25 1.75 1.56 0.52 0.00 0.00 175.17 179.54 2x0x h GLN 372 N 7.72 0.00 -0.07 4.34 1.08 -1.90 -1.45 115.11 124.83 2x0x h GLN 372 Ca -0.01 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.07 2x0x h GLN 372 Cb 1.19 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.62 2x0x h GLN 372 CO 0.12 0.40 -0.43 0.93 -0.95 0.00 0.00 178.83 178.89 2x0x h GLU 373 N 0.00 0.42 -0.93 1.46 4.39 -1.97 -1.87 114.58 116.08 2x0x h GLU 373 Ca -0.00 -0.35 -0.00 0.00 0.34 0.00 0.00 59.36 59.34 2x0x h GLU 373 Cb 0.85 0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 29.54 2x0x h GLU 373 CO 0.05 1.00 0.57 1.49 -1.16 0.00 0.00 179.01 180.95 2x0x h GLU 374 N -0.05 1.25 0.15 2.33 4.57 -1.87 -0.53 114.58 120.43 2x0x h GLU 374 Ca -0.03 -0.11 0.00 0.00 -1.18 0.00 0.00 59.36 58.04 2x0x h GLU 374 Cb 1.09 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 29.41 2x0x h GLU 374 CO 0.09 0.87 -0.14 0.35 -1.18 0.00 0.00 179.01 179.00 2x0x h PHE 375 N 1.27 -0.38 -0.48 0.92 3.57 -1.24 0.43 116.94 121.04 2x0x h PHE 375 Ca 0.33 0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.93 2x0x h PHE 375 Cb -0.06 0.15 -0.09 0.00 2.79 0.00 0.00 35.95 38.73 2x0x h PHE 375 CO 0.00 -0.22 -0.09 1.49 -2.23 0.00 0.00 178.31 177.26 2x0x h GLU 376 N -0.32 0.02 -0.48 1.11 4.81 -1.08 0.31 114.58 118.94 2x0x h GLU 376 Ca 0.00 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 2x0x h GLU 376 Cb 0.30 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 2x0x h GLU 376 CO -0.03 0.01 0.20 -0.09 -0.73 0.00 0.00 179.01 178.37 2x0x h ARG 377 N 0.02 0.70 -0.17 1.92 2.43 -0.86 -1.40 114.38 117.03 2x0x h ARG 377 Ca 0.23 -0.12 -0.20 0.00 -0.81 0.00 0.00 59.98 59.08 2x0x h ARG 377 Cb 0.36 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2x0x h ARG 377 CO -0.48 0.62 -0.69 -0.07 -1.51 0.00 0.00 179.97 177.84 2x0x h LEU 378 N 0.63 0.82 0.48 3.80 3.38 -0.65 -2.71 115.31 121.04 2x0x h LEU 378 Ca 0.16 -0.50 -0.02 0.00 0.09 0.00 0.00 57.88 57.60 2x0x h LEU 378 Cb 0.17 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2x0x h LEU 378 CO -0.02 1.28 -0.23 0.22 0.09 0.00 0.00 178.44 179.78 2x0x h TYR 379 N 0.50 -0.60 -0.88 1.13 3.20 -0.27 0.16 116.97 120.21 2x0x h TYR 379 Ca -0.03 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.87 2x0x h TYR 379 Cb 1.30 0.20 -0.06 0.00 1.54 0.00 0.00 36.73 39.71 2x0x h TYR 379 CO 0.07 -0.28 0.56 1.79 -1.64 0.00 0.00 178.16 178.66 2x0x h THR 380 N -0.90 1.11 -0.26 1.81 1.35 -1.39 0.19 112.91 114.81 2x0x h THR 380 Ca -0.07 -0.36 0.03 0.00 -0.55 0.00 0.00 66.41 65.46 2x0x h THR 380 Cb 0.59 -0.05 -0.03 0.00 -1.73 0.00 0.00 68.15 66.93 2x0x h THR 380 CO 0.11 0.19 0.07 0.50 -0.25 0.00 0.00 175.52 176.14 2x0x h LYS 381 N 1.06 0.18 0.00 4.72 3.64 -1.37 -2.07 116.57 122.73 2x0x h LYS 381 Ca 0.36 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.63 2x0x h LYS 381 Cb 0.07 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 2x0x h LYS 381 CO -0.14 0.12 -0.47 1.88 -2.27 0.00 0.00 179.45 178.57 2x0x h TYR 382 N 0.18 0.00 -0.50 1.91 0.05 -0.20 -2.84 116.97 115.58 2x0x h TYR 382 Ca 0.12 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.85 2x0x h TYR 382 Cb 0.10 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.82 2x0x h TYR 382 CO -0.14 0.47 0.10 0.93 -1.05 0.00 0.00 178.16 178.46 2x0x h GLU 383 N 0.00 0.76 0.00 4.88 5.08 -0.28 -3.08 114.58 121.95 2x0x h GLU 383 Ca -0.00 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 2x0x h GLU 383 Cb 0.89 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.03 2x0x h GLU 383 CO 0.06 0.70 -0.14 0.87 -1.00 0.00 0.00 179.01 179.50 2x0x h LYS 384 N 0.73 0.00 -5.95 2.33 6.56 -1.17 -3.45 116.57 115.63 2x0x h LYS 384 Ca 0.16 0.00 -0.60 0.00 -1.06 0.00 0.00 60.65 59.15 2x0x h LYS 384 Cb 0.30 0.00 -0.10 0.00 -0.57 0.00 0.00 32.23 31.86 2x0x h LYS 384 CO 0.00 0.00 0.52 0.34 -2.06 0.00 0.00 179.45 178.25 2x0x s ASP 385 N -5.40 6.68 0.41 0.86 -1.08 -1.09 -4.95 116.67 112.10 2x0x s ASP 385 Ca 0.07 0.62 0.13 0.00 -0.52 0.00 0.00 52.55 52.85 2x0x s ASP 385 Cb 0.09 -2.44 0.88 0.00 -1.46 0.00 0.00 42.92 39.98 2x0x s ASP 385 CO 0.66 -0.76 1.93 0.44 0.52 0.00 0.00 175.17 177.97 2x0x h ASP 386 N 8.31 0.06 1.04 -0.34 3.32 -1.87 -2.99 116.42 123.95 2x0x h ASP 386 Ca -0.23 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.80 2x0x h ASP 386 Cb 1.09 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.62 2x0x h ASP 386 CO 0.94 0.28 0.00 -1.54 -1.72 0.00 0.00 179.24 177.20 2x0x n SER 387 N -4.26 0.44 -4.68 6.45 3.41 -1.26 -4.75 113.62 108.97 2x0x n SER 387 Ca -0.02 0.56 -0.40 0.00 -0.26 0.00 0.00 58.87 58.76 2x0x n SER 387 Cb 0.29 -0.67 -0.06 0.00 -0.26 0.00 0.00 64.21 63.51 2x0x n SER 387 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2x0x s ILE 388 N -3.10 5.06 0.30 -1.33 -1.09 -1.13 -5.04 121.20 114.86 2x0x s ILE 388 Ca 0.10 1.18 -0.30 0.00 -2.23 0.00 0.00 60.65 59.40 2x0x s ILE 388 Cb 0.13 -3.94 -0.12 0.00 -1.58 0.00 0.00 42.46 36.95 2x0x s ILE 388 CO 0.48 0.18 1.50 -1.14 -1.23 0.00 0.00 174.94 174.73 2x0x n ARG 389 N 4.54 2.46 -3.49 2.79 0.63 -1.26 -4.99 116.66 117.35 2x0x n ARG 389 Ca -0.03 0.87 -0.10 0.00 -0.92 0.00 0.00 57.85 57.68 2x0x n ARG 389 Cb 0.50 -2.59 -0.03 0.00 0.45 0.00 0.00 32.46 30.80 2x0x n ARG 389 CO 0.00 0.00 0.00 -1.59 -2.51 0.00 0.00 177.63 173.53 2x0x s LYS 390 N -0.89 0.92 -0.01 -0.14 -2.85 -1.26 -4.66 119.74 110.86 2x0x s LYS 390 Ca 0.62 -0.26 0.02 0.00 -1.00 0.00 0.00 55.97 55.35 2x0x s LYS 390 Cb -0.54 0.43 -0.00 0.00 -2.06 0.00 0.00 37.83 35.66 2x0x s LYS 390 CO 0.53 -0.39 -0.07 -1.14 0.10 0.00 0.00 175.35 174.37 2x0x s GLN 391 N -2.95 0.69 -0.08 1.78 0.74 -0.93 -4.95 119.66 113.96 2x0x s GLN 391 Ca 0.02 -0.26 -0.06 0.00 0.05 0.00 0.00 55.36 55.12 2x0x s GLN 391 Cb -0.01 -0.67 -0.04 0.00 1.10 0.00 0.00 33.01 33.39 2x0x s GLN 391 CO -0.08 0.13 0.16 1.03 -0.55 0.00 0.00 175.29 175.98 2x0x s ARG 392 N 0.00 3.45 0.05 1.67 0.52 -1.26 0.45 118.95 123.82 2x0x s ARG 392 Ca 0.00 -0.18 -0.03 0.00 -0.52 0.00 0.00 55.73 55.00 2x0x s ARG 392 Cb -0.05 -3.16 -0.03 0.00 0.52 0.00 0.00 34.95 32.23 2x0x s ARG 392 CO -0.00 0.74 0.02 0.14 0.02 0.00 0.00 175.30 176.23 2x0x s VAL 393 N -1.13 0.17 0.13 3.52 -7.23 -0.75 -4.99 120.40 110.13 2x0x s VAL 393 Ca 0.19 -1.41 -0.31 0.00 -1.81 0.00 0.00 61.98 58.64 2x0x s VAL 393 Cb -0.12 -1.13 -0.08 0.00 0.56 0.00 0.00 36.38 35.61 2x0x s VAL 393 CO 0.09 -0.78 1.37 -0.54 -0.31 0.00 0.00 175.10 174.93 2x0x s LYS 394 N -3.16 4.33 0.27 4.82 3.01 -1.26 -0.99 119.74 126.76 2x0x s LYS 394 Ca -0.00 2.06 0.01 0.00 -1.01 0.00 0.00 55.97 57.03 2x0x s LYS 394 Cb 0.02 -3.24 0.60 0.00 -1.01 0.00 0.00 37.83 34.21 2x0x s LYS 394 CO -0.07 -0.40 1.73 0.00 0.51 0.00 0.00 175.35 177.12 2x0x h ALA 395 N 6.54 1.32 -0.41 5.17 0.00 -1.72 -1.37 119.26 128.78 2x0x h ALA 395 Ca -0.43 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 2x0x h ALA 395 Cb 1.21 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2x0x h ALA 395 CO 0.85 -0.20 0.10 0.28 0.00 0.00 0.00 179.25 180.28 2x0x h VAL 396 N 0.52 1.19 -0.06 0.00 2.07 -1.87 -1.06 116.25 117.03 2x0x h VAL 396 Ca 0.50 -0.66 -0.21 0.00 0.82 0.00 0.00 66.70 67.15 2x0x h VAL 396 Cb 0.81 0.77 0.01 0.00 -1.52 0.00 0.00 31.29 31.36 2x0x h VAL 396 CO -0.43 0.24 -0.78 -0.33 0.02 0.00 0.00 177.57 176.29 2x0x h GLU 397 N 0.60 0.64 -0.10 1.57 5.08 -1.74 -2.36 114.58 118.27 2x0x h GLU 397 Ca 0.14 -0.61 -0.01 0.00 -1.00 0.00 0.00 59.36 57.88 2x0x h GLU 397 Cb 0.23 0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 2x0x h GLU 397 CO -0.00 1.21 0.02 1.25 -1.00 0.00 0.00 179.01 180.49 2x0x h LEU 398 N 0.29 0.17 -1.05 1.33 5.85 -1.15 -1.78 115.31 118.96 2x0x h LEU 398 Ca -0.08 -0.26 0.02 0.00 0.84 0.00 0.00 57.88 58.40 2x0x h LEU 398 Cb 1.44 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 42.38 2x0x h LEU 398 CO 0.16 0.38 0.64 -0.26 -0.34 0.00 0.00 178.44 179.02 2x0x h PHE 399 N -0.06 1.21 -0.42 1.25 0.04 -1.29 -1.84 116.94 115.83 2x0x h PHE 399 Ca 0.03 0.03 -0.13 0.00 2.80 0.00 0.00 57.97 60.70 2x0x h PHE 399 Cb 0.29 -0.41 -0.01 0.00 2.20 0.00 0.00 35.95 38.02 2x0x h PHE 399 CO 0.02 0.75 -0.25 0.77 -0.60 0.00 0.00 178.31 179.00 2x0x h SER 400 N 1.30 0.95 -0.61 2.17 0.02 -1.37 -1.00 113.55 115.01 2x0x h SER 400 Ca 0.36 -0.42 -0.01 0.00 -0.84 0.00 0.00 61.79 60.89 2x0x h SER 400 Cb -0.12 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.13 2x0x h SER 400 CO -0.09 1.16 0.35 0.25 -1.14 0.00 0.00 176.83 177.37 2x0x h LEU 401 N 0.74 0.75 -0.03 5.07 5.85 -1.10 0.22 115.31 126.81 2x0x h LEU 401 Ca 0.09 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2x0x h LEU 401 Cb 0.83 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.66 2x0x h LEU 401 CO 0.07 0.61 0.02 -0.03 -0.34 0.00 0.00 178.44 178.77 2x0x h MET 402 N 0.83 0.03 -0.25 1.25 4.05 -1.23 -1.45 114.93 118.16 2x0x h MET 402 Ca 0.22 -0.00 -0.12 0.00 -0.28 0.00 0.00 59.70 59.52 2x0x h MET 402 Cb 0.01 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 30.79 2x0x h MET 402 CO -0.04 0.03 -0.33 0.52 0.23 0.00 0.00 176.91 177.32 2x0x h MET 403 N 0.02 0.52 -0.08 0.39 2.86 -0.96 0.32 114.93 118.00 2x0x h MET 403 Ca 0.01 -0.23 -0.00 0.00 -2.06 0.00 0.00 59.70 57.41 2x0x h MET 403 Cb 0.01 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.65 2x0x h MET 403 CO -0.00 0.79 0.04 0.37 1.06 0.00 0.00 176.91 179.17 2x0x h GLN 404 N 0.44 0.12 -0.70 1.72 4.15 -0.47 0.30 115.11 120.68 2x0x h GLN 404 Ca 0.05 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.43 2x0x h GLN 404 Cb 0.80 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.43 2x0x h GLN 404 CO 0.06 0.20 0.35 0.93 -1.93 0.00 0.00 178.83 178.44 2x0x h GLU 405 N 0.01 1.01 -0.30 1.69 4.39 -1.03 -0.83 114.58 119.52 2x0x h GLU 405 Ca 0.03 -0.14 0.05 0.00 0.34 0.00 0.00 59.36 59.63 2x0x h GLU 405 Cb 0.12 -0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 28.54 2x0x h GLU 405 CO -0.00 0.78 0.03 -0.09 -1.16 0.00 0.00 179.01 178.57 2x0x h ARG 406 N 0.98 0.12 -0.58 2.33 2.43 -0.13 -2.74 114.38 116.78 2x0x h ARG 406 Ca 0.24 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.35 2x0x h ARG 406 Cb 0.10 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 2x0x h ARG 406 CO -0.03 0.08 0.15 0.00 -1.51 0.00 0.00 179.97 178.65 2x0x h ALA 407 N 1.24 0.76 -0.01 2.80 0.00 0.01 0.68 119.26 124.74 2x0x h ALA 407 Ca 0.14 -0.22 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 2x0x h ALA 407 Cb 0.17 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2x0x h ALA 407 CO -0.22 0.46 -0.75 0.66 0.00 0.00 0.00 179.25 179.41 2x0x h SER 408 N 0.83 0.15 0.00 0.00 4.64 -1.14 -3.34 113.55 114.69 2x0x h SER 408 Ca 0.18 -0.11 -0.19 0.00 -0.47 0.00 0.00 61.79 61.21 2x0x h SER 408 Cb 0.34 -0.04 -0.04 0.00 -0.31 0.00 0.00 62.40 62.35 2x0x h SER 408 CO 0.00 0.84 -2.02 0.35 -0.87 0.00 0.00 176.83 175.13 2x0x n THR 409 N -3.72 0.70 -0.80 2.95 -2.24 -1.04 -5.00 114.28 105.14 2x0x n THR 409 Ca -0.02 -0.59 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 2x0x n THR 409 Cb 0.72 -0.31 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 2x0x n THR 409 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x0x n GLY 410 N 1.78 0.56 0.20 3.38 0.00 0.24 -4.87 105.19 106.48 2x0x n GLY 410 Ca -0.18 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.93 2x0x n GLY 410 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x0x n ARG 411 N -1.96 1.69 -3.66 1.61 5.12 -1.25 -2.29 116.66 115.91 2x0x n ARG 411 Ca 0.00 -2.53 -0.38 0.00 -1.93 0.00 0.00 57.85 53.00 2x0x n ARG 411 Cb 0.01 -1.51 -0.12 0.00 -1.16 0.00 0.00 32.46 29.68 2x0x n ARG 411 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2x0x s ILE 412 N -2.70 4.57 0.27 0.55 -1.09 -1.26 -2.46 121.20 119.09 2x0x s ILE 412 Ca 0.31 -0.41 0.07 0.00 -2.23 0.00 0.00 60.65 58.39 2x0x s ILE 412 Cb 0.27 -3.32 -0.03 0.00 -1.58 0.00 0.00 42.46 37.79 2x0x s ILE 412 CO 0.04 0.08 0.25 -0.31 -1.23 0.00 0.00 174.94 173.77 2x0x s TYR 413 N 1.61 3.10 -0.09 3.97 2.02 0.21 -4.65 117.35 123.52 2x0x s TYR 413 Ca 0.05 -0.15 0.02 0.00 -0.37 0.00 0.00 57.07 56.62 2x0x s TYR 413 Cb -0.17 -1.55 -0.01 0.00 -0.40 0.00 0.00 41.96 39.83 2x0x s TYR 413 CO 0.06 0.40 -0.17 0.42 -1.57 0.00 0.00 175.55 174.70 2x0x s ILE 414 N -2.16 2.77 -0.19 2.71 1.09 -0.97 0.25 121.20 124.69 2x0x s ILE 414 Ca 0.36 -0.79 0.01 0.00 -1.10 0.00 0.00 60.65 59.13 2x0x s ILE 414 Cb -0.08 -2.11 0.03 0.00 -1.06 0.00 0.00 42.46 39.25 2x0x s ILE 414 CO 0.26 0.55 -0.15 -1.58 -0.10 0.00 0.00 174.94 173.92 2x0x s GLN 415 N 0.00 2.54 -0.89 2.79 0.74 0.01 -0.60 119.66 124.25 2x0x s GLN 415 Ca -0.05 -0.88 -0.22 0.00 0.05 0.00 0.00 55.36 54.25 2x0x s GLN 415 Cb -0.15 -2.52 0.07 0.00 1.10 0.00 0.00 33.01 31.52 2x0x s GLN 415 CO 0.05 -0.32 1.26 -0.80 -0.55 0.00 0.00 175.29 174.92 2x0x s