#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i2m s VAL 25 N 0.00 3.58 0.00 3.15 -7.23 -0.74 -5.04 120.40 114.13 1i2m s VAL 25 Ca 0.00 0.92 -0.16 0.00 -1.81 0.00 0.00 61.98 60.93 1i2m s VAL 25 Cb 0.00 -3.37 0.03 0.00 0.56 0.00 0.00 36.38 33.60 1i2m s VAL 25 CO 0.00 -0.27 0.35 -0.94 -0.31 0.00 0.00 175.10 173.92 1i2m s SER 26 N -2.12 -0.22 -0.12 4.85 1.04 -1.26 -4.96 113.70 110.92 1i2m s SER 26 Ca 0.68 0.07 -0.29 0.00 0.48 0.00 0.00 55.95 56.89 1i2m s SER 26 Cb -0.19 0.35 0.07 0.00 0.10 0.00 0.00 66.02 66.35 1i2m s SER 26 CO 0.26 -0.52 0.70 -2.28 0.98 0.00 0.00 173.24 172.39 1i2m s HIS 27 N -1.68 -0.69 0.59 5.02 2.46 -1.26 -4.93 115.29 114.80 1i2m s HIS 27 Ca -0.11 1.36 0.29 0.00 0.47 0.00 0.00 55.06 57.07 1i2m s HIS 27 Cb -0.03 0.37 1.68 0.00 -0.13 0.00 0.00 32.58 34.46 1i2m s HIS 27 CO 0.03 -0.54 2.11 0.07 -2.47 0.00 0.00 174.74 173.94 1i2m h ARG 28 N 3.59 0.00 0.00 2.88 0.11 -1.95 -1.11 114.38 117.90 1i2m h ARG 28 Ca -0.27 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.81 1i2m h ARG 28 Cb 1.15 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.23 1i2m h ARG 28 CO 0.29 0.00 0.00 0.66 0.10 0.00 0.00 179.97 181.02 1i2m h SER 29 N 0.00 0.00 -3.70 0.08 4.64 -1.96 -3.45 113.55 109.16 1i2m h SER 29 Ca 0.08 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.87 1i2m h SER 29 Cb 0.45 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.59 1i2m h SER 29 CO -0.00 0.00 0.67 -1.00 -0.87 0.00 0.00 176.83 175.63 1i2m s HIS 30 N -3.39 3.07 -0.10 4.77 3.76 -0.42 -5.01 115.29 117.96 1i2m s HIS 30 Ca 0.04 1.30 -0.03 0.00 -0.15 0.00 0.00 55.06 56.22 1i2m s HIS 30 Cb 0.09 -3.70 -0.04 0.00 1.11 0.00 0.00 32.58 30.04 1i2m s HIS 30 CO 0.51 -2.05 0.04 -1.12 -0.85 0.00 0.00 174.74 171.27 1i2m s SER 31 N -0.19 5.53 0.00 1.40 0.01 -1.26 -5.00 113.70 114.19 1i2m s SER 31 Ca 0.52 0.22 0.00 0.00 1.31 0.00 0.00 55.95 58.00 1i2m s SER 31 Cb -0.40 -1.65 0.00 0.00 0.21 0.00 0.00 66.02 64.18 1i2m s SER 31 CO 0.49 0.37 0.09 0.35 0.41 0.00 0.00 173.24 174.95 1i2m n THR 32 N 2.21 0.00 -2.86 1.44 -2.24 -1.26 -4.80 114.28 106.77 1i2m n THR 32 Ca -0.19 -0.14 -0.42 0.00 -2.27 0.00 0.00 64.05 61.03 1i2m n THR 32 Cb 0.54 1.48 -0.04 0.00 -2.10 0.00 0.00 70.33 70.21 1i2m n THR 32 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1i2m s GLU 33 N -0.09 3.94 0.24 -0.78 2.02 -1.26 -4.97 118.70 117.79 1i2m s GLU 33 Ca 0.00 0.66 -0.30 0.00 0.02 0.00 0.00 54.97 55.35 1i2m s GLU 33 Cb 0.00 -3.75 -0.10 0.00 0.10 0.00 0.00 34.13 30.38 1i2m s GLU 33 CO 0.00 -0.79 1.46 -1.25 0.02 0.00 0.00 175.26 174.70 1i2m s PRO 34 N 3.21 4.25 0.04 0.39 0.04 -1.26 -4.43 135.00 137.24 1i2m s PRO 34 Ca 0.36 2.32 -0.00 0.00 0.04 0.00 0.00 61.00 63.72 1i2m s PRO 34 Cb -0.13 -3.11 0.00 0.00 0.04 0.00 0.00 34.50 31.29 1i2m s PRO 34 CO 0.15 -0.45 0.06 0.41 0.04 0.00 0.00 177.00 177.20 1i2m n GLY 35 N 2.42 3.09 3.54 0.56 0.00 0.25 -4.84 105.19 110.22 1i2m n GLY 35 Ca 0.08 -1.43 -0.31 0.00 0.00 0.00 0.00 46.02 44.35 1i2m n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i2m s LEU 36 N 0.00 2.94 -0.15 0.99 1.43 0.15 -1.58 118.68 122.46 1i2m s LEU 36 Ca 0.04 -0.28 -0.13 0.00 -1.03 0.00 0.00 54.13 52.73 1i2m s LEU 36 Cb -0.00 -1.71 -0.05 0.00 0.03 0.00 0.00 46.19 44.46 1i2m s LEU 36 CO 0.03 0.26 0.27 -0.69 0.23 0.00 0.00 176.35 176.45 1i2m s VAL 37 N -1.00 5.31 0.03 -1.59 1.01 -1.26 -0.88 120.40 122.02 1i2m s VAL 37 Ca 0.17 0.51 0.08 0.00 0.00 0.00 0.00 61.98 62.73 1i2m s VAL 37 Cb -0.11 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.64 1i2m s VAL 37 CO 0.08 0.42 -0.22 -0.76 0.00 0.00 0.00 175.10 174.62 1i2m s LEU 38 N 0.27 2.14 0.12 3.92 1.43 -0.10 -0.52 118.68 125.93 1i2m s LEU 38 Ca 0.16 -0.51 0.04 0.00 -1.03 0.00 0.00 54.13 52.80 1i2m s LEU 38 Cb -0.13 -1.07 -0.04 0.00 0.03 0.00 0.00 46.19 44.98 1i2m s LEU 38 CO 0.04 0.20 -0.11 0.42 0.23 0.00 0.00 176.35 177.14 1i2m s THR 39 N -0.74 1.09 0.12 5.49 -4.23 -0.26 -0.25 115.64 116.87 1i2m s THR 39 Ca 0.09 -1.81 -0.19 0.00 -1.18 0.00 0.00 61.69 58.59 1i2m s THR 39 Cb -0.09 -1.57 0.05 0.00 1.34 0.00 0.00 72.50 72.23 1i2m s THR 39 CO 0.01 -0.61 0.49 -1.48 -0.54 0.00 0.00 174.62 172.49 1i2m s LEU 40 N -2.72 -0.01 0.00 4.79 2.34 -0.77 -1.10 118.68 121.20 1i2m s LEU 40 Ca 0.10 -0.13 0.00 0.00 0.06 0.00 0.00 54.13 54.17 1i2m s LEU 40 Cb -0.01 2.15 0.00 0.00 -0.56 0.00 0.00 46.19 47.77 1i2m s LEU 40 CO 0.01 -0.87 0.00 0.61 -1.06 0.00 0.00 176.35 175.04 1i2m n GLY 41 N -0.17 0.23 3.87 -3.48 0.00 0.04 -1.04 105.19 104.64 1i2m n GLY 41 Ca -0.17 -1.93 -0.33 0.00 0.00 0.00 0.00 46.02 43.60 1i2m n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1i2m s GLN 42 N 0.00 3.80 -0.01 1.61 -1.52 -0.21 -1.29 119.66 122.04 1i2m s GLN 42 Ca 0.00 0.24 0.24 0.00 -1.95 0.00 0.00 55.36 53.89 1i2m s GLN 42 Cb 0.00 -2.77 0.41 0.00 -0.22 0.00 0.00 33.01 30.43 1i2m s GLN 42 CO 0.00 0.40 1.16 0.41 -0.25 0.00 0.00 175.29 177.01 1i2m n GLY 43 N 0.19 1.24 0.44 3.09 0.00 0.62 -4.49 105.19 106.29 1i2m n GLY 43 Ca -0.02 -0.84 0.27 0.00 0.00 0.00 0.00 46.02 45.43 1i2m n GLY 43 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1i2m h ASP 44 N 0.95 0.32 -0.20 1.61 3.32 -1.87 -1.20 116.42 119.36 1i2m h ASP 44 Ca -0.20 0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.91 1i2m h ASP 44 Cb 1.82 0.02 0.00 0.00 0.22 0.00 0.00 39.33 41.39 1i2m h ASP 44 CO 0.09 0.04 0.00 1.33 -1.72 0.00 0.00 179.24 178.98 1i2m n VAL 45 N -4.53 1.79 -0.20 -1.35 0.24 -1.26 -4.96 118.33 108.05 1i2m n VAL 45 Ca 0.26 -1.67 0.00 0.00 -2.04 0.00 0.00 64.34 60.90 1i2m n VAL 45 Cb 1.01 -0.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.37 1i2m n VAL 45 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1i2m n GLY 46 N -0.46 0.70 0.17 7.63 0.00 -0.45 -2.91 105.19 109.88 1i2m n GLY 46 Ca 0.16 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.30 1i2m n GLY 46 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1i2m h GLN 47 N 4.18 0.00 0.00 1.61 -0.00 -1.79 -1.36 115.11 117.75 1i2m h GLN 47 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 58.65 58.59 1i2m h GLN 47 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.47 1i2m h GLN 47 CO 0.00 0.00 -0.66 -0.07 -0.00 0.00 0.00 178.83 178.10 1i2m h LEU 48 N 0.00 0.00 1.04 0.06 3.38 -1.84 -3.41 115.31 114.54 1i2m h LEU 48 Ca 0.00 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.73 1i2m h LEU 48 Cb 0.12 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 1i2m h LEU 48 CO 0.00 0.26 -0.25 0.61 0.09 0.00 0.00 178.44 179.14 1i2m n GLY 49 N 1.21 0.66 1.19 0.83 0.00 -0.52 -4.78 105.19 103.78 1i2m n GLY 49 Ca -0.00 -0.45 0.08 0.00 0.00 0.00 0.00 46.02 45.65 1i2m n GLY 49 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1i2m n LEU 50 N -1.47 4.30 0.00 0.99 4.77 -1.12 -4.34 117.00 120.13 1i2m n LEU 50 Ca -0.13 -2.77 0.00 0.00 -0.03 0.00 0.00 56.01 53.09 1i2m n LEU 50 Cb 0.48 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1i2m n LEU 50 CO 0.17 0.70 0.00 0.61 -1.33 0.00 0.00 177.39 177.54 1i2m n GLY 51 N 0.14 2.21 0.35 -0.72 0.00 -0.57 -4.54 105.19 102.06 1i2m n GLY 51 Ca 0.22 -1.93 0.16 0.00 0.00 0.00 0.00 46.02 44.47 1i2m n GLY 51 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1i2m h GLU 52 N 0.00 0.00 -0.02 1.61 4.81 -1.85 -3.01 114.58 116.12 1i2m h GLU 52 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1i2m h GLU 52 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1i2m h GLU 52 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 178.37 1i2m n ASN 53 N -3.03 1.50 -4.39 1.04 3.02 -1.26 -4.90 115.26 107.24 1i2m n ASN 53 Ca -0.00 -1.36 -0.44 0.00 -0.03 0.00 0.00 54.58 52.74 1i2m n ASN 53 Cb 0.45 -0.02 -0.04 0.00 -0.61 0.00 0.00 39.78 39.56 1i2m n ASN 53 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1i2m s VAL 54 N -0.44 4.75 -1.40 2.41 1.01 -1.14 -4.83 120.40 120.77 1i2m s VAL 54 Ca 0.04 -0.97 0.22 0.00 0.00 0.00 0.00 61.98 61.27 1i2m s VAL 54 Cb 0.02 -4.54 -0.11 0.00 0.00 0.00 0.00 36.38 31.75 1i2m s VAL 54 CO 0.03 -1.20 1.03 0.23 0.00 0.00 0.00 175.10 175.19 1i2m n MET 55 N 6.51 0.46 -3.63 2.72 2.81 -1.26 -4.64 117.12 120.09 1i2m n MET 55 Ca -0.06 -0.37 -0.14 0.00 -1.81 0.00 0.00 57.70 55.32 1i2m n MET 55 Cb 0.43 -1.49 -0.07 0.00 -0.71 0.00 0.00 33.22 31.38 1i2m n MET 55 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1i2m s GLU 56 N -2.79 0.82 -0.11 0.03 2.12 -1.26 -0.27 118.70 117.24 1i2m s GLU 56 Ca 0.13 0.97 -0.02 0.00 0.36 0.00 0.00 54.97 56.41 1i2m s GLU 56 Cb 0.17 0.40 0.04 0.00 0.26 0.00 0.00 34.13 35.00 1i2m s GLU 56 CO 0.74 -0.10 0.01 1.03 -0.54 0.00 0.00 175.26 176.40 1i2m s ARG 57 N 0.36 0.66 0.31 4.30 1.81 -0.42 -4.97 118.95 121.01 1i2m s ARG 57 Ca 0.00 -0.06 0.24 0.00 -1.72 0.00 0.00 55.73 54.19 1i2m s ARG 57 Cb -0.05 -1.33 0.37 0.00 -0.45 0.00 0.00 34.95 33.50 1i2m s ARG 57 CO 0.01 -0.40 1.51 0.87 -0.68 0.00 0.00 175.30 176.60 1i2m h LYS 58 N 8.30 0.00 -4.92 3.54 1.57 -1.86 0.15 116.57 123.35 1i2m h LYS 58 Ca -0.19 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.27 1i2m h LYS 58 Cb 1.12 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.24 1i2m h LYS 58 CO 0.29 0.00 -0.74 0.15 -0.57 0.00 0.00 179.45 178.58 1i2m s LYS 59 N -3.21 0.77 0.02 3.15 1.02 -1.26 -3.78 119.74 116.44 1i2m s LYS 59 Ca 0.06 -1.04 -0.38 0.00 0.02 0.00 0.00 55.97 54.63 1i2m s LYS 59 Cb 0.08 -0.51 -0.18 0.00 -0.52 0.00 0.00 37.83 36.71 1i2m s LYS 59 CO 0.68 0.09 1.31 -2.30 -0.92 0.00 0.00 175.35 174.21 1i2m n PRO 60 N 0.86 0.82 -5.10 -1.68 -0.02 -1.26 -4.76 135.00 123.86 1i2m n PRO 60 Ca -0.18 0.30 -0.29 0.00 -2.02 0.00 0.00 63.50 61.30 1i2m n PRO 60 Cb 0.57 -1.90 -0.16 0.00 -0.02 0.00 0.00 33.50 31.98 1i2m n PRO 60 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1i2m s ALA 61 N 0.69 1.90 0.09 3.55 0.00 -0.26 -4.45 121.76 123.27 1i2m s ALA 61 Ca 0.88 -0.92 -0.31 0.00 0.00 0.00 0.00 51.96 51.61 1i2m s ALA 61 Cb -1.06 -0.57 -0.07 0.00 0.00 0.00 0.00 23.12 21.41 1i2m s ALA 61 CO 0.52 0.39 1.38 -1.17 0.00 0.00 0.00 175.76 176.88 1i2m s LEU 62 N -0.20 4.36 -0.20 0.00 2.96 -1.26 -1.10 118.68 123.24 1i2m s LEU 62 Ca -0.01 2.27 -0.09 0.00 -0.22 0.00 0.00 54.13 56.08 1i2m s LEU 62 Cb -0.12 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 1i2m s LEU 62 CO 0.02 -0.65 0.10 -0.69 -1.32 0.00 0.00 176.35 173.81 1i2m s VAL 63 N 1.36 5.03 -0.27 1.68 1.01 0.32 -4.95 120.40 124.58 1i2m s VAL 63 Ca 0.64 0.06 -0.26 0.00 0.00 0.00 0.00 61.98 62.42 1i2m s VAL 63 Cb -0.35 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 32.73 1i2m s VAL 63 CO 0.30 0.42 0.91 -0.44 0.00 0.00 0.00 175.10 176.29 1i2m s SER 64 N 0.62 6.87 -0.02 3.32 0.01 -1.26 -4.46 113.70 118.77 1i2m s SER 64 Ca 0.05 1.03 0.04 0.00 1.31 0.00 0.00 55.95 58.39 1i2m s SER 64 Cb -0.13 -2.47 -0.01 0.00 0.21 0.00 0.00 66.02 63.63 1i2m s SER 64 CO 0.01 -0.64 -0.15 -0.63 0.41 0.00 0.00 173.24 172.24 1i2m s ILE 65 N 3.09 1.23 -0.24 1.44 -1.09 -1.26 -4.75 121.20 119.62 1i2m s ILE 65 Ca 0.38 -0.64 0.18 0.00 -2.23 0.00 0.00 60.65 58.34 1i2m s ILE 65 Cb -0.14 -1.04 0.18 0.00 -1.58 0.00 0.00 42.46 39.87 1i2m s ILE 65 CO 0.10 0.35 1.51 -2.65 -1.23 0.00 0.00 174.94 173.02 1i2m n PRO 66 N 2.93 0.11 -4.24 2.79 -0.02 -1.26 -4.75 135.00 130.56 1i2m n PRO 66 Ca -0.16 0.60 -0.15 0.00 -2.02 0.00 0.00 63.50 61.77 1i2m n PRO 66 Cb 0.54 -1.94 -0.09 0.00 -0.02 0.00 0.00 33.50 31.99 1i2m n PRO 66 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1i2m s GLU 67 N -3.43 1.45 0.46 -0.52 2.02 -1.26 -5.14 118.70 112.27 1i2m s GLU 67 Ca -0.02 -1.80 -0.21 0.00 0.02 0.00 0.00 54.97 52.96 1i2m s GLU 67 Cb 0.05 0.30 -0.09 0.00 0.10 0.00 0.00 34.13 34.49 1i2m s GLU 67 CO 0.16 -0.51 1.03 -0.51 0.02 0.00 0.00 175.26 175.46 1i2m s ASP 68 N -3.25 6.48 -0.04 -0.19 1.01 -1.26 -4.94 116.67 114.47 1i2m s ASP 68 Ca 0.40 1.93 0.03 0.00 0.71 0.00 0.00 52.55 55.62 1i2m s ASP 68 Cb 0.05 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.39 1i2m s ASP 68 CO 0.19 -0.69 -0.10 -0.69 0.21 0.00 0.00 175.17 174.10 1i2m s VAL 69 N -1.92 3.44 -0.20 -1.27 1.01 -0.61 -1.17 120.40 119.68 1i2m s VAL 69 Ca 0.65 -0.66 0.13 0.00 0.00 0.00 0.00 61.98 62.10 1i2m s VAL 69 Cb -0.17 -2.41 -0.19 0.00 0.00 0.00 0.00 36.38 33.61 1i2m s VAL 69 CO 0.21 0.54 0.37 1.33 0.00 0.00 0.00 175.10 177.55 1i2m n VAL 70 N 2.06 0.00 -3.74 2.92 0.24 0.50 0.84 118.33 121.16 1i2m n VAL 70 Ca -0.17 -0.27 -0.12 0.00 -2.04 0.00 0.00 64.34 61.73 1i2m n VAL 70 Cb 0.53 0.44 -0.11 0.00 -1.47 0.00 0.00 33.84 33.23 1i2m n VAL 70 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1i2m s GLN 71 N -2.72 0.41 -0.18 7.34 0.74 -1.17 -4.47 119.66 119.61 1i2m s GLN 71 Ca -0.02 0.57 -0.02 0.00 0.05 0.00 0.00 55.36 55.94 1i2m s GLN 71 Cb 0.09 0.15 0.05 0.00 1.10 0.00 0.00 33.01 34.40 1i2m s GLN 71 CO 0.55 -0.08 0.01 0.00 -0.55 0.00 0.00 175.29 175.22 1i2m s ALA 72 