ASN 416 N 1.31 6.43 0.43 6.67 0.01 0.77 -1.06 114.94 129.50 2x0x s ASN 416 Ca 0.01 -1.38 0.23 0.00 -0.71 0.00 0.00 52.86 51.01 2x0x s ASN 416 Cb -0.15 -2.50 0.84 0.00 0.41 0.00 0.00 41.25 39.85 2x0x s ASN 416 CO -0.10 -1.43 1.79 -0.37 -1.51 0.00 0.00 177.10 175.48 2x0x h VAL 417 N 6.27 0.55 0.13 1.60 -1.51 -1.35 -2.17 116.25 119.77 2x0x h VAL 417 Ca 0.03 -1.20 -0.01 0.00 -1.23 0.00 0.00 66.70 64.30 2x0x h VAL 417 Cb 1.03 1.82 0.00 0.00 -2.13 0.00 0.00 31.29 32.01 2x0x h VAL 417 CO 1.28 0.23 -0.06 -2.24 -1.23 0.00 0.00 177.57 175.54 2x0x h ASP 418 N 0.00 -0.15 -0.88 4.19 2.03 -1.80 -3.05 116.42 116.77 2x0x h ASP 418 Ca -0.00 -0.24 0.16 0.00 -0.73 0.00 0.00 57.03 56.21 2x0x h ASP 418 Cb 0.80 0.04 -0.07 0.00 -0.83 0.00 0.00 39.33 39.27 2x0x h ASP 418 CO 0.03 0.17 0.57 0.45 -1.03 0.00 0.00 179.24 179.43 2x0x h HIS 419 N -0.48 0.74 0.00 4.15 3.86 -1.82 0.22 115.15 121.82 2x0x h HIS 419 Ca -0.02 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2x0x h HIS 419 Cb 0.38 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 28.62 2x0x h HIS 419 CO 0.02 0.25 0.00 0.00 0.86 0.00 0.00 177.93 179.07 2x0x n ASN 421 N -2.85 4.62 0.07 0.00 3.02 -0.13 -4.54 115.26 115.45 2x0x n ASN 421 Ca 0.00 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.58 2x0x n ASN 421 Cb 0.23 1.03 -0.04 0.00 -0.61 0.00 0.00 39.78 40.39 2x0x n ASN 421 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 2x0x h THR 422 N 0.00 0.50 -3.31 3.41 1.35 -0.71 -3.42 112.91 110.72 2x0x h THR 422 Ca -0.00 -1.87 -0.63 0.00 -0.55 0.00 0.00 66.41 63.35 2x0x h THR 422 Cb 0.16 2.04 -0.41 0.00 -1.73 0.00 0.00 68.15 68.22 2x0x h THR 422 CO 0.00 0.28 -0.68 -2.28 -0.25 0.00 0.00 175.52 172.59 2x0x s HIS 423 N -3.00 2.88 -0.22 4.73 5.65 -0.98 -4.86 115.29 119.48 2x0x s HIS 423 Ca -0.01 -2.88 -0.27 0.00 0.25 0.00 0.00 55.06 52.15 2x0x s HIS 423 Cb 0.08 -2.54 0.10 0.00 -1.18 0.00 0.00 32.58 29.05 2x0x s HIS 423 CO 0.79 -0.79 0.87 0.45 -0.65 0.00 0.00 174.74 175.41 2x0x s SER 424 N 0.16 -0.56 0.00 9.88 0.15 -1.26 -4.64 113.70 117.43 2x0x s SER 424 Ca 0.16 0.93 0.15 0.00 0.70 0.00 0.00 55.95 57.89 2x0x s SER 424 Cb -0.24 0.90 0.75 0.00 -1.71 0.00 0.00 66.02 65.72 2x0x s SER 424 CO -0.02 -0.29 1.39 -0.81 1.20 0.00 0.00 173.24 174.70 2x0x n PRO 425 N 1.87 0.23 -4.95 5.44 -0.04 -1.26 -4.61 135.00 131.68 2x0x n PRO 425 Ca -0.14 0.13 -0.32 0.00 -0.04 0.00 0.00 63.50 63.13 2x0x n PRO 425 Cb 0.56 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.38 2x0x n PRO 425 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2x0x s PHE 426 N -2.51 2.65 -0.43 0.54 0.08 -1.26 -0.59 117.98 116.46 2x0x s PHE 426 Ca 0.15 -0.25 -0.29 0.00 0.12 0.00 0.00 56.93 56.66 2x0x s PHE 426 Cb 0.10 -1.63 0.02 0.00 -0.57 0.00 0.00 43.02 40.94 2x0x s PHE 426 CO 0.22 0.11 1.24 0.34 -0.10 0.00 0.00 175.22 177.03 2x0x s ASP 427 N -0.61 6.56 0.21 1.36 -1.08 -0.73 -4.61 116.67 117.76 2x0x s ASP 427 Ca 0.09 0.68 0.20 0.00 -0.52 0.00 0.00 52.55 53.00 2x0x s ASP 427 Cb -0.11 -2.55 0.89 0.00 -1.46 0.00 0.00 42.92 39.69 2x0x s ASP 427 CO 0.01 -1.28 1.61 -0.81 0.52 0.00 0.00 175.17 175.23 2x0x n PRO 428 N 7.82 0.14 0.23 4.34 -0.04 -1.26 0.39 135.00 146.61 2x0x n PRO 428 Ca 0.14 0.44 0.11 0.00 -0.04 0.00 0.00 63.50 64.15 2x0x n PRO 428 Cb 0.48 -1.80 0.48 0.00 -0.04 0.00 0.00 33.50 32.63 2x0x n PRO 428 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2x0x h ALA 429 N 2.24 1.01 0.00 0.55 0.00 -1.91 -3.31 119.26 117.84 2x0x h ALA 429 Ca 0.00 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 2x0x h ALA 429 Cb 0.25 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2x0x h ALA 429 CO 0.00 0.22 -1.29 -0.89 0.00 0.00 0.00 179.25 177.29 2x0x n ILE 430 N -3.32 0.29 -3.10 0.00 5.41 -0.12 -4.93 119.36 113.59 2x0x n ILE 430 Ca 0.00 -0.10 -0.20 0.00 1.00 0.00 0.00 62.75 63.45 2x0x n ILE 430 Cb 0.42 -0.90 -0.04 0.00 -0.71 0.00 0.00 39.64 38.40 2x0x n ILE 430 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2x0x n ALA 431 N -2.79 1.62 -1.72 -1.39 0.00 0.16 -5.06 120.51 111.33 2x0x n ALA 431 Ca -0.09 -2.98 -0.35 0.00 0.00 0.00 0.00 53.44 50.02 2x0x n ALA 431 Cb 0.59 -0.92 0.01 0.00 0.00 0.00 0.00 19.45 19.13 2x0x n ALA 431 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2x0x s PRO 432 N -0.83 3.22 -0.29 0.00 0.04 -1.25 -4.40 135.00 131.48 2x0x s PRO 432 Ca 0.34 1.59 -0.15 0.00 0.04 0.00 0.00 61.00 62.82 2x0x s PRO 432 Cb 0.19 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.71 2x0x s PRO 432 CO -0.14 -0.96 0.39 0.08 0.04 0.00 0.00 177.00 176.42 2x0x s VAL 433 N -1.86 5.15 -0.05 -0.36 1.01 -1.26 -4.21 120.40 118.81 2x0x s VAL 433 Ca 0.72 0.45 0.07 0.00 0.00 0.00 0.00 61.98 63.22 2x0x s VAL 433 Cb -0.24 -3.76 0.10 0.00 0.00 0.00 0.00 36.38 32.48 2x0x s VAL 433 CO 0.30 0.06 0.97 0.54 0.00 0.00 0.00 175.10 176.97 2x0x n ARG 434 N 5.40 1.20 -3.66 2.72 1.74 -1.26 -4.80 116.66 118.01 2x0x n ARG 434 Ca -0.08 -1.61 0.03 0.00 -0.77 0.00 0.00 57.85 55.42 2x0x n ARG 434 Cb 0.50 -0.98 0.01 0.00 -1.02 0.00 0.00 32.46 30.97 2x0x n ARG 434 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2x0x n GLN 435 N -0.64 0.10 -0.98 5.56 10.64 -1.26 -4.96 117.38 125.84 2x0x n GLN 435 Ca 0.06 -0.56 0.00 0.00 -1.83 0.00 0.00 57.00 54.67 2x0x n GLN 435 Cb 0.54 0.98 0.00 0.00 -0.86 0.00 0.00 30.24 30.90 2x0x n GLN 435 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2x0x n SER 436 N -0.89 0.40 -1.52 2.61 2.88 -1.26 -4.45 113.62 111.39 2x0x n SER 436 Ca 0.04 -0.49 0.00 0.00 -1.33 0.00 0.00 58.87 57.10 2x0x n SER 436 Cb 0.48 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 2x0x n SER 436 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2x0x n ASN 437 N -1.27 0.80 -0.19 -3.46 6.94 -1.21 -4.50 115.26 112.36 2x0x n ASN 437 Ca 0.00 -0.76 -0.00 0.00 -0.02 0.00 0.00 54.58 53.80 2x0x n ASN 437 Cb 0.00 0.00 0.10 0.00 -2.36 0.00 0.00 39.78 37.52 2x0x n ASN 437 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 2x0x h LEU 438 N 0.00 0.07 -2.68 -4.53 5.85 -1.88 -3.09 115.31 109.06 2x0x h LEU 438 Ca 0.00 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2x0x h LEU 438 Cb 0.00 0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.15 2x0x h LEU 438 CO 0.00 0.05 0.00 0.00 -0.34 0.00 0.00 178.44 178.15 2x0x n LEU 440 N 1.41 -0.75 -0.00 0.00 7.99 -1.17 -4.51 117.00 119.97 2x0x n LEU 440 Ca 0.21 0.26 0.06 0.00 -0.01 0.00 0.00 56.01 56.54 2x0x n LEU 440 Cb 0.58 -1.74 -0.08 0.00 -0.11 0.00 0.00 43.42 42.07 2x0x n LEU 440 CO 0.15 -0.57 -0.15 -1.84 -1.51 0.00 0.00 177.39 173.47 2x0x n GLU 441 N -2.62 2.25 -3.96 3.23 0.00 -1.26 -4.05 120.64 114.23 2x0x n GLU 441 Ca -0.11 -0.02 -0.36 0.00 0.00 0.00 0.00 57.16 56.68 2x0x n GLU 441 Cb 0.36 -1.16 -0.08 0.00 0.00 0.00 0.00 31.44 30.56 2x0x n GLU 441 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 2x0x s ILE 442 N -2.37 5.11 -0.28 3.84 -1.09 -1.26 -0.92 121.20 124.23 2x0x s ILE 442 Ca 0.03 0.07 -0.02 0.00 -2.23 0.00 0.00 60.65 58.50 2x0x s ILE 442 Cb 0.10 -3.26 0.12 0.00 -1.58 0.00 0.00 42.46 37.84 2x0x s ILE 442 CO 0.54 0.54 0.25 0.00 -1.23 0.00 0.00 174.94 175.04 2x0x s ALA 443 N -0.37 -0.16 0.03 9.38 0.00 -1.26 -3.32 121.76 126.06 2x0x s ALA 443 Ca 0.10 -0.49 -0.01 0.00 0.00 0.00 0.00 51.96 51.56 2x0x s ALA 443 Cb -0.12 -1.66 -0.03 0.00 0.00 0.00 0.00 23.12 21.31 2x0x s ALA 443 CO 0.01 -1.67 -0.01 -0.51 0.00 0.00 0.00 175.76 173.59 2x0x s LEU 444 N 2.29 2.26 0.66 0.00 1.43 -1.26 -4.83 118.68 119.23 2x0x s LEU 444 Ca 0.09 -0.68 -0.15 0.00 -1.03 0.00 0.00 54.13 52.35 2x0x s LEU 444 Cb -0.15 0.21 -0.00 0.00 0.03 0.00 0.00 46.19 46.29 2x0x s LEU 444 CO -0.33 -0.44 1.12 -2.84 0.23 0.00 0.00 176.35 174.09 2x0x s PRO 445 N -2.51 2.78 0.10 1.29 0.02 -1.26 -4.43 135.00 130.98 2x0x s PRO 445 Ca -0.06 1.44 -0.10 0.00 0.02 0.00 0.00 61.00 62.30 2x0x s PRO 445 Cb -0.02 -1.94 0.00 0.00 0.02 0.00 0.00 34.50 32.56 2x0x s PRO 445 CO -0.05 -1.28 0.23 0.95 -0.33 0.00 0.00 177.00 176.52 2x0x s THR 446 N -2.27 0.13 -0.05 0.99 -4.23 -1.26 -4.29 115.64 104.65 2x0x s THR 446 Ca 0.68 -1.09 -0.04 0.00 -1.18 0.00 0.00 61.69 60.06 2x0x s THR 446 Cb -0.21 -1.33 0.02 0.00 1.34 0.00 0.00 72.50 72.32 2x0x s THR 446 CO 0.41 -0.58 0.13 -0.75 -0.54 0.00 0.00 174.62 173.29 2x0x s LYS 447 N -3.86 0.12 0.48 3.99 2.20 0.04 -4.88 119.74 117.84 2x0x s LYS 447 Ca 0.05 0.26 -0.23 0.00 -0.36 0.00 0.00 55.97 55.68 2x0x s LYS 447 Cb 0.04 -0.03 -0.08 0.00 -1.51 0.00 0.00 37.83 36.25 2x0x s LYS 447 CO -0.11 -0.08 1.21 -2.30 -0.36 0.00 0.00 175.35 173.72 2x0x n PRO 448 N 3.51 1.64 -3.60 4.03 -0.02 -1.25 -1.62 135.00 137.69 2x0x n PRO 448 Ca -0.18 0.59 -0.32 0.00 -2.02 0.00 0.00 63.50 61.58 2x0x n PRO 448 Cb 0.56 -2.36 -0.05 0.00 -0.02 0.00 0.00 33.50 31.63 2x0x n PRO 448 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2x0x s LEU 449 N -2.04 4.25 0.00 2.45 1.02 -1.26 -4.32 118.68 118.78 2x0x s LEU 449 Ca 0.66 0.68 0.11 0.00 0.02 0.00 0.00 54.13 55.60 2x0x s LEU 449 Cb -0.48 -3.38 0.27 0.00 0.02 0.00 0.00 46.19 42.62 2x0x s LEU 449 CO 0.54 0.03 1.19 0.59 0.02 0.00 0.00 176.35 178.72 2x0x n ASN 450 N 0.08 2.78 -3.57 2.29 3.02 -1.26 -4.02 115.26 114.57 2x0x n ASN 450 Ca -0.02 -1.92 -0.08 0.00 -0.03 0.00 0.00 54.58 52.53 2x0x n ASN 450 Cb 0.52 -0.20 -0.04 0.00 -0.61 0.00 0.00 39.78 39.45 2x0x n ASN 450 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2x0x s ASP 451 N -0.99 -0.29 0.27 6.41 -1.08 -1.26 -4.52 116.67 115.21 2x0x s ASP 451 Ca 0.22 0.22 -0.01 0.00 -0.52 0.00 0.00 52.55 52.46 2x0x s ASP 451 Cb 0.12 0.26 0.45 0.00 -1.46 0.00 0.00 42.92 42.29 2x0x s ASP 451 CO 0.16 -0.34 1.88 0.58 0.52 0.00 0.00 175.17 177.97 2x0x h VAL 452 N 2.31 1.06 -0.56 1.11 2.07 -1.90 -2.11 116.25 118.24 2x0x h VAL 452 Ca -0.16 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 66.97 2x0x h VAL 452 Cb 1.18 -0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 2x0x h VAL 452 CO 0.29 0.21 0.00 0.59 0.02 0.00 0.00 177.57 178.67 2x0x n ASN 453 N -4.51 5.65 -4.63 0.57 3.02 -1.26 -4.56 115.26 109.54 2x0x n ASN 453 Ca 0.16 -2.94 -0.42 0.00 -0.03 0.00 0.00 54.58 51.34 2x0x n ASN 453 Cb 0.21 -0.68 -0.03 0.00 -0.61 0.00 0.00 39.78 38.67 2x0x n ASN 453 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2x0x s ASP 454 N -0.86 6.04 0.16 6.41 2.15 -0.80 -4.86 116.67 124.91 2x0x s ASP 454 Ca 0.54 2.27 0.27 0.00 0.43 0.00 0.00 52.55 56.06 2x0x s ASP 454 Cb 0.41 -2.52 0.92 0.00 -0.30 0.00 0.00 42.92 41.43 2x0x s ASP 454 CO 0.16 -1.44 1.81 -0.62 -0.17 0.00 0.00 175.17 174.91 2x0x n GLU 455 N 8.04 0.20 0.00 4.34 -0.58 -1.26 -3.01 120.64 128.36 2x0x n GLU 455 Ca 0.24 0.16 0.13 0.00 -0.42 0.00 0.00 57.16 57.27 2x0x n GLU 455 Cb 0.43 -1.73 0.36 0.00 -0.57 0.00 0.00 31.44 29.93 2x0x n GLU 455 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2x0x n ASN 456 N -2.07 1.86 -4.80 1.62 4.13 -1.26 -4.86 115.26 109.88 2x0x n ASN 456 Ca 0.06 -1.55 -0.29 0.00 1.68 0.00 0.00 54.58 54.48 2x0x n ASN 456 Cb 0.41 0.05 0.10 0.00 -1.54 0.00 0.00 39.78 38.80 2x0x n ASN 456 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 2x0x s GLY 457 N -2.10 1.62 -0.16 7.41 0.00 -1.16 -4.93 107.32 107.98 2x0x s GLY 457 Ca 0.32 -0.73 -0.04 0.00 0.00 0.00 0.00 44.72 44.27 2x0x s GLY 457 CO 0.37 -0.20 0.23 1.85 0.00 0.00 0.00 173.10 175.35 2x0x s GLU 458 N -5.62 0.16 -0.19 2.90 2.12 -0.64 -4.63 118.70 112.81 2x0x s GLU 458 Ca 0.64 0.44 -0.08 0.00 0.36 0.00 0.00 54.97 56.33 2x0x s GLU 458 Cb -0.10 -0.67 -0.04 0.00 0.26 0.00 0.00 34.13 33.58 2x0x s GLU 458 CO 0.49 -0.49 0.07 0.42 -0.54 0.00 0.00 175.26 175.22 2x0x s ILE 459 N 2.36 4.88 0.01 -3.70 1.01 -0.13 -0.78 121.20 124.85 2x0x s ILE 459 Ca 0.05 -0.00 -0.22 0.00 0.00 0.00 0.00 60.65 60.47 2x0x s ILE 459 Cb -0.14 -3.21 -0.05 0.00 0.01 0.00 0.00 42.46 39.07 2x0x s ILE 459 CO -0.10 0.45 0.67 0.00 0.00 0.00 0.00 174.94 175.96 2x0x s ALA 460 N 0.42 3.43 0.17 9.38 0.00 -0.45 -4.07 121.76 130.64 2x0x s ALA 460 Ca 0.04 0.14 0.09 0.00 0.00 0.00 0.00 51.96 52.22 2x0x s ALA 460 Cb -0.12 -2.85 -0.04 0.00 0.00 0.00 0.00 23.12 20.10 2x0x s ALA 460 CO 0.00 0.11 -0.18 -0.51 0.00 0.00 0.00 175.76 175.18 2x0x s LEU 461 N -0.09 2.44 -0.05 0.00 1.43 -1.26 -0.52 118.68 120.63 2x0x s LEU 461 Ca 0.34 -0.87 -0.04 0.00 -1.03 0.00 0.00 54.13 52.53 2x0x s LEU 461 Cb -0.19 -0.83 0.02 0.00 0.03 0.00 0.00 46.19 45.21 2x0x s LEU 461 CO 0.20 -0.04 0.12 0.00 0.23 0.00 0.00 176.35 176.86 2x0x s THR 463 N 0.27 4.76 0.22 0.00 2.01 -1.23 -4.55 115.64 117.12 2x0x s THR 463 Ca -0.02 -0.05 0.08 0.00 0.31 0.00 0.00 61.69 62.01 2x0x s THR 463 Cb -0.03 -3.14 -0.04 0.00 0.01 0.00 0.00 72.50 69.30 2x0x s THR 463 CO -0.01 0.47 0.06 -0.76 -0.69 0.00 0.00 174.62 173.69 2x0x s LEU 464 N 0.31 3.46 0.16 4.42 1.43 -1.26 -1.20 118.68 126.01 2x0x s LEU 464 Ca 0.03 -0.40 -0.23 0.00 -1.03 0.00 