N 0.49 1.12 -0.06 1.58 0.00 -1.26 -0.40 121.76 123.23 1i2m s ALA 72 Ca -0.02 -0.71 0.03 0.00 0.00 0.00 0.00 51.96 51.26 1i2m s ALA 72 Cb -0.04 -1.14 -0.03 0.00 0.00 0.00 0.00 23.12 21.91 1i2m s ALA 72 CO -0.03 -1.03 -0.12 -1.21 0.00 0.00 0.00 175.76 173.37 1i2m s GLU 73 N 1.80 2.61 -0.21 0.00 0.41 0.43 -4.56 118.70 119.17 1i2m s GLU 73 Ca -0.00 -0.65 -0.08 0.00 -0.41 0.00 0.00 54.97 53.83 1i2m s GLU 73 Cb -0.16 -2.45 -0.04 0.00 -1.78 0.00 0.00 34.13 29.69 1i2m s GLU 73 CO -0.07 0.62 0.09 0.00 -0.49 0.00 0.00 175.26 175.41 1i2m s ALA 74 N -0.72 3.38 0.47 5.21 0.00 -1.26 -0.91 121.76 127.93 1i2m s ALA 74 Ca 0.11 -0.88 -0.00 0.00 0.00 0.00 0.00 51.96 51.19 1i2m s ALA 74 Cb -0.11 -2.05 0.02 0.00 0.00 0.00 0.00 23.12 20.98 1i2m s ALA 74 CO 0.01 -0.08 0.12 0.41 0.00 0.00 0.00 175.76 176.22 1i2m n GLY 75 N 4.07 0.60 0.19 0.00 0.00 0.20 -4.58 105.19 105.67 1i2m n GLY 75 Ca -0.16 -1.94 -0.08 0.00 0.00 0.00 0.00 46.02 43.84 1i2m n GLY 75 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1i2m h GLY 76 N -0.08 0.65 -3.08 -0.02 0.00 -1.55 -3.35 103.07 95.64 1i2m h GLY 76 Ca -0.04 -0.30 -0.18 0.00 0.00 0.00 0.00 47.33 46.81 1i2m h GLY 76 CO 0.04 0.29 -1.02 1.03 0.00 0.00 0.00 176.54 176.88 1i2m n MET 77 N -4.70 0.21 -3.89 4.80 2.81 -1.26 -1.88 117.12 113.22 1i2m n MET 77 Ca 0.01 -2.17 -0.09 0.00 -1.81 0.00 0.00 57.70 53.64 1i2m n MET 77 Cb 0.09 -0.20 -0.04 0.00 -0.71 0.00 0.00 33.22 32.36 1i2m n MET 77 CO 0.00 0.00 0.00 -3.38 1.51 0.00 0.00 175.97 174.10 1i2m s HIS 78 N -0.43 0.09 0.00 2.03 0.00 -1.26 -1.57 115.29 114.15 1i2m s HIS 78 Ca 0.34 -0.47 0.03 0.00 -3.00 0.00 0.00 55.06 51.96 1i2m s HIS 78 Cb 0.38 0.37 -0.01 0.00 -4.00 0.00 0.00 32.58 29.32 1i2m s HIS 78 CO -0.16 -1.02 -0.10 0.99 -1.00 0.00 0.00 174.74 173.46 1i2m s THR 79 N -3.95 0.74 -0.08 -5.38 2.01 0.57 0.60 115.64 110.15 1i2m s THR 79 Ca 0.16 -0.51 0.01 0.00 0.31 0.00 0.00 61.69 61.65 1i2m s THR 79 Cb -0.02 -0.65 0.02 0.00 0.01 0.00 0.00 72.50 71.86 1i2m s THR 79 CO 0.05 0.13 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.31 1i2m s VAL 80 N -0.38 1.04 0.00 3.82 1.01 -0.09 -1.83 120.40 123.97 1i2m s VAL 80 Ca 0.02 -0.39 0.08 0.00 0.00 0.00 0.00 61.98 61.69 1i2m s VAL 80 Cb -0.05 -0.99 -0.02 0.00 0.00 0.00 0.00 36.38 35.33 1i2m s VAL 80 CO -0.00 0.34 -0.25 0.00 0.00 0.00 0.00 175.10 175.19 1i2m s LEU 82 N -0.86 3.02 0.65 0.00 2.96 0.46 -0.94 118.68 123.97 1i2m s LEU 82 Ca 0.11 -0.28 -0.09 0.00 -0.22 0.00 0.00 54.13 53.64 1i2m s LEU 82 Cb -0.10 -1.75 0.00 0.00 0.50 0.00 0.00 46.19 44.85 1i2m s LEU 82 CO 0.00 0.07 1.01 -0.94 -1.32 0.00 0.00 176.35 175.17 1i2m s SER 83 N 0.96 5.63 0.53 3.68 1.04 0.35 -0.37 113.70 125.53 1i2m s SER 83 Ca 0.00 1.02 0.20 0.00 0.48 0.00 0.00 55.95 57.65 1i2m s SER 83 Cb -0.15 -1.94 1.37 0.00 0.10 0.00 0.00 66.02 65.40 1i2m s SER 83 CO 0.01 -1.16 2.12 0.50 0.98 0.00 0.00 173.24 175.69 1i2m h LYS 84 N -0.42 0.00 -0.01 4.02 1.63 -1.46 -0.45 116.57 119.89 1i2m h LYS 84 Ca -0.45 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.35 1i2m h LYS 84 Cb 1.24 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.87 1i2m h LYS 84 CO 0.63 0.00 -0.08 -1.13 -3.45 0.00 0.00 179.45 175.41 1i2m n SER 85 N -4.41 0.63 0.00 4.20 3.41 -1.26 -4.91 113.62 111.28 1i2m n SER 85 Ca 0.00 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.77 1i2m n SER 85 Cb 0.22 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 1i2m n SER 85 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i2m n GLY 86 N 1.22 0.76 3.88 5.00 0.00 -0.18 -4.78 105.19 111.09 1i2m n GLY 86 Ca 0.17 -0.43 -0.35 0.00 0.00 0.00 0.00 46.02 45.41 1i2m n GLY 86 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1i2m s GLN 87 N -0.78 3.40 -0.13 1.61 -0.21 -1.26 -2.02 119.66 120.27 1i2m s GLN 87 Ca 0.00 -0.25 -0.05 0.00 0.02 0.00 0.00 55.36 55.07 1i2m s GLN 87 Cb 0.00 -3.11 -0.04 0.00 1.00 0.00 0.00 33.01 30.86 1i2m s GLN 87 CO 0.00 0.72 0.07 0.08 -2.12 0.00 0.00 175.29 174.04 1i2m s VAL 88 N -1.18 4.89 0.08 1.09 1.01 -1.26 -0.49 120.40 124.54 1i2m s VAL 88 Ca 0.21 -0.02 0.09 0.00 0.00 0.00 0.00 61.98 62.26 1i2m s VAL 88 Cb -0.12 -3.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 1i2m s VAL 88 CO 0.12 0.56 -0.23 -0.31 0.00 0.00 0.00 175.10 175.24 1i2m s TYR 89 N -0.54 1.97 0.06 5.22 1.51 -0.12 -0.52 117.35 124.94 1i2m s TYR 89 Ca 0.11 -0.40 -0.08 0.00 -1.01 0.00 0.00 57.07 55.69 1i2m s TYR 89 Cb -0.12 -1.12 -0.00 0.00 -0.11 0.00 0.00 41.96 40.61 1i2m s TYR 89 CO 0.02 0.18 0.17 -1.54 -1.11 0.00 0.00 175.55 173.27 1i2m s SER 90 N -1.59 0.12 -0.06 2.29 1.04 -0.34 -0.55 113.70 114.60 1i2m s SER 90 Ca 0.09 -0.56 -0.30 0.00 0.48 0.00 0.00 55.95 55.66 1i2m s SER 90 Cb -0.10 0.30 0.07 0.00 0.10 0.00 0.00 66.02 66.39 1i2m s SER 90 CO 0.03 -0.63 0.68 0.72 0.98 0.00 0.00 173.24 175.02 1i2m s PHE 91 N -3.24 -0.66 -2.71 5.02 -0.71 -0.76 -1.95 117.98 112.96 1i2m s PHE 91 Ca 0.00 1.18 0.00 0.00 -1.04 0.00 0.00 56.93 57.07 1i2m s PHE 91 Cb 0.02 0.40 0.00 0.00 -1.21 0.00 0.00 43.02 42.23 1i2m s PHE 91 CO -0.08 -0.59 0.00 0.41 -1.34 0.00 0.00 175.22 173.62 1i2m n GLY 92 N 1.04 0.76 3.67 1.99 0.00 -0.25 -0.32 105.19 112.08 1i2m n GLY 92 Ca -0.19 -2.05 -0.43 0.00 0.00 0.00 0.00 46.02 43.36 1i2m n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i2m n ASN 94 N 6.09 3.26 0.25 0.00 5.15 -1.26 -4.45 115.26 124.30 1i2m n ASN 94 Ca 0.13 -3.30 0.08 0.00 -0.60 0.00 0.00 54.58 50.89 1i2m n ASN 94 Cb 0.45 -0.57 0.61 0.00 -0.53 0.00 0.00 39.78 39.74 1i2m n ASN 94 CO 0.00 0.00 0.00 0.44 1.40 0.00 0.00 177.26 179.10 1i2m h ASP 95 N 1.36 0.00 -0.24 1.20 3.32 -2.00 -2.55 116.42 117.52 1i2m h ASP 95 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1i2m h ASP 95 Cb 1.51 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.06 1i2m h ASP 95 CO 0.28 0.10 0.00 -0.62 -1.72 0.00 0.00 179.24 177.28 1i2m n GLU 96 N -4.25 2.12 -0.46 3.56 -0.58 -1.26 -4.97 120.64 114.78 1i2m n GLU 96 Ca -0.03 -1.77 0.00 0.00 -0.42 0.00 0.00 57.16 54.95 1i2m n GLU 96 Cb 0.18 -1.25 0.00 0.00 -0.57 0.00 0.00 31.44 29.80 1i2m n GLU 96 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1i2m n GLY 97 N 0.56 0.76 0.37 0.62 0.00 -0.96 -3.62 105.19 102.93 1i2m n GLY 97 Ca 0.10 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.32 1i2m n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i2m h ALA 98 N 0.00 2.32 0.00 4.61 0.00 -1.78 -1.46 119.26 122.95 1i2m h ALA 98 Ca 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1i2m h ALA 98 Cb 0.00 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1i2m h ALA 98 CO 0.00 -0.59 -0.02 -0.07 0.00 0.00 0.00 179.25 178.56 1i2m h LEU 99 N 0.00 0.00 0.05 0.00 3.38 -1.89 -3.41 115.31 113.44 1i2m h LEU 99 Ca 0.21 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.77 1i2m h LEU 99 Cb 0.93 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.76 1i2m h LEU 99 CO -0.00 0.02 -0.65 0.61 0.09 0.00 0.00 178.44 178.51 1i2m n GLY 100 N 0.82 -0.53 3.46 0.83 0.00 -0.55 -4.76 105.19 104.46 1i2m n GLY 100 Ca 0.03 0.19 -0.11 0.00 0.00 0.00 0.00 46.02 46.12 1i2m n GLY 100 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1i2m s ARG 101 N -6.05 1.32 -0.20 1.61 1.70 -1.24 -4.24 118.95 111.84 1i2m s ARG 101 Ca 0.46 -0.53 -0.29 0.00 -0.47 0.00 0.00 55.73 54.90 1i2m s ARG 101 Cb -0.21 0.59 -0.01 0.00 -0.57 0.00 0.00 34.95 34.75 1i2m s ARG 101 CO 0.57 -0.58 1.21 0.34 -1.08 0.00 0.00 175.30 175.76 1i2m s ASP 102 N -2.77 6.95 -0.28 -2.89 2.15 -1.26 -4.91 116.67 113.66 1i2m s ASP 102 Ca 0.02 1.55 0.08 0.00 0.43 0.00 0.00 52.55 54.63 1i2m s ASP 102 Cb -0.01 -2.54 0.45 0.00 -0.30 0.00 0.00 42.92 40.52 1i2m s ASP 102 CO -0.11 -0.78 1.25 0.35 -0.17 0.00 0.00 175.17 175.71 1i2m n THR 103 N 5.47 2.49 -0.34 1.71 -2.24 -1.26 -4.77 114.28 115.34 1i2m n THR 103 Ca 0.13 -3.83 -0.02 0.00 -2.27 0.00 0.00 64.05 58.06 1i2m n THR 103 Cb 0.45 -0.85 0.13 0.00 -2.10 0.00 0.00 70.33 67.96 1i2m n THR 103 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1i2m h SER 104 N 1.79 1.10 -3.14 3.42 0.02 -1.99 -3.42 113.55 111.33 1i2m h SER 104 Ca 0.27 -0.05 -0.54 0.00 -0.84 0.00 0.00 61.79 60.63 1i2m h SER 104 Cb 1.37 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 63.63 1i2m h SER 104 CO 0.57 0.82 0.62 -0.69 -1.14 0.00 0.00 176.83 177.02 1i2m s VAL 105 N -5.98 4.06 0.14 2.27 1.01 -1.26 -4.95 120.40 115.68 1i2m s VAL 105 Ca -0.13 1.45 -0.35 0.00 0.00 0.00 0.00 61.98 62.96 1i2m s VAL 105 Cb 0.18 -3.93 -0.15 0.00 0.00 0.00 0.00 36.38 32.47 1i2m s VAL 105 CO 0.82 0.07 1.39 1.21 0.00 0.00 0.00 175.10 178.59 1i2m n GLU 106 N 4.39 1.55 0.00 2.72 2.13 -1.26 -1.57 120.64 128.60 1i2m n GLU 106 Ca 0.10 0.56 0.00 0.00 0.66 0.00 0.00 57.16 58.48 1i2m n GLU 106 Cb 0.46 -2.22 0.00 0.00 0.27 0.00 0.00 31.44 29.95 1i2m n GLU 106 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1i2m n GLY 107 N 2.68 2.45 0.31 8.31 0.00 -1.26 -4.91 105.19 112.77 1i2m n GLY 107 Ca 0.17 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.36 1i2m n GLY 107 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1i2m h SER 108 N 0.00 0.00 1.27 1.61 4.64 -1.59 -1.25 113.55 118.23 1i2m h SER 108 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1i2m h SER 108 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1i2m h SER 108 CO 0.00 0.01 -0.21 -1.84 -0.87 0.00 0.00 176.83 173.92 1i2m n GLU 109 N -3.63 0.27 0.00 4.77 0.00 -1.26 -3.77 120.64 117.01 1i2m n GLU 109 Ca -0.03 0.17 0.13 0.00 0.00 0.00 0.00 57.16 57.44 1i2m n GLU 109 Cb 0.09 -1.76 0.48 0.00 0.00 0.00 0.00 31.44 30.25 1i2m n GLU 109 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1i2m n MET 110 N -2.20 0.41 -4.27 3.44 2.81 -0.47 -1.09 117.12 115.74 1i2m n MET 110 Ca 0.05 -0.17 -0.16 0.00 -1.81 0.00 0.00 57.70 55.61 1i2m n MET 110 Cb 0.43 -1.50 -0.10 0.00 -0.71 0.00 0.00 33.22 31.34 1i2m n MET 110 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1i2m s VAL 111 N -2.71 1.33 0.34 2.03 -7.23 -1.25 -1.51 120.40 111.41 1i2m s VAL 111 Ca 0.21 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 58.09 1i2m s VAL 111 Cb 0.19 -1.80 -0.12 0.00 0.56 0.00 0.00 36.38 35.21 1i2m s VAL 111 CO 0.55 -0.63 1.47 -2.65 -0.31 0.00 0.00 175.10 173.53 1i2m n PRO 112 N -0.05 2.53 -3.93 4.82 -0.02 -1.26 -4.64 135.00 132.45 1i2m n PRO 112 Ca -0.11 0.89 -0.10 0.00 -2.02 0.00 0.00 63.50 62.16 1i2m n PRO 112 Cb 0.60 -2.60 -0.12 0.00 -0.02 0.00 0.00 33.50 31.36 1i2m n PRO 112 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1i2m s GLY 113 N 0.01 0.13 0.33 -1.23 0.00 -0.82 -4.93 107.32 100.81 1i2m s GLY 113 Ca 0.57 -0.32 -0.27 0.00 0.00 0.00 0.00 44.72 44.70 1i2m s GLY 113 CO 0.59 -0.37 1.04 1.25 0.00 0.00 0.00 173.10 175.61 1i2m s LYS 114 N -0.85 4.48 -0.28 2.90 2.20 -1.26 -1.20 119.74 125.72 1i2m s LYS 114 Ca -0.09 1.58 -0.17 0.00 -0.36 0.00 0.00 55.97 56.93 1i2m s LYS 114 Cb -0.06 -2.90 -0.02 0.00 -1.51 0.00 0.00 37.83 33.34 1i2m s LYS 114 CO -0.01 0.13 0.49 0.08 -0.36 0.00 0.00 175.35 175.68 1i2m s VAL 115 N -1.42 5.08 -0.54 4.02 1.01 0.32 -4.84 120.40 124.03 1i2m s VAL 115 Ca 0.50 0.69 -0.27 0.00 0.00 0.00 0.00 61.98 62.90 1i2m s VAL 115 Cb -0.25 -3.83 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 1i2m s VAL 115 CO 0.32 0.03 1.87 -1.61 0.00 0.00 0.00 175.10 175.71 1i2m s GLU 116 N 2.29 2.77 -0.28 2.72 2.02 -1.26 -4.62 118.70 122.34 1i2m s GLU 116 Ca 0.19 0.83 0.01 0.00 0.02 0.00 0.00 54.97 56.02 1i2m s GLU 116 Cb -0.16 -4.35 0.15 0.00 0.10 0.00 0.00 34.13 29.88 1i2m s GLU 116 CO 0.10 -2.55 0.40 -1.17 0.02 0.00 0.00 175.26 172.07 1i2m s LEU 117 N 8.71 -0.75 -1.31 1.80 2.96 -1.26 -4.78 118.68 124.04 1i2m s LEU 117 Ca 0.71 -0.21 -0.11 0.00 -0.22 0.00 0.00 54.13 54.31 1i2m s LEU 117 Cb -0.15 1.12 -0.06 0.00 0.50 0.00 0.00 46.19 47.60 1i2m s LEU 117 CO 0.24 -0.34 2.47 0.00 -1.32 0.00 0.00 176.35 177.40 1i2m n GLN 118 N 5.36 2.86 -3.92 1.98 6.02 -1.26 -4.80 117.38 123.61 1i2m n GLN 118 Ca -0.01 -2.05 -0.09 0.00 -0.01 0.00 0.00 57.00 54.84 1i2m n GLN 118 Cb 0.49 -2.83 -0.09 0.00 1.02 0.00 0.00 30.24 28.84 1i2m n GLN 118 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1i2m s GLU 119 N 3.03 0.63 -0.55 -1.09 0.41 -1.26 -5.10 118.70 114.77 1i2m s GLU 119 Ca 0.56 -0.78 -0.19 0.00 -0.41 0.00 0.00 54.97 54.15 1i2m s GLU 119 Cb 0.15 0.25 0.08 0.00 -1.78 0.00 0.00 34.13 32.83 1i2m s GLU 119 CO -0.04 -0.16 0.67 0.21 -0.49 0.00 0.00 175.26 175.45 1i2m s LYS 120 N -2.79 3.08 0.15 1.61 2.20 -1.26 -4.73 119.74 118.00 1i2m s LYS 120 Ca -0.03 -1.11 -0.24 0.00 -0.36 0.00 0.00 55.97 54.22 1i2m s LYS 120 Cb -0.00 -4.19 -0.08 0.00 -1.51 0.00 0.00 37.83 32.06 1i2m s LYS 120 CO -0.05 -1.39 0.75 0.08 -0.36 0.00 0.00 175.35 174.37 1i2m s VAL 121 N 2.67 4.42 -0.25 4.02 1.01 -0.85 -0.60 120.40 130.82 1i2m s VAL 121 Ca 0.13 1.63 0.06 0.00 0.00 0.00 0.00 61.98 63.81 1i2m s VAL 121 Cb -0.22 -4.10 -0.07 0.00 0.00 0.00 0.00 36.38 31.99 1i2m s VAL 121 CO 0.09 0.53 0.24 1.33 0.00 0.00 0.00 175.10 177.29 1i2m n VAL 122 N 1.62 0.00 -3.59 2.92 0.24 0.74 -4.34 118.33 115.92 1i2m n VAL 122 Ca -0.06 -0.33 -0.14 0.00 -2.04 0.00 0.00 64.34 61.77 1i2m n VAL 122 Cb 0.49 0.92 -0.06 0.00 -1.47 0.00 0.00 33.84 33.72 1i2m n VAL 122 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1i2m s GLN 123 N -1.68 0.80 0.17 7.34 0.74 -1.20 -4.47 119.66 121.37 1i2m s GLN 123 Ca 0.02 0.52 0.05 0.00 0.05 0.00 0.00 55.36 55.99 1i2m s GLN 123 Cb 0.05 0.38 -0.05 0.00 1.10 0.00 0.00 33.01 34.49 1i2m s GLN 123 CO 0.25 -0.18 -0.09 0.14 -0.55 0.00 0.00 175.29 174.86 1i2m s VAL 124 N -0.44 1.20 0.01 1.34 -7.23 -1.26 -0.01 120.40 114.01 1i2m s VAL 124 Ca -0.03 -2.07 -0.09 0.00 -1.81 0.00 0.00 61.98 57.97 1i2m s VAL 124 Cb -0.03 -1.97 0.00 0.00 0.56 0.00 0.00 36.38 34.95 1i2m s VAL 124 CO 0.03 -0.65 0.18 -0.94 -0.31 0.00 0.00 175.10 173.41 1i2m s SER 125 N -3.21 0.00 -0.01 4.85 1.04 -0.49 -4.95 113.70 110.93 1i2m s SER 125 Ca 0.20 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.40 1i2m s SER 125 Cb 0.03 0.25 0.01 0.00 0.10 0.00 0.00 66.02 66.40 1i2m s SER 125 CO 0.03 -0.45 -0.00 0.00 0.98 0.00 0.00 173.24 173.80 1i2m s ALA 126 N -1.79 0.10 0.00 5.32 0.00 -1.26 -0.77 121.76 123.36 1i2m s ALA 126 Ca -0.11 0.03 0.00 0.00 0.00 0.00 0.00 51.96 51.87 1i2m s ALA 126 Cb -0.05 -0.08 0.00 0.00 0.00 0.00 0.00 23.12 22.99 1i2m s ALA 126 CO 0.00 -0.01 0.00 0.41 0.00 0.00 0.00 175.76 176.17 1i2m n GLY 127 N 3.31 4.09 0.19 0.00 0.00 -0.16 -4.56 105.19 108.07 1i2m n GLY 127 Ca -0.16 -1.90 -0.18 0.00 0.00 0.00 0.00 46.02 43.78 1i2m n GLY 127 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1i2m h ASP 128 N 0.00 0.82 0.00 1.61 3.32 -0.79 -1.81 116.42 119.57 1i2m h ASP 128 Ca 0.00 -0.64 0.00 0.00 0.02 0.00 0.00 57.03 56.41 1i2m h ASP 128 Cb 0.00 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.30 1i2m h ASP 128 CO 0.00 1.44 0.00 -1.20 -1.72 0.00 0.00 179.24 177.76 1i2m n SER 129 N -3.84 0.64 -4.24 6.45 7.64 -1.26 -4.48 113.62 114.54 1i2m n SER 129 Ca -0.09 -1.32 -0.13 0.00 1.01 0.00 0.00 58.87 58.34 1i2m n SER 129 Cb 0.85 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.95 1i2m n SER 129 CO 0.00 0.00 0.00 -1.38 -3.01 0.00 0.00 175.04 170.65 1i2m s HIS 130 N -0.32 1.18 -0.00 1.43 -3.43 -1.21 -0.66 115.29 112.29 1i2m s HIS 130 Ca 0.00 -0.89 -0.00 0.00 -0.80 0.00 0.00 55.06 53.37 1i2m s HIS 130 Cb 0.00 -0.65 0.00 0.00 -1.43 0.00 0.00 32.58 30.50 1i2m s HIS 130 CO 0.00 -0.08 0.00 0.99 -2.00 0.00 0.00 174.74 173.66 1i2m s THR 131 N -3.51 -0.00 0.06 -5.38 2.01 -0.63 -0.98 115.64 107.20 1i2m s THR 131 Ca 0.19 0.01 0.08 0.00 0.31 0.00 0.00 61.69 62.28 1i2m s THR 131 Cb 0.05 -0.02 -0.03 0.00 0.01 0.00 0.00 72.50 72.51 1i2m s THR 131 CO 0.01 0.00 -0.23 0.00 -0.69 0.00 0.00 174.62 173.72 1i2m s ALA 132 N 0.04 1.93 -0.03 7.40 0.00 0.05 -1.79 121.76 129.37 1i2m s ALA 132 Ca -0.00 -1.17 0.01 0.00 0.00 0.00 0.00 51.96 50.80 1i2m s ALA 132 Cb -0.01 -0.36 0.01 0.00 0.00 0.00 0.00 23.12 22.77 1i2m s ALA 132 CO -0.00 0.43 -0.05 0.00 0.00 0.00 0.00 175.76 176.14 1i2m s ALA 133 N -0.88 0.62 -0.22 0.00 0.00 0.48 -1.39 121.76 120.37 1i2m s ALA 133 Ca 0.09 -0.13 -0.08 0.00 0.00 0.00 0.00 51.96 51.84 1i2m s ALA 133 Cb -0.09 -0.31 -0.04 0.00 0.00 0.00 0.00 23.12 22.68 1i2m s ALA 133 CO 0.03 0.05 0.07 -1.17 0.00 0.00 0.00 175.76 174.74 1i2m s LEU 134 N 0.51 3.63 0.58 0.00 2.96 0.99 -0.67 118.68 126.66 1i2m s LEU 134 Ca -0.07 -0.08 -0.10 0.00 -0.22 0.00 0.00 54.13 53.67 1i2m s LEU 134 Cb -0.10 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.60 1i2m s LEU 134 CO 0.00 0.05 0.97 0.42 -1.32 0.00 0.00 176.35 176.47 1i2m s THR 135 N 1.10 4.74 0.67 3.68 -4.23 0.32 -0.19 115.64 121.73 1i2m s THR 135 Ca 0.04 0.75 0.40 0.00 -1.18 0.00 0.00 61.69 61.71 1i2m s THR 135 Cb -0.14 -3.86 0.40 0.00 1.34 0.00 0.00 72.50 70.25 1i2m s THR 135 CO 0.03 -1.05 2.24 -2.24 -0.54 0.00 0.00 174.62 173.07 1i2m h ASP 136 N -0.10 0.00 -0.68 3.99 2.03 -1.18 -0.13 116.42 120.35 1i2m h ASP 136 Ca -0.45 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.85 1i2m h ASP 136 Cb 1.19 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.69 1i2m h ASP 136 CO 0.62 0.00 0.00 -0.90 -1.03 0.00 0.00 179.24 177.93 1i2m n ASP 137 N -3.05 3.97 0.00 4.15 5.75 -1.26 -1.61 116.55 124.50 1i2m n ASP 137 Ca -0.03 -2.07 0.00 0.00 -0.01 0.00 0.00 54.79 52.69 1i2m n ASP 137 Cb 0.16 -0.48 0.00 0.00 -1.03 0.00 0.00 41.12 39.78 1i2m n ASP 137 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1i2m n GLY 138 N 1.45 0.75 3.86 6.12 0.00 -0.06 -4.77 105.19 112.55 1i2m n GLY 138 Ca 0.23 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 1i2m n GLY 138 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1i2m s ARG 139 N -0.65 3.81 -0.17 1.61 0.52 -1.26 -1.02 118.95 121.78 1i2m s ARG 139 Ca 0.00 0.25 -0.03 0.00 -0.52 0.00 0.00 55.73 55.43 1i2m s ARG 139 Cb 0.00 -2.92 -0.02 0.00 0.52 0.00 0.00 34.95 32.53 1i2m s ARG 139 CO 0.00 0.50 -0.05 0.08 0.02 0.00 0.00 175.30 175.85 1i2m s VAL 140 N -1.49 3.64 0.01 3.52 1.01 -1.26 -0.53 120.40 125.30 1i2m s VAL 140 Ca 0.37 -0.43 0.03 0.00 0.00 0.00 0.00 61.98 61.95 1i2m s VAL 140 Cb -0.14 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.60 1i2m s VAL 140 CO 0.19 0.47 -0.05 -0.36 0.00 0.00 0.00 175.10 175.35 1i2m s PHE 141 N 0.74 2.93 0.02 5.22 0.40 0.15 -0.14 117.98 127.31 1i2m s PHE 141 Ca -0.02 -0.01 -0.01 0.00 -0.60 0.00 0.00 56.93 56.29 1i2m s PHE 141 Cb -0.15 -1.62 -0.02 0.00 0.51 0.00 0.00 43.02 41.75 1i2m s PHE 141 CO 0.02 0.40 -0.00 -1.17 0.70 0.00 0.00 175.22 175.17 1i2m s LEU 142 N -1.50 2.12 0.15 -0.37 2.96 0.49 -0.39 118.68 122.13 1i2m s LEU 142 Ca 0.18 -0.43 -0.15 0.00 -0.22 0.00 0.00 54.13 53.51 1i2m s LEU 142 Cb -0.11 0.19 0.02 0.00 0.50 0.00 0.00 46.19 46.79 1i2m s LEU 142 CO 0.09 -0.30 0.40 -1.66 -1.32 0.00 0.00 176.35 173.56 1i2m s TRP 143 N -1.38 -0.06 0.00 5.38 -2.14 -0.74 -0.85 118.94 119.15 1i2m s TRP 143 Ca -0.15 -0.28 0.00 0.00 2.66 0.00 0.00 56.10 58.33 1i2m s TRP 143 Cb -0.09 0.22 0.00 0.00 -3.10 0.00 0.00 33.47 30.50 1i2m s TRP 143 CO -0.01 -0.75 0.00 0.41 -2.66 0.00 0.00 176.95 173.95 1i2m n GLY 144 N -0.24 1.08 3.74 3.67 0.00 0.11 -1.60 105.19 111.95 1i2m n GLY 144 Ca -0.13 -1.58 -0.08 0.00 0.00 0.00 0.00 46.02 44.23 1i2m n GLY 144 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1i2m s SER 145 N -4.00 -0.33 0.08 1.61 0.15 0.16 -1.15 113.70 110.23 1i2m s SER 145 Ca 0.00 -0.43 0.06 0.00 0.70 0.00 0.00 55.95 56.28 1i2m s SER 145 Cb 0.00 0.67 -0.04 0.00 -1.71 0.00 0.00 66.02 64.94 1i2m s SER 145 CO 0.00 -1.20 -0.08 -0.36 1.20 0.00 0.00 173.24 172.80 1i2m s PHE 146 N -3.79 2.79 0.13 3.44 0.40 -0.21 -3.30 117.98 117.44 1i2m s PHE 146 Ca 0.09 -0.12 0.07 0.00 -0.60 0.00 0.00 56.93 56.36 1i2m s PHE 146 Cb -0.04 -1.48 -0.04 0.00 0.51 0.00 0.00 43.02 41.97 1i2m s PHE 146 CO 0.01 0.42 -0.16 1.03 0.70 0.00 0.00 175.22 177.22 1i2m s ARG 147 N -2.06 1.08 0.00 0.44 0.52 -1.26 -1.42 118.95 116.25 1i2m s ARG 147 Ca 0.21 -1.25 0.00 0.00 -0.52 0.00 0.00 55.73 54.17 1i2m s ARG 147 Cb -0.11 -1.06 0.00 0.00 0.52 0.00 0.00 34.95 34.30 1i2m s ARG 147 CO 0.13 0.22 0.00 -0.40 0.02 0.00 0.00 175.30 175.27 1i2m n ASP 148 N 0.60 1.27 -0.19 0.23 5.75 -0.10 -4.76 116.55 119.36 1i2m n ASP 148 Ca -0.16 -0.65 0.00 0.00 -0.01 0.00 0.00 54.79 53.97 1i2m n ASP 148 Cb 0.56 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.65 1i2m n ASP 148 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1i2m n ASN 149 N -1.12 0.24 0.00 -1.12 5.15 -1.26 -2.21 115.26 114.94 1i2m n ASN 149 Ca 0.00 -1.28 0.00 0.00 -0.60 0.00 0.00 54.58 52.70 1i2m n ASN 149 Cb 0.00 -0.12 0.00 0.00 -0.53 0.00 0.00 39.78 39.13 1i2m n ASN 149 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1i2m n ASN 150 N -0.25 0.36 0.00 1.20 3.02 -1.26 -5.15 115.26 113.19 1i2m n ASN 150 Ca 0.00 -1.12 0.00 0.00 -0.03 0.00 0.00 54.58 53.43 1i2m n ASN 150 Cb 0.06 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.23 1i2m n ASN 150 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1i2m n GLY 151 N -0.06 0.22 3.71 7.41 0.00 -0.94 -5.03 105.19 110.50 1i2m n GLY 151 Ca 0.00 -2.27 -0.42 0.00 0.00 0.00 0.00 46.02 43.33 1i2m n GLY 151 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i2m s VAL 152 N 0.00 2.36 -0.76 1.61 1.01 -1.26 -0.92 120.40 122.44 1i2m s VAL 152 Ca 0.00 0.17 0.10 0.00 0.00 0.00 0.00 61.98 62.25 1i2m s VAL 152 Cb 0.00 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.24 1i2m s VAL 152 CO 0.00 0.01 0.56 2.30 0.00 0.00 0.00 175.10 177.97 1i2m n ILE 153 N 4.20 0.00 0.00 2.22 -5.35 -0.51 -4.78 119.36 115.14 1i2m n ILE 153 Ca 0.16 -0.36 0.00 0.00 -0.27 0.00 0.00 62.75 62.28 1i2m n ILE 153 Cb 0.37 1.08 0.00 0.00 -1.74 0.00 0.00 39.64 39.35 1i2m n ILE 153 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1i2m n GLY 154 N 0.99 -1.40 0.31 3.28 0.00 -1.22 -0.64 105.19 106.51 1i2m n GLY 154 Ca 0.03 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 43.86 1i2m n GLY 154 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1i2m n LEU 155 N 0.00 0.00 -0.01 0.99 7.94 -0.01 -1.04 117.00 124.87 1i2m n LEU 155 Ca 0.00 0.00 0.06 0.00 -1.11 0.00 0.00 56.01 54.96 1i2m n LEU 155 Cb 0.00 -0.05 -0.09 0.00 0.53 0.00 0.00 43.42 43.81 1i2m n LEU 155 CO 0.00 -0.21 -0.64 0.18 -1.11 0.00 0.00 177.39 175.61 1i2m n LEU 156 N -1.70 0.00 -4.26 -1.96 4.77 -1.26 -4.82 117.00 107.77 1i2m n LEU 156 Ca 0.00 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.70 1i2m n LEU 156 Cb 0.00 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 40.94 1i2m n LEU 156 CO 0.00 0.00 -0.54 -1.61 -1.33 0.00 0.00 177.39 173.91 1i2m s GLU 157 N -2.79 1.70 0.21 3.23 2.02 -1.26 -4.68 118.70 117.14 1i2m s GLU 157 Ca -0.04 -0.87 -0.30 0.00 0.02 0.00 0.00 54.97 53.77 1i2m s GLU 157 Cb 0.07 -1.72 -0.15 0.00 0.10 0.00 0.00 34.13 32.43 1i2m s GLU 157 CO 0.47 0.46 0.98 -2.30 0.02 0.00 0.00 175.26 174.89 1i2m n PRO 158 N 2.27 0.97 -1.36 0.39 -0.02 -1.26 -1.89 135.00 134.09 1i2m n PRO 158 Ca -0.16 0.34 -0.12 0.00 -2.02 0.00 0.00 63.50 61.54 1i2m n PRO 158 Cb 0.52 -1.70 -0.05 0.00 -0.02 0.00 0.00 33.50 32.26 1i2m n PRO 158 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1i2m n MET 159 N 1.21 -1.28 -3.89 -0.52 2.81 0.18 -4.86 117.12 110.77 1i2m n MET 159 Ca 0.14 0.72 -0.27 0.00 -1.81 0.00 0.00 57.70 56.48 1i2m n MET 159 Cb 0.27 -4.95 -0.17 0.00 -0.71 0.00 0.00 33.22 27.66 1i2m n MET 159 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1i2m s LYS 160 N -3.05 1.44 0.58 0.03 1.02 -0.79 -4.70 119.74 114.26 1i2m s LYS 160 Ca 0.00 -0.34 -0.04 0.00 0.02 0.00 0.00 55.97 55.61 1i2m s LYS 160 Cb 0.00 -1.73 0.02 0.00 -0.52 0.00 0.00 37.83 35.60 1i2m s LYS 160 CO 0.00 -0.34 0.87 -1.59 -0.92 0.00 0.00 175.35 173.37 1i2m s LYS 161 N 1.69 2.81 -0.09 1.68 -2.85 -1.26 -0.83 119.74 120.89 1i2m s LYS 161 Ca 0.03 -0.19 0.00 0.00 -1.00 0.00 0.00 55.97 54.82 1i2m s LYS 161 Cb -0.14 -2.32 0.02 0.00 -2.06 0.00 0.00 37.83 33.33 1i2m s LYS 161 CO -0.08 -0.70 -0.07 0.45 0.10 0.00 0.00 175.35 175.04 1i2m s SER 162 N -4.33 1.94 0.21 0.03 0.15 -0.30 -4.92 113.70 106.48 1i2m s SER 162 Ca 0.54 -0.26 0.26 0.00 0.70 0.00 0.00 55.95 57.19 1i2m s SER 162 Cb -0.10 -0.76 0.84 0.00 -1.71 0.00 0.00 66.02 64.29 1i2m s SER 162 CO 0.43 -0.09 1.77 0.23 1.20 0.00 0.00 173.24 176.78 1i2m n MET 163 N 4.69 0.25 -4.39 5.44 0.00 -1.26 0.08 117.12 121.93 1i2m n MET 163 Ca -0.15 0.24 -0.21 0.00 0.00 0.00 0.00 57.70 57.58 1i2m n MET 163 Cb 0.50 -1.81 -0.10 0.00 0.00 0.00 0.00 33.22 31.81 1i2m n MET 163 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 175.97 176.11 1i2m s VAL 164 N -3.13 2.00 0.22 2.03 -7.23 -1.26 -3.61 120.40 109.41 1i2m s VAL 164 Ca 0.10 -2.24 -0.32 0.00 -1.81 0.00 0.00 61.98 57.71 1i2m s VAL 164 Cb 0.12 -2.11 -0.12 0.00 0.56 0.00 0.00 36.38 34.83 1i2m s VAL 164 CO 0.57 -0.50 1.66 -2.65 -0.31 0.00 0.00 175.10 173.87 1i2m n PRO 165 N -0.38 2.61 -4.70 4.82 -0.02 -1.26 -4.62 135.00 131.45 1i2m n PRO 165 Ca -0.08 0.94 -0.23 0.00 -2.02 0.00 0.00 63.50 62.11 1i2m n PRO 165 Cb 0.60 -2.75 -0.15 0.00 -0.02 0.00 0.00 33.50 31.17 1i2m n PRO 165 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1i2m s VAL 166 N 0.85 1.19 0.18 -1.45 -7.23 -0.03 -4.90 120.40 109.00 1i2m s VAL 166 Ca 0.73 -0.65 -0.30 0.00 -1.81 0.00 0.00 61.98 59.96 1i2m s VAL 166 Cb -0.54 -0.99 -0.07 0.00 0.56 0.00 0.00 36.38 35.33 1i2m s VAL 166 CO 0.37 0.33 0.95 -1.58 -0.31 0.00 0.00 175.10 174.87 1i2m s GLN 167 N -0.36 4.77 -0.19 4.82 0.74 -1.26 -0.38 119.66 127.80 1i2m s GLN 167 Ca 0.06 1.48 -0.25 0.00 0.05 0.00 0.00 55.36 56.69 1i2m s GLN 167 Cb -0.06 -3.33 -0.01 0.00 1.10 0.00 0.00 33.01 30.71 1i2m s GLN 167 CO -0.01 0.36 0.83 