0.00 54.13 52.50 2x0x s LEU 464 Cb -0.12 -2.04 0.08 0.00 0.03 0.00 0.00 46.19 44.13 2x0x s LEU 464 CO 0.00 0.03 1.04 -0.44 0.23 0.00 0.00 176.35 177.21 2x0x s SER 465 N -3.40 -0.04 0.01 2.29 0.01 -1.08 -4.30 113.70 107.19 2x0x s SER 465 Ca 0.30 -0.58 -0.10 0.00 1.31 0.00 0.00 55.95 56.89 2x0x s SER 465 Cb -0.08 0.47 0.01 0.00 0.21 0.00 0.00 66.02 66.63 2x0x s SER 465 CO 0.21 -0.92 0.20 0.00 0.41 0.00 0.00 173.24 173.14 2x0x s ALA 466 N -2.44 -0.48 -0.00 1.44 0.00 -0.87 -0.01 121.76 119.41 2x0x s ALA 466 Ca 0.19 -0.03 -0.19 0.00 0.00 0.00 0.00 51.96 51.93 2x0x s ALA 466 Cb -0.02 0.14 -0.06 0.00 0.00 0.00 0.00 23.12 23.19 2x0x s ALA 466 CO 0.04 -0.26 0.55 -0.06 0.00 0.00 0.00 175.76 176.03 2x0x s PHE 467 N -1.66 3.70 -0.69 0.00 0.08 0.10 -0.80 117.98 118.71 2x0x s PHE 467 Ca -0.12 1.15 -0.24 0.00 0.12 0.00 0.00 56.93 57.84 2x0x s PHE 467 Cb -0.05 -2.53 0.06 0.00 -0.57 0.00 0.00 43.02 39.93 2x0x s PHE 467 CO 0.01 0.42 1.05 1.21 -0.10 0.00 0.00 175.22 177.81 2x0x s ASN 468 N -0.42 6.18 0.32 1.36 3.84 -0.39 -1.50 114.94 124.33 2x0x s ASN 468 Ca 0.29 -0.88 0.25 0.00 0.21 0.00 0.00 52.86 52.72 2x0x s ASN 468 Cb -0.18 -2.45 1.12 0.00 -0.55 0.00 0.00 41.25 39.19 2x0x s ASN 468 CO 0.16 -1.53 1.75 -0.07 -2.79 0.00 0.00 177.10 174.62 2x0x h LEU 469 N 11.75 0.00 -0.04 3.21 3.38 -1.70 -1.11 115.31 130.80 2x0x h LEU 469 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2x0x h LEU 469 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2x0x h LEU 469 CO 1.21 0.00 -0.50 0.61 0.09 0.00 0.00 178.44 179.84 2x0x n GLY 470 N -0.35 -1.19 0.36 0.83 0.00 -1.26 -4.12 105.19 99.46 2x0x n GLY 470 Ca 0.01 -0.36 0.09 0.00 0.00 0.00 0.00 46.02 45.76 2x0x n GLY 470 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x0x n ALA 471 N -1.44 3.50 -2.80 4.61 0.00 -0.43 -4.95 120.51 119.01 2x0x n ALA 471 Ca 0.06 -0.57 -0.34 0.00 0.00 0.00 0.00 53.44 52.58 2x0x n ALA 471 Cb 0.34 -0.66 -0.05 0.00 0.00 0.00 0.00 19.45 19.07 2x0x n ALA 471 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2x0x s ILE 472 N -2.24 5.35 -0.05 0.00 -4.36 -1.20 -4.88 121.20 113.82 2x0x s ILE 472 Ca 0.14 0.09 -0.00 0.00 -0.26 0.00 0.00 60.65 60.62 2x0x s ILE 472 Cb 0.15 -3.55 -0.26 0.00 1.25 0.00 0.00 42.46 40.05 2x0x s ILE 472 CO 0.52 0.38 0.65 0.78 0.24 0.00 0.00 174.94 177.51 2x0x h ASN 473 N 4.02 0.30 -5.24 4.36 2.35 -1.92 -3.48 115.58 115.97 2x0x h ASN 473 Ca -0.50 -0.54 -0.09 0.00 -0.55 0.00 0.00 56.30 54.62 2x0x h ASN 473 Cb 1.20 -0.10 -0.12 0.00 0.05 0.00 0.00 38.32 39.35 2x0x h ASN 473 CO 0.66 1.47 -0.27 0.54 -1.65 0.00 0.00 177.43 178.18 2x0x s ASN 474 N -6.78 -0.00 0.52 5.81 2.20 -1.26 -5.06 114.94 110.37 2x0x s ASN 474 Ca -0.12 -0.83 0.27 0.00 -0.94 0.00 0.00 52.86 51.24 2x0x s ASN 474 Cb 0.07 0.46 1.46 0.00 -2.00 0.00 0.00 41.25 41.23 2x0x s ASN 474 CO 0.82 -0.92 2.08 -0.07 -2.94 0.00 0.00 177.10 176.07 2x0x h LEU 475 N 2.49 0.00 -0.56 3.54 3.38 -2.00 -2.13 115.31 120.02 2x0x h LEU 475 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 2x0x h LEU 475 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 2x0x h LEU 475 CO 0.46 0.11 0.00 0.44 0.09 0.00 0.00 178.44 179.55 2x0x h ASP 476 N 0.00 0.00 -0.23 -0.43 3.32 -1.98 -2.02 116.42 115.08 2x0x h ASP 476 Ca -0.00 0.00 0.07 0.00 0.02 0.00 0.00 57.03 57.12 2x0x h ASP 476 Cb 0.30 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 2x0x h ASP 476 CO 0.01 0.00 0.27 -0.33 -1.72 0.00 0.00 179.24 177.47 2x0x h GLU 477 N 0.00 0.00 0.00 3.56 5.08 -1.81 -2.29 114.58 119.12 2x0x h GLU 477 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2x0x h GLU 477 Cb 0.69 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.94 2x0x h GLU 477 CO 0.00 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.29 2x0x n LEU 478 N -3.72 0.60 0.19 1.33 4.77 -0.76 -2.74 117.00 116.66 2x0x n LEU 478 Ca 0.03 0.69 -0.14 0.00 -0.03 0.00 0.00 56.01 56.56 2x0x n LEU 478 Cb 0.40 -0.67 -0.08 0.00 -2.33 0.00 0.00 43.42 40.74 2x0x n LEU 478 CO 0.27 -0.70 0.62 -0.08 -1.33 0.00 0.00 177.39 176.17 2x0x h GLU 479 N 0.00 -0.44 -0.48 3.23 4.81 -1.62 -0.89 114.58 119.19 2x0x h GLU 479 Ca 0.00 0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.20 2x0x h GLU 479 Cb 0.22 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.68 2x0x h GLU 479 CO 0.00 -0.17 0.08 0.93 -0.73 0.00 0.00 179.01 179.12 2x0x h GLU 480 N -0.67 0.80 -0.62 1.92 3.07 -1.74 -2.62 114.58 114.71 2x0x h GLU 480 Ca -0.05 -0.21 -0.01 0.00 -0.50 0.00 0.00 59.36 58.59 2x0x h GLU 480 Cb 0.48 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.26 2x0x h GLU 480 CO 0.08 0.80 0.33 -0.07 -1.40 0.00 0.00 179.01 178.75 2x0x h LEU 481 N 0.67 0.78 -0.71 1.33 3.38 -1.52 -1.23 115.31 118.01 2x0x h LEU 481 Ca 0.15 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 2x0x h LEU 481 Cb 0.39 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2x0x h LEU 481 CO 0.01 0.65 0.37 0.00 0.09 0.00 0.00 178.44 179.56 2x0x h ALA 482 N 1.16 0.91 0.01 1.53 0.00 -1.13 0.54 119.26 122.27 2x0x h ALA 482 Ca 0.22 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.02 2x0x h ALA 482 Cb 0.05 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2x0x h ALA 482 CO -0.03 0.45 -0.11 0.82 0.00 0.00 0.00 179.25 180.37 2x0x h ILE 483 N 0.98 0.72 0.17 0.00 2.04 -1.10 -1.12 117.51 119.20 2x0x h ILE 483 Ca 0.25 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.10 2x0x h ILE 483 Cb 0.08 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 2x0x h ILE 483 CO -0.04 0.00 -0.08 -0.07 0.00 0.00 0.00 178.15 177.96 2x0x h LEU 484 N -0.19 -0.19 -0.39 1.44 -0.00 -0.85 -2.37 115.31 112.76 2x0x h LEU 484 Ca 0.04 -0.01 -0.04 0.00 -0.00 0.00 0.00 57.88 57.87 2x0x h LEU 484 Cb 0.24 0.05 -0.02 0.00 -0.00 0.00 0.00 40.66 40.93 2x0x h LEU 484 CO -0.10 -0.11 0.09 0.00 -0.00 0.00 0.00 178.44 178.31 2x0x h ALA 485 N 0.58 0.51 -0.44 1.53 0.00 -0.86 -0.70 119.26 119.88 2x0x h ALA 485 Ca -0.02 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 2x0x h ALA 485 Cb 0.19 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2x0x h ALA 485 CO 0.04 0.18 0.12 0.28 0.00 0.00 0.00 179.25 179.87 2x0x h VAL 486 N 0.48 1.23 -0.44 0.00 2.07 -1.25 -1.93 116.25 116.41 2x0x h VAL 486 Ca 0.12 -0.77 -0.12 0.00 0.82 0.00 0.00 66.70 66.75 2x0x h VAL 486 Cb 0.31 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 2x0x h VAL 486 CO 0.00 0.27 -0.22 0.03 0.02 0.00 0.00 177.57 177.68 2x0x h ARG 487 N 0.57 0.89 -0.17 1.57 3.08 -1.32 -1.08 114.38 117.93 2x0x h ARG 487 Ca 0.14 -0.37 -0.01 0.00 0.07 0.00 0.00 59.98 59.81 2x0x h ARG 487 Cb 0.29 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 2x0x h ARG 487 CO -0.00 1.02 0.07 0.00 -1.07 0.00 0.00 179.97 179.98 2x0x h ALA 488 N 0.97 0.22 -0.37 0.04 0.00 -1.03 -1.72 119.26 117.37 2x0x h ALA 488 Ca 0.10 -0.11 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 2x0x h ALA 488 Cb 0.76 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2x0x h ALA 488 CO 0.06 -0.19 -0.37 -0.07 0.00 0.00 0.00 179.25 178.68 2x0x h LEU 489 N 0.12 0.94 -0.96 0.00 3.38 -1.35 -2.10 115.31 115.34 2x0x h LEU 489 Ca 0.06 -0.42 -0.03 0.00 0.09 0.00 0.00 57.88 57.58 2x0x h LEU 489 Cb 0.18 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 2x0x h LEU 489 CO -0.00 1.21 0.39 -0.78 0.09 0.00 0.00 178.44 179.34 2x0x h ASP 490 N 0.73 1.02 -0.53 -0.43 3.58 -1.20 -2.22 116.42 117.38 2x0x h ASP 490 Ca 0.06 -0.11 -0.02 0.00 0.42 0.00 0.00 57.03 57.38 2x0x h ASP 490 Cb 0.95 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.72 2x0x h ASP 490 CO 0.09 0.86 0.26 0.00 -2.88 0.00 0.00 179.24 177.56 2x0x h ALA 491 N 1.30 0.68 -0.92 -0.78 0.00 -1.15 -2.92 119.26 115.48 2x0x h ALA 491 Ca 0.27 -0.12 0.13 0.00 0.00 0.00 0.00 54.91 55.19 2x0x h ALA 491 Cb 0.10 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 17.61 2x0x h ALA 491 CO -0.04 0.25 0.59 1.25 0.00 0.00 0.00 179.25 181.30 2x0x h LEU 492 N 0.71 0.74 -1.18 0.00 5.85 -0.83 -1.57 115.31 119.03 2x0x h LEU 492 Ca 0.18 0.04 0.15 0.00 0.84 0.00 0.00 57.88 59.09 2x0x h LEU 492 Cb 0.12 -0.11 -0.08 0.00 0.37 0.00 0.00 40.66 40.96 2x0x h LEU 492 CO -0.02 0.39 0.60 -0.07 -0.34 0.00 0.00 178.44 178.99 2x0x h LEU 493 N 0.79 0.74 0.00 2.25 3.38 -1.21 0.35 115.31 121.61 2x0x h LEU 493 Ca 0.46 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.48 2x0x h LEU 493 Cb 0.62 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2x0x h LEU 493 CO -0.22 0.36 -0.38 0.44 0.09 0.00 0.00 178.44 178.73 2x0x h ASP 494 N 0.77 0.00 0.13 -0.43 3.32 -1.38 -3.35 116.42 115.47 2x0x h ASP 494 Ca 0.48 -0.05 -0.26 0.00 0.02 0.00 0.00 57.03 57.23 2x0x h ASP 494 Cb 0.72 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.27 2x0x h ASP 494 CO -0.25 0.02 -1.27 0.22 -1.72 0.00 0.00 179.24 176.25 2x0x h TYR 495 N 0.00 0.50 -4.33 4.55 3.20 -0.76 -3.48 116.97 116.65 2x0x h TYR 495 Ca 0.00 -0.37 -0.51 0.00 3.14 0.00 0.00 58.73 60.99 2x0x h TYR 495 Cb 0.89 -0.02 0.11 0.00 1.54 0.00 0.00 36.73 39.25 2x0x h TYR 495 CO 0.00 1.49 0.35 1.14 -1.64 0.00 0.00 178.16 179.51 2x0x s GLN 496 N -2.47 2.72 0.48 1.82 -2.07 -0.04 -4.97 119.66 115.13 2x0x s GLN 496 Ca -0.18 1.03 -0.06 0.00 -1.82 0.00 0.00 55.36 54.34 2x0x s GLN 496 Cb 0.03 -1.96 -0.04 0.00 -1.09 0.00 0.00 33.01 29.96 2x0x s GLN 496 CO 0.79 -1.27 0.79 -0.51 -1.32 0.00 0.00 175.29 173.77 2x0x s ASP 497 N -3.64 6.28 -0.28 12.60 1.01 0.06 -5.01 116.67 127.69 2x0x s ASP 497 Ca 0.59 0.95 -0.01 0.00 0.71 0.00 0.00 52.55 54.79 2x0x s ASP 497 Cb -0.15 -2.26 0.09 0.00 1.01 0.00 0.00 42.92 41.61 2x0x s ASP 497 CO 0.55 -0.57 0.08 -0.31 0.21 0.00 0.00 175.17 175.12 2x0x s TYR 498 N -2.73 1.54 0.18 4.23 2.02 -1.26 -4.86 117.35 116.48 2x0x s TYR 498 Ca 0.48 -1.52 0.33 0.00 -0.37 0.00 0.00 57.07 55.99 2x0x s TYR 498 Cb -0.10 -1.53 1.40 0.00 -0.40 0.00 0.00 41.96 41.33 2x0x s TYR 498 CO 0.44 -0.81 2.00 -1.00 -1.57 0.00 0.00 175.55 174.61 2x0x h PRO 499 N 8.13 0.00 -4.90 -1.71 0.13 -1.98 -3.43 132.00 128.24 2x0x h PRO 499 Ca -0.15 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.36 2x0x h PRO 499 Cb 1.04 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.82 2x0x h PRO 499 CO 0.44 0.04 -0.85 0.42 -0.23 0.00 0.00 178.00 177.83 2x0x s ILE 500 N -3.75 1.72 0.26 -3.56 -1.09 -1.26 -5.05 121.20 108.47 2x0x s ILE 500 Ca 0.00 -0.77 -0.04 0.00 -2.23 0.00 0.00 60.65 57.62 2x0x s ILE 500 Cb 0.10 -1.56 0.27 0.00 -1.58 0.00 0.00 42.46 39.69 2x0x s ILE 500 CO 0.55 0.48 1.66 -0.65 -1.23 0.00 0.00 174.94 175.75 2x0x h PRO 501 N 7.49 0.19 0.00 2.79 0.11 -1.82 -1.77 132.00 139.00 2x0x h PRO 501 Ca -0.33 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.76 2x0x h PRO 501 Cb 1.17 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 2x0x h PRO 501 CO 0.52 0.13 -0.03 0.00 -0.21 0.00 0.00 178.00 178.41 2x0x h ALA 502 N 1.69 1.38 0.10 -0.75 0.00 -1.82 -1.52 119.26 118.33 2x0x h ALA 502 Ca 0.45 -0.03 -0.29 0.00 0.00 0.00 0.00 54.91 55.04 2x0x h ALA 502 Cb 0.82 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2x0x h ALA 502 CO -0.60 0.04 -1.41 0.00 0.00 0.00 0.00 179.25 177.28 2x0x h ALA 503 N 1.97 0.26 -0.88 0.00 0.00 -1.50 -0.29 119.26 118.82 2x0x h ALA 503 Ca -0.00 -1.05 -0.01 0.00 0.00 0.00 0.00 54.91 53.85 2x0x h ALA 503 Cb 0.10 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 2x0x h ALA 503 CO 0.00 1.13 0.51 -0.22 0.00 0.00 0.00 179.25 180.67 2x0x h LYS 504 N 0.06 1.21 -0.63 0.00 3.64 -1.23 -1.44 116.57 118.17 2x0x h LYS 504 Ca -0.19 -0.12 -0.00 0.00 -1.27 0.00 0.00 60.65 59.06 2x0x h LYS 504 Cb 1.98 -0.25 -0.03 0.00 -0.41 0.00 0.00 32.23 33.52 2x0x h LYS 504 CO 0.16 0.86 0.39 0.00 -2.27 0.00 0.00 179.45 178.59 2x0x h ARG 505 N 1.22 0.85 -0.09 1.90 3.08 -1.34 0.18 114.38 120.18 2x0x h ARG 505 Ca 0.31 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.29 2x0x h ARG 505 Cb -0.01 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 29.85 2x0x h ARG 505 CO -0.05 0.60 0.05 0.78 -1.07 0.00 0.00 179.97 180.28 2x0x h GLY 506 N 0.86 0.14 1.15 0.04 0.00 -1.32 -0.63 103.07 103.31 2x0x h GLY 506 Ca 0.23 -0.07 -0.18 0.00 0.00 0.00 0.00 47.33 47.31 2x0x h GLY 506 CO -0.04 0.06 -0.53 0.00 0.00 0.00 0.00 176.54 176.03 2x0x h ALA 507 N 0.94 0.48 0.04 3.60 0.00 -0.96 -2.07 119.26 121.29 2x0x h ALA 507 Ca 0.03 -0.51 -0.23 0.00 0.00 0.00 0.00 54.91 54.20 2x0x h ALA 507 Cb 0.10 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2x0x h ALA 507 CO -0.00 0.68 -1.02 0.52 0.00 0.00 0.00 179.25 179.43 2x0x h MET 508 N 0.69 0.31 -0.17 0.00 2.07 -0.71 -0.37 114.93 116.74 2x0x h MET 508 Ca 0.02 -0.39 -0.14 0.00 -2.07 0.00 0.00 59.70 57.12 2x0x h MET 508 Cb 1.14 0.12 0.00 0.00 -1.87 0.00 0.00 31.60 30.99 2x0x h MET 508 CO 0.12 1.10 -0.44 0.78 1.07 0.00 0.00 176.91 179.54 2x0x h GLY 509 N 1.51 0.67 0.00 8.32 0.00 -1.12 -3.39 103.07 