0.08 -0.55 0.00 0.00 175.29 176.01 1i2m s VAL 168 N -0.58 4.86 -0.45 1.34 1.01 0.81 -4.94 120.40 122.46 1i2m s VAL 168 Ca 0.44 1.61 -0.28 0.00 0.00 0.00 0.00 61.98 63.75 1i2m s VAL 168 Cb -0.25 -4.13 0.01 0.00 0.00 0.00 0.00 36.38 32.01 1i2m s VAL 168 CO 0.31 -0.01 1.44 -1.10 0.00 0.00 0.00 175.10 175.74 1i2m s GLN 169 N 2.38 3.48 -0.01 2.72 -1.52 -1.26 -4.57 119.66 120.88 1i2m s GLN 169 Ca 0.37 0.84 -0.01 0.00 -1.95 0.00 0.00 55.36 54.61 1i2m s GLN 169 Cb -0.16 -4.06 0.00 0.00 -0.22 0.00 0.00 33.01 28.57 1i2m s GLN 169 CO 0.11 -1.69 0.03 -0.51 -0.25 0.00 0.00 175.29 172.97 1i2m s LEU 170 N 5.72 1.90 -0.13 2.90 1.43 -1.26 -4.93 118.68 124.32 1i2m s LEU 170 Ca 0.60 0.05 0.12 0.00 -1.03 0.00 0.00 54.13 53.87 1i2m s LEU 170 Cb -0.13 0.10 0.56 0.00 0.03 0.00 0.00 46.19 46.75 1i2m s LEU 170 CO 0.31 -0.01 1.40 -0.90 0.23 0.00 0.00 176.35 177.38 1i2m n ASP 171 N 3.04 4.01 -3.93 2.29 5.75 -1.26 -4.88 116.55 121.57 1i2m n ASP 171 Ca -0.12 -2.49 -0.10 0.00 -0.01 0.00 0.00 54.79 52.06 1i2m n ASP 171 Cb 0.60 -0.56 -0.12 0.00 -1.03 0.00 0.00 41.12 40.01 1i2m n ASP 171 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 1i2m s VAL 172 N -2.01 0.07 0.34 2.12 -7.23 -1.26 -5.14 120.40 107.29 1i2m s VAL 172 Ca 0.38 -0.56 -0.28 0.00 -1.81 0.00 0.00 61.98 59.71 1i2m s VAL 172 Cb 0.27 -0.19 -0.10 0.00 0.56 0.00 0.00 36.38 36.93 1i2m s VAL 172 CO 0.15 -0.31 1.27 -2.84 -0.31 0.00 0.00 175.10 173.06 1i2m s PRO 173 N -0.92 4.31 -0.09 4.82 0.02 -1.26 -4.93 135.00 136.94 1i2m s PRO 173 Ca -0.10 2.14 -0.04 0.00 0.02 0.00 0.00 61.00 63.02 1i2m s PRO 173 Cb -0.06 -3.01 -0.04 0.00 0.02 0.00 0.00 34.50 31.41 1i2m s PRO 173 CO -0.00 -0.20 0.06 0.08 -0.33 0.00 0.00 177.00 176.61 1i2m s VAL 174 N -1.18 4.80 -0.22 3.83 1.01 -0.19 -1.09 120.40 127.35 1i2m s VAL 174 Ca 0.50 -0.08 0.11 0.00 0.00 0.00 0.00 61.98 62.52 1i2m s VAL 174 Cb -0.38 -3.06 -0.16 0.00 0.00 0.00 0.00 36.38 32.79 1i2m s VAL 174 CO 0.50 0.60 0.34 1.33 0.00 0.00 0.00 175.10 177.87 1i2m n VAL 175 N 2.03 0.00 -3.70 2.92 0.24 0.78 -4.32 118.33 116.28 1i2m n VAL 175 Ca -0.19 -0.25 -0.13 0.00 -2.04 0.00 0.00 64.34 61.73 1i2m n VAL 175 Cb 0.54 0.54 -0.09 0.00 -1.47 0.00 0.00 33.84 33.36 1i2m n VAL 175 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1i2m s LYS 176 N -2.50 0.57 0.03 7.34 2.20 -1.16 -4.52 119.74 121.70 1i2m s LYS 176 Ca -0.01 0.70 0.09 0.00 -0.36 0.00 0.00 55.97 56.38 1i2m s LYS 176 Cb 0.08 0.26 -0.03 0.00 -1.51 0.00 0.00 37.83 36.63 1i2m s LYS 176 CO 0.47 -0.07 -0.25 0.14 -0.36 0.00 0.00 175.35 175.28 1i2m s VAL 177 N 0.33 2.24 -0.05 4.02 -7.23 -1.26 -1.17 120.40 117.29 1i2m s VAL 177 Ca -0.01 -1.30 -0.07 0.00 -1.81 0.00 0.00 61.98 58.79 1i2m s VAL 177 Cb -0.04 -1.87 0.01 0.00 0.56 0.00 0.00 36.38 35.05 1i2m s VAL 177 CO -0.00 0.40 0.19 0.00 -0.31 0.00 0.00 175.10 175.38 1i2m s ALA 178 N -0.79 -0.46 0.01 1.32 0.00 -0.66 -4.77 121.76 116.42 1i2m s ALA 178 Ca 0.12 0.34 0.05 0.00 0.00 0.00 0.00 51.96 52.46 1i2m s ALA 178 Cb -0.10 -0.17 -0.02 0.00 0.00 0.00 0.00 23.12 22.83 1i2m s ALA 178 CO 0.02 -0.14 -0.14 -1.12 0.00 0.00 0.00 175.76 174.38 1i2m s SER 179 N -0.42 1.68 0.00 0.00 0.01 -1.26 -0.94 113.70 112.77 1i2m s SER 179 Ca -0.05 -0.35 0.00 0.00 1.31 0.00 0.00 55.95 56.86 1i2m s SER 179 Cb -0.03 -0.15 0.00 0.00 0.21 0.00 0.00 66.02 66.05 1i2m s SER 179 CO 0.01 0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.38 1i2m n GLY 180 N 2.33 2.24 0.16 3.44 0.00 -0.08 -4.70 105.19 108.59 1i2m n GLY 180 Ca -0.16 -2.10 -0.09 0.00 0.00 0.00 0.00 46.02 43.68 1i2m n GLY 180 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1i2m h ASN 181 N 0.00 0.40 -0.16 1.61 4.21 -1.31 -3.36 115.58 116.98 1i2m h ASN 181 Ca 0.00 -0.04 -0.20 0.00 1.21 0.00 0.00 56.30 57.27 1i2m h ASN 181 Cb 0.00 -0.10 -0.35 0.00 -1.12 0.00 0.00 38.32 36.75 1i2m h ASN 181 CO 0.00 0.33 -0.98 0.47 -1.29 0.00 0.00 177.43 175.96 1i2m n ASP 182 N -4.82 1.47 -3.82 5.81 8.00 -1.26 -0.25 116.55 121.68 1i2m n ASP 182 Ca -0.01 -2.35 -0.12 0.00 0.71 0.00 0.00 54.79 53.03 1i2m n ASP 182 Cb 0.05 -0.38 -0.09 0.00 -0.02 0.00 0.00 41.12 40.68 1i2m n ASP 182 CO 0.00 0.00 0.00 -1.38 -0.39 0.00 0.00 177.20 175.43 1i2m s HIS 183 N -1.62 -0.03 -0.03 1.24 -3.43 -1.26 -0.45 115.29 109.71 1i2m s HIS 183 Ca 0.34 -0.04 0.06 0.00 -0.80 0.00 0.00 55.06 54.62 1i2m s HIS 183 Cb 0.37 0.01 -0.01 0.00 -1.43 0.00 0.00 32.58 31.52 1i2m s HIS 183 CO -0.11 -0.38 -0.22 -1.17 -2.00 0.00 0.00 174.74 170.86 1i2m s LEU 184 N -1.62 2.03 -0.03 5.38 2.96 -0.23 -0.90 118.68 126.28 1i2m s LEU 184 Ca -0.11 -0.43 0.07 0.00 -0.22 0.00 0.00 54.13 53.44 1i2m s LEU 184 Cb -0.05 -1.19 -0.01 0.00 0.50 0.00 0.00 46.19 45.44 1i2m s LEU 184 CO 0.01 0.25 -0.23 0.68 -1.32 0.00 0.00 176.35 175.74 1i2m s VAL 185 N -0.37 1.83 -0.12 1.68 -7.23 -0.12 -1.94 120.40 114.13 1i2m s VAL 185 Ca 0.04 -0.97 -0.00 0.00 -1.81 0.00 0.00 61.98 59.24 1i2m s VAL 185 Cb -0.10 -1.53 0.02 0.00 0.56 0.00 0.00 36.38 35.33 1i2m s VAL 185 CO 0.01 0.52 -0.09 -0.04 -0.31 0.00 0.00 175.10 175.18 1i2m s MET 186 N -0.37 1.68 -0.17 4.82 1.00 0.71 -1.65 119.30 125.32 1i2m s MET 186 Ca 0.04 -0.32 -0.18 0.00 0.00 0.00 0.00 55.69 55.23 1i2m s MET 186 Cb -0.10 -1.70 -0.04 0.00 0.00 0.00 0.00 34.83 32.99 1i2m s MET 186 CO 0.01 -0.26 0.49 -1.17 0.00 0.00 0.00 175.02 174.08 1i2m s LEU 187 N 1.66 4.20 0.56 -0.03 2.96 -0.31 -0.93 118.68 126.79 1i2m s LEU 187 Ca 0.05 0.72 -0.04 0.00 -0.22 0.00 0.00 54.13 54.64 1i2m s LEU 187 Cb -0.13 -2.68 0.01 0.00 0.50 0.00 0.00 46.19 43.90 1i2m s LEU 187 CO -0.09 -0.10 0.84 0.42 -1.32 0.00 0.00 176.35 176.11 1i2m s THR 188 N 1.19 3.45 0.62 3.68 -4.23 0.17 -0.15 115.64 120.38 1i2m s THR 188 Ca 0.24 -0.24 0.35 0.00 -1.18 0.00 0.00 61.69 60.87 1i2m s THR 188 Cb -0.15 -3.35 0.39 0.00 1.34 0.00 0.00 72.50 70.73 1i2m s THR 188 CO 0.10 -0.32 2.27 0.00 -0.54 0.00 0.00 174.62 176.12 1i2m h ALA 189 N -0.05 1.36 -0.01 3.99 0.00 -1.44 -1.00 119.26 122.11 1i2m h ALA 189 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1i2m h ALA 189 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1i2m h ALA 189 CO 0.59 -0.05 -0.22 -0.25 0.00 0.00 0.00 179.25 179.31 1i2m n ASP 190 N -3.52 1.31 0.00 0.00 8.00 -1.26 -4.94 116.55 116.14 1i2m n ASP 190 Ca -0.02 -1.12 0.00 0.00 0.71 0.00 0.00 54.79 54.35 1i2m n ASP 190 Cb 0.12 0.14 0.00 0.00 -0.02 0.00 0.00 41.12 41.37 1i2m n ASP 190 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1i2m n GLY 191 N 1.32 0.81 3.85 0.44 0.00 -0.38 -4.82 105.19 106.40 1i2m n GLY 191 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 1i2m n GLY 191 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1i2m s ASP 192 N -2.31 6.81 -0.25 1.61 1.01 -1.26 0.42 116.67 122.70 1i2m s ASP 192 Ca 0.00 1.29 -0.02 0.00 0.71 0.00 0.00 52.55 54.53 1i2m s ASP 192 Cb 0.00 -2.38 0.03 0.00 1.01 0.00 0.00 42.92 41.58 1i2m s ASP 192 CO 0.00 -0.17 -0.05 -0.22 0.21 0.00 0.00 175.17 174.94 1i2m s LEU 193 N -2.85 3.28 -0.08 1.23 2.96 -1.26 -0.65 118.68 121.30 1i2m s LEU 193 Ca 0.53 -0.88 -0.04 0.00 -0.22 0.00 0.00 54.13 53.52 1i2m s LEU 193 Cb -0.11 -1.68 -0.04 0.00 0.50 0.00 0.00 46.19 44.86 1i2m s LEU 193 CO 0.18 -0.14 0.11 -0.31 -1.32 0.00 0.00 176.35 174.87 1i2m s TYR 194 N 1.33 3.45 0.07 5.38 1.51 -0.11 -0.30 117.35 128.69 1i2m s TYR 194 Ca 0.00 0.38 0.02 0.00 -1.01 0.00 0.00 57.07 56.47 1i2m s TYR 194 Cb -0.17 -1.86 -0.03 0.00 -0.11 0.00 0.00 41.96 39.79 1i2m s TYR 194 CO -0.04 0.64 -0.08 0.95 -1.11 0.00 0.00 175.55 175.91 1i2m s THR 195 N -1.07 0.67 0.14 -0.71 -4.23 -0.76 -0.21 115.64 109.48 1i2m s THR 195 Ca 0.18 -1.46 -0.24 0.00 -1.18 0.00 0.00 61.69 58.99 1i2m s THR 195 Cb -0.12 -1.10 0.07 0.00 1.34 0.00 0.00 72.50 72.70 1i2m s THR 195 CO 0.07 -0.57 0.64 -1.48 -0.54 0.00 0.00 174.62 172.75 1i2m s LEU 196 N -2.20 -0.54 0.00 4.79 2.34 -0.82 -3.01 118.68 119.24 1i2m s LEU 196 Ca -0.00 -0.01 0.00 0.00 0.06 0.00 0.00 54.13 54.18 1i2m s LEU 196 Cb -0.04 2.52 0.00 0.00 -0.56 0.00 0.00 46.19 48.12 1i2m s LEU 196 CO -0.01 -0.93 0.00 0.61 -1.06 0.00 0.00 176.35 174.96 1i2m n GLY 197 N -0.36 0.21 3.73 -3.48 0.00 0.05 -1.06 105.19 104.28 1i2m n GLY 197 Ca -0.16 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.46 1i2m n GLY 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i2m n GLY 199 N 2.21 2.62 0.41 0.00 0.00 -1.26 -4.51 105.19 104.65 1i2m n GLY 199 Ca 0.03 -0.44 0.21 0.00 0.00 0.00 0.00 46.02 45.82 1i2m n GLY 199 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1i2m h GLU 200 N 0.00 0.36 -0.20 1.61 4.81 -1.92 -0.23 114.58 119.02 1i2m h GLU 200 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1i2m h GLU 200 Cb 0.88 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.18 1i2m h GLU 200 CO 0.00 0.24 0.00 1.04 -0.73 0.00 0.00 179.01 179.56 1i2m n GLN 201 N -4.53 2.32 -0.35 1.92 3.00 -1.26 -4.89 117.38 113.59 1i2m n GLN 201 Ca 0.22 -2.06 0.00 0.00 -0.01 0.00 0.00 57.00 55.15 1i2m n GLN 201 Cb 0.80 -1.47 0.00 0.00 0.00 0.00 0.00 30.24 29.57 1i2m n GLN 201 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1i2m n GLY 202 N 1.36 0.74 0.00 1.08 0.00 -0.10 -3.06 105.19 105.22 1i2m n GLY 202 Ca 0.16 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.21 1i2m n GLY 202 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i2m n GLN 203 N -2.15 0.04 0.08 1.61 0.00 -1.26 -1.61 117.38 114.10 1i2m n GLN 203 Ca 0.00 0.31 0.11 0.00 0.00 0.00 0.00 57.00 57.43 1i2m n GLN 203 Cb 0.00 -1.50 0.01 0.00 0.00 0.00 0.00 30.24 28.75 1i2m n GLN 203 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1i2m n LEU 204 N -1.40 0.75 -2.02 2.61 4.77 -1.26 -4.61 117.00 115.83 1i2m n LEU 204 Ca 0.02 0.26 -0.19 0.00 -0.03 0.00 0.00 56.01 56.07 1i2m n LEU 204 Cb 0.07 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.04 1i2m n LEU 204 CO 0.06 -0.14 -0.22 0.61 -1.33 0.00 0.00 177.39 176.37 1i2m n GLY 205 N 1.22 0.58 0.05 -0.72 0.00 -0.63 -4.76 105.19 100.93 1i2m n GLY 205 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1i2m n GLY 205 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1i2m n ARG 206 N -2.66 0.00 -4.69 1.61 1.85 -1.26 -4.51 116.66 107.01 1i2m n ARG 206 Ca -0.21 -0.28 -0.29 0.00 -1.00 0.00 0.00 57.85 56.07 1i2m n ARG 206 Cb 0.66 -0.26 -0.17 0.00 -1.05 0.00 0.00 32.46 31.64 1i2m n ARG 206 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1i2m s VAL 207 N 0.00 1.57 0.60 8.89 1.01 -1.26 -5.06 120.40 126.15 1i2m s VAL 207 Ca 0.00 -0.71 -0.18 0.00 0.00 0.00 0.00 61.98 61.08 1i2m s VAL 207 Cb 0.00 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 1i2m s VAL 207 CO 0.00 0.45 1.20 -2.84 0.00 0.00 0.00 175.10 173.91 1i2m s PRO 208 N 0.74 2.94 0.51 2.72 0.02 -1.26 -4.84 135.00 135.82 1i2m s PRO 208 Ca -0.12 1.79 0.27 0.00 0.02 0.00 0.00 61.00 62.96 1i2m s PRO 208 Cb -0.16 -1.93 1.36 0.00 0.02 0.00 0.00 34.50 33.80 1i2m s PRO 208 CO 0.02 -1.22 1.91 1.49 -0.33 0.00 0.00 177.00 178.86 1i2m h GLU 209 N 0.80 0.10 0.00 5.54 4.81 -1.97 0.16 114.58 124.02 1i2m h GLU 209 Ca -0.50 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 58.71 1i2m h GLU 209 Cb 1.29 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.65 1i2m h GLU 209 CO 0.55 0.07 -0.06 1.25 -0.73 0.00 0.00 179.01 180.09 1i2m h LEU 210 N 0.10 0.00 -2.98 1.64 5.85 -2.01 -2.24 115.31 115.68 1i2m h LEU 210 Ca 0.40 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.12 1i2m h LEU 210 Cb 1.42 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.45 1i2m h LEU 210 CO -0.05 0.06 0.00 0.49 -0.34 0.00 0.00 178.44 178.60 1i2m n PHE 211 N -3.44 0.47 -0.30 1.25 0.99 0.54 -4.58 117.46 112.38 1i2m n PHE 211 Ca -0.02 -0.59 -0.00 0.00 -0.00 0.00 0.00 57.45 56.84 1i2m n PHE 211 Cb 0.19 -0.09 0.18 0.00 -1.00 0.00 0.00 39.48 38.76 1i2m n PHE 211 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1i2m h ALA 212 N 1.59 1.38 -1.39 4.37 0.00 -1.11 -1.31 119.26 122.79 1i2m h ALA 212 Ca 0.00 -0.06 -0.60 0.00 0.00 0.00 0.00 54.91 54.25 1i2m h ALA 212 Cb 0.84 -0.35 -0.11 0.00 0.00 0.00 0.00 17.79 18.17 1i2m h ALA 212 CO 0.04 0.56 1.14 1.21 0.00 0.00 0.00 179.25 182.21 1i2m s ASN 213 N -6.20 6.38 -1.36 0.00 2.47 -1.26 -3.64 114.94 111.33 1i2m s ASN 213 Ca -0.12 -1.21 -0.07 0.00 0.42 0.00 0.00 52.86 51.87 1i2m s ASN 213 Cb 0.18 -2.52 0.05 0.00 -1.45 0.00 0.00 41.25 37.51 1i2m s ASN 213 CO 0.80 -1.52 0.50 0.54 -3.72 0.00 0.00 177.10 173.70 1i2m n ARG 214 N 8.48 -3.80 -0.92 0.43 1.74 -1.26 -1.04 116.66 120.29 1i2m n ARG 214 Ca 0.18 0.62 0.00 0.00 -0.77 0.00 0.00 57.85 57.88 1i2m n ARG 214 Cb 0.49 -5.37 0.00 0.00 -1.02 0.00 0.00 32.46 26.56 1i2m n ARG 214 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1i2m n GLY 215 N -1.26 0.98 7.00 -0.13 0.00 -0.50 -2.71 105.19 108.57 1i2m n GLY 215 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1i2m n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i2m n GLY 216 N -2.00 0.53 0.30 -0.02 0.00 -0.21 -3.20 105.19 100.59 1i2m n GLY 216 Ca 0.00 -0.80 0.11 0.00 0.00 0.00 0.00 46.02 45.33 1i2m n GLY 216 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1i2m h ARG 217 N 0.00 0.05 0.00 1.61 3.08 -1.88 -2.10 114.38 115.13 1i2m h ARG 217 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1i2m h ARG 217 Cb 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.04 1i2m h ARG 217 CO 0.00 0.04 0.00 1.04 -1.07 0.00 0.00 179.97 179.98 1i2m n GLN 218 N -4.49 0.01 0.00 0.04 6.02 -1.20 -5.02 117.38 112.75 1i2m n GLN 218 Ca 0.01 0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 1i2m n GLN 218 Cb 0.24 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.00 1i2m n GLN 218 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1i2m n GLY 219 N 0.94 -0.83 0.26 1.08 0.00 -0.79 -4.60 105.19 101.25 1i2m n GLY 219 Ca 0.06 -1.69 0.12 0.00 0.00 0.00 0.00 46.02 44.51 1i2m n GLY 219 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1i2m h LEU 220 N 0.00 0.00 -0.82 0.99 3.38 -1.83 -3.29 115.31 113.74 1i2m h LEU 220 Ca 0.00 0.00 0.19 0.00 0.09 0.00 0.00 57.88 58.16 1i2m h LEU 220 Cb 0.00 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.60 1i2m h LEU 220 CO 0.00 0.13 -0.01 -0.33 0.09 0.00 0.00 178.44 178.32 1i2m h GLU 221 N 0.00 0.08 -0.28 1.13 5.08 -1.89 0.54 114.58 119.23 1i2m h GLU 221 Ca -0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1i2m h GLU 221 Cb 0.37 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1i2m h GLU 221 CO 0.02 0.05 0.19 -0.09 -1.00 0.00 0.00 179.01 178.17 1i2m h ARG 222 N 0.08 0.37 0.14 2.33 2.43 -1.86 -1.87 114.38 115.99 1i2m h ARG 222 Ca 0.46 -0.02 -0.29 0.00 -0.81 0.00 0.00 59.98 59.31 1i2m h ARG 222 Cb 0.83 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1i2m h ARG 222 CO -0.74 0.24 -1.38 -0.07 -1.51 0.00 0.00 179.97 176.52 1i2m h LEU 223 N 0.38 0.46 0.00 3.80 3.38 -1.16 -3.36 115.31 118.81 1i2m h LEU 223 Ca 0.10 -0.54 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1i2m h LEU 223 Cb -0.04 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.56 1i2m h LEU 223 CO -0.02 1.43 -0.56 0.18 0.09 0.00 0.00 178.44 179.56 1i2m n LEU 224 N -3.52 0.62 -4.70 1.67 4.77 -0.71 -0.77 117.00 114.37 1i2m n LEU 224 Ca -0.12 0.19 -0.38 0.00 -0.03 0.00 0.00 56.01 55.67 1i2m n LEU 224 Cb 1.04 -0.21 -0.06 0.00 -2.33 0.00 0.00 43.42 41.85 1i2m n LEU 224 CO 0.53 -0.01 0.17 -0.69 -1.33 0.00 0.00 177.39 176.06 1i2m s VAL 225 N -3.12 5.17 0.07 4.08 1.01 -0.72 -4.69 120.40 122.20 1i2m s VAL 225 Ca 0.08 0.90 -0.30 0.00 0.00 0.00 0.00 61.98 62.65 1i2m s VAL 225 Cb 0.15 -3.80 -0.09 0.00 0.00 0.00 0.00 36.38 32.63 1i2m s VAL 225 CO 0.71 0.28 1.89 -2.84 0.00 0.00 0.00 175.10 175.14 1i2m s PRO 226 N 1.00 4.14 0.07 2.72 0.02 -1.26 -4.81 135.00 136.88 1i2m s PRO 226 Ca 0.24 2.59 0.03 0.00 0.02 0.00 0.00 61.00 63.88 1i2m s PRO 226 Cb -0.15 -3.91 -0.03 0.00 0.02 0.00 0.00 34.50 30.43 1i2m s PRO 226 CO 0.09 -0.90 -0.09 0.15 -0.33 0.00 0.00 177.00 175.92 1i2m s LYS 227 N 3.70 0.69 0.43 5.54 1.02 -1.16 -4.94 119.74 125.02 1i2m s LYS 227 Ca 0.85 -0.95 -0.23 0.00 0.02 0.00 0.00 55.97 55.66 1i2m s LYS 227 Cb -0.44 -0.44 -0.09 0.00 -0.52 0.00 0.00 37.83 36.34 1i2m s LYS 227 CO 0.39 0.08 1.05 0.00 -0.92 0.00 0.00 175.35 175.94 1i2m s VAL 229 N -1.78 4.61 -0.30 0.00 1.01 0.58 -4.89 120.40 119.65 1i2m s VAL 229 Ca 0.61 0.40 -0.10 0.00 0.00 0.00 0.00 61.98 62.89 1i2m s VAL 229 Cb -0.20 -4.35 -0.03 0.00 0.00 0.00 0.00 36.38 31.80 1i2m s VAL 229 CO 0.25 -0.78 0.17 -0.04 0.00 0.00 0.00 175.10 174.70 1i2m s MET 230 N 3.37 3.63 -0.03 2.72 -1.94 -1.26 -4.67 119.30 121.13 1i2m s MET 230 Ca 0.30 -0.53 0.03 0.00 -1.71 0.00 0.00 55.69 53.79 1i2m s MET 230 Cb -0.12 -3.61 -0.00 0.00 2.01 0.00 0.00 34.83 33.11 1i2m s MET 230 CO 0.22 -0.30 -0.13 -0.51 -0.01 0.00 0.00 175.02 174.29 1i2m s LEU 231 N 1.69 1.88 -0.56 -0.03 1.43 -1.26 -5.04 118.68 116.78 1i2m s LEU 231 Ca 0.06 -0.26 -0.27 0.00 -1.03 0.00 0.00 54.13 52.63 1i2m s LEU 231 Cb -0.16 -0.74 -0.02 0.00 0.03 0.00 0.00 46.19 45.29 1i2m s LEU 231 CO 0.08 0.12 1.89 -0.75 0.23 0.00 0.00 176.35 177.92 1i2m s LYS 232 N 0.04 2.70 0.23 1.70 2.36 -1.26 -1.46 119.74 124.06 1i2m s LYS 232 Ca -0.02 0.80 0.07 0.00 -2.55 0.00 0.00 55.97 54.27 1i2m s LYS 232 Cb -0.09 -4.37 -0.04 0.00 -1.05 0.00 0.00 37.83 32.28 1i2m s LYS 232 CO 0.01 -2.63 0.18 -3.38 1.55 0.00 0.00 175.35 171.08 1i2m s HIS 239 N 8.94 3.12 0.29 4.03 -3.43 -1.26 -5.13 115.29 121.85 1i2m s HIS 239 Ca 0.71 -0.09 -0.29 0.00 -0.80 0.00 0.00 55.06 54.59 1i2m s HIS 239 Cb -0.14 -1.43 -0.10 0.00 -1.43 0.00 0.00 32.58 29.48 1i2m s HIS 239 CO 0.23 0.52 1.30 0.08 -2.00 0.00 0.00 174.74 174.87 1i2m s VAL 240 N -2.04 2.90 0.22 -5.38 1.01 -0.53 -5.03 120.40 111.55 1i2m s VAL 240 Ca 0.32 0.85 0.10 0.00 0.00 0.00 0.00 61.98 63.25 1i2m s VAL 240 Cb -0.08 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 1i2m s VAL 240 CO 0.24 0.18 -0.09 -0.13 0.00 0.00 0.00 175.10 175.31 1i2m s ARG 241 N -1.21 2.06 0.15 2.72 0.52 -1.26 -4.77 118.95 117.16 1i2m s ARG 241 Ca 0.51 -1.40 0.10 0.00 -0.52 0.00 0.00 55.73 54.42 1i2m s ARG 241 Cb -0.38 -2.09 -0.04 0.00 0.52 0.00 0.00 34.95 32.95 1i2m s ARG 241 CO 0.47 0.39 -0.22 -0.06 0.02 0.00 0.00 175.30 175.90 1i2m s PHE 242 N -2.03 2.04 -0.47 -0.53 0.40 0.17 -0.92 117.98 116.65 1i2m s PHE 242 Ca 0.28 -0.41 0.11 0.00 -0.60 0.00 0.00 56.93 56.30 1i2m s PHE 242 Cb -0.07 -1.06 -0.12 0.00 0.51 0.00 0.00 43.02 42.28 1i2m s PHE 242 CO 0.16 0.35 0.44 0.00 0.70 0.00 0.00 175.22 176.87 1i2m n GLN 243 N 0.59 3.25 -3.49 0.44 10.64 0.14 -4.34 117.38 124.63 1i2m n GLN 243 Ca -0.15 -0.01 -0.10 0.00 -1.83 0.00 0.00 57.00 54.91 1i2m n GLN 243 Cb 0.55 -1.02 -0.02 0.00 -0.86 0.00 0.00 30.24 28.89 1i2m n GLN 243 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1i2m s ASP 244 N -2.10 -0.43 -0.04 2.61 -1.08 -1.20 -5.01 116.67 109.42 1i2m s ASP 244 Ca 0.03 0.05 -0.20 0.00 -0.52 0.00 0.00 52.55 51.91 1i2m s ASP 244 Cb 0.08 0.44 0.04 0.00 -1.46 0.00 0.00 42.92 42.02 1i2m s ASP 244 CO 0.44 -0.69 0.45 0.00 0.52 0.00 0.00 175.17 175.88 1i2m s ALA 245 N -3.08 -1.14 0.05 3.66 0.00 -1.26 -1.31 121.76 118.66 1i2m s ALA 245 Ca 0.03 0.74 -0.03 0.00 0.00 0.00 0.00 51.96 52.70 1i2m s ALA 245 Cb -0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 23.12 23.07 1i2m s ALA 245 CO -0.09 -0.29 0.03 -0.06 0.00 0.00 0.00 175.76 175.35 1i2m s PHE 246 N -1.16 0.34 -0.03 0.00 0.40 0.68 -4.90 117.98 113.31 1i2m s PHE 246 Ca -0.12 -0.76 0.04 0.00 -0.60 0.00 0.00 56.93 55.50 1i2m s PHE 246 Cb -0.03 -0.25 -0.00 0.00 0.51 0.00 0.00 43.02 43.24 1i2m s PHE 246 CO 0.06 -0.36 -0.16 0.00 0.70 0.00 0.00 175.22 175.46 1i2m n GLY 248 N 3.04 2.04 0.30 0.00 0.00 0.04 -4.20 105.19 106.41 1i2m n GLY 248 Ca -0.17 -2.18 -0.00 0.00 0.00 0.00 0.00 46.02 43.66 1i2m n GLY 248 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i2m h ALA 249 N 0.35 1.09 0.00 4.61 0.00 -1.47 -3.31 119.26 120.53 1i2m h ALA 249 Ca -0.14 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.64 1i2m h ALA 249 Cb 0.62 -0.21 -0.28 0.00 0.00 0.00 0.00 17.79 17.92 1i2m h ALA 249 CO 0.20 0.22 -0.88 0.66 0.00 0.00 0.00 179.25 179.46 1i2m n TYR 250 N -4.66 0.00 -3.89 0.00 4.01 -1.26 -1.14 117.16 110.21 1i2m n TYR 250 Ca 0.11 -0.52 -0.09 0.00 -0.16 0.00 0.00 57.90 57.23 1i2m n TYR 250 Cb 0.17 -0.14 -0.06 0.00 -0.31 0.00 0.00 39.34 39.00 1i2m n TYR 250 CO 0.00 0.00 0.00 -0.59 -0.46 0.00 0.00 176.86 175.81 1i2m s PHE 251 N -0.37 0.22 0.00 -0.72 -0.12 -1.25 -1.04 117.98 114.71 1i2m s PHE 251 Ca 0.29 -0.57 0.01 0.00 -0.05 0.00 0.00 56.93 56.60 1i2m s PHE 251 Cb 0.32 0.14 -0.00 0.00 -0.63 0.00 0.00 43.02 42.85 1i2m s PHE 251 CO -0.13 -0.84 -0.03 0.99 -0.05 0.00 0.00 175.22 175.16 1i2m s THR 252 N -3.95 0.26 0.01 -4.49 2.01 0.30 -0.78 115.64 109.00 1i2m s THR 252 Ca 0.15 -0.22 0.07 0.00 0.31 0.00 0.00 61.69 62.01 1i2m s THR 252 Cb 0.01 -0.24 -0.03 0.00 0.01 0.00 0.00 72.50 72.25 1i2m s THR 252 CO 0.01 0.02 -0.22 -0.36 -0.69 0.00 0.00 174.62 173.38 1i2m s PHE 253 N -0.20 2.45 -0.03 4.92 0.40 0.01 -1.95 117.98 123.57 1i2m s PHE 253 Ca -0.00 -0.33 -0.02 0.00 -0.60 0.00 0.00 56.93 55.97 1i2m s PHE 253 Cb -0.02 -1.47 0.02 0.00 0.51 0.00 0.00 43.02 42.05 1i2m s PHE 253 CO -0.00 0.13 0.08 0.00 0.70 0.00 0.00 175.22 176.14 1i2m s ALA 254 N -0.79 -0.16 -0.26 5.36 0.00 0.44 -0.23 121.76 126.12 1i2m s ALA 254 Ca 0.12 0.33 -0.08 0.00 0.00 0.00 0.00 51.96 52.33 1i2m s ALA 254 Cb -0.10 -0.21 -0.03 0.00 0.00 0.00 0.00 23.12 22.77 1i2m s ALA 254 CO 0.02 -0.07 0.10 0.42 0.00 0.00 0.00 175.76 176.23 1i2m s ILE 255 N 0.44 4.51 0.92 0.00 1.01 -0.43 0.07 121.20 127.72 1i2m s ILE 255 Ca -0.03 -0.12 -0.12 0.00 0.00 0.00 0.00 60.65 60.37 1i2m s ILE 255 Cb -0.05 -3.13 0.14 0.00 0.01 0.00 0.00 42.46 39.43 1i2m s ILE 255 CO -0.02 0.31 1.11 -0.94 0.00 0.00 0.00 174.94 175.40 1i2m s SER 256 N 1.64 3.41 0.43 3.58 1.04 0.05 -0.68 113.70 123.17 1i2m s SER 256 Ca 0.06 1.13 0.13 0.00 0.48 0.00 0.00 55.95 57.76 1i2m s SER 256 Cb -0.15 -1.77 1.01 0.00 0.10 0.00 0.00 66.02 65.20 1i2m s SER 256 CO 0.05 -2.63 1.98 0.45 0.98 0.00 0.00 173.24 174.07 1i2m h HIS 257 N -1.55 0.45 0.00 5.02 3.86 -1.32 0.33 115.15 121.94 1i2m h HIS 257 Ca -0.51 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 58.71 1i2m h HIS 257 Cb 1.32 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 29.64 1i2m h HIS 257 CO 0.33 0.22 0.00 0.39 0.86 0.00 0.00 177.93 179.73 1i2m n GLU 258 N -4.47 0.07 -0.05 2.45 4.71 -1.26 -4.88 120.64 117.21 1i2m n GLU 258 Ca 0.09 0.18 0.00 0.00 -0.01 0.00 0.00 57.16 57.42 1i2m n GLU 258 Cb 0.35 -1.60 0.00 0.00 -1.01 0.00 0.00 31.44 29.18 1i2m n GLU 258 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1i2m n GLY 259 N 0.75 0.61 3.78 0.62 0.00 0.10 -5.07 105.19 105.98 1i2m n GLY 259 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 1i2m n GLY 259 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1i2m s HIS 260 N -2.07 3.47 -0.28 1.61 3.76 -1.26 -4.74 115.29 115.78 1i2m s HIS 260 Ca 0.00 1.70 -0.14 0.00 -0.15 0.00 0.00 55.06 56.48 1i2m s HIS 260 Cb 0.00 -3.10 -0.04 0.00 1.11 0.00 0.00 32.58 30.55 1i2m s HIS 260 CO 0.00 -0.36 0.31 0.08 -0.85 0.00 0.00 174.74 173.92 1i2m s VAL 261 N -1.53 5.22 0.05 -0.90 1.01 -1.26 -0.77 120.40 122.22 1i2m s VAL 261 Ca 0.52 0.38 0.04 0.00 0.00 0.00 0.00 61.98 62.93 1i2m s VAL 261 Cb -0.23 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 1i2m s VAL 261 CO 0.29 0.16 -0.06 -0.31 0.00 0.00 0.00 175.10 175.19 1i2m s TYR 262 N 1.96 2.88 0.05 5.22 1.51 0.11 -1.49 117.35 127.59 1i2m s TYR 262 Ca 0.12 -0.06 -0.06 0.00 -1.01 0.00 0.00 57.07 56.06 1i2m s TYR 262 Cb -0.16 -1.55 -0.01 0.00 -0.11 0.00 0.00 41.96 40.13 1i2m s TYR 262 CO 0.10 0.41 0.11 0.20 -1.11 0.00 0.00 175.55 175.27 1i2m s GLY 263 N -1.82 0.18 0.01 0.71 0.00 -0.66 -0.42 107.32 105.31 1i2m s GLY 263 Ca 0.20 -0.62 -0.29 0.00 0.00 0.00 0.00 44.72 44.02 1i2m s GLY 263 CO 0.12 -0.76 0.67 -0.11 0.00 0.00 0.00 173.10 173.01 1i2m s PHE 264 N -3.04 -0.61 -0.04 1.90 -0.12 -0.82 -1.54 117.98 113.71 1i2m s PHE 264 Ca -0.01 0.87 0.00 0.00 -0.05 0.00 0.00 56.93 57.74 1i2m s PHE 264 Cb 0.01 0.46 0.00 0.00 -0.63 0.00 0.00 43.02 42.86 1i2m s PHE 264 CO -0.07 -0.67 0.00 0.41 -0.05 0.00 0.00 175.22 174.85 1i2m n GLY 265 N 0.52 0.44 3.75 1.99 0.00 0.28 -0.54 105.19 111.63 1i2m n GLY 265 Ca -0.18 -2.20 -0.41 0.00 0.00 0.00 0.00 46.02 43.23 1i2m n GLY 265 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1i2m s LEU 266 N 0.00 4.43 -0.07 0.99 2.96 -0.20 -0.45 118.68 126.34 1i2m s LEU 266 Ca 0.00 2.50 0.15 0.00 -0.22 0.00 0.00 54.13 56.57 1i2m s LEU 266 Cb 0.00 -3.63 0.29 0.00 0.50 0.00 0.00 46.19 43.35 1i2m s LEU 266 CO 0.00 -0.50 1.14 -0.24 -1.32 0.00 0.00 176.35 175.43 1i2m n SER 267 N 1.87 0.13 0.26 3.68 2.88 -0.48 -4.44 113.62 117.52 1i2m n SER 267 Ca 0.03 -2.03 0.18 0.00 -1.33 0.00 0.00 58.87 55.72 1i2m n SER 267 Cb 0.42 -0.01 0.81 0.00 -0.75 0.00 0.00 64.21 64.68 1i2m n SER 267 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1i2m h ASN 268 N 0.86 0.00 0.00 -3.46 -1.07 -1.82 -1.95 115.58 108.15 1i2m h ASN 268 Ca -0.36 0.00 -0.00 0.00 0.07 0.00 0.00 56.30 56.01 1i2m h ASN 268 Cb 1.59 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.83 1i2m h ASN 268 CO -0.05 0.00 -0.30 -1.22 0.07 0.00 0.00 177.43 175.92 1i2m n TYR 269 N -2.86 0.00 -1.84 4.14 4.02 -1.26 -4.96 117.16 114.40 1i2m n TYR 269 Ca -0.01 -1.26 -0.14 0.00 -0.01 0.00 0.00 57.90 56.49 1i2m n TYR 269 Cb 0.19 -0.20 -0.03 0.00 -0.02 0.00 0.00 39.34 39.27 1i2m n TYR 269 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 1i2m n HIS 270 N -1.21 -0.33 0.30 -0.72 8.25 -0.73 -3.37 115.22 117.40 1i2m n HIS 270 Ca 0.17 0.00 0.19 0.00 -0.26 0.00 0.00 57.72 57.83 1i2m