109.05 2x0x h GLY 509 Ca -0.09 -0.83 -0.06 0.00 0.00 0.00 0.00 47.33 46.36 2x0x h GLY 509 CO 0.17 0.74 -1.47 0.54 0.00 0.00 0.00 176.54 176.53 2x0x n ARG 510 N -4.22 1.15 -3.86 4.80 1.74 -0.78 -0.34 116.66 115.15 2x0x n ARG 510 Ca -0.06 -0.05 -0.26 0.00 -0.77 0.00 0.00 57.85 56.70 2x0x n ARG 510 Cb 0.56 -1.21 0.02 0.00 -1.02 0.00 0.00 32.46 30.81 2x0x n ARG 510 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2x0x n ARG 511 N -1.99 -4.70 -2.46 5.56 1.74 -0.15 -0.86 116.66 113.80 2x0x n ARG 511 Ca -0.06 0.55 -0.41 0.00 -0.77 0.00 0.00 57.85 57.16 2x0x n ARG 511 Cb 0.43 -5.16 -0.03 0.00 -1.02 0.00 0.00 32.46 26.68 2x0x n ARG 511 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2x0x s THR 512 N -3.57 3.93 0.29 0.55 -4.23 -1.26 -3.99 115.64 107.35 2x0x s THR 512 Ca 0.29 1.51 0.11 0.00 -1.18 0.00 0.00 61.69 62.42 2x0x s THR 512 Cb -0.15 -3.97 -0.05 0.00 1.34 0.00 0.00 72.50 69.68 2x0x s THR 512 CO 0.84 0.19 -0.13 -0.76 -0.54 0.00 0.00 174.62 174.22 2x0x s LEU 513 N 0.32 2.76 -0.34 4.79 1.43 -0.61 -3.51 118.68 123.51 2x0x s LEU 513 Ca 0.54 -0.96 0.01 0.00 -1.03 0.00 0.00 54.13 52.69 2x0x s LEU 513 Cb -0.30 -1.24 0.14 0.00 0.03 0.00 0.00 46.19 44.83 2x0x s LEU 513 CO 0.32 -0.02 0.30 -0.83 0.23 0.00 0.00 176.35 176.35 2x0x s GLY 514 N -3.57 0.21 -0.17 -3.19 0.00 -0.34 -3.54 107.32 96.72 2x0x s GLY 514 Ca 0.31 -1.07 -0.06 0.00 0.00 0.00 0.00 44.72 43.90 2x0x s GLY 514 CO 0.17 2.50 0.03 -0.42 0.00 0.00 0.00 173.10 175.38 2x0x s ILE 515 N 1.60 4.52 0.00 0.90 1.01 0.13 -2.63 121.20 126.73 2x0x s ILE 515 Ca 0.15 -0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.67 2x0x s ILE 515 Cb -0.17 -3.02 0.00 0.00 0.01 0.00 0.00 42.46 39.28 2x0x s ILE 515 CO -0.12 0.48 0.00 0.61 0.00 0.00 0.00 174.94 175.91 2x0x n GLY 516 N 3.47 5.45 3.20 6.18 0.00 0.99 -2.34 105.19 122.14 2x0x n GLY 516 Ca -0.17 -1.77 -0.12 0.00 0.00 0.00 0.00 46.02 43.96 2x0x n GLY 516 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2x0x s VAL 517 N 1.73 0.73 0.24 1.61 -7.23 -1.26 -0.72 120.40 115.50 2x0x s VAL 517 Ca 0.00 -1.96 0.01 0.00 -1.81 0.00 0.00 61.98 58.22 2x0x s VAL 517 Cb 0.00 -1.82 -0.05 0.00 0.56 0.00 0.00 36.38 35.07 2x0x s VAL 517 CO 0.00 -0.75 0.09 0.27 -0.31 0.00 0.00 175.10 174.40 2x0x s ILE 518 N -3.61 0.52 -1.36 -0.62 -4.36 -0.56 -4.23 121.20 106.99 2x0x s ILE 518 Ca 0.16 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.55 2x0x s ILE 518 Cb 0.05 -2.57 0.00 0.00 1.25 0.00 0.00 42.46 41.20 2x0x s ILE 518 CO -0.02 -0.06 0.00 0.59 0.24 0.00 0.00 174.94 175.70 2x0x n ASN 519 N -0.42 -4.54 0.11 4.36 3.02 -0.12 -2.18 115.26 115.49 2x0x n ASN 519 Ca -0.01 0.15 -0.13 0.00 -0.03 0.00 0.00 54.58 54.56 2x0x n ASN 519 Cb 0.66 -3.51 -0.08 0.00 -0.61 0.00 0.00 39.78 36.24 2x0x n ASN 519 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 2x0x h PHE 520 N 0.00 -0.20 -0.73 3.10 3.57 -1.71 -1.37 116.94 119.61 2x0x h PHE 520 Ca -0.32 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.28 2x0x h PHE 520 Cb 1.11 0.07 -0.08 0.00 2.79 0.00 0.00 35.95 39.84 2x0x h PHE 520 CO 0.39 -0.03 0.35 0.00 -2.23 0.00 0.00 178.31 176.79 2x0x h ALA 521 N 0.49 1.02 -0.01 2.41 0.00 -1.80 0.65 119.26 122.02 2x0x h ALA 521 Ca -0.02 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2x0x h ALA 521 Cb 0.26 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2x0x h ALA 521 CO 0.04 -0.08 0.00 -0.92 0.00 0.00 0.00 179.25 178.29 2x0x h TYR 522 N 0.57 0.01 -0.54 0.00 3.20 -1.92 -0.63 116.97 117.67 2x0x h TYR 522 Ca 0.37 -0.00 0.11 0.00 3.14 0.00 0.00 58.73 62.35 2x0x h TYR 522 Cb 0.44 -0.00 -0.11 0.00 1.54 0.00 0.00 36.73 38.60 2x0x h TYR 522 CO -0.12 0.08 -0.20 -0.92 -1.64 0.00 0.00 178.16 175.36 2x0x h TYR 523 N -0.06 -0.49 -0.55 -3.82 3.20 -0.75 0.24 116.97 114.73 2x0x h TYR 523 Ca 0.00 0.06 -0.04 0.00 3.14 0.00 0.00 58.73 61.89 2x0x h TYR 523 Cb 0.07 0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 2x0x h TYR 523 CO -0.05 -0.29 0.21 -0.07 -1.64 0.00 0.00 178.16 176.31 2x0x h LEU 524 N -0.07 0.78 -0.48 2.82 3.38 -0.75 -2.55 115.31 118.44 2x0x h LEU 524 Ca 0.25 -0.18 0.06 0.00 0.09 0.00 0.00 57.88 58.10 2x0x h LEU 524 Cb 0.46 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 2x0x h LEU 524 CO -0.59 0.75 0.18 0.00 0.09 0.00 0.00 178.44 178.86 2x0x h ALA 525 N 1.06 0.59 0.00 1.53 0.00 -0.34 0.00 119.26 122.10 2x0x h ALA 525 Ca 0.18 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2x0x h ALA 525 Cb 0.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2x0x h ALA 525 CO -0.01 -0.21 0.00 1.57 0.00 0.00 0.00 179.25 180.60 2x0x h LYS 526 N 0.36 0.00 -0.45 0.00 2.10 -0.89 -2.06 116.57 115.63 2x0x h LYS 526 Ca 0.23 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.88 2x0x h LYS 526 Cb 0.22 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.55 2x0x h LYS 526 CO -0.22 0.00 0.00 0.72 -2.00 0.00 0.00 179.45 177.95 2x0x n HIS 527 N -2.64 0.60 -2.49 0.07 8.25 -0.83 -4.96 115.22 113.23 2x0x n HIS 527 Ca 0.03 -0.30 -0.16 0.00 -0.26 0.00 0.00 57.72 57.02 2x0x n HIS 527 Cb 0.34 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.45 2x0x n HIS 527 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2x0x n GLY 528 N 1.31 -0.27 3.75 -1.41 0.00 -0.78 -5.03 105.19 102.77 2x0x n GLY 528 Ca 0.17 -0.17 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 2x0x n GLY 528 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x0x s LYS 529 N -5.01 2.18 0.12 1.61 -0.14 -0.08 -5.02 119.74 113.40 2x0x s LYS 529 Ca 0.08 -2.02 -0.01 0.00 -1.36 0.00 0.00 55.97 52.66 2x0x s LYS 529 Cb -0.03 -1.86 -0.04 0.00 -1.68 0.00 0.00 37.83 34.21 2x0x s LYS 529 CO 0.10 -0.23 0.04 1.03 -0.76 0.00 0.00 175.35 175.52 2x0x s ARG 530 N -3.93 0.88 0.03 1.68 0.52 -1.26 -4.17 118.95 112.70 2x0x s ARG 530 Ca 0.32 -1.40 -0.17 0.00 -0.52 0.00 0.00 55.73 53.96 2x0x s ARG 530 Cb 0.03 0.21 -0.27 0.00 0.52 0.00 0.00 34.95 35.45 2x0x s ARG 530 CO 0.18 -0.22 1.10 1.88 0.02 0.00 0.00 175.30 178.25 2x0x h TYR 531 N 2.91 0.87 0.00 -0.53 -1.99 -1.92 -3.27 116.97 113.03 2x0x h TYR 531 Ca -0.35 -0.52 0.00 0.00 2.00 0.00 0.00 58.73 59.86 2x0x h TYR 531 Cb 1.19 -0.08 0.00 0.00 2.00 0.00 0.00 36.73 39.84 2x0x h TYR 531 CO 0.46 1.36 -0.52 -1.13 -0.00 0.00 0.00 178.16 178.33 2x0x n SER 532 N -3.95 0.52 -0.34 3.88 3.41 -1.26 -3.01 113.62 112.86 2x0x n SER 532 Ca -0.12 -0.12 0.05 0.00 -0.26 0.00 0.00 58.87 58.41 2x0x n SER 532 Cb 0.87 0.21 0.03 0.00 -0.26 0.00 0.00 64.21 65.06 2x0x n SER 532 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2x0x n ASP 533 N -1.65 1.66 0.00 4.04 5.68 -1.26 -4.05 116.55 120.96 2x0x n ASP 533 Ca 0.05 -1.33 0.00 0.00 -0.50 0.00 0.00 54.79 53.01 2x0x n ASP 533 Cb 0.36 0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.44 2x0x n ASP 533 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2x0x n GLY 534 N 0.60 0.66 0.14 6.12 0.00 -1.26 -4.93 105.19 106.52 2x0x n GLY 534 Ca 0.05 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.20 2x0x n GLY 534 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2x0x h SER 535 N 0.00 0.00 -0.19 1.61 4.64 -1.89 -3.15 113.55 114.56 2x0x h SER 535 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2x0x h SER 535 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2x0x h SER 535 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 2x0x n ALA 536 N -1.85 2.43 0.07 5.18 0.00 -1.23 -4.69 120.51 120.42 2x0x n ALA 536 Ca 0.04 -0.83 -0.12 0.00 0.00 0.00 0.00 53.44 52.54 2x0x n ALA 536 Cb 0.41 -0.74 -0.06 0.00 0.00 0.00 0.00 19.45 19.06 2x0x n ALA 536 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2x0x h ASN 537 N 4.03 -0.31 -0.02 0.00 4.21 -1.88 0.22 115.58 121.82 2x0x h ASN 537 Ca 0.00 0.04 -0.18 0.00 1.21 0.00 0.00 56.30 57.37 2x0x h ASN 537 Cb 0.89 0.12 -0.00 0.00 -1.12 0.00 0.00 38.32 38.21 2x0x h ASN 537 CO 0.00 -0.17 -0.63 0.78 -1.29 0.00 0.00 177.43 176.13 2x0x h ASN 538 N -0.22 0.72 -0.60 5.81 2.35 -1.85 -1.64 115.58 120.16 2x0x h ASN 538 Ca 0.03 -0.42 -0.03 0.00 -0.55 0.00 0.00 56.30 55.33 2x0x h ASN 538 Cb 0.24 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.37 2x0x h ASN 538 CO -0.08 1.17 0.25 0.25 -1.65 0.00 0.00 177.43 177.38 2x0x h LEU 539 N 0.47 0.81 -0.27 1.61 5.85 -1.84 -1.24 115.31 120.69 2x0x h LEU 539 Ca -0.01 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 2x0x h LEU 539 Cb 1.20 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.01 2x0x h LEU 539 CO 0.12 0.75 0.14 0.74 -0.34 0.00 0.00 178.44 179.85 2x0x h THR 540 N 0.82 1.13 -0.29 1.05 2.02 -0.86 -0.20 112.91 116.59 2x0x h THR 540 Ca 0.20 -0.35 0.06 0.00 0.77 0.00 0.00 66.41 67.09 2x0x h THR 540 Cb 0.18 0.87 -0.05 0.00 -1.74 0.00 0.00 68.15 67.40 2x0x h THR 540 CO -0.02 0.13 -0.06 -0.74 0.37 0.00 0.00 175.52 175.20 2x0x h HIS 541 N 0.32 -0.12 -0.27 3.16 -0.00 -1.10 -1.11 115.15 116.03 2x0x h HIS 541 Ca 0.10 0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.49 2x0x h HIS 541 Cb 0.08 0.10 -0.01 0.00 -0.00 0.00 0.00 27.41 27.57 2x0x h HIS 541 CO -0.03 -0.11 0.15 -0.22 -0.00 0.00 0.00 177.93 177.72 2x0x h LYS 542 N 0.02 0.37 -0.59 5.26 3.64 -1.14 -1.18 116.57 122.95 2x0x h LYS 542 Ca 0.14 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 2x0x h LYS 542 Cb 0.21 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.92 2x0x h LYS 542 CO -0.28 0.32 0.34 1.15 -2.27 0.00 0.00 179.45 178.71 2x0x h THR 543 N 0.32 1.18 0.00 1.00 2.02 -0.72 -1.71 112.91 115.00 2x0x h THR 543 Ca 0.09 -0.42 -0.07 0.00 0.77 0.00 0.00 66.41 66.78 2x0x h THR 543 Cb 0.06 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 2x0x h THR 543 CO -0.02 0.19 -0.74 -0.26 0.37 0.00 0.00 175.52 175.06 2x0x h PHE 544 N 0.79 0.00 0.32 3.16 0.04 -1.21 -1.49 116.94 118.56 2x0x h PHE 544 Ca 0.21 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.97 2x0x h PHE 544 Cb 0.01 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.16 2x0x h PHE 544 CO -0.02 0.26 -0.17 1.49 -0.60 0.00 0.00 178.31 179.27 2x0x h GLU 545 N 0.00 -0.44 -0.51 1.51 4.81 -1.10 -1.80 114.58 117.06 2x0x h GLU 545 Ca -0.04 0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.27 2x0x h GLU 545 Cb 1.23 0.10 -0.05 0.00 0.63 0.00 0.00 28.75 30.67 2x0x h GLU 545 CO 0.03 -0.29 0.24 0.00 -0.73 0.00 0.00 179.01 178.26 2x0x h ALA 546 N 0.22 0.65 0.24 2.92 0.00 -1.18 0.36 119.26 122.46 2x0x h ALA 546 Ca -0.04 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2x0x h ALA 546 Cb 0.36 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2x0x h ALA 546 CO 0.06 -0.11 -0.17 0.82 0.00 0.00 0.00 179.25 179.85 2x0x h ILE 547 N 0.48 0.65 -0.46 0.00 2.04 -1.24 -1.84 117.51 117.12 2x0x h ILE 547 Ca 0.23 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.97 2x0x h ILE 547 Cb 0.16 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 2x0x h ILE 547 CO -0.18 0.00 -0.20 -0.61 0.00 0.00 0.00 178.15 177.17 2x0x h GLN 548 N -0.40 0.95 0.03 2.37 5.75 -1.16 -1.38 115.11 121.26 2x0x h GLN 548 Ca -0.02 -0.40 0.02 0.00 -0.15 0.00 0.00 58.65 58.10 2x0x h GLN 548 Cb 0.35 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.84 2x0x h GLN 548 CO 0.01 1.07 -0.15 -0.92 -2.65 0.00 0.00 178.83 176.18 2x0x h TYR 549 N 0.79 -0.40 -0.02 3.99 3.20 -0.88 -0.92 116.97 122.74 2x0x h TYR 549 Ca 0.11 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.88 2x0x h TYR 549 Cb 0.77 0.17 -0.01 0.00 1.54 0.00 0.00 36.73 39.20 2x0x h TYR 549 CO 0.05 -0.23 -0.48 1.88 -1.64 0.00 0.00 178.16 177.74 2x0x h TYR 550 N -0.27 0.06 -0.09 -3.82 0.05 -1.30 -1.02 116.97 110.58 2x0x h TYR 550 Ca 0.04 -0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.80 2x0x h TYR 550 Cb 0.32 -0.01 -0.00 0.00 1.01 0.00 0.00 36.73 38.05 2x0x h TYR 550 CO -0.20 0.52 0.01 -0.07 -1.05 0.00 0.00 178.16 177.38 2x0x h LEU 551 N 0.04 0.14 -0.68 3.88 3.38 -1.06 -1.10 115.31 119.90 2x0x h LEU 551 Ca -0.00 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.73 2x0x h LEU 551 Cb 0.87 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.54 2x0x h LEU 551 CO 0.06 0.36 0.43 -0.07 0.09 0.00 0.00 178.44 179.32 2x0x h LEU 552 N -0.09 0.72 -0.65 1.67 3.38 -1.05 -1.69 115.31 117.60 2x0x h LEU 552 Ca 0.03 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2x0x h LEU 552 Cb 0.28 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 2x0x h LEU 552 CO 0.00 0.51 0.33 0.50 0.09 0.00 0.00 178.44 179.87 2x0x h LYS 553 N 0.86 0.93 -0.51 1.13 3.64 -1.14 0.26 116.57 121.74 2x0x h LYS 553 Ca 0.27 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 59.47 2x0x h LYS 553 Cb -0.02 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.61 2x0x h LYS 553 CO -0.09 0.73 0.14 0.00 -2.27 0.00 0.00 179.45 177.96 2x0x h ALA 554 N 1.15 0.67 -0.02 5.00 0.00 -0.97 -1.22 119.26 123.87 2x0x h ALA 554 Ca 0.23 -0.20 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 2x0x h ALA 554 Cb 0.09 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2x0x h ALA 554 CO -0.03 0.34 -0.70 1.03 0.00 0.00 0.00 179.25 179.89 2x0x h SER 555 N 0.70 0.13 -0.21 0.00 0.87 -0.99 -0.94 113.55 113.11 2x0x h SER 555 Ca 0.16 -0.09 -0.04 0.00 -1.23 0.00 0.00 61.79 60.59 2x0x h SER 555 Cb 0.30 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 2x0x h SER 555 CO -0.00 0.79 -0.04 -1.13 -0.53 0.00 0.00 176.83 175.91 2x0x h ASN 556 N 0.07 0.39 -0.48 6.23 -0.00 -0.38 -1.22 115.58 120.19 2x0x h ASN 556 Ca -0.01 -0.35 -0.06 0.00 -0.00 0.00 0.00 56.30 55.87 2x0x h ASN 556 Cb 1.24 -0.11 -0.02 0.00 -0.00 0.00 0.00 38.32 39.42 2x0x h ASN 556 CO 0.10 0.66 0.10 -0.33 -0.00 0.00 0.00 177.43 177.96 2x0x h GLU 557 N 0.12 0.85 -0.47 6.67 4.39 -1.18 -1.94 114.58 123.03 2x0x h GLU 557 Ca 0.05 -0.19 -0.08 0.00 0.34 0.00 0.00 59.36 59.48 2x0x h GLU 557 Cb 0.48 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.99 2x0x h GLU 557 CO 0.02 0.78 -0.04 1.25 -1.16 0.00 0.00 179.01 179.86 2x0x h LEU 558 N 0.81 0.78 -0.98 1.33 5.85 -1.10 -1.93 115.31 120.07 2x0x h LEU 558 Ca 0.17 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 2x0x h LEU 558 Cb 0.34 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 2x0x h LEU 558 CO 0.00 0.87 0.48 0.00 -0.34 0.00 0.00 178.44 179.46 2x0x h ALA 559 N 1.21 1.22 -0.45 1.25 0.00 -0.81 0.42 119.26 122.10 2x0x h ALA 559 Ca 0.14 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2x0x h ALA 559 Cb 0.51 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 2x0x h ALA 559 CO 0.03 0.64 0.27 0.87 0.00 0.00 0.00 179.25 181.05 2x0x h LYS 560 N 1.21 0.53 -0.15 0.00 1.57 -1.08 0.19 116.57 118.83 2x0x h LYS 560 Ca 0.31 -0.03 -0.21 0.00 -1.87 0.00 0.00 60.65 58.84 2x0x h LYS 560 Cb 0.01 -0.12 0.01 0.00 0.08 0.00 0.00 32.23 32.21 2x0x h LYS 560 CO -0.05 0.35 -0.75 1.49 -0.57 0.00 0.00 179.45 179.92 2x0x h GLU 561 N 0.54 0.74 0.00 3.15 4.81 -0.95 -3.40 114.58 119.47 2x0x h GLU 561 Ca 0.18 -0.59 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 2x0x h GLU 561 Cb -0.00 0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.50 2x0x h GLU 561 CO -0.07 1.20 0.00 1.04 -0.73 0.00 0.00 179.01 180.45 2x0x n GLN 562 N -3.93 3.84 0.00 1.92 6.02 0.10 -5.10 117.38 120.24 2x0x n GLN 562 Ca -0.07 -0.03 0.00 0.00 -0.01 0.00 0.00 57.00 56.90 2x0x n GLN 562 Cb 0.73 -0.35 0.00 0.00 1.02 0.00 0.00 30.24 31.64 2x0x n GLN 562 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2x0x n GLY 563 N 0.56 2.32 3.62 1.08 0.00 0.67 -5.01 105.19 108.43 2x0x n GLY 563 Ca 0.00 -1.56 -0.30 0.00 0.00 0.00 0.00 46.02 44.17 2x0x n GLY 563 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x0x s ALA 564 N -0.96 0.79 0.48 4.61 0.00 -1.24 -4.46 121.76 120.98 2x0x s ALA 564 Ca 0.00 0.14 -0.22 0.00 0.00 0.00 0.00 51.96 51.88 2x0x s ALA 564 Cb 0.00 -3.30 -0.07 0.00 0.00 0.00 0.00 23.12 19.75 2x0x s ALA 564 CO 0.00 -3.03 1.17 0.00 0.00 0.00 0.00 175.76 173.90 2x0x h PRO 566 N 1.84 0.47 -0.75 0.00 0.11 -1.74 -0.69 132.00 131.24 2x0x h PRO 566 Ca -0.50 -0.03 -0.33 0.00 0.11 0.00 0.00 66.00 65.26 2x0x h PRO 566 Cb 1.25 -0.11 -0.19 0.00 0.11 0.00 0.00 31.00 32.06 2x0x h PRO 566 CO 0.59 0.31 0.35 0.91 -0.21 0.00 0.00 178.00 179.96 2x0x n TRP 567 N -4.83 2.38 -0.19 0.65 8.01 0.54 -4.56 117.44 119.44 2x0x n TRP 567 Ca 0.27 -1.54 0.21 0.00 -1.31 0.00 0.00 57.50 55.14 2x0x n TRP 567 Cb 0.83 -0.74 0.58 0.00 -2.01 0.00 0.00 31.31 29.97 2x0x n TRP 567 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.69 177.03 2x0x h PHE 568 N 1.60 0.34 0.00 -5.99 3.57 -1.33 -1.72 116.94 113.42 2x0x h PHE 568 Ca 0.40 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.91 2x0x h PHE 568 Cb 2.39 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 41.03 2x0x h PHE 568 CO 1.33 0.10 0.00 0.27 -2.23 0.00 0.00 178.31 177.78 2x0x n ASN 569 N -4.43 0.03 -0.21 0.41 6.94 -1.26 -1.81 115.26 114.93 2x0x n ASN 569 Ca 0.17 0.51 0.13 0.00 -0.02 0.00 0.00 54.58 55.37 2x0x n ASN 569 Cb 0.73 -0.51 0.40 0.00 -2.36 0.00 0.00 39.78 38.04 2x0x n ASN 569 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2x0x n GLU 570 N -1.54 0.74 -3.14 -3.83 1.02 -0.65 -4.93 120.64 108.33 2x0x n GLU 570 Ca 0.02 -0.41 -0.30 0.00 -0.02 0.00 0.00 57.16 56.45 2x0x n GLU 570 Cb 0.11 -1.49 -0.04 0.00 -0.02 0.00 0.00 31.44 30.00 2x0x n GLU 570 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2x0x s THR 571 N -2.54 4.89 0.32 2.62 -4.23 -0.75 -1.77 115.64 114.17 2x0x s THR 571 Ca 0.24 0.41 0.05 0.00 -1.18 0.00 0.00 61.69 61.21 2x0x s THR 571 Cb 0.19 -3.71 0.10 0.00 1.34 0.00 0.00 72.50 70.42 2x0x s THR 571 CO 0.53 -0.36 1.79 0.71 -0.54 0.00 0.00 174.62 176.75 2x0x h THR 572 N 1.38 1.24 -1.00 3.99 1.35 -1.10 -2.89 112.91 115.87 2x0x h THR 572 Ca -0.47 -1.12 0.22 0.00 -0.55 0.00 0.00 66.41 64.49 2x0x h THR 572 Cb 1.18 1.32 -0.11 0.00 -1.73 0.00 0.00 68.15 68.82 2x0x h THR 572 CO 0.65 0.35 0.62 1.88 -0.25 0.00 0.00 175.52 178.78 2x0x h TYR 573 N 0.34 0.93 0.00 4.73 0.05 -1.71 -1.38 116.97 119.93 2x0x h TYR 573 Ca 0.06 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.83 2x0x h TYR 573 Cb 0.57 -0.27 -0.00 0.00 1.01 0.00 0.00 36.73 38.03 2x0x h TYR 573 CO 0.01 0.15 -0.16 0.00 -1.05 0.00 0.00 178.16 177.11 2x0x h ALA 574 N 1.66 1.53 -0.32 3.88 0.00 -1.72 -1.34 119.26 122.96 2x0x h ALA 574 Ca 0.59 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.35 2x0x h ALA 574 Cb 1.13 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2x0x h ALA 574 CO -0.37 0.21 0.00 1.63 0.00 0.00 0.00 179.25 180.72 2x0x n LYS 575 N -4.06 1.82 -1.59 0.00 5.02 -0.58 -4.76 118.16 114.01 2x0x n LYS 575 Ca -0.02 -1.26 -0.11 0.00 -2.02 0.00 0.00 58.31 54.89 2x0x n LYS 575 Cb 0.24 -1.31 -0.04 0.00 -0.02 0.00 0.00 35.03 33.91 2x0x n LYS 575 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2x0x n GLY 576 N 1.09 0.85 3.74 0.72 0.00 -0.50 -5.02 105.19 106.06 2x0x n GLY 576 Ca 0.13 -0.48 -0.36 0.00 0.00 0.00 0.00 46.02 45.31 2x0x n GLY 576 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x0x s ILE 577 N -2.46 5.38 0.27 -0.61 1.01 -0.86 -5.01 121.20 118.92 2x0x s ILE 577 Ca 0.00 0.32 0.11 0.00 0.00 0.00 0.00 60.65 61.08 2x0x s ILE 577 Cb 0.00 -3.52 -0.05 0.00 0.01 0.00 0.00 42.46 38.90 2x0x s ILE 577 CO 0.00 0.43 -0.14 -0.76 0.00 0.00 0.00 174.94 174.47 2x0x s LEU 578 N 0.33 2.78 0.54 2.97 1.43 -1.26 -3.14 118.68 122.34 2x0x s LEU 578 Ca 0.11 -0.90 0.23 0.00 -1.03 0.00 0.00 54.13 52.53 2x0x s LEU 578 Cb -0.12 -1.30 1.41 0.00 0.03 0.00 0.00 46.19 46.21 2x0x s LEU 578 CO 0.00 0.03 2.08 1.55 0.23 0.00 0.00 176.35 180.24 2x0x h PRO 579 N 2.16 0.00 0.00 1.29 0.13 -1.92 0.37 132.00 134.03 2x0x h PRO 579 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2x0x h PRO 579 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2x0x h PRO 579 CO 0.60 0.00 0.00 0.44 -0.23 0.00 0.00 178.00 178.81 2x0x n ILE 580 N -4.32 0.25 -0.04 -3.56 -5.35 -1.26 -2.67 119.36 102.41 2x0x n ILE 580 Ca 0.03 0.06 0.03 0.00 -0.27 0.00 0.00 62.75 62.61 2x0x n ILE 580 Cb 0.35 -0.78 -0.16 0.00 -1.74 0.00 0.00 39.64 37.31 2x0x n ILE 580 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 2x0x n ASP 581 N -1.14 0.24 -0.11 7.28 8.00 0.12 -4.71 116.55 126.22 2x0x n ASP 581 Ca 0.11 0.00 0.01 0.00 0.71 0.00 0.00 54.79 55.62 2x0x n ASP 581 Cb 0.10 1.60 0.02 0.00 -0.02 0.00 0.00 41.12 42.82 2x0x n ASP 581 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2x0x n THR 582 N -2.40 0.39 -1.05 -3.53 -2.24 -1.09 -5.04 114.28 99.33 2x0x n THR 582 Ca -0.14 -0.70 -0.29 0.00 -2.27 0.00 0.00 64.05 60.65 2x0x n THR 582 Cb 0.75 0.83 0.16 0.00 -2.10 0.00 0.00 70.33 69.98 2x0x n THR 582 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2x0x s TYR 583 N -0.51 2.07 -0.13 4.78 -0.85 -1.15 -4.41 117.35 117.14 2x0x s TYR 583 Ca 0.04 1.27 -0.29 0.00 -0.52 0.00 0.00 57.07 57.56 2x0x s TYR 583 Cb 0.02 -3.18 -0.04 0.00 0.38 0.00 0.00 41.96 39.14 2x0x s TYR 583 CO 0.03 -2.73 1.64 0.21 -1.52 0.00 0.00 175.55 173.18 2x0x s LYS 584 N -4.83 4.00 0.54 -3.49 2.47 -1.26 -4.90 119.74 112.27 2x0x s LYS 584 Ca 0.65 1.95 0.30 0.00 -1.56 0.00 0.00 55.97 57.30 2x0x s LYS 584 Cb -0.20 -4.01 1.56 0.00 -1.46 0.00 0.00 37.83 33.72 2x0x s LYS 584 CO 0.58 -1.06 2.10 0.87 0.16 0.00 0.00 175.35 178.01 2x0x h LYS 585 N 10.12 0.00 -0.24 4.03 1.57 -1.91 -1.76 116.57 128.37 2x0x h LYS 585 Ca -0.36 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.49 2x0x h LYS 585 Cb 1.17 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.47 2x0x h LYS 585 CO 0.97 0.09 0.40 -0.44 -0.57 0.00 0.00 179.45 179.90 2x0x h ASP 586 N 0.00 0.00 0.03 0.86 5.19 -1.91 0.32 116.42 120.91 2x0x h ASP 586 Ca -0.00 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2x0x h ASP 586 Cb 0.29 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.80 2x0x h ASP 586 CO 0.01 0.00 -0.01 -0.07 -3.12 0.00 0.00 179.24 176.05 2x0x h LEU 587 N 0.00 0.00 -2.27 1.55 3.38 -1.62 -2.35 115.31 113.99 2x0x h LEU 587 Ca 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2x0x h LEU 587 Cb 0.91 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.66 2x0x h LEU 587 CO -0.00 0.01 -0.05 0.44 0.09 0.00 0.00 178.44 178.93 2x0x h ASP 588 N 0.00 0.00 0.95 -0.43 3.32 -1.15 -2.38 116.42 116.72 2x0x h ASP 588 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2x0x h ASP 588 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 2x0x h ASP 588 CO 0.00 0.05 -0.22 0.35 -1.72 0.00 0.00 179.24 177.70 2x0x n THR 589 N -3.71 0.17 0.07 0.35 -2.24 -0.88 -4.07 114.28 103.97 2x0x n THR 589 Ca -0.02 -0.10 0.01 0.00 -2.27 0.00 0.00 64.05 61.66 2x0x n THR 589 Cb 0.14 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.10 2x0x n THR 589 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 2x0x n ILE 590 N -1.74 0.00 -3.70 2.28 -5.35 -0.91 -5.00 119.36 104.92 2x0x n ILE 590 Ca 0.06 -0.49 -0.14 0.00 -0.27 0.00 0.00 62.75 61.91 2x0x n ILE 590 Cb 0.37 1.02 -0.09 0.00 -1.74 0.00 0.00 39.64 39.21 2x0x n ILE 590 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2x0x s ALA 591 N -0.43 -1.12 -0.01 -1.28 0.00 -1.11 -4.79 121.76 113.01 2x0x s ALA 591 Ca 0.02 1.03 0.01 0.00 0.00 0.00 0.00 51.96 53.02 2x0x s ALA 591 Cb 0.01 -0.44 0.02 0.00 0.00 0.00 0.00 23.12 22.72 2x0x s ALA 591 CO 0.03 -0.25 0.89 0.27 0.00 0.00 0.00 175.76 176.70 2x0x n ASN 592 N 2.17 1.47 -4.68 0.00 0.23 -1.26 -4.61 115.26 108.58 2x0x n ASN 592 Ca -0.16 -1.84 -0.45 0.00 -0.53 0.00 0.00 54.58 51.60 2x0x n ASN 592 Cb 0.57 -0.04 -0.04 0.00 -2.08 0.00 0.00 39.78 38.19 2x0x n ASN 592 CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 2x0x n GLU 593 N -0.43 2.38 -1.77 -3.83 4.07 -1.26 -4.98 120.64 114.82 2x0x n GLU 593 Ca 0.01 0.86 -0.32 0.00 -0.06 0.00 0.00 57.16 57.66 2x0x n GLU 593 Cb 0.36 -2.68 0.04 0.00 -0.06 0.00 0.00 31.44 29.09 2x0x n GLU 593 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 2x0x s PRO 594 N 1.79 3.05 0.25 5.31 0.04 -1.26 -4.99 135.00 139.19 2x0x s PRO 594 Ca 0.81 1.11 -0.30 0.00 0.04 0.00 0.00 61.00 62.66 2x0x s PRO 594 Cb -0.61 -2.00 -0.09 0.00 0.04 0.00 0.00 34.50 31.83 2x0x s PRO 594 CO 0.39 -1.02 1.31 -0.51 0.04 0.00 0.00 177.00 177.21 2x0x s LEU 595 N -5.07 4.43 0.00 -3.56 1.43 -1.26 -4.91 118.68 109.74 2x0x s LEU 595 Ca 0.61 2.51 0.14 0.00 -1.03 0.00 0.00 54.13 56.36 2x0x s LEU 595 Cb -0.15 -3.62 -0.13 0.00 0.03 0.00 0.00 46.19 42.31 2x0x s LEU 595 CO 0.46 -0.53 0.63 1.41 0.23 0.00 0.00 176.35 178.56 2x0x n HIS 596 N 1.98 0.00 -4.28 0.29 8.25 -1.26 -5.01 115.22 115.20 2x0x n HIS 596 Ca 0.04 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.26 2x0x n HIS 596 Cb 0.42 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.46 2x0x n HIS 596 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2x0x s TYR 597 N -2.23 2.71 -1.09 4.41 2.02 -1.26 -5.05 117.35 116.86 2x0x s TYR 597 Ca 0.06 -0.21 -0.20 0.00 -0.37 0.00 0.00 57.07 56.36 2x0x s TYR 597 Cb 0.11 -1.25 0.08 0.00 -0.40 0.00 0.00 41.96 40.50 2x0x s TYR 597 CO 0.54 0.58 1.47 0.34 -1.57 0.00 0.00 175.55 176.91 2x0x s ASP 598 N -3.37 6.65 0.45 2.29 -1.08 -1.26 -4.79 116.67 115.56 2x0x s ASP 598 Ca 0.29 -1.90 0.25 0.00 -0.52 0.00 0.00 52.55 50.68 2x0x s ASP 598 Cb -0.07 -2.53 0.69 0.00 -1.46 0.00 0.00 42.92 39.54 2x0x s ASP 598 CO 0.19 -1.30 1.73 -0.50 0.52 0.00 0.00 175.17 175.81 2x0x h TRP 599 N 8.91 0.00 -0.18 -5.34 4.06 -1.99 -3.02 115.95 118.40 2x0x h TRP 599 Ca 0.26 0.00 -0.19 0.00 2.06 0.00 0.00 58.89 61.03 2x0x h TRP 599 Cb 0.97 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 29.13 2x0x h TRP 599 CO 1.29 0.09 -0.62 0.93 -3.56 0.00 0.00 178.44 176.57 2x0x h GLU 600 N 0.00 0.73 0.02 0.49 4.39 -1.99 -0.31 114.58 117.90 2x0x h GLU 600 Ca -0.00 -0.55 -0.00 0.00 0.34 0.00 0.00 59.36 59.15 2x0x h GLU 600 