n HIS 270 Cb 0.68 -2.75 1.01 0.00 1.12 0.00 0.00 29.99 30.05 1i2m n HIS 270 CO 0.00 0.00 0.00 -0.56 0.64 0.00 0.00 176.34 176.42 1i2m h GLN 271 N 0.00 0.00 -0.35 -0.41 -0.00 -1.81 0.12 115.11 112.65 1i2m h GLN 271 Ca -0.31 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.34 1i2m h GLN 271 Cb 1.08 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.56 1i2m h GLN 271 CO 0.41 0.00 0.00 1.28 -0.00 0.00 0.00 178.83 180.52 1i2m n LEU 272 N -2.86 2.94 0.00 0.06 4.77 -1.26 -4.69 117.00 115.95 1i2m n LEU 272 Ca -0.02 -1.84 0.00 0.00 -0.03 0.00 0.00 56.01 54.11 1i2m n LEU 272 Cb 0.09 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 1i2m n LEU 272 CO 0.18 0.71 0.00 0.61 -1.33 0.00 0.00 177.39 177.57 1i2m n GLY 273 N 0.71 1.02 2.49 -0.72 0.00 0.40 -4.53 105.19 104.55 1i2m n GLY 273 Ca 0.13 -1.09 -0.25 0.00 0.00 0.00 0.00 46.02 44.81 1i2m n GLY 273 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1i2m n THR 274 N 0.00 1.67 0.30 2.61 -2.24 -1.26 -4.49 114.28 110.87 1i2m n THR 274 Ca 0.00 -5.01 0.17 0.00 -2.27 0.00 0.00 64.05 56.93 1i2m n THR 274 Cb 0.00 -1.66 0.81 0.00 -2.10 0.00 0.00 70.33 67.38 1i2m n THR 274 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1i2m h PRO 275 N 3.68 0.00 0.00 -0.78 0.11 -1.94 -3.46 132.00 129.61 1i2m h PRO 275 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1i2m h PRO 275 Cb 0.70 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1i2m h PRO 275 CO 0.72 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.92 1i2m n GLY 276 N -0.61 0.77 3.32 -0.55 0.00 -1.26 -5.02 105.19 101.84 1i2m n GLY 276 Ca -0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1i2m n GLY 276 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1i2m s THR 277 N -2.84 0.04 0.08 2.61 -1.32 -1.26 -5.04 115.64 107.91 1i2m s THR 277 Ca 0.00 -0.35 0.31 0.00 -1.21 0.00 0.00 61.69 60.45 1i2m s THR 277 Cb 0.00 -0.75 0.36 0.00 -1.51 0.00 0.00 72.50 70.60 1i2m s THR 277 CO 0.00 -0.19 1.93 -0.33 -2.21 0.00 0.00 174.62 173.82 1i2m h GLU 278 N 3.55 0.00 -3.40 7.08 5.08 -1.95 -3.40 114.58 121.54 1i2m h GLU 278 Ca -0.29 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.57 1i2m h GLU 278 Cb 1.17 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 30.02 1i2m h GLU 278 CO 0.40 0.05 -0.76 -1.12 -1.00 0.00 0.00 179.01 176.58 1i2m s SER 279 N -5.83 2.67 -0.72 1.42 0.01 -1.26 -1.38 113.70 108.61 1i2m s SER 279 Ca 0.01 -0.72 -0.17 0.00 1.31 0.00 0.00 55.95 56.38 1i2m s SER 279 Cb 0.09 -0.48 0.14 0.00 0.21 0.00 0.00 66.02 65.99 1i2m s SER 279 CO 0.57 -0.32 0.79 0.00 0.41 0.00 0.00 173.24 174.69 1i2m h PHE 281 N 8.70 0.32 -3.52 0.00 -1.00 -1.81 0.82 116.94 120.46 1i2m h PHE 281 Ca -0.09 -0.23 -0.61 0.00 2.81 0.00 0.00 57.97 59.85 1i2m h PHE 281 Cb 1.06 -0.02 -0.12 0.00 3.61 0.00 0.00 35.95 40.49 1i2m h PHE 281 CO 0.95 1.16 -0.08 0.42 -1.61 0.00 0.00 178.31 179.15 1i2m s ILE 282 N -2.74 5.12 0.28 -0.55 1.01 -1.26 -4.21 121.20 118.85 1i2m s ILE 282 Ca -0.02 0.86 -0.29 0.00 0.00 0.00 0.00 60.65 61.20 1i2m s ILE 282 Cb 0.08 -3.80 -0.14 0.00 0.01 0.00 0.00 42.46 38.61 1i2m s ILE 282 CO 0.86 0.17 1.10 -2.65 0.00 0.00 0.00 174.94 174.42 1i2m n PRO 283 N 4.96 1.53 -4.29 2.79 -0.02 -1.26 -4.85 135.00 133.85 1i2m n PRO 283 Ca -0.06 0.54 -0.18 0.00 -2.02 0.00 0.00 63.50 61.78 1i2m n PRO 283 Cb 0.50 -1.98 -0.15 0.00 -0.02 0.00 0.00 33.50 31.86 1i2m n PRO 283 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1i2m s GLN 284 N -1.42 0.72 -0.63 -0.52 0.74 -0.59 -4.95 119.66 113.01 1i2m s GLN 284 Ca 0.60 -0.25 -0.27 0.00 0.05 0.00 0.00 55.36 55.49 1i2m s GLN 284 Cb -0.69 -0.70 -0.00 0.00 1.10 0.00 0.00 33.01 32.73 1i2m s GLN 284 CO 0.59 0.12 1.64 1.21 -0.55 0.00 0.00 175.29 178.30 1i2m s ASN 285 N 0.06 5.65 -0.17 6.67 3.84 -1.26 -1.66 114.94 128.07 1i2m s ASN 285 Ca -0.01 0.14 -0.28 0.00 0.21 0.00 0.00 52.86 52.92 1i2m s ASN 285 Cb -0.06 -2.54 -0.06 0.00 -0.55 0.00 0.00 41.25 38.04 1i2m s ASN 285 CO -0.00 -2.12 2.14 -0.76 -2.79 0.00 0.00 177.10 173.56 1i2m s LEU 286 N 7.70 3.66 0.39 3.21 1.43 -0.55 -4.86 118.68 129.65 1i2m s LEU 286 Ca 0.57 2.03 0.10 0.00 -1.03 0.00 0.00 54.13 55.79 1i2m s LEU 286 Cb -0.11 -3.52 0.80 0.00 0.03 0.00 0.00 46.19 43.40 1i2m s LEU 286 CO 0.20 -1.75 1.93 0.71 0.23 0.00 0.00 176.35 177.67 1i2m h THR 287 N 6.80 1.17 0.00 5.49 1.35 -1.90 -1.76 112.91 124.06 1i2m h THR 287 Ca -0.42 -0.71 0.00 0.00 -0.55 0.00 0.00 66.41 64.73 1i2m h THR 287 Cb 1.23 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 68.81 1i2m h THR 287 CO 0.96 0.22 0.02 0.28 -0.25 0.00 0.00 175.52 176.75 1i2m h SER 288 N 0.24 0.00 -0.20 5.36 0.02 -1.89 -2.31 113.55 114.77 1i2m h SER 288 Ca 0.05 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.86 1i2m h SER 288 Cb 0.33 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 62.77 1i2m h SER 288 CO 0.02 0.00 -0.48 0.49 -1.14 0.00 0.00 176.83 175.71 1i2m n PHE 289 N -2.32 0.71 -2.77 3.45 3.01 -0.66 -4.49 117.46 114.39 1i2m n PHE 289 Ca -0.02 -1.67 -0.43 0.00 1.01 0.00 0.00 57.45 56.35 1i2m n PHE 289 Cb 0.05 -0.32 -0.04 0.00 -0.01 0.00 0.00 39.48 39.17 1i2m n PHE 289 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1i2m s LYS 290 N -3.32 3.28 0.00 -1.08 2.47 -0.87 -4.66 119.74 115.57 1i2m s LYS 290 Ca 0.42 -0.33 0.00 0.00 -1.56 0.00 0.00 55.97 54.50 1i2m s LYS 290 Cb 0.38 -4.10 0.00 0.00 -1.46 0.00 0.00 37.83 32.65 1i2m s LYS 290 CO -0.04 -1.67 0.00 0.27 0.16 0.00 0.00 175.35 174.07 1i2m n ASN 291 N 7.89 0.00 0.00 1.43 0.23 -1.26 -5.02 115.26 118.52 1i2m n ASN 291 Ca 0.01 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.06 1i2m n ASN 291 Cb 0.47 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.17 1i2m n ASN 291 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 1i2m n SER 292 N 0.00 0.00 -0.06 0.53 7.64 -1.26 -4.78 113.62 115.69 1i2m n SER 292 Ca 0.00 0.00 0.02 0.00 1.01 0.00 0.00 58.87 59.90 1i2m n SER 292 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 1i2m n SER 292 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1i2m n THR 293 N 0.00 0.00 -3.54 0.44 -2.24 -1.26 -5.01 114.28 102.67 1i2m n THR 293 Ca 0.00 -0.42 -0.37 0.00 -2.27 0.00 0.00 64.05 60.99 1i2m n THR 293 Cb 0.00 1.03 -0.06 0.00 -2.10 0.00 0.00 70.33 69.20 1i2m n THR 293 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1i2m s LYS 294 N -1.18 3.85 -0.19 -0.78 1.02 -1.26 -5.06 119.74 116.13 1i2m s LYS 294 Ca 0.03 0.32 -0.01 0.00 0.02 0.00 0.00 55.97 56.34 1i2m s LYS 294 Cb 0.04 -3.17 0.05 0.00 -0.52 0.00 0.00 37.83 34.23 1i2m s LYS 294 CO 0.16 0.67 -0.03 -1.12 -0.92 0.00 0.00 175.35 174.11 1i2m s SER 295 N -1.23 3.10 0.09 2.83 0.01 -1.26 -4.67 113.70 112.57 1i2m s SER 295 Ca 0.25 -0.82 -0.30 0.00 1.31 0.00 0.00 55.95 56.39 1i2m s SER 295 Cb -0.16 -0.91 -0.05 0.00 0.21 0.00 0.00 66.02 65.11 1i2m s SER 295 CO 0.14 -0.22 0.99 0.26 0.41 0.00 0.00 173.24 174.82 1i2m s TRP 296 N 1.62 3.74 0.00 2.43 0.52 -1.26 0.27 118.94 126.26 1i2m s TRP 296 Ca -0.01 1.73 0.00 0.00 0.02 0.00 0.00 56.10 57.84 1i2m s TRP 296 Cb -0.17 -3.11 0.00 0.00 -1.15 0.00 0.00 33.47 29.04 1i2m s TRP 296 CO -0.07 0.00 0.00 1.33 0.02 0.00 0.00 176.95 178.23 1i2m n VAL 297 N 3.04 0.00 -3.72 4.03 0.24 -0.38 -4.86 118.33 116.67 1i2m n VAL 297 Ca 0.03 -0.18 -0.14 0.00 -2.04 0.00 0.00 64.34 62.02 1i2m n VAL 297 Cb 0.49 0.67 -0.09 0.00 -1.47 0.00 0.00 33.84 33.44 1i2m n VAL 297 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1i2m s GLY 298 N -1.44 -0.29 0.01 7.63 0.00 -1.06 -4.99 107.32 107.18 1i2m s GLY 298 Ca 0.00 0.92 0.01 0.00 0.00 0.00 0.00 44.72 45.65 1i2m s GLY 298 CO 0.00 0.72 -0.03 -1.36 0.00 0.00 0.00 173.10 172.43 1i2m s PHE 299 N -0.40 0.26 0.10 1.90 0.40 -1.26 -1.27 117.98 117.70 1i2m s PHE 299 Ca -0.05 -0.27 -0.10 0.00 -0.60 0.00 0.00 56.93 55.91 1i2m s PHE 299 Cb -0.03 -0.17 0.00 0.00 0.51 0.00 0.00 43.02 43.33 1i2m s PHE 299 CO 0.03 -0.08 0.23 -1.54 0.70 0.00 0.00 175.22 174.56 1i2m s SER 300 N -0.76 0.06 -0.11 1.36 1.04 0.22 -4.71 113.70 110.79 1i2m s SER 300 Ca -0.07 -0.60 -0.30 0.00 0.48 0.00 0.00 55.95 55.46 1i2m s SER 300 Cb -0.05 0.37 0.09 0.00 0.10 0.00 0.00 66.02 66.52 1i2m s SER 300 CO -0.00 -0.76 0.78 -0.83 0.98 0.00 0.00 173.24 173.42 1i2m s GLY 301 N -2.85 -0.47 0.00 7.32 0.00 -1.26 -1.30 107.32 108.75 1i2m s GLY 301 Ca 0.05 1.64 0.00 0.00 0.00 0.00 0.00 44.72 46.41 1i2m s GLY 301 CO -0.11 1.09 0.00 0.61 0.00 0.00 0.00 173.10 174.69 1i2m n GLY 302 N 1.08 1.98 0.15 0.20 0.00 -0.14 -3.40 105.19 105.06 1i2m n GLY 302 Ca -0.16 -1.86 -0.16 0.00 0.00 0.00 0.00 46.02 43.85 1i2m n GLY 302 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1i2m h GLN 303 N 0.00 0.43 0.00 1.61 4.20 -1.74 -2.59 115.11 117.02 1i2m h GLN 303 Ca 0.00 -0.36 0.00 0.00 0.06 0.00 0.00 58.65 58.35 1i2m h GLN 303 Cb 0.00 0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.86 1i2m h GLN 303 CO 0.00 1.00 -0.02 0.72 -0.67 0.00 0.00 178.83 179.86 1i2m n HIS 304 N -4.31 0.00 -4.02 2.96 8.25 -1.26 -4.77 115.22 112.06 1i2m n HIS 304 Ca -0.08 -0.43 -0.08 0.00 -0.26 0.00 0.00 57.72 56.87 1i2m n HIS 304 Cb 0.57 -0.05 -0.09 0.00 1.12 0.00 0.00 29.99 31.54 1i2m n HIS 304 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 1i2m s HIS 305 N -0.96 0.43 -0.01 4.41 -3.43 -1.26 -1.20 115.29 113.26 1i2m s HIS 305 Ca 0.04 -0.93 0.03 0.00 -0.80 0.00 0.00 55.06 53.40 1i2m s HIS 305 Cb 0.03 -0.29 -0.00 0.00 -1.43 0.00 0.00 32.58 30.89 1i2m s HIS 305 CO 0.00 -0.44 -0.10 0.99 -2.00 0.00 0.00 174.74 173.20 1i2m s THR 306 N -3.91 0.79 -0.08 -5.38 2.01 -0.18 -0.96 115.64 107.92 1i2m s THR 306 Ca 0.07 -0.41 0.02 0.00 0.31 0.00 0.00 61.69 61.69 1i2m s THR 306 Cb 0.07 -0.67 0.01 0.00 0.01 0.00 0.00 72.50 71.92 1i2m s THR 306 CO -0.10 0.23 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.23 1i2m s VAL 307 N -0.11 1.30 0.24 3.82 1.01 -0.42 -1.30 120.40 124.94 1i2m s VAL 307 Ca 0.02 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.44 1i2m s VAL 307 Cb -0.05 -1.18 -0.05 0.00 0.00 0.00 0.00 36.38 35.10 1i2m s VAL 307 CO -0.00 0.39 0.12 0.00 0.00 0.00 0.00 175.10 175.61 1i2m s MET 309 N -4.06 0.55 0.57 0.00 0.23 -0.40 0.36 119.30 116.54 1i2m s MET 309 Ca 0.38 -0.66 0.07 0.00 -1.03 0.00 0.00 55.69 54.45 1i2m s MET 309 Cb 0.07 0.22 0.07 0.00 -1.53 0.00 0.00 34.83 33.66 1i2m s MET 309 CO 0.13 -0.13 0.58 -0.40 -2.03 0.00 0.00 175.02 173.17 1i2m n ASP 310 N 0.97 2.51 0.00 -1.18 5.68 -0.73 -1.25 116.55 122.55 1i2m n ASP 310 Ca -0.20 -2.76 0.05 0.00 -0.50 0.00 0.00 54.79 51.38 1i2m n ASP 310 Cb 0.58 -0.20 0.23 0.00 -1.14 0.00 0.00 41.12 40.58 1i2m n ASP 310 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1i2m n SER 311 N -2.03 0.00 -1.25 -1.12 3.41 0.14 -2.23 113.62 110.55 1i2m n SER 311 Ca 0.06 0.47 0.12 0.00 -0.26 0.00 0.00 58.87 59.26 1i2m n SER 311 Cb 0.62 -0.49 0.26 0.00 -0.26 0.00 0.00 64.21 64.34 1i2m n SER 311 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1i2m n GLU 312 N -1.49 2.60 -0.93 4.33 1.02 -1.26 -4.95 120.64 119.97 1i2m n GLU 312 Ca 0.03 -2.45 0.00 0.00 -0.02 0.00 0.00 57.16 54.72 1i2m n GLU 312 Cb 0.12 -1.54 0.00 0.00 -0.02 0.00 0.00 31.44 30.00 1i2m n GLU 312 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1i2m n GLY 313 N 1.58 0.46 3.86 0.62 0.00 -0.94 -4.85 105.19 105.92 1i2m n GLY 313 Ca 0.22 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 45.17 1i2m n GLY 313 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i2m s LYS 314 N -1.30 3.67 0.01 1.61 1.02 -1.26 -0.21 119.74 123.28 1i2m s LYS 314 Ca 0.00 0.12 0.01 0.00 0.02 0.00 0.00 55.97 56.12 1i2m s LYS 314 Cb 0.00 -3.17 -0.04 0.00 -0.52 0.00 0.00 37.83 34.10 1i2m s LYS 314 CO 0.00 0.71 0.03 0.00 -0.92 0.00 0.00 175.35 175.17 1i2m s ALA 315 N -1.11 3.38 0.06 5.17 0.00 -1.26 -1.77 121.76 126.23 1i2m s ALA 315 Ca 0.21 -0.95 0.01 0.00 0.00 0.00 0.00 51.96 51.24 1i2m s ALA 315 Cb -0.14 -1.40 -0.03 0.00 0.00 0.00 0.00 23.12 21.55 1i2m s ALA 315 CO 0.10 0.67 -0.06 0.71 0.00 0.00 0.00 175.76 177.18 1i2m s TYR 316 N -1.15 0.66 0.07 0.00 1.51 0.16 -0.87 117.35 117.72 1i2m s TYR 316 Ca 0.21 -0.74 0.01 0.00 -1.01 0.00 0.00 57.07 55.55 1i2m s TYR 316 Cb -0.12 -0.41 -0.03 0.00 -0.11 0.00 0.00 41.96 41.29 1i2m s TYR 316 CO 0.12 -0.17 -0.06 -1.54 -1.11 0.00 0.00 175.55 172.80 1i2m s SER 317 N -2.28 0.86 0.16 2.29 1.04 -0.42 -0.01 113.70 115.34 1i2m s SER 317 Ca -0.01 -0.84 -0.17 0.00 0.48 0.00 0.00 55.95 55.41 1i2m s SER 317 Cb -0.02 0.10 0.04 0.00 0.10 0.00 0.00 66.02 66.24 1i2m s SER 317 CO -0.03 -0.41 0.48 -1.48 0.98 0.00 0.00 173.24 172.78 1i2m s LEU 318 N -2.49 0.15 0.00 2.42 2.34 -0.42 -0.74 118.68 119.94 1i2m s LEU 318 Ca 0.03 -0.36 0.00 0.00 0.06 0.00 0.00 54.13 53.86 1i2m s LEU 318 Cb 0.00 2.05 0.00 0.00 -0.56 0.00 0.00 46.19 47.69 1i2m s LEU 318 CO -0.04 -0.96 0.00 0.61 -1.06 0.00 0.00 176.35 174.90 1i2m n