Cb 0.87 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.62 2x0x h GLU 600 CO 0.01 1.17 -0.01 0.00 -1.16 0.00 0.00 179.01 179.02 2x0x h ALA 601 N 0.57 -0.02 -0.73 3.43 0.00 -1.97 -2.73 119.26 117.80 2x0x h ALA 601 Ca -0.03 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.89 2x0x h ALA 601 Cb 1.24 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.98 2x0x h ALA 601 CO 0.13 -0.45 0.41 1.25 0.00 0.00 0.00 179.25 180.59 2x0x h LEU 602 N -0.15 0.61 -0.54 0.00 5.85 -1.56 0.10 115.31 119.63 2x0x h LEU 602 Ca -0.00 0.03 0.11 0.00 0.84 0.00 0.00 57.88 58.86 2x0x h LEU 602 Cb 0.14 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 40.99 2x0x h LEU 602 CO 0.00 0.38 0.00 -0.09 -0.34 0.00 0.00 178.44 178.40 2x0x h ARG 603 N 0.75 0.12 -0.26 1.25 2.43 -0.91 0.54 114.38 118.29 2x0x h ARG 603 Ca 0.33 -0.01 -0.19 0.00 -0.81 0.00 0.00 59.98 59.30 2x0x h ARG 603 Cb 0.23 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 2x0x h ARG 603 CO -0.20 0.08 -0.59 0.93 -1.51 0.00 0.00 179.97 178.68 2x0x h GLU 604 N 0.12 0.85 -0.29 0.20 4.39 -1.05 -1.97 114.58 116.82 2x0x h GLU 604 Ca 0.27 -0.56 -0.03 0.00 0.34 0.00 0.00 59.36 59.38 2x0x h GLU 604 Cb 0.42 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.13 2x0x h GLU 604 CO -0.45 1.19 0.04 1.03 -1.16 0.00 0.00 179.01 179.67 2x0x h SER 605 N 0.64 0.39 0.02 1.42 0.87 -0.31 -2.08 113.55 114.50 2x0x h SER 605 Ca 0.00 -0.05 -0.13 0.00 -1.23 0.00 0.00 61.79 60.38 2x0x h SER 605 Cb 1.20 -0.10 0.01 0.00 -0.44 0.00 0.00 62.40 63.07 2x0x h SER 605 CO 0.13 0.42 -0.52 0.40 -0.53 0.00 0.00 176.83 176.73 2x0x h ILE 606 N 0.42 1.49 -0.76 2.23 2.04 -0.79 -0.92 117.51 121.23 2x0x h ILE 606 Ca 0.10 -2.14 0.11 0.00 1.00 0.00 0.00 64.86 63.93 2x0x h ILE 606 Cb 0.21 2.78 -0.05 0.00 -0.74 0.00 0.00 36.82 39.02 2x0x h ILE 606 CO 0.00 0.61 0.50 0.50 0.00 0.00 0.00 178.15 179.75 2x0x h LYS 607 N -0.29 0.59 0.00 2.37 3.64 -1.28 0.56 116.57 122.15 2x0x h LYS 607 Ca -0.07 -0.04 -0.18 0.00 -1.27 0.00 0.00 60.65 59.10 2x0x h LYS 607 Cb 1.28 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.94 2x0x h LYS 607 CO 0.10 0.39 -0.97 1.15 -2.27 0.00 0.00 179.45 177.85 2x0x h THR 608 N 0.61 1.05 0.00 1.00 2.02 -1.34 -3.41 112.91 112.84 2x0x h THR 608 Ca 0.36 -2.16 0.00 0.00 0.77 0.00 0.00 66.41 65.38 2x0x h THR 608 Cb 0.56 2.36 0.00 0.00 -1.74 0.00 0.00 68.15 69.33 2x0x h THR 608 CO -0.13 0.36 -1.25 1.41 0.37 0.00 0.00 175.52 176.28 2x0x n HIS 609 N -4.48 0.05 -1.93 3.16 8.25 -0.35 -5.10 115.22 114.82 2x0x n HIS 609 Ca -0.27 0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.21 2x0x n HIS 609 Cb 0.62 -0.22 0.00 0.00 1.12 0.00 0.00 29.99 31.51 2x0x n HIS 609 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2x0x n GLY 610 N 1.41 -2.29 3.27 -1.41 0.00 0.19 -4.36 105.19 101.99 2x0x n GLY 610 Ca 0.02 -1.61 -0.26 0.00 0.00 0.00 0.00 46.02 44.16 2x0x n GLY 610 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x0x s LEU 611 N 0.00 2.18 0.45 0.99 1.43 -1.26 -4.38 118.68 118.09 2x0x s LEU 611 Ca 0.00 -0.55 0.18 0.00 -1.03 0.00 0.00 54.13 52.73 2x0x s LEU 611 Cb 0.00 -1.01 1.05 0.00 0.03 0.00 0.00 46.19 46.26 2x0x s LEU 611 CO 0.00 0.16 1.96 -0.09 0.23 0.00 0.00 176.35 178.61 2x0x h ARG 612 N 4.75 0.00 -4.17 1.70 9.65 -1.64 -2.37 114.38 122.30 2x0x h ARG 612 Ca -0.44 0.00 -0.48 0.00 -1.10 0.00 0.00 59.98 57.96 2x0x h ARG 612 Cb 1.16 0.00 -0.36 0.00 -1.39 0.00 0.00 29.97 29.38 2x0x h ARG 612 CO 0.43 0.23 -0.79 -0.80 2.80 0.00 0.00 179.97 181.84 2x0x s ASN 613 N -6.67 1.73 0.48 -3.80 -0.87 -1.26 -3.54 114.94 101.01 2x0x s ASN 613 Ca -0.03 -0.23 0.22 0.00 -1.57 0.00 0.00 52.86 51.25 2x0x s ASN 613 Cb 0.14 -0.69 1.20 0.00 -0.02 0.00 0.00 41.25 41.88 2x0x s ASN 613 CO 0.67 -0.08 2.00 0.28 -2.57 0.00 0.00 177.10 177.39 2x0x h SER 614 N 7.72 0.00 -4.73 -1.22 0.02 -1.13 -3.42 113.55 110.78 2x0x h SER 614 Ca -0.30 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.39 2x0x h SER 614 Cb 1.15 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 63.49 2x0x h SER 614 CO 0.41 0.18 -0.72 0.42 -1.14 0.00 0.00 176.83 175.98 2x0x s THR 615 N -4.24 0.57 0.00 -2.27 -4.23 -1.26 -4.84 115.64 99.36 2x0x s THR 615 Ca -0.03 -1.30 0.00 0.00 -1.18 0.00 0.00 61.69 59.19 2x0x s THR 615 Cb 0.14 -0.88 0.00 0.00 1.34 0.00 0.00 72.50 73.10 2x0x s THR 615 CO 0.63 -0.51 0.00 0.18 -0.54 0.00 0.00 174.62 174.39 2x0x n LEU 616 N 1.08 0.25 -4.28 4.79 4.77 -1.23 -1.58 117.00 120.80 2x0x n LEU 616 Ca -0.20 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.51 2x0x n LEU 616 Cb 0.56 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.51 2x0x n LEU 616 CO 0.23 0.04 -0.53 -0.94 -1.33 0.00 0.00 177.39 174.86 2x0x s SER 617 N -2.75 2.67 -0.26 -1.43 1.04 -1.25 0.19 113.70 111.89 2x0x s SER 617 Ca 0.00 -0.57 -0.25 0.00 0.48 0.00 0.00 55.95 55.61 2x0x s SER 617 Cb 0.00 -0.21 0.09 0.00 0.10 0.00 0.00 66.02 65.99 2x0x s SER 617 CO 0.00 0.17 0.83 0.00 0.98 0.00 0.00 173.24 175.22 2x0x s ALA 618 N -0.86 -1.85 -0.51 5.32 0.00 -0.99 -1.60 121.76 121.28 2x0x s ALA 618 Ca 0.09 1.95 -0.14 0.00 0.00 0.00 0.00 51.96 53.85 2x0x s ALA 618 Cb -0.09 -1.22 0.12 0.00 0.00 0.00 0.00 23.12 21.93 2x0x s ALA 618 CO 0.02 -0.31 0.45 -0.51 0.00 0.00 0.00 175.76 175.42 2x0x s LEU 619 N 0.25 6.00 0.36 0.00 1.43 -0.32 -2.96 118.68 123.45 2x0x s LEU 619 Ca 0.01 -1.78 0.00 0.00 -1.03 0.00 0.00 54.13 51.33 2x0x s LEU 619 Cb -0.05 -2.15 -0.03 0.00 0.03 0.00 0.00 46.19 43.99 2x0x s LEU 619 CO -0.01 -0.80 0.57 0.00 0.23 0.00 0.00 176.35 176.35 2x0x s MET 620 N 1.54 3.46 0.56 1.70 0.23 -1.26 -0.89 119.30 124.64 2x0x s MET 620 Ca 0.04 -0.31 -0.19 0.00 -1.03 0.00 0.00 55.69 54.20 2x0x s MET 620 Cb -0.28 -2.63 -0.05 0.00 -1.53 0.00 0.00 34.83 30.33 2x0x s MET 620 CO 0.02 0.10 1.14 -2.14 -2.03 0.00 0.00 175.02 172.10 2x0x s PRO 621 N -4.36 3.27 0.22 3.16 0.02 -1.26 -4.69 135.00 131.35 2x0x s PRO 621 Ca 0.41 1.61 0.06 0.00 0.02 0.00 0.00 61.00 63.11 2x0x s PRO 621 Cb -0.10 -1.99 -0.05 0.00 0.02 0.00 0.00 34.50 32.38 2x0x s PRO 621 CO 0.37 -0.92 -0.09 -1.54 -0.33 0.00 0.00 177.00 174.49 2x0x s SER 622 N -1.82 2.35 0.24 2.53 1.04 -1.26 -4.93 113.70 111.85 2x0x s SER 622 Ca 0.73 -1.09 0.00 0.00 0.48 0.00 0.00 55.95 56.06 2x0x s SER 622 Cb -0.24 -0.10 0.00 0.00 0.10 0.00 0.00 66.02 65.78 2x0x s SER 622 CO 0.29 -0.30 0.00 1.21 0.98 0.00 0.00 173.24 175.42 2x0x n GLU 623 N -0.40 0.00 0.26 4.02 4.07 -1.26 -4.54 120.64 122.79 2x0x n GLU 623 Ca -0.07 0.00 -0.16 0.00 -0.06 0.00 0.00 57.16 56.87 2x0x n GLU 623 Cb 0.62 0.00 -0.08 0.00 -0.06 0.00 0.00 31.44 31.91 2x0x n GLU 623 CO 0.00 0.00 0.00 1.15 -0.06 0.00 0.00 177.13 178.22 2x0x h THR 624 N 0.00 0.53 -0.66 6.31 2.02 -1.99 -1.62 112.91 117.50 2x0x h THR 624 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 2x0x h THR 624 Cb 0.00 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 66.91 2x0x h THR 624 CO 0.00 0.00 0.27 0.28 0.37 0.00 0.00 175.52 176.44 2x0x h SER 625 N -0.62 0.90 0.84 4.18 0.02 -1.93 -1.48 113.55 115.45 2x0x h SER 625 Ca -0.06 -0.17 -0.04 0.00 -0.84 0.00 0.00 61.79 60.69 2x0x h SER 625 Cb 0.48 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 2x0x h SER 625 CO 0.09 0.82 -0.18 0.77 -1.14 0.00 0.00 176.83 177.19 2x0x h SER 626 N 0.93 0.00 -0.36 3.07 4.64 -1.87 -2.92 113.55 117.04 2x0x h SER 626 Ca 0.22 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.48 2x0x h SER 626 Cb 0.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 2x0x h SER 626 CO -0.02 0.18 -0.03 1.56 -0.87 0.00 0.00 176.83 177.66 2x0x h GLN 627 N 0.00 0.65 -0.97 4.77 4.20 -0.26 0.56 115.11 124.06 2x0x h GLN 627 Ca -0.00 -0.22 0.10 0.00 0.06 0.00 0.00 58.65 58.59 2x0x h GLN 627 Cb 0.65 -0.05 -0.07 0.00 0.30 0.00 0.00 27.48 28.31 2x0x h GLN 627 CO 0.02 0.78 0.62 0.82 -0.67 0.00 0.00 178.83 180.40 2x0x h ILE 628 N 0.46 0.98 -0.03 2.54 1.08 -1.24 -2.03 117.51 119.26 2x0x h ILE 628 Ca 0.10 -0.35 0.00 0.00 -0.39 0.00 0.00 64.86 64.22 2x0x h ILE 628 Cb 0.50 -0.12 0.00 0.00 -3.07 0.00 0.00 36.82 34.13 2x0x h ILE 628 CO 0.02 0.18 0.00 -1.20 -0.69 0.00 0.00 178.15 176.47 2x0x n SER 629 N -4.56 1.76 -3.99 1.72 7.64 -1.17 -4.65 113.62 110.36 2x0x n SER 629 Ca 0.17 -1.59 -0.33 0.00 1.01 0.00 0.00 58.87 58.13 2x0x n SER 629 Cb 0.30 -0.01 -0.01 0.00 -1.01 0.00 0.00 64.21 63.48 2x0x n SER 629 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2x0x n ASN 630 N 0.38 -2.03 -4.73 6.43 4.05 -0.76 -4.99 115.26 113.61 2x0x n ASN 630 Ca 0.18 -1.13 -0.26 0.00 0.45 0.00 0.00 54.58 53.82 2x0x n ASN 630 Cb 0.39 -2.52 -0.06 0.00 1.23 0.00 0.00 39.78 38.82 2x0x n ASN 630 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2x0x s ALA 631 N -3.84 3.37 0.64 5.20 0.00 0.19 -4.35 121.76 122.97 2x0x s ALA 631 Ca 0.22 -1.35 -0.16 0.00 0.00 0.00 0.00 51.96 50.67 2x0x s ALA 631 Cb -0.10 -1.14 -0.01 0.00 0.00 0.00 0.00 23.12 21.88 2x0x s ALA 631 CO 0.92 0.44 1.13 0.95 0.00 0.00 0.00 175.76 179.21 2x0x s THR 632 N -1.84 3.05 -0.13 0.00 -4.23 -1.26 -4.55 115.64 106.67 2x0x s THR 632 Ca 0.30 0.53 -0.29 0.00 -1.18 0.00 0.00 61.69 61.05 2x0x s THR 632 Cb -0.09 -3.09 -0.01 0.00 1.34 0.00 0.00 72.50 70.65 2x0x s THR 632 CO 0.21 -0.26 1.07 0.20 -0.54 0.00 0.00 174.62 175.31 2x0x s ASN 633 N -2.27 7.15 0.37 3.99 0.02 -1.26 -0.95 114.94 121.99 2x0x s ASN 633 Ca 0.70 1.56 0.00 0.00 -1.02 0.00 0.00 52.86 54.10 2x0x s ASN 633 Cb -0.23 -2.55 0.00 0.00 0.02 0.00 0.00 41.25 38.49 2x0x s ASN 633 CO 0.38 -0.56 0.00 0.61 0.02 0.00 0.00 177.10 177.56 2x0x n GLY 634 N 3.25 2.60 1.02 0.66 0.00 -1.26 -0.83 105.19 110.63 2x0x n GLY 634 Ca 0.10 0.20 0.12 0.00 0.00 0.00 0.00 46.02 46.44 2x0x n GLY 634 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2x0x n ILE 635 N 0.00 0.21 -2.83 -0.61 -5.35 -1.26 -2.45 119.36 107.06 2x0x n ILE 635 Ca 0.00 -0.61 -0.40 0.00 -0.27 0.00 0.00 62.75 61.48 2x0x n ILE 635 Cb 0.00 1.28 -0.06 0.00 -1.74 0.00 0.00 39.64 39.12 2x0x n ILE 635 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2x0x s GLU 636 N -1.75 4.75 0.33 6.28 0.41 -0.01 -4.59 118.70 124.11 2x0x s GLU 636 Ca 0.32 1.37 -0.29 0.00 -0.41 0.00 0.00 54.97 55.96 2x0x s GLU 636 Cb 0.21 -3.28 -0.10 0.00 -1.78 0.00 0.00 34.13 29.17 2x0x s GLU 636 CO 0.30 0.52 1.39 -2.14 -0.49 0.00 0.00 175.26 174.84 2x0x s PRO 637 N -1.09 4.26 0.51 0.39 0.02 -1.26 -4.39 135.00 133.45 2x0x s PRO 637 Ca 0.39 2.34 -0.22 0.00 0.02 0.00 0.00 61.00 63.54 2x0x s PRO 637 Cb -0.25 -3.05 -0.06 0.00 0.02 0.00 0.00 34.50 31.16 2x0x s PRO 637 CO 0.30 -0.34 1.23 -1.25 -0.33 0.00 0.00 177.00 176.61 2x0x s PRO 638 N -1.58 3.46 0.12 5.54 0.04 -1.26 -4.41 135.00 136.90 2x0x s PRO 638 Ca 0.52 1.91 -0.14 0.00 0.04 0.00 0.00 61.00 63.33 2x0x s PRO 638 Cb -0.42 -2.28 -0.05 0.00 0.04 0.00 0.00 34.50 31.79 2x0x s PRO 638 CO 0.54 -0.84 1.49 0.00 0.04 0.00 0.00 177.00 178.23 2x0x h ARG 639 N 1.68 0.75 -4.45 4.56 3.08 -1.94 0.31 114.38 118.38 2x0x h ARG 639 Ca -0.50 -0.33 -0.32 0.00 0.07 0.00 0.00 59.98 58.90 2x0x h ARG 639 Cb 1.27 -0.02 -0.11 0.00 0.08 0.00 0.00 29.97 31.19 2x0x h ARG 639 CO 0.58 0.94 -0.37 0.20 -1.07 0.00 0.00 179.97 180.26 2x0x s GLY 640 N -3.56 1.71 0.44 0.04 0.00 -1.26 -4.22 107.32 100.46 2x0x s GLY 640 Ca -0.12 -1.70 0.24 0.00 0.00 0.00 0.00 44.72 43.14 2x0x s GLY 640 CO 0.82 -1.21 1.81 -0.97 0.00 0.00 0.00 173.10 173.55 2x0x h TYR 641 N 2.23 0.00 -3.27 1.90 0.05 -1.95 -3.44 116.97 112.49 2x0x h TYR 641 Ca -0.28 0.00 -0.54 0.00 0.05 0.00 0.00 58.73 57.95 2x0x h TYR 641 Cb 1.24 0.00 -0.35 0.00 1.01 0.00 0.00 36.73 38.63 2x0x h TYR 641 CO 1.27 0.22 -0.82 0.08 -1.05 0.00 0.00 178.16 177.86 2x0x s VAL 642 N -3.61 1.23 0.08 -2.88 1.01 -1.26 -1.38 120.40 113.59 2x0x s VAL 642 Ca 0.01 -0.47 -0.07 0.00 0.00 0.00 0.00 61.98 61.44 2x0x s VAL 642 Cb 0.10 -1.17 -0.05 0.00 0.00 0.00 0.00 36.38 35.26 2x0x s VAL 642 CO 0.64 0.39 0.35 -0.44 0.00 0.00 0.00 175.10 176.04 2x0x s SER 643 N 1.16 6.55 -0.04 3.32 0.01 -0.06 -4.93 113.70 119.71 2x0x s SER 643 Ca -0.04 0.65 0.03 0.00 1.31 0.00 0.00 55.95 57.90 2x0x s SER 643 Cb -0.14 -2.12 0.00 0.00 0.21 0.00 0.00 66.02 63.97 2x0x s SER 643 CO -0.03 0.16 -0.12 -0.63 0.41 0.00 0.00 173.24 173.03 2x0x s ILE 644 N -1.45 1.06 0.03 1.44 1.01 -1.26 -1.63 121.20 120.41 2x0x s ILE 644 Ca 0.34 -0.49 0.06 0.00 0.00 0.00 0.00 60.65 60.56 2x0x s ILE 644 Cb -0.13 -0.94 -0.02 0.00 0.01 0.00 0.00 42.46 41.38 2x0x s ILE 644 CO 0.20 0.32 -0.19 -0.54 0.00 0.00 0.00 174.94 174.73 2x0x s LYS 645 N 0.28 1.31 0.22 2.79 3.01 -0.47 -5.00 119.74 121.88 2x0x s LYS 645 Ca -0.06 -0.85 -0.30 0.00 -1.01 0.00 0.00 55.97 53.75 2x0x s LYS 645 Cb -0.11 -1.37 -0.09 0.00 -1.01 0.00 0.00 37.83 35.25 2x0x s LYS 645 CO 0.02 0.35 0.96 0.00 0.51 0.00 0.00 175.35 177.19 2x0x s ALA 646 N -0.74 3.33 -0.13 5.17 0.00 -1.26 -1.59 121.76 126.55 2x0x s ALA 646 Ca 0.06 0.65 -0.11 0.00 0.00 0.00 0.00 51.96 52.56 2x0x s ALA 646 Cb -0.08 -3.24 0.04 0.00 0.00 0.00 0.00 23.12 19.84 2x0x s ALA 646 CO 0.01 0.13 0.33 0.45 0.00 0.00 0.00 175.76 176.68 2x0x s SER 647 N -0.94 -0.35 0.46 0.00 0.15 -0.97 -4.91 113.70 107.13 2x0x s SER 647 Ca 0.42 0.67 0.31 0.00 0.70 0.00 0.00 55.95 58.06 2x0x s SER 647 Cb -0.26 0.67 1.42 0.00 -1.71 0.00 0.00 66.02 66.14 2x0x s SER 647 CO 0.33 -0.12 1.67 0.07 1.20 0.00 0.00 173.24 176.38 2x0x h LYS 648 N 5.84 0.12 -0.02 5.44 -0.00 -2.03 0.26 116.57 126.18 2x0x h LYS 648 Ca -0.28 -0.01 0.00 0.00 -0.00 0.00 0.00 60.65 60.36 2x0x h LYS 648 Cb 1.18 -0.03 0.00 0.00 -0.00 0.00 0.00 32.23 33.39 2x0x h LYS 648 CO 0.30 0.08 0.00 -0.25 -0.00 0.00 0.00 179.45 179.58 2x0x n ASP 649 N -4.51 0.41 0.00 7.07 8.00 -1.26 -5.02 116.55 121.24 2x0x n ASP 649 Ca 0.34 -1.24 0.00 0.00 0.71 0.00 0.00 54.79 54.61 2x0x n ASP 649 Cb 1.38 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 42.47 2x0x n ASP 649 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2x0x n GLY 650 N 1.00 0.73 3.67 0.44 0.00 0.92 -4.95 105.19 106.99 2x0x n GLY 650 Ca 0.20 -2.29 -0.43 0.00 0.00 0.00 0.00 46.02 43.51 2x0x n GLY 650 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x0x s ILE 651 N -0.78 4.18 -0.28 -0.61 1.01 -1.26 -2.28 121.20 121.17 2x0x s ILE 651 Ca 0.00 1.44 -0.14 0.00 0.00 0.00 0.00 60.65 61.95 2x0x s ILE 651 Cb 0.00 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.50 2x0x s ILE 651 CO 0.00 -0.10 0.35 -0.76 0.00 0.00 0.00 174.94 174.42 2x0x s LEU 652 N 3.32 4.06 0.00 2.97 1.43 -0.62 -4.83 118.68 125.01 2x0x s LEU 652 Ca 0.57 0.21 0.04 0.00 -1.03 0.00 0.00 54.13 53.92 2x0x s LEU 652 Cb -0.24 -2.38 -0.03 0.00 0.03 0.00 0.00 46.19 43.57 2x0x s LEU 652 CO 0.18 -0.17 -0.08 -0.13 0.23 0.00 0.00 176.35 176.37 2x0x s ARG 653 N 2.02 2.51 -0.05 1.70 0.52 -1.26 -1.37 118.95 123.02 2x0x s ARG 653 Ca 0.14 -0.74 -0.01 0.00 -0.52 0.00 0.00 55.73 54.60 2x0x s ARG 653 Cb -0.16 -2.47 0.03 0.00 0.52 0.00 0.00 34.95 32.87 2x0x s ARG 653 CO 0.10 0.60 0.00 -1.14 0.02 0.00 0.00 175.30 174.89 2x0x s GLN 654 N -1.37 0.47 -0.07 3.54 0.74 -0.64 -4.49 119.66 117.84 2x0x s GLN 654 Ca 0.16 0.12 -0.16 0.00 0.05 0.00 0.00 55.36 55.53 2x0x s GLN 654 Cb -0.11 -0.78 -0.05 0.00 1.10 0.00 0.00 33.01 33.17 2x0x s GLN 654 CO 0.07 -0.25 0.41 0.08 -0.55 0.00 0.00 175.29 175.06 2x0x s VAL 655 N 1.68 5.14 0.53 1.34 1.01 -1.26 -0.88 120.40 127.95 2x0x s VAL 655 Ca -0.00 0.83 -0.19 0.00 0.00 0.00 0.00 61.98 62.62 2x0x s VAL 655 Cb -0.13 -3.74 -0.10 0.00 0.00 0.00 0.00 36.38 32.41 2x0x s VAL 655 CO -0.04 0.45 0.46 1.33 0.00 0.00 0.00 175.10 177.30 2x0x n VAL 656 N 2.82 1.90 -2.11 2.92 0.24 -0.48 -4.83 118.33 118.79 2x0x n VAL 656 Ca -0.11 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.34 61.28 2x0x n VAL 656 Cb 0.52 -0.58 -0.02 0.00 -1.47 0.00 0.00 33.84 32.28 2x0x n VAL 656 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2x0x s PRO 657 N -1.86 4.34 -1.48 7.34 0.04 -1.26 -2.86 135.00 139.27 2x0x s PRO 657 Ca 0.66 2.20 -0.11 0.00 0.04 0.00 0.00 61.00 63.79 2x0x s PRO 657 Cb -0.48 -3.11 0.06 0.00 0.04 0.00 0.00 34.50 31.01 2x0x s PRO 657 CO 0.56 -0.26 0.99 -3.47 0.04 0.00 0.00 177.00 174.86 2x0x n ASP 658 N 1.64 -4.65 -0.27 6.66 2.03 -1.26 -4.89 116.55 115.82 2x0x n ASP 658 Ca 0.03 -0.74 0.05 0.00 0.52 0.00 0.00 54.79 54.65 2x0x n ASP 658 Cb 0.42 -4.10 0.19 0.00 -0.72 0.00 0.00 41.12 36.91 2x0x n ASP 658 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 2x0x h TYR 659 N -2.17 0.62 -0.79 -0.67 3.20 -1.88 -0.60 116.97 114.68 2x0x h TYR 659 Ca -0.58 0.03 0.19 0.00 3.14 0.00 0.00 58.73 61.51 2x0x h TYR 659 Cb 1.37 -0.16 -0.13 0.00 1.54 0.00 0.00 36.73 39.35 2x0x h TYR 659 CO 0.55 0.14 0.10 1.49 -1.64 0.00 0.00 178.16 178.79 2x0x h GLU 660 N 0.54 0.15 0.00 1.82 4.81 -1.89 -0.02 114.58 119.98 2x0x h GLU 660 Ca 0.42 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.61 2x0x h GLU 660 Cb 0.58 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.92 2x0x h GLU 660 CO -0.36 0.10 -1.72 0.72 -0.73 0.00 0.00 179.01 177.03 2x0x n HIS 661 N -5.28 0.31 0.14 0.92 8.25 -1.02 -4.65 115.22 113.89 2x0x n HIS 661 Ca 0.16 0.09 0.02 0.00 -0.26 0.00 0.00 57.72 57.73 2x0x n HIS 661 Cb 0.53 -0.68 0.02 0.00 1.12 0.00 0.00 29.99 30.99 2x0x n HIS 661 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2x0x n LEU 662 N -2.42 1.39 -0.35 2.41 4.77 -0.26 -4.77 117.00 117.76 2x0x n LEU 662 Ca -0.04 -1.08 0.25 0.00 -0.03 0.00 0.00 56.01 55.11 2x0x n LEU 662 Cb 0.60 -0.01 0.51 0.00 -2.33 0.00 0.00 43.42 42.20 2x0x n LEU 662 CO 0.44 0.31 1.18 1.12 -1.33 0.00 0.00 177.39 179.11 2x0x h HIS 663 N 0.74 0.77 0.00 -1.77 2.07 -1.22 0.39 115.15 116.14 2x0x h HIS 663 Ca 0.00 0.03 -0.13 0.00 -2.85 0.00 0.00 60.37 57.42 2x0x h HIS 663 Cb 0.19 -0.21 -0.02 0.00 2.57 0.00 0.00 27.41 29.94 2x0x h HIS 663 CO 0.01 -0.07 -0.76 -0.44 -3.07 0.00 0.00 177.93 173.59 2x0x h ASP 664 N 0.33 0.00 0.18 3.10 3.32 -1.86 -3.32 116.42 118.17 2x0x h ASP 664 Ca 0.69 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 57.55 2x0x h ASP 664 Cb 1.74 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.29 2x0x h ASP 664 CO -0.45 0.58 -0.76 0.00 -1.72 0.00 0.00 179.24 176.89 2x0x h ALA 665 N 1.42 0.51 -2.96 3.45 0.00 -0.59 -3.45 119.26 117.65 2x0x h ALA 665 Ca -0.04 -0.62 -0.54 0.00 0.00 0.00 0.00 54.91 53.71 2x0x h ALA 665 Cb 1.47 -0.05 0.11 0.00 0.00 0.00 0.00 17.79 19.33 2x0x h ALA 665 CO 0.07 0.75 0.73 0.71 0.00 0.00 0.00 179.25 181.51 2x0x s TYR 666 N -3.61 2.54 -0.39 0.00 2.02 -0.49 -4.65 117.35 112.77 2x0x s TYR 666 Ca -0.07 1.24 -0.04 0.00 -0.37 0.00 0.00 57.07 57.83 2x0x s TYR 666 Cb 0.10 -3.95 0.09 0.00 -0.40 0.00 0.00 41.96 37.80 2x0x s TYR 666 CO 0.86 -2.90 0.17 -2.00 -1.57 0.00 0.00 175.55 170.11 2x0x s GLU 667 N -2.29 2.26 0.59 -0.62 2.12 -1.26 -5.00 118.70 114.50 2x0x s GLU 667 Ca 0.57 -1.60 -0.19 0.00 0.36 0.00 0.00 54.97 54.12 2x0x s GLU 667 Cb -0.44 -3.55 -0.03 0.00 0.26 0.00 0.00 34.13 30.36 2x0x s GLU 667 CO 0.59 -0.94 1.21 -0.51 -0.54 0.00 0.00 175.26 175.07 2x0x s LEU 668 N 1.24 3.66 0.22 2.70 1.43 -1.26 -4.57 118.68 122.11 2x0x s LEU 668 Ca 0.04 2.39 -0.15 0.00 -1.03 0.00 0.00 54.13 55.37 2x0x s LEU 668 Cb -0.22 -4.60 0.26 0.00 0.03 0.00 0.00 46.19 41.65 2x0x s LEU 668 CO -0.02 -1.60 1.58 0.25 0.23 0.00 0.00 176.35 176.79 2x0x h LEU 669 N 0.87 -1.02 -0.34 1.79 5.85 -0.54 -0.99 115.31 120.93 2x0x h LEU 669 Ca -0.50 0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.47 2x0x h LEU 669 Cb 1.30 0.58 0.00 0.00 0.37 0.00 0.00 40.66 42.91 2x0x h LEU 669 CO 0.55 -0.28 -0.00 0.79 -0.34 0.00 0.00 178.44 179.15 2x0x n TRP 670 N -5.49 0.00 1.08 1.25 7.02 -1.26 -2.83 117.44 117.21 2x0x n TRP 670 Ca 0.09 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.71 2x0x n TRP 670 Cb 0.39 -0.01 0.52 0.00 -2.42 0.00 0.00 31.31 29.79 2x0x n TRP 670 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 2x0x n GLU 671 N -0.60 0.11 -2.40 -0.99 1.02 -0.38 -4.83 120.64 112.57 2x0x n GLU 671 Ca 0.22 -0.03 -0.42 0.00 -0.02 0.00 0.00 57.16 56.90 2x0x n GLU 671 Cb 0.20 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.10 2x0x n GLU 671 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2x0x s MET 672 N -2.91 4.30 0.63 3.49 -1.94 -1.13 -4.90 119.30 116.83 2x0x s MET 672 Ca 0.16 1.73 0.36 0.00 -1.71 0.00 0.00 55.69 56.23 2x0x s MET 672 Cb 0.19 -3.64 2.08 0.00 2.01 0.00 0.00 34.83 35.46 2x0x s MET 672 CO 0.57 -0.56 2.29 -1.35 -0.01 0.00 0.00 175.02 175.95 2x0x h PRO 673 N 7.83 0.00 0.00 2.03 0.11 -1.92 -3.47 132.00 136.59 2x0x h PRO 673 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2x0x h PRO 673 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2x0x h PRO 673 CO 0.92 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 179.12 2x0x n GLY 674 N -1.22 0.83 0.01 -0.55 0.00 -1.26 -5.05 105.19 97.94 2x0x n GLY 674 Ca -0.03 -0.85 0.11 0.00 0.00 0.00 0.00 46.02 45.25 2x0x n GLY 674 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2x0x n ASN 675 N -0.27 0.68 0.06 1.61 3.02 -1.26 -4.59 115.26 114.51 2x0x n ASN 675 Ca 0.00 -0.47 -0.11 0.00 -0.03 0.00 0.00 54.58 53.96 2x0x n ASN 675 Cb 0.00 0.57 -0.05 0.00 -0.61 0.00 0.00 39.78 39.70 2x0x n ASN 675 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2x0x h ASP 676 N 0.00 -0.56 -0.83 6.41 3.32 -1.95 -1.43 116.42 121.38 2x0x h ASP 676 Ca 0.00 0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 2x0x h ASP 676 Cb 0.54 0.23 -0.04 0.00 0.22 0.00 0.00 39.33 40.28 2x0x h ASP 676 CO 0.00 -0.26 0.43 1.23 -1.72 0.00 0.00 179.24 178.92 2x0x h GLY 677 N -0.32 1.27 1.09 2.75 0.00 -1.74 -0.73 103.07 105.39 2x0x h GLY 677 Ca 0.05 -0.60 -0.17 0.00 0.00 0.00 0.00 47.33 46.62 2x0x h GLY 677 CO -0.17 0.57 -0.46 -1.82 0.00 0.00 0.00 176.54 174.67 2x0x h TYR 678 N 1.18 1.04 -0.33 5.60 3.20 -1.41 -2.45 116.97 123.80 2x0x h TYR 678 Ca 0.29 -0.35 -0.11 0.00 3.14 0.00 0.00 58.73 61.70 2x0x h TYR 678 Cb 0.08 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.13 2x0x h TYR 678 CO 0.01 1.16 -0.23 -0.07 -1.64 0.00 0.00 178.16 177.39 2x0x h LEU 679 N 0.61 0.64 -0.92 2.82 3.38 -1.02 -0.57 115.31 120.25 2x0x h LEU 679 Ca 0.03 -0.22 0.03 0.00 0.09 0.00 0.00 57.88 57.81 2x0x h LEU 679 Cb 1.06 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.58 2x0x h LEU 679 CO 0.11 0.86 0.59 1.56 0.09 0.00 0.00 178.44 181.65 2x0x h GLN 680 N 0.56 1.12 -0.51 1.13 4.20 -1.09 -0.72 115.11 119.79 2x0x h GLN 680 Ca 0.08 -0.07 -0.10 0.00 0.06 0.00 0.00 58.65 58.63 2x0x h GLN 680 Cb 0.70 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 28.21 2x0x h GLN 680 CO 0.05 0.74 -0.05 -0.07 -0.67 0.00 0.00 178.83 178.83 2x0x h LEU 681 N 1.15 0.93 -0.38 1.46 3.38 -0.92 -1.44 115.31 119.49 2x0x h LEU 681 Ca 0.36 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2x0x h LEU 681 Cb 0.00 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2x0x h LEU 681 CO -0.12 1.04 0.21 0.58 0.09 0.00 0.00 178.44 180.24 2x0x h VAL 682 N 0.80 1.14 -0.63 1.22 2.07 -0.98 -1.27 116.25 118.61 2x0x h VAL 682 Ca 0.14 -0.36 0.04 0.00 0.82 0.00 0.00 66.70 67.34 2x0x h VAL 682 Cb 0.60 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 2x0x h VAL 682 CO 0.04 0.15 0.36 1.23 0.02 0.00 0.00 177.57 179.37 2x0x h GLY 683 N 0.48 0.91 0.92 2.17 0.00 -0.98 0.20 103.07 106.78 2x0x h GLY 683 Ca 0.13 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 2x0x h GLY 683 CO -0.02 0.19 0.11 -2.22 0.00 0.00 0.00 176.54 174.60 2x0x h ILE 684 N 0.69 1.14 -0.74 2.60 2.04 -1.09 -2.16 117.51 119.99 2x0x h ILE 684 Ca 0.27 -0.40 0.10 0.00 1.00 0.00 0.00 64.86 65.83 2x0x h ILE 684 Cb 0.11 0.98 -0.07 0.00 -0.74 0.00 0.00 36.82 37.09 2x0x h ILE 684 CO -0.14 0.14 0.37 0.24 0.00 0.00 0.00 178.15 178.76 2x0x h MET 685 N 0.24 0.61 0.00 2.37 2.86 -1.02 -2.71 114.93 117.28 2x0x h MET 685 Ca 0.08 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2x0x h MET 685 Cb 0.12 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.64 2x0x h MET 685 CO -0.01 0.40 0.00 0.37 1.06 0.00 0.00 176.91 178.73 2x0x h GLN 686 N 0.63 0.00 -0.85 1.72 5.75 -0.33 -1.43 115.11 120.59 2x0x h GLN 686 Ca 0.37 0.00 0.11 0.00 -0.15 0.00 0.00 58.65 58.97 2x0x h GLN 686 Cb 0.39 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 28.88 2x0x h GLN 686 CO -0.28 0.00 0.55 -0.22 -2.65 0.00 0.00 178.83 176.24 2x0x h LYS 687 N 0.00 0.77 0.00 1.69 3.64 -1.11 -3.25 116.57 118.31 2x0x h LYS 687 Ca 0.00 -0.05 -0.29 0.00 -1.27 0.00 0.00 60.65 59.04 2x0x h LYS 687 Cb 0.32 -0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 31.91 2x0x h LYS 687 CO 0.00 0.51 -2.09 1.19 -2.27 0.00 0.00 179.45 176.79 2x0x n PHE 688 N -4.53 0.00 -1.98 1.91 3.72 -0.62 -4.41 117.46 111.56 2x0x n PHE 688 Ca 0.15 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.13 2x0x n PHE 688 Cb 0.34 -0.78 -0.03 0.00 -0.94 0.00 0.00 39.48 38.08 2x0x n PHE 688 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2x0x s ILE 689 N -2.38 2.67 0.11 4.37 -1.09 -0.73 -4.87 121.20 119.28 2x0x s ILE 689 Ca -0.08 0.52 -0.14 0.00 -2.23 0.00 0.00 60.65 58.71 2x0x s ILE 689 Cb 0.05 -3.33 -0.06 0.00 -1.58 0.00 0.00 42.46 37.54 2x0x s ILE 689 CO 0.65 0.06 1.47 0.44 -1.23 0.00 0.00 174.94 176.33 2x0x h ASP 690 N 5.99 0.76 0.00 3.58 3.32 -1.89 -3.46 116.42 124.73 2x0x h ASP 690 Ca -0.44 -0.42 0.00 0.00 0.02 0.00 0.00 57.03 56.19 2x0x h ASP 690 Cb 1.21 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.55 2x0x h ASP 690 CO 0.85 1.02 0.00 0.00 -1.72 0.00 0.00 179.24 179.39 2x0x n GLN 691 N -4.30 0.00 -1.46 3.56 6.02 -0.63 -4.36 117.38 116.22 2x0x n GLN 691 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.96 2x0x n GLN 691 Cb 0.42 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.68 2x0x n GLN 691 