GLY 319 N -0.29 -0.16 3.76 -3.48 0.00 0.33 -1.02 105.19 104.33 1i2m n GLY 319 Ca -0.13 -2.07 -0.41 0.00 0.00 0.00 0.00 46.02 43.40 1i2m n GLY 319 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1i2m s ARG 320 N 0.00 4.26 -0.01 1.61 3.52 -0.34 -1.60 118.95 126.39 1i2m s ARG 320 Ca 0.00 2.34 0.22 0.00 -0.13 0.00 0.00 55.73 58.16 1i2m s ARG 320 Cb 0.00 -3.06 -0.25 0.00 -1.56 0.00 0.00 34.95 30.08 1i2m s ARG 320 CO 0.00 -0.37 0.72 0.00 -0.81 0.00 0.00 175.30 174.84 1i2m n ALA 321 N 1.35 3.71 -1.56 6.12 0.00 -1.26 -4.47 120.51 124.40 1i2m n ALA 321 Ca 0.03 -0.54 -0.43 0.00 0.00 0.00 0.00 53.44 52.50 1i2m n ALA 321 Cb 0.40 -0.78 -0.00 0.00 0.00 0.00 0.00 19.45 19.07 1i2m n ALA 321 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1i2m n GLU 322 N -1.91 1.09 -1.09 0.00 4.07 -1.26 -1.64 120.64 119.91 1i2m n GLU 322 Ca 0.00 0.39 -0.03 0.00 -0.06 0.00 0.00 57.16 57.46 1i2m n GLU 322 Cb 0.45 -1.79 -0.01 0.00 -0.06 0.00 0.00 31.44 30.03 1i2m n GLU 322 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 1i2m n TYR 323 N -0.32 0.00 -1.22 4.31 0.53 -1.26 -3.19 117.16 116.01 1i2m n TYR 323 Ca 0.10 0.00 -0.04 0.00 -1.02 0.00 0.00 57.90 56.94 1i2m n TYR 323 Cb 0.36 -1.71 -0.02 0.00 -1.03 0.00 0.00 39.34 36.94 1i2m n TYR 323 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1i2m n GLY 324 N -0.25 0.67 0.07 2.72 0.00 -0.65 -2.69 105.19 105.05 1i2m n GLY 324 Ca -0.03 -0.85 0.07 0.00 0.00 0.00 0.00 46.02 45.20 1i2m n GLY 324 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1i2m n ARG 325 N -2.73 0.07 0.12 1.61 1.85 -1.19 -1.80 116.66 114.59 1i2m n ARG 325 Ca -0.04 0.47 0.12 0.00 -1.00 0.00 0.00 57.85 57.39 1i2m n ARG 325 Cb 0.18 -1.69 0.11 0.00 -1.05 0.00 0.00 32.46 30.01 1i2m n ARG 325 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 177.63 177.55 1i2m h LEU 326 N 0.00 0.00 1.31 2.89 3.38 -1.79 -3.41 115.31 117.69 1i2m h LEU 326 Ca 0.00 -0.06 -0.30 0.00 0.09 0.00 0.00 57.88 57.61 1i2m h LEU 326 Cb 0.12 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.79 1i2m h LEU 326 CO 0.00 0.03 -0.32 0.61 0.09 0.00 0.00 178.44 178.85 1i2m n GLY 327 N 1.21 0.77 1.20 0.83 0.00 -0.75 -4.70 105.19 103.76 1i2m n GLY 327 Ca 0.02 -0.30 0.10 0.00 0.00 0.00 0.00 46.02 45.84 1i2m n GLY 327 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1i2m n LEU 328 N -1.88 3.50 0.00 0.99 4.77 -1.12 -4.33 117.00 118.93 1i2m n LEU 328 Ca -0.16 -1.75 0.00 0.00 -0.03 0.00 0.00 56.01 54.07 1i2m n LEU 328 Cb 0.55 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1i2m n LEU 328 CO 0.22 0.84 0.00 0.61 -1.33 0.00 0.00 177.39 177.73 1i2m n GLY 329 N 1.47 1.04 3.77 -0.72 0.00 0.94 -4.82 105.19 106.87 1i2m n GLY 329 Ca 0.21 -1.95 -0.35 0.00 0.00 0.00 0.00 46.02 43.93 1i2m n GLY 329 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1i2m s GLU 330 N -2.02 3.22 0.00 1.61 2.02 -1.26 -3.02 118.70 119.26 1i2m s GLU 330 Ca 0.00 1.67 0.00 0.00 0.02 0.00 0.00 54.97 56.66 1i2m s GLU 330 Cb 0.00 -1.98 0.00 0.00 0.10 0.00 0.00 34.13 32.25 1i2m s GLU 330 CO 0.00 -0.97 0.00 0.41 0.02 0.00 0.00 175.26 174.72 1i2m n GLY 331 N 0.25 1.46 3.64 -1.39 0.00 -1.26 -5.01 105.19 102.87 1i2m n GLY 331 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 1i2m n GLY 331 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i2m n ALA 332 N 0.25 0.43 -2.48 4.61 0.00 -1.17 -5.02 120.51 117.13 1i2m n ALA 332 Ca 0.00 0.09 -0.23 0.00 0.00 0.00 0.00 53.44 53.29 1i2m n ALA 332 Cb 0.00 -2.14 -0.10 0.00 0.00 0.00 0.00 19.45 17.20 1i2m n ALA 332 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1i2m s GLU 333 N -2.56 1.68 0.17 0.00 2.02 -1.26 -4.86 118.70 113.88 1i2m s GLU 333 Ca 0.71 -1.87 -0.33 0.00 0.02 0.00 0.00 54.97 53.50 1i2m s GLU 333 Cb -0.45 -1.35 -0.15 0.00 0.10 0.00 0.00 34.13 32.28 1i2m s GLU 333 CO 0.50 0.05 1.27 -1.91 0.02 0.00 0.00 175.26 175.19 1i2m n GLU 334 N -0.69 1.41 -5.05 1.61 2.13 -1.26 -4.69 120.64 114.10 1i2m n GLU 334 Ca -0.05 0.50 -0.32 0.00 0.66 0.00 0.00 57.16 57.95 1i2m n GLU 334 Cb 0.64 -2.08 -0.14 0.00 0.27 0.00 0.00 31.44 30.13 1i2m n GLU 334 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1i2m s LYS 335 N -0.14 2.36 0.00 5.31 -0.14 -0.63 -4.95 119.74 121.56 1i2m s LYS 335 Ca 0.75 -0.79 0.12 0.00 -1.36 0.00 0.00 55.97 54.69 1i2m s LYS 335 Cb -0.82 -2.25 0.13 0.00 -1.68 0.00 0.00 37.83 33.22 1i2m s LYS 335 CO 0.50 0.60 0.95 -1.13 -0.76 0.00 0.00 175.35 175.50 1i2m n SER 336 N 2.37 2.18 -4.05 2.83 3.41 -1.26 -0.51 113.62 118.59 1i2m n SER 336 Ca -0.17 -1.59 -0.13 0.00 -0.26 0.00 0.00 58.87 56.72 1i2m n SER 336 Cb 0.52 -0.04 -0.12 0.00 -0.26 0.00 0.00 64.21 64.31 1i2m n SER 336 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1i2m s ILE 337 N -1.04 0.53 0.03 -1.33 -4.36 -1.26 -4.06 121.20 109.72 1i2m s ILE 337 Ca 0.16 -0.97 -0.32 0.00 -0.26 0.00 0.00 60.65 59.26 1i2m s ILE 337 Cb 0.11 -0.58 -0.11 0.00 1.25 0.00 0.00 42.46 43.13 1i2m s ILE 337 CO 0.16 -0.31 1.85 -0.81 0.24 0.00 0.00 174.94 176.07 1i2m n PRO 338 N 1.65 2.51 -4.39 0.37 -0.04 -1.26 -4.62 135.00 129.22 1i2m n PRO 338 Ca -0.21 0.91 -0.34 0.00 -0.04 0.00 0.00 63.50 63.82 1i2m n PRO 338 Cb 0.55 -2.79 -0.13 0.00 -0.04 0.00 0.00 33.50 31.09 1i2m n PRO 338 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1i2m s THR 339 N 3.35 3.61 0.19 0.52 2.01 0.08 -4.85 115.64 120.55 1i2m s THR 339 Ca 0.87 -0.45 -0.33 0.00 0.31 0.00 0.00 61.69 62.09 1i2m s THR 339 Cb -0.57 -2.58 -0.13 0.00 0.01 0.00 0.00 72.50 69.23 1i2m s THR 339 CO 0.44 0.48 1.66 -0.11 -0.69 0.00 0.00 174.62 176.40 1i2m n LEU 340 N 3.79 3.63 -4.39 4.42 7.94 -1.26 -1.30 117.00 129.83 1i2m n LEU 340 Ca -0.18 1.07 -0.45 0.00 -1.11 0.00 0.00 56.01 55.34 1i2m n LEU 340 Cb 0.52 -1.51 -0.03 0.00 0.53 0.00 0.00 43.42 42.93 1i2m n LEU 340 CO 0.32 -0.01 0.62 -0.63 -1.11 0.00 0.00 177.39 176.57 1i2m s ILE 341 N 1.06 5.03 0.31 1.96 1.01 -0.05 -4.91 121.20 125.60 1i2m s ILE 341 Ca 0.77 -1.65 0.12 0.00 0.00 0.00 0.00 60.65 59.88 1i2m s ILE 341 Cb -0.58 -4.59 0.03 0.00 0.01 0.00 0.00 42.46 37.34 1i2m s ILE 341 CO 0.35 -1.23 1.71 0.77 0.00 0.00 0.00 174.94 176.54 1i2m h SER 342 N 8.63 0.00 0.00 3.58 4.64 -1.88 -3.29 113.55 125.23 1i2m h SER 342 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1i2m h SER 342 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1i2m h SER 342 CO 0.99 0.50 0.00 0.54 -0.87 0.00 0.00 176.83 177.99 1i2m n ARG 343 N -3.91 0.88 -4.83 4.77 1.74 -1.26 -4.80 116.66 109.25 1i2m n ARG 343 Ca -0.01 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 56.82 1i2m n ARG 343 Cb 0.52 -1.07 -0.15 0.00 -1.02 0.00 0.00 32.46 30.73 1i2m n ARG 343 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1i2m s LEU 344 N 0.00 2.03 0.00 0.55 1.43 -1.24 -4.84 118.68 116.61 1i2m s LEU 344 Ca 0.00 -0.31 -0.17 0.00 -1.03 0.00 0.00 54.13 52.61 1i2m s LEU 344 Cb 0.00 -0.89 0.25 0.00 0.03 0.00 0.00 46.19 45.58 1i2m s LEU 344 CO 0.00 0.21 1.06 -2.65 0.23 0.00 0.00 176.35 175.20 1i2m n PRO 345 N 2.66 -2.30 -1.68 1.29 -0.02 -1.26 -4.90 135.00 128.79 1i2m n PRO 345 Ca -0.15 -1.67 -0.45 0.00 -2.02 0.00 0.00 63.50 59.21 1i2m n PRO 345 Cb 0.54 -1.39 -0.03 0.00 -0.02 0.00 0.00 33.50 32.60 1i2m n PRO 345 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1i2m n ALA 346 N -4.36 1.28 -2.71 3.55 0.00 -1.26 -4.91 120.51 112.10 1i2m n ALA 346 Ca -0.19 0.42 -0.33 0.00 0.00 0.00 0.00 53.44 53.33 1i2m n ALA 346 Cb 0.53 -2.31 -0.08 0.00 0.00 0.00 0.00 19.45 17.59 1i2m n ALA 346 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1i2m s VAL 347 N 0.17 4.39 -0.11 0.00 1.01 0.70 -1.37 120.40 125.19 1i2m s VAL 347 Ca 0.70 -0.43 0.16 0.00 0.00 0.00 0.00 61.98 62.41 1i2m s VAL 347 Cb -0.64 -2.94 -0.23 0.00 0.00 0.00 0.00 36.38 32.57 1i2m s VAL 347 CO 0.47 0.44 0.17 -1.54 0.00 0.00 0.00 175.10 174.64 1i2m n SER 348 N 1.56 0.97 -3.44 3.32 3.41 0.78 -4.40 113.62 115.82 1i2m n SER 348 Ca -0.15 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.34 1i2m n SER 348 Cb 0.53 1.22 -0.02 0.00 -0.26 0.00 0.00 64.21 65.68 1i2m n SER 348 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1i2m s SER 349 N -4.66 -0.54 0.16 4.04 1.04 -1.11 -5.01 113.70 107.62 1i2m s SER 349 Ca -0.07 0.06 0.03 0.00 0.48 0.00 0.00 55.95 56.44 1i2m s SER 349 Cb 0.07 0.56 -0.05 0.00 0.10 0.00 0.00 66.02 66.70 1i2m s SER 349 CO 0.69 -0.88 -0.06 0.68 0.98 0.00 0.00 173.24 174.65 1i2m s VAL 350 N -3.44 0.97 0.07 5.02 -7.23 -1.26 -0.76 120.40 113.78 1i2m s VAL 350 Ca 0.01 -2.02 -0.25 0.00 -1.81 0.00 0.00 61.98 57.91 1i2m s VAL 350 Cb -0.01 -1.97 0.06 0.00 0.56 0.00 0.00 36.38 35.03 1i2m s VAL 350 CO -0.11 -0.63 0.59 0.00 -0.31 0.00 0.00 175.10 174.64 1i2m s ALA 351 N -3.46 -1.55 0.05 1.32 0.00 -0.81 -4.83 121.76 112.47 1i2m s ALA 351 Ca 0.20 0.72 0.05 0.00 0.00 0.00 0.00 51.96 52.92 1i2m s ALA 351 Cb 0.04 0.52 -0.02 0.00 0.00 0.00 0.00 23.12 23.66 1i2m s ALA 351 CO 0.02 -0.59 -0.14 0.00 0.00 0.00 0.00 175.76 175.05 1i2m n GLY 353 N 1.77 2.69 0.31 0.00 0.00 -0.09 -4.25 105.19 105.62 1i2m n GLY 353 Ca -0.19 -2.23 0.05 0.00 0.00 0.00 0.00 46.02 43.65 1i2m n GLY 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i2m h ALA 354 N 0.62 1.25 0.00 4.61 0.00 -1.68 -3.28 119.26 120.79 1i2m h ALA 354 Ca -0.18 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 1i2m h ALA 354 Cb 0.68 -0.10 -0.23 0.00 0.00 0.00 0.00 17.79 18.14 1i2m h ALA 354 CO 0.27 0.05 -0.81 0.43 0.00 0.00 0.00 179.25 179.20 1i2m n SER 355 N -4.77 0.57 -4.23 0.00 7.64 -1.26 -2.75 113.62 108.82 1i2m n SER 355 Ca 0.15 -2.00 -0.13 0.00 1.01 0.00 0.00 58.87 57.91 1i2m n SER 355 Cb 0.34 -0.25 -0.10 0.00 -1.01 0.00 0.00 64.21 63.18 1i2m n SER 355 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1i2m s VAL 356 N 0.00 0.72 0.08 0.44 -7.23 -1.23 -1.81 120.40 111.36 1i2m s VAL 356 Ca 0.20 -1.98 0.04 0.00 -1.81 0.00 0.00 61.98 58.42 1i2m s VAL 356 Cb 0.22 -2.01 -0.03 0.00 0.56 0.00 0.00 36.38 35.12 1i2m s VAL 356 CO -0.10 -0.58 -0.10 -0.83 -0.31 0.00 0.00 175.10 173.18 1i2m s GLY 357 N -3.15 0.75 0.05 2.32 0.00 0.18 -0.91 107.32 106.57 1i2m s GLY 357 Ca 0.21 -1.03 -0.03 0.00 0.00 0.00 0.00 44.72 43.87 1i2m s GLY 357 CO 0.02 -1.08 0.04 -0.19 0.00 0.00 0.00 173.10 171.88 1i2m s TYR 358 N -1.89 0.36 -0.13 1.90 1.51 0.34 -1.45 117.35 117.98 1i2m s TYR 358 Ca -0.01 -0.80 -0.08 0.00 -1.01 0.00 0.00 57.07 55.17 1i2m s TYR 358 Cb -0.06 -0.26 0.05 0.00 -0.11 0.00 0.00 41.96 41.58 1i2m s TYR 358 CO 0.01 -0.39 0.33 0.00 -1.11 0.00 0.00 175.55 174.38 1i2m s ALA 359 N -3.37 -0.80 -0.20 3.71 0.00 -0.71 -1.93 121.76 118.46 1i2m s ALA 359 Ca 0.02 1.18 -0.07 0.00 0.00 0.00 0.00 51.96 53.09 1i2m s ALA 359 Cb 0.04 -0.72 -0.04 0.00 0.00 0.00 0.00 23.12 22.40 1i2m s ALA 359 CO -0.08 -0.21 0.06 0.08 0.00 0.00 0.00 175.76 175.61 1i2m s VAL 360 N 1.06 4.68 0.64 0.00 1.01 0.07 -0.87 120.40 126.99 1i2m s VAL 360 Ca -0.07 -0.07 -0.10 0.00 0.00 0.00 0.00 61.98 61.74 1i2m s VAL 360 Cb -0.08 -3.12 -0.00 0.00 0.00 0.00 0.00 36.38 33.18 1i2m s VAL 360 CO -0.08 0.43 1.02 0.42 0.00 0.00 0.00 175.10 176.88 1i2m s THR 361 N 0.67 3.90 0.36 3.92 -4.23 0.19 -0.16 115.64 120.30 1i2m s THR 361 Ca 0.03 0.44 0.04 0.00 -1.18 0.00 0.00 61.69 61.03 1i2m s THR 361 Cb -0.13 -3.59 0.27 0.00 1.34 0.00 0.00 72.50 70.39 1i2m s THR 361 CO 0.02 -0.73 2.00 0.11 -0.54 0.00 0.00 174.62 175.48 1i2m h LYS 362 N -0.41 0.76 0.00 3.99 1.79 -1.50 -1.76 116.57 119.43 1i2m h LYS 362 Ca -0.45 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 57.97 1i2m h LYS 362 Cb 1.24 -0.17 0.00 0.00 -1.58 0.00 0.00 32.23 31.72 1i2m h LYS 362 CO 0.63 0.50 0.00 -0.40 -1.08 0.00 0.00 179.45 179.10 1i2m n ASP 363 N -4.46 0.00 0.00 0.86 5.68 -1.26 -4.89 116.55 112.48 1i2m n ASP 363 Ca 0.07 -1.44 0.00 0.00 -0.50 0.00 0.00 54.79 52.92 1i2m n ASP 363 Cb 0.11 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.09 1i2m n ASP 363 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1i2m n GLY 364 N 0.73 0.68 3.95 6.12 0.00 -0.66 -4.91 105.19 111.10 1i2m n GLY 364 Ca 0.12 -0.43 -0.20 0.00 0.00 0.00 0.00 46.02 45.52 1i2m n GLY 364 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1i2m s ARG 365 N -0.91 3.04 -0.04 1.61 0.52 -1.26 -0.01 118.95 121.89 1i2m s ARG 365 Ca 0.00 -1.07 0.02 0.00 -0.52 0.00 0.00 55.73 54.16 1i2m s ARG 365 Cb 0.00 -2.73 0.01 0.00 0.52 0.00 0.00 34.95 32.75 1i2m s ARG 365 CO 0.00 0.10 -0.09 0.54 0.02 0.00 0.00 175.30 175.88 1i2m s VAL 366 N -2.19 0.82 0.10 3.52 0.11 -1.26 -0.63 120.40 120.86 1i2m s VAL 366 Ca 0.43 -0.32 0.07 0.00 -2.93 0.00 0.00 61.98 59.22 1i2m s VAL 366 Cb -0.08 -0.77 -0.04 0.00 -1.53 0.00 0.00 36.38 33.96 1i2m s VAL 366 CO 0.30 0.27 -0.08 -0.36 -3.33 0.00 0.00 175.10 171.90 1i2m s PHE 367 N 0.57 2.79 0.06 1.54 0.40 -0.04 -1.03 117.98 122.27 1i2m s PHE 367 Ca -0.10 -0.13 0.01 0.00 -0.60 0.00 0.00 56.93 56.11 1i2m