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2x0x n SER 692 N 0.00 0.96 -3.94 1.08 2.88 -0.09 -4.92 113.62 109.59 2x0x n SER 692 Ca 0.00 -0.73 -0.18 0.00 -1.33 0.00 0.00 58.87 56.63 2x0x n SER 692 Cb 0.00 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.31 2x0x n SER 692 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2x0x s ILE 693 N -1.12 0.49 -1.31 2.46 1.01 -1.26 -1.17 121.20 120.29 2x0x s ILE 693 Ca 0.00 -0.20 -0.10 0.00 0.00 0.00 0.00 60.65 60.35 2x0x s ILE 693 Cb 0.00 -0.46 -0.07 0.00 0.01 0.00 0.00 42.46 41.95 2x0x s ILE 693 CO 0.00 0.17 2.52 -1.20 0.00 0.00 0.00 174.94 176.43 2x0x n SER 694 N 3.38 6.48 -4.68 3.58 7.64 -0.06 -4.55 113.62 125.41 2x0x n SER 694 Ca -0.18 -2.53 -0.42 0.00 1.01 0.00 0.00 58.87 56.74 2x0x n SER 694 Cb 0.55 -1.39 -0.03 0.00 -1.01 0.00 0.00 64.21 62.33 2x0x n SER 694 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2x0x s ALA 695 N 2.91 3.56 0.26 -0.43 0.00 -1.26 -4.71 121.76 122.08 2x0x s ALA 695 Ca 0.56 0.64 -0.11 0.00 0.00 0.00 0.00 51.96 53.06 2x0x s ALA 695 Cb 0.15 -3.56 -0.08 0.00 0.00 0.00 0.00 23.12 19.63 2x0x s ALA 695 CO -0.04 -0.91 0.60 -0.80 0.00 0.00 0.00 175.76 174.61 2x0x s ASN 696 N 1.74 6.66 0.12 0.00 0.02 -1.26 0.42 114.94 122.63 2x0x s ASN 696 Ca 0.58 1.02 0.06 0.00 -1.02 0.00 0.00 52.86 53.49 2x0x s ASN 696 Cb -0.26 -2.26 -0.04 0.00 0.02 0.00 0.00 41.25 38.71 2x0x s ASN 696 CO 0.21 -0.12 -0.03 0.42 0.02 0.00 0.00 177.10 177.61 2x0x s THR 697 N -1.88 3.76 -0.02 1.60 -4.23 -0.59 -4.97 115.64 109.31 2x0x s THR 697 Ca 0.49 -1.18 0.01 0.00 -1.18 0.00 0.00 61.69 59.83 2x0x s THR 697 Cb -0.11 -2.81 0.01 0.00 1.34 0.00 0.00 72.50 70.93 2x0x s THR 697 CO 0.21 0.06 -0.01 0.20 -0.54 0.00 0.00 174.62 174.53 2x0x s ASN 698 N -2.44 0.39 -0.03 3.99 0.01 -1.26 -0.15 114.94 115.45 2x0x s ASN 698 Ca 0.25 -0.04 -0.00 0.00 -0.71 0.00 0.00 52.86 52.35 2x0x s ASN 698 Cb -0.11 -0.14 0.03 0.00 0.41 0.00 0.00 41.25 41.44 2x0x s ASN 698 CO 0.17 -0.04 0.02 -0.31 -1.51 0.00 0.00 177.10 175.44 2x0x s TYR 699 N 0.51 0.23 -0.43 2.20 2.02 0.10 -4.74 117.35 117.23 2x0x s TYR 699 Ca -0.05 0.07 -0.18 0.00 -0.37 0.00 0.00 57.07 56.54 2x0x s TYR 699 Cb -0.08 -0.43 0.02 0.00 -0.40 0.00 0.00 41.96 41.08 2x0x s TYR 699 CO -0.01 -0.16 0.48 0.34 -1.57 0.00 0.00 175.55 174.64 2x0x s ASP 700 N 1.41 6.22 0.42 2.29 -1.08 -1.26 -1.14 116.67 123.53 2x0x s ASP 700 Ca -0.05 -0.63 0.17 0.00 -0.52 0.00 0.00 52.55 51.52 2x0x s ASP 700 Cb -0.13 -2.24 1.07 0.00 -1.46 0.00 0.00 42.92 40.16 2x0x s ASP 700 CO -0.03 -0.64 1.89 -0.65 0.52 0.00 0.00 175.17 176.27 2x0x h PRO 701 N 8.77 0.39 0.00 4.34 0.11 -1.80 -1.67 132.00 142.14 2x0x h PRO 701 Ca -0.26 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2x0x h PRO 701 Cb 1.11 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2x0x h PRO 701 CO 0.82 0.26 0.00 -1.13 -0.21 0.00 0.00 178.00 177.74 2x0x n SER 702 N -4.49 0.00 -0.23 -2.05 3.41 -1.26 -1.53 113.62 107.47 2x0x n SER 702 Ca 0.17 -0.24 0.13 0.00 -0.26 0.00 0.00 58.87 58.67 2x0x n SER 702 Cb 0.62 -0.15 0.37 0.00 -0.26 0.00 0.00 64.21 64.78 2x0x n SER 702 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2x0x n ARG 703 N -1.15 0.79 -4.49 4.33 1.74 -0.63 -4.93 116.66 112.33 2x0x n ARG 703 Ca 0.10 -0.47 -0.30 0.00 -0.77 0.00 0.00 57.85 56.41 2x0x n ARG 703 Cb 0.10 -1.49 -0.12 0.00 -1.02 0.00 0.00 32.46 29.93 2x0x n ARG 703 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2x0x s PHE 704 N -2.53 2.57 0.25 -1.55 0.40 -0.58 -5.08 117.98 111.46 2x0x s PHE 704 Ca 0.24 -0.24 -0.31 0.00 -0.60 0.00 0.00 56.93 56.01 2x0x s PHE 704 Cb 0.19 -1.42 -0.13 0.00 0.51 0.00 0.00 43.02 42.17 2x0x s PHE 704 CO 0.53 0.32 1.54 -2.30 0.70 0.00 0.00 175.22 176.01 2x0x n PRO 705 N 1.21 2.41 -1.27 0.24 -0.02 -1.26 -1.35 135.00 134.96 2x0x n PRO 705 Ca -0.16 0.86 -0.09 0.00 -2.02 0.00 0.00 63.50 62.09 2x0x n PRO 705 Cb 0.52 -2.60 -0.04 0.00 -0.02 0.00 0.00 33.50 31.36 2x0x n PRO 705 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2x0x n SER 706 N 2.52 -4.88 -2.58 2.55 7.64 -1.26 -3.18 113.62 114.44 2x0x n SER 706 Ca 0.11 0.23 -0.20 0.00 1.01 0.00 0.00 58.87 60.03 2x0x n SER 706 Cb 0.34 -3.19 0.00 0.00 -1.01 0.00 0.00 64.21 60.35 2x0x n SER 706 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2x0x n GLY 707 N -0.83 -0.50 3.04 0.23 0.00 -0.46 -4.99 105.19 101.67 2x0x n GLY 707 Ca -0.09 0.03 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 2x0x n GLY 707 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2x0x s LYS 708 N -5.22 1.34 -0.06 1.61 -2.85 -1.19 -4.69 119.74 108.68 2x0x s LYS 708 Ca 0.08 -0.40 -0.30 0.00 -1.00 0.00 0.00 55.97 54.35 2x0x s LYS 708 Cb -0.04 -1.19 -0.03 0.00 -2.06 0.00 0.00 37.83 34.52 2x0x s LYS 708 CO 0.10 0.12 1.16 0.08 0.10 0.00 0.00 175.35 176.91 2x0x s VAL 709 N 0.30 4.35 0.06 1.79 1.01 -1.26 -4.59 120.40 122.06 2x0x s VAL 709 Ca -0.06 1.66 -0.28 0.00 0.00 0.00 0.00 61.98 63.30 2x0x s VAL 709 Cb -0.11 -4.07 -0.05 0.00 0.00 0.00 0.00 36.38 32.15 2x0x s VAL 709 CO 0.02 0.00 0.87 -2.16 0.00 0.00 0.00 175.10 173.83 2x0x s PRO 710 N 2.14 4.58 0.35 2.72 0.04 -1.26 -4.93 135.00 138.64 2x0x s PRO 710 Ca 0.55 1.26 0.16 0.00 0.04 0.00 0.00 61.00 63.00 2x0x s PRO 710 Cb -0.24 -3.39 1.12 0.00 0.04 0.00 0.00 34.50 32.04 2x0x s PRO 710 CO 0.21 0.20 1.66 1.98 0.04 0.00 0.00 177.00 181.09 2x0x h MET 711 N 5.83 0.28 -0.79 4.56 4.05 -1.99 0.32 114.93 127.19 2x0x h MET 711 Ca -0.43 -0.02 0.11 0.00 -0.28 0.00 0.00 59.70 59.09 2x0x h MET 711 Cb 1.21 -0.06 -0.08 0.00 -0.80 0.00 0.00 31.60 31.87 2x0x h MET 711 CO 0.72 0.19 0.41 0.37 0.23 0.00 0.00 176.91 178.82 2x0x h GLN 712 N 0.29 0.63 -0.21 0.39 5.75 -1.99 -0.26 115.11 119.71 2x0x h GLN 712 Ca 0.75 -0.04 -0.17 0.00 -0.15 0.00 0.00 58.65 59.04 2x0x h GLN 712 Cb 1.75 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 30.15 2x0x h GLN 712 CO -0.61 0.42 -0.55 0.37 -2.65 0.00 0.00 178.83 175.80 2x0x h GLN 713 N 0.65 0.63 -0.54 1.69 5.75 -1.33 -0.63 115.11 121.32 2x0x h GLN 713 Ca 0.40 -0.40 0.01 0.00 -0.15 0.00 0.00 58.65 58.51 2x0x h GLN 713 Cb 0.47 0.05 -0.03 0.00 1.07 0.00 0.00 27.48 29.04 2x0x h GLN 713 CO -0.30 1.01 0.35 -0.07 -2.65 0.00 0.00 178.83 177.18 2x0x h LEU 714 N 0.48 0.61 -0.29 -2.39 3.38 -1.05 -1.12 115.31 114.94 2x0x h LEU 714 Ca 0.01 -0.01 -0.20 0.00 0.09 0.00 0.00 57.88 57.77 2x0x h LEU 714 Cb 1.11 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.72 2x0x h LEU 714 CO 0.11 0.44 -0.66 -0.07 0.09 0.00 0.00 178.44 178.34 2x0x h LEU 715 N 0.72 0.86 -0.08 1.67 3.38 -1.07 -2.61 115.31 118.17 2x0x h LEU 715 Ca 0.20 -0.51 0.03 0.00 0.09 0.00 0.00 57.88 57.68 2x0x h LEU 715 Cb -0.07 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.40 2x0x h LEU 715 CO -0.05 1.29 -0.07 0.50 0.09 0.00 0.00 178.44 180.20 2x0x h LYS 716 N 0.54 -0.09 -0.67 1.13 1.63 -0.95 -1.65 116.57 116.52 2x0x h LYS 716 Ca -0.02 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.77 2x0x h LYS 716 Cb 1.27 0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 32.88 2x0x h LYS 716 CO 0.14 -0.06 0.33 -0.44 -3.45 0.00 0.00 179.45 175.97 2x0x h ASP 717 N -0.09 0.84 -0.93 4.20 3.32 -1.23 -0.65 116.42 121.88 2x0x h ASP 717 Ca 0.06 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 2x0x h ASP 717 Cb 0.17 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.46 2x0x h ASP 717 CO -0.14 0.70 0.55 0.25 -1.72 0.00 0.00 179.24 178.88 2x0x h LEU 718 N 0.94 1.13 -0.08 1.55 5.85 -1.14 -1.27 115.31 122.27 2x0x h LEU 718 Ca 0.23 -0.08 -0.24 0.00 0.84 0.00 0.00 57.88 58.63 2x0x h LEU 718 Cb 0.07 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 40.82 2x0x h LEU 718 CO -0.03 0.88 -1.03 -0.07 -0.34 0.00 0.00 178.44 177.84 2x0x h LEU 719 N 1.29 0.51 -0.25 2.25 3.38 -0.85 -2.46 115.31 119.18 2x0x h LEU 719 Ca 0.33 -0.45 0.04 0.00 0.09 0.00 0.00 57.88 57.89 2x0x h LEU 719 Cb -0.03 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 2x0x h LEU 719 CO -0.06 1.27 0.02 0.74 0.09 0.00 0.00 178.44 180.50 2x0x h THR 720 N 0.19 0.85 -0.25 0.22 2.02 -0.95 -0.36 112.91 114.63 2x0x h THR 720 Ca -0.10 -0.04 0.06 0.00 0.77 0.00 0.00 66.41 67.10 2x0x h THR 720 Cb 1.70 0.73 -0.06 0.00 -1.74 0.00 0.00 68.15 68.78 2x0x h THR 720 CO 0.18 0.02 -0.11 0.00 0.37 0.00 0.00 175.52 175.97 2x0x h ALA 721 N 1.20 0.09 -0.27 6.16 0.00 -1.24 -1.92 119.26 123.29 2x0x h ALA 721 Ca 0.12 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.13 2x0x h ALA 721 Cb 0.14 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2x0x h ALA 721 CO -0.18 -0.52 0.17 -0.92 0.00 0.00 0.00 179.25 177.80 2x0x h TYR 722 N -0.08 0.32 -0.81 0.00 3.20 -1.22 -0.42 116.97 117.96 2x0x h TYR 722 Ca 0.13 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.05 2x0x h TYR 722 Cb 0.27 -0.11 -0.05 0.00 1.54 0.00 0.00 36.73 38.39 2x0x h TYR 722 CO -0.29 0.20 0.53 -0.22 -1.64 0.00 0.00 178.16 176.74 2x0x h LYS 723 N 0.35 0.94 -0.35 1.82 3.64 -0.87 -1.87 116.57 120.23 2x0x h LYS 723 Ca 0.10 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2x0x h LYS 723 Cb -0.03 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.58 2x0x h LYS 723 CO -0.03 0.62 0.00 1.19 -2.27 0.00 0.00 179.45 178.96 2x0x n PHE 724 N -4.46 0.46 -0.94 1.91 3.72 -0.74 -4.61 117.46 112.80 2x0x n PHE 724 Ca 0.11 -0.22 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 2x0x n PHE 724 Cb 0.14 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.67 2x0x n PHE 724 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2x0x n GLY 725 N 0.99 0.46 3.69 1.37 0.00 -0.70 -4.53 105.19 106.47 2x0x n GLY 725 Ca 0.11 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 2x0x n GLY 725 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x0x s VAL 726 N -2.00 2.85 0.10 1.61 1.01 -0.19 -4.90 120.40 118.88 2x0x s VAL 726 Ca 0.00 0.39 -0.05 0.00 0.00 0.00 0.00 61.98 62.32 2x0x s VAL 726 Cb 0.00 -3.25 -0.24 0.00 0.00 0.00 0.00 36.38 32.89 2x0x s VAL 726 CO 0.00 0.00 1.21 0.11 0.00 0.00 0.00 175.10 176.42 2x0x h LYS 727 N 8.10 0.35 -3.85 2.72 1.57 -1.89 -3.42 116.57 120.14 2x0x h LYS 727 Ca -0.43 -0.48 -0.09 0.00 -1.87 0.00 0.00 60.65 57.77 2x0x h LYS 727 Cb 1.20 0.16 -0.15 0.00 0.08 0.00 0.00 32.23 33.53 2x0x h LYS 727 CO 0.93 1.18 -0.42 0.95 -0.57 0.00 0.00 179.45 181.52 2x0x s THR 728 N -2.92 0.15 -0.09 -0.16 -4.23 -1.26 -0.16 115.64 106.96 2x0x s THR 728 Ca -0.05 -1.25 0.01 0.00 -1.18 0.00 0.00 61.69 59.23 2x0x s THR 728 Cb 0.08 -1.31 0.02 0.00 1.34 0.00 0.00 72.50 72.62 2x0x s THR 728 CO 0.88 -0.69 -0.11 -0.76 -0.54 0.00 0.00 174.62 173.40 2x0x s LEU 729 N -2.77 1.50 0.00 4.79 1.43 0.23 -4.49 118.68 119.37 2x0x s LEU 729 Ca 0.04 -0.33 0.00 0.00 -1.03 0.00 0.00 54.13 52.81 2x0x s LEU 729 Cb 0.05 -0.90 0.00 0.00 0.03 0.00 0.00 46.19 45.37 2x0x s LEU 729 CO -0.10 -0.03 0.00 0.00 0.23 0.00 0.00 176.35 176.45 2x0x n TYR 730 N 4.34 0.00 -1.53 0.29 9.36 0.17 -2.28 117.16 127.50 2x0x n TYR 730 Ca -0.18 0.00 -0.46 0.00 3.32 0.00 0.00 57.90 60.57 2x0x n TYR 730 Cb 0.51 0.00 -0.02 0.00 -0.63 0.00 0.00 39.34 39.20 2x0x n TYR 730 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 2x0x n TYR 731 N 0.00 0.77 -3.65 2.98 4.01 -1.26 -4.68 117.16 115.34 2x0x n TYR 731 Ca 0.00 0.78 -0.37 0.00 -0.16 0.00 0.00 57.90 58.15 2x0x n TYR 731 Cb 0.00 -2.17 -0.11 0.00 -0.31 0.00 0.00 39.34 36.75 2x0x n TYR 731 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 2x0x s GLN 732 N -1.23 3.89 -0.21 -0.72 0.74 -0.97 -1.55 119.66 119.61 2x0x s GLN 732 Ca 0.62 -0.35 -0.10 0.00 0.05 0.00 0.00 55.36 55.58 2x0x s GLN 732 Cb -0.79 -3.55 -0.05 0.00 1.10 0.00 0.00 33.01 29.72 2x0x s GLN 732 CO 0.58 -0.14 0.14 -0.80 -0.55 0.00 0.00 175.29 174.51 2x0x s ASN 733 N 1.61 6.12 -0.19 6.67 0.01 0.79 -4.37 114.94 125.58 2x0x s ASN 733 Ca 0.07 0.17 -0.02 0.00 -0.71 0.00 0.00 52.86 52.37 2x0x s ASN 733 Cb -0.15 -2.08 -0.01 0.00 0.41 0.00 0.00 41.25 39.42 2x0x s ASN 733 CO 0.08 0.14 -0.09 -0.89 -1.51 0.00 0.00 177.10 174.83 2x0x s THR 734 N 0.63 3.08 0.23 1.60 2.01 -1.26 -0.72 115.64 121.21 2x0x s THR 734 Ca 0.07 -0.61 -0.31 0.00 0.31 0.00 0.00 61.69 61.15 2x0x s THR 734 Cb -0.12 -2.36 -0.12 0.00 0.01 0.00 0.00 72.50 69.91 2x0x s THR 734 CO 0.01 0.47 1.67 -0.60 -0.69 0.00 0.00 174.62 175.47 2x0x s ARG 735 N 1.17 4.13 -0.16 4.92 3.52 -0.29 -4.95 118.95 127.29 2x0x s ARG 735 Ca 0.02 2.58 -0.25 0.00 -0.13 0.00 0.00 55.73 57.94 2x0x s ARG 735 Cb -0.14 -3.06 -0.02 0.00 -1.56 0.00 0.00 34.95 30.16 2x0x s ARG 735 CO -0.03 -0.70 0.81 0.16 -0.81 0.00 0.00 175.30 174.73 2x0x s ASP 736 N 0.95 6.94 0.00 -2.12 -4.77 -1.26 -4.55 116.67 111.86 2x0x s ASP 736 Ca 0.71 1.15 0.00 0.00 -3.30 0.00 0.00 52.55 51.11 2x0x s ASP 736 Cb -0.49 -2.44 0.00 0.00 -1.09 0.00 0.00 42.92 38.90 2x0x s ASP 736 CO 0.37 -0.37 0.00 0.61 0.70 0.00 0.00 175.17 176.48