s PHE 367 Cb -0.13 -1.46 -0.03 0.00 0.51 0.00 0.00 43.02 41.91 1i2m s PHE 367 CO 0.01 0.44 -0.05 0.00 0.70 0.00 0.00 175.22 176.32 1i2m s ALA 368 N -1.23 0.59 0.21 5.36 0.00 -0.08 -1.74 121.76 124.88 1i2m s ALA 368 Ca 0.22 -1.02 -0.22 0.00 0.00 0.00 0.00 51.96 50.95 1i2m s ALA 368 Cb -0.11 0.15 0.04 0.00 0.00 0.00 0.00 23.12 23.21 1i2m s ALA 368 CO 0.14 -0.20 0.64 1.67 0.00 0.00 0.00 175.76 178.02 1i2m s TRP 369 N -2.68 -0.35 0.00 0.00 -2.14 -0.53 -0.60 118.94 112.63 1i2m s TRP 369 Ca -0.00 0.02 0.00 0.00 2.66 0.00 0.00 56.10 58.78 1i2m s TRP 369 Cb -0.01 0.61 0.00 0.00 -3.10 0.00 0.00 33.47 30.96 1i2m s TRP 369 CO -0.04 -1.02 0.00 0.41 -2.66 0.00 0.00 176.95 173.64 1i2m n GLY 370 N -0.41 -0.33 3.69 3.67 0.00 0.50 -0.64 105.19 111.68 1i2m n GLY 370 Ca -0.11 -2.20 -0.43 0.00 0.00 0.00 0.00 46.02 43.27 1i2m n GLY 370 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1i2m n MET 371 N 0.00 2.63 0.00 1.61 1.56 -0.75 -1.25 117.12 120.92 1i2m n MET 371 Ca 0.00 0.95 0.12 0.00 -0.27 0.00 0.00 57.70 58.50 1i2m n MET 371 Cb 0.00 -2.81 0.11 0.00 2.15 0.00 0.00 33.22 32.66 1i2m n MET 371 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1i2m n GLY 372 N 4.05 0.26 0.34 -5.12 0.00 -1.25 -4.60 105.19 98.87 1i2m n GLY 372 Ca 0.18 -0.62 0.20 0.00 0.00 0.00 0.00 46.02 45.77 1i2m n GLY 372 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1i2m h THR 373 N 3.00 0.46 -0.26 2.61 2.02 -1.81 -1.06 112.91 117.87 1i2m h THR 373 Ca 0.00 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.01 1i2m h THR 373 Cb 0.79 -0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.12 1i2m h THR 373 CO 0.00 0.09 0.00 0.59 0.37 0.00 0.00 175.52 176.57 1i2m n ASN 374 N -4.93 2.06 -2.40 4.18 3.02 -1.26 -4.93 115.26 111.00 1i2m n ASN 374 Ca 0.28 -1.82 -0.18 0.00 -0.03 0.00 0.00 54.58 52.83 1i2m n ASN 374 Cb 0.82 -0.17 0.03 0.00 -0.61 0.00 0.00 39.78 39.85 1i2m n ASN 374 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1i2m n TYR 375 N 0.59 -1.52 0.69 3.10 4.02 -0.40 -3.47 117.16 120.17 1i2m n TYR 375 Ca 0.16 0.39 0.12 0.00 -0.01 0.00 0.00 57.90 58.57 1i2m n TYR 375 Cb 0.37 -3.76 0.26 0.00 -0.02 0.00 0.00 39.34 36.19 1i2m n TYR 375 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1i2m n GLN 376 N -3.31 0.21 0.16 -0.72 6.02 -1.26 -3.44 117.38 115.05 1i2m n GLN 376 Ca -0.10 0.08 0.04 0.00 -0.01 0.00 0.00 57.00 57.01 1i2m n GLN 376 Cb 0.60 -1.65 0.21 0.00 1.02 0.00 0.00 30.24 30.41 1i2m n GLN 376 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1i2m h LEU 377 N 0.00 0.00 0.24 1.08 3.38 -1.87 -3.47 115.31 114.68 1i2m h LEU 377 Ca 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1i2m h LEU 377 Cb 0.68 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.39 1i2m h LEU 377 CO 0.00 0.47 -0.10 0.61 0.09 0.00 0.00 178.44 179.51 1i2m n GLY 378 N 0.59 0.77 0.15 0.83 0.00 -1.26 -4.75 105.19 101.52 1i2m n GLY 378 Ca 0.00 -0.72 0.08 0.00 0.00 0.00 0.00 46.02 45.38 1i2m n GLY 378 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1i2m h THR 379 N 0.00 0.27 0.00 2.61 1.35 -1.90 -3.36 112.91 111.87 1i2m h THR 379 Ca -0.10 -1.43 0.00 0.00 -0.55 0.00 0.00 66.41 64.32 1i2m h THR 379 Cb 0.36 1.93 0.00 0.00 -1.73 0.00 0.00 68.15 68.71 1i2m h THR 379 CO 0.15 0.15 0.00 0.61 -0.25 0.00 0.00 175.52 176.19 1i2m n GLY 380 N 1.21 2.07 3.65 5.82 0.00 -1.25 -5.04 105.19 111.65 1i2m n GLY 380 Ca -0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1i2m n GLY 380 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1i2m s GLN 381 N -0.88 2.15 -0.09 1.61 -1.52 -1.26 -4.99 119.66 114.67 1i2m s GLN 381 Ca 0.00 -1.69 0.17 0.00 -1.95 0.00 0.00 55.36 51.89 1i2m s GLN 381 Cb 0.00 -1.99 0.59 0.00 -0.22 0.00 0.00 33.01 31.39 1i2m s GLN 381 CO 0.00 0.14 1.50 -0.40 -0.25 0.00 0.00 175.29 176.28 1i2m n ASP 382 N -0.99 4.12 -4.78 5.90 5.75 -1.26 -4.75 116.55 120.54 1i2m n ASP 382 Ca -0.04 -2.39 -0.37 0.00 -0.01 0.00 0.00 54.79 51.98 1i2m n ASP 382 Cb 0.62 -0.48 -0.05 0.00 -1.03 0.00 0.00 41.12 40.18 1i2m n ASP 382 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1i2m s GLU 383 N -1.72 4.32 0.62 0.11 2.02 -1.26 -2.62 118.70 120.16 1i2m s GLU 383 Ca 0.43 1.47 -0.17 0.00 0.02 0.00 0.00 54.97 56.72 1i2m s GLU 383 Cb 0.27 -2.65 -0.02 0.00 0.10 0.00 0.00 34.13 31.83 1i2m s GLU 383 CO 0.21 0.01 1.15 -0.51 0.02 0.00 0.00 175.26 176.13 1i2m s ASP 384 N -1.54 5.18 -0.26 -0.19 1.01 -1.26 -4.00 116.67 115.61 1i2m s ASP 384 Ca 0.55 2.18 0.03 0.00 0.71 0.00 0.00 52.55 56.01 1i2m s ASP 384 Cb -0.21 -2.57 0.06 0.00 1.01 0.00 0.00 42.92 41.20 1i2m s ASP 384 CO 0.27 -1.59 -0.11 0.00 0.21 0.00 0.00 175.17 173.95 1i2m s ALA 385 N -1.97 2.57 -0.90 5.23 0.00 -0.38 -4.88 121.76 121.43 1i2m s ALA 385 Ca 0.72 -1.76 0.27 0.00 0.00 0.00 0.00 51.96 51.19 1i2m s ALA 385 Cb -0.25 -1.59 0.97 0.00 0.00 0.00 0.00 23.12 22.25 1i2m s ALA 385 CO 0.36 -1.18 1.78 0.91 0.00 0.00 0.00 175.76 177.63 1i2m n TRP 386 N 4.44 0.30 -4.22 0.00 7.02 -1.26 -0.37 117.44 123.35 1i2m n TRP 386 Ca -0.14 0.09 -0.20 0.00 -1.02 0.00 0.00 57.50 56.23 1i2m n TRP 386 Cb 0.42 -0.60 -0.12 0.00 -2.42 0.00 0.00 31.31 28.59 1i2m n TRP 386 CO 0.00 0.00 0.00 -1.12 -2.02 0.00 0.00 177.69 174.55 1i2m s SER 387 N -3.51 2.00 0.31 -0.99 0.01 -1.26 -0.04 113.70 110.22 1i2m s SER 387 Ca 0.12 -0.69 -0.29 0.00 1.31 0.00 0.00 55.95 56.40 1i2m s SER 387 Cb 0.17 -0.08 -0.12 0.00 0.21 0.00 0.00 66.02 66.19 1i2m s SER 387 CO 0.58 -0.06 1.41 -2.65 0.41 0.00 0.00 173.24 172.94 1i2m n PRO 388 N 1.02 2.31 -4.59 12.44 -0.02 -1.26 -4.70 135.00 140.20 1i2m n PRO 388 Ca -0.19 0.81 -0.24 0.00 -2.02 0.00 0.00 63.50 61.87 1i2m n PRO 388 Cb 0.55 -2.48 -0.16 0.00 -0.02 0.00 0.00 33.50 31.39 1i2m n PRO 388 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1i2m s VAL 389 N -0.63 1.10 0.11 -1.45 0.11 0.23 -4.89 120.40 114.98 1i2m s VAL 389 Ca 0.60 -0.50 -0.31 0.00 -2.93 0.00 0.00 61.98 58.84 1i2m s VAL 389 Cb -0.56 -0.98 -0.07 0.00 -1.53 0.00 0.00 36.38 33.24 1i2m s VAL 389 CO 0.57 0.34 1.29 -0.70 -3.33 0.00 0.00 175.10 173.27 1i2m s GLU 390 N 0.37 4.38 0.08 1.54 2.12 -1.26 -0.90 118.70 125.03 1i2m s GLU 390 Ca -0.08 1.94 -0.30 0.00 0.36 0.00 0.00 54.97 56.89 1i2m s GLU 390 Cb -0.13 -3.28 -0.05 0.00 0.26 0.00 0.00 34.13 30.93 1i2m s GLU 390 CO 0.02 -0.33 1.07 -1.64 -0.54 0.00 0.00 175.26 173.84 1i2m s MET 391 N 0.89 4.56 0.07 4.30 -1.94 -0.20 -4.95 119.30 122.03 1i2m s MET 391 Ca 0.61 1.60 0.04 0.00 -1.71 0.00 0.00 55.69 56.22 1i2m s MET 391 Cb -0.34 -3.37 -0.03 0.00 2.01 0.00 0.00 34.83 33.11 1i2m s MET 391 CO 0.31 -0.03 -0.10 -1.64 -0.01 0.00 0.00 175.02 173.55 1i2m s MET 392 N 0.48 0.71 0.00 2.03 1.00 -1.26 -4.79 119.30 117.47 1i2m s MET 392 Ca 0.52 -0.93 0.00 0.00 0.00 0.00 0.00 55.69 55.28 1i2m s MET 392 Cb -0.26 -0.53 0.00 0.00 0.00 0.00 0.00 34.83 34.04 1i2m s MET 392 CO 0.30 0.10 0.00 0.41 0.00 0.00 0.00 175.02 175.84 1i2m n GLY 393 N 1.16 1.80 0.33 -0.03 0.00 -1.26 -4.85 105.19 102.35 1i2m n GLY 393 Ca -0.21 -0.81 0.09 0.00 0.00 0.00 0.00 46.02 45.10 1i2m n GLY 393 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1i2m h LYS 394 N 0.00 0.68 0.00 1.61 3.64 -1.98 -0.18 116.57 120.33 1i2m h LYS 394 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1i2m h LYS 394 Cb 0.00 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1i2m h LYS 394 CO 0.00 0.45 0.00 1.04 -2.27 0.00 0.00 179.45 178.67 1i2m n GLN 395 N -4.82 0.44 0.00 1.90 1.13 -1.26 -2.78 117.38 111.99 1i2m n GLN 395 Ca 0.19 0.05 0.08 0.00 -1.94 0.00 0.00 57.00 55.38 1i2m n GLN 395 Cb 0.47 -1.50 -0.09 0.00 0.11 0.00 0.00 30.24 29.23 1i2m n GLN 395 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1i2m n LEU 396 N -1.22 0.88 -4.74 1.08 4.77 -0.10 -4.87 117.00 112.80 1i2m n LEU 396 Ca 0.13 -0.52 -0.41 0.00 -0.03 0.00 0.00 56.01 55.17 1i2m n LEU 396 Cb 0.17 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.23 1i2m n LEU 396 CO 0.17 0.21 1.05 -1.61 -1.33 0.00 0.00 177.39 175.89 1i2m s GLU 397 N -2.57 4.33 -1.81 3.23 2.02 -1.10 -2.68 118.70 120.11 1i2m s GLU 397 Ca 0.07 2.16 0.00 0.00 0.02 0.00 0.00 54.97 57.22 1i2m s GLU 397 Cb 0.13 -3.17 0.00 0.00 0.10 0.00 0.00 34.13 31.19 1i2m s GLU 397 CO 0.68 -0.36 0.00 0.09 0.02 0.00 0.00 175.26 175.69 1i2m n ASN 398 N 2.79 -5.80 -4.07 -0.19 3.02 -1.26 -4.98 115.26 104.77 1i2m n ASN 398 Ca 0.08 0.06 -0.11 0.00 -0.03 0.00 0.00 54.58 54.58 1i2m n ASN 398 Cb 0.42 -4.86 -0.11 0.00 -0.61 0.00 0.00 39.78 34.61 1i2m n ASN 398 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1i2m s ARG 399 N -4.89 0.56 0.03 3.52 0.52 -1.09 -4.51 118.95 113.09 1i2m s ARG 399 Ca 0.00 -0.93 0.06 0.00 -0.52 0.00 0.00 55.73 54.34 1i2m s ARG 399 Cb 0.00 -0.09 -0.03 0.00 0.52 0.00 0.00 34.95 35.34 1i2m s ARG 399 CO 0.00 -0.02 -0.16 0.14 0.02 0.00 0.00 175.30 175.28 1i2m s VAL 400 N -2.33 2.93 -0.09 3.52 -7.23 0.14 -4.92 120.40 112.42 1i2m s VAL 400 Ca -0.04 -1.10 -0.23 0.00 -1.81 0.00 0.00 61.98 58.80 1i2m s VAL 400 Cb -0.04 -2.24 -0.03 0.00 0.56 0.00 0.00 36.38 34.64 1i2m s VAL 400 CO -0.03 0.36 0.71 -0.69 -0.31 0.00 0.00 175.10 175.15 1i2m s VAL 401 N -0.92 5.02 -0.14 1.32 1.01 0.98 -1.02 120.40 126.64 1i2m s VAL 401 Ca 0.15 1.45 0.03 0.00 0.00 0.00 0.00 61.98 63.61 1i2m s VAL 401 Cb -0.11 -4.05 -0.23 0.00 0.00 0.00 0.00 36.38 31.99 1i2m s VAL 401 CO 0.05 0.21 0.28 0.18 0.00 0.00 0.00 175.10 175.82 1i2m n LEU 402 N 4.07 1.95 -3.64 3.92 4.77 0.13 -4.62 117.00 123.58 1i2m n LEU 402 Ca -0.00 0.16 -0.08 0.00 -0.03 0.00 0.00 56.01 56.06 1i2m n LEU 402 Cb 0.51 -0.56 -0.02 0.00 -2.33 0.00 0.00 43.42 41.02 1i2m n LEU 402 CO 0.47 0.72 0.56 -0.94 -1.33 0.00 0.00 177.39 176.86 1i2m s SER 403 N -6.51 -0.35 -0.01 -1.43 1.04 -1.07 -4.98 113.70 100.39 1i2m s SER 403 Ca -0.19 -0.27 -0.02 0.00 0.48 0.00 0.00 55.95 55.95 1i2m s SER 403 Cb 0.07 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.76 1i2m s SER 403 CO 0.76 -0.99 0.05 0.54 0.98 0.00 0.00 173.24 174.57 1i2m s VAL 404 N -3.56 0.03 -0.05 5.02 0.11 -1.26 -1.72 120.40 118.97 1i2m s VAL 404 Ca 0.07 -0.24 -0.07 0.00 -2.93 0.00 0.00 61.98 58.81 1i2m s VAL 404 Cb -0.03 -0.15 0.01 0.00 -1.53 0.00 0.00 36.38 34.69 1i2m s VAL 404 CO -0.03 -0.13 0.19 -0.55 -3.33 0.00 0.00 175.10 171.25 1i2m s SER 405 N -0.40 -0.14 0.04 3.54 0.15 -0.31 -4.76 113.70 111.82 1i2m s SER 405 Ca -0.05 0.21 0.01 0.00 0.70 0.00 0.00 55.95 56.83 1i2m s SER 405 Cb -0.03 0.34 -0.03 0.00 -1.71 0.00 0.00 66.02 64.60 1i2m s SER 405 CO 0.00 -0.18 -0.06 -0.55 1.20 0.00 0.00 173.24 173.65 1i2m s SER 406 N -0.40 0.68 0.00 5.45 0.15 -1.26 -0.03 113.70 118.29 1i2m s SER 406 Ca -0.05 -0.60 0.00 0.00 0.70 0.00 0.00 55.95 56.00 1i2m s SER 406 Cb -0.03 0.07 0.00 0.00 -1.71 0.00 0.00 66.02 64.35 1i2m s SER 406 CO 0.01 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 174.78 1i2m n GLY 407 N 1.29 4.28 0.18 9.45 0.00 0.15 -4.52 105.19 116.02 1i2m n GLY 407 Ca -0.22 -1.77 -0.18 0.00 0.00 0.00 0.00 46.02 43.85 1i2m n GLY 407 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1i2m h GLY 408 N 0.00 0.67 0.00 -0.02 0.00 -1.56 -2.42 103.07 99.75 1i2m h GLY 408 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 47.33 46.26 1i2m h GLY 408 CO 0.00 0.95 0.00 -1.06 0.00 0.00 0.00 176.54 176.43 1i2m n GLN 409 N -4.05 -0.41 -4.32 4.80 6.02 -1.26 -4.58 117.38 113.57 1i2m n GLN 409 Ca -0.09 -0.21 -0.17 0.00 -0.01 0.00 0.00 57.00 56.52 1i2m n GLN 409 Cb 0.74 -0.71 -0.10 0.00 1.02 0.00 0.00 30.24 31.19 1i2m n GLN 409 CO 0.00 0.00 0.00 -3.38 -1.01 0.00 0.00 177.06 172.67 1i2m s HIS 410 N -0.00 1.55 0.00 1.08 -3.43 -1.26 -1.04 115.29 112.20 1i2m s HIS 410 Ca 0.00 -1.22 -0.02 0.00 -0.80 0.00 0.00 55.06 53.02 1i2m s HIS 410 Cb 0.00 -0.90 -0.01 0.00 -1.43 0.00 0.00 32.58 30.25 1i2m s HIS 410 CO 0.00 -0.37 0.04 0.99 -2.00 0.00 0.00 174.74 173.40 1i2m s THR 411 N -3.72 0.07 -0.06 -5.38 2.01 -0.21 -0.68 115.64 107.68 1i2m s THR 411 Ca 0.37 -0.56 0.03 0.00 0.31 0.00 0.00 61.69 61.84 1i2m s THR 411 Cb 0.07 -0.24 0.01 0.00 0.01 0.00 0.00 72.50 72.35 1i2m s THR 411 CO 0.14 -0.31 -0.14 -0.69 -0.69 0.00 0.00 174.62 172.93 1i2m s VAL 412 N -0.96 1.27 0.06 3.82 1.01 0.96 -1.85 120.40 124.72 1i2m s VAL 412 Ca -0.10 -0.58 0.09 0.00 0.00 0.00 0.00 61.98 61.38 1i2m s VAL 412 Cb -0.06 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.15 1i2m s VAL 412 CO -0.00 0.38 -0.24 -0.76 0.00 0.00 0.00 175.10 174.48 1i2m s LEU 413 N 0.43 2.34 -0.20 3.92 1.43 0.66 -1.16 118.68 126.09 1i2m s LEU 413 Ca -0.11 -0.58 -0.03 0.00 -1.03 0.00 0.00 54.13 52.38 1i2m s LEU 413 Cb -0.14 -1.35 -0.00 0.00 0.03 0.00 0.00 46.19 44.73 1i2m s LEU 413 CO 0.04 0.24 -0.08 -0.22 0.23 0.00 0.00 176.35 176.56 1i2m s LEU 414 N -1.49 2.75 0.29 1.79 2.96 -0.70 -0.92 118.68 123.35 1i2m s LEU 414 Ca 0.13 -0.43 0.06 0.00 -0.22 0.00 0.00 54.13 53.67 1i2m s LEU 414 Cb -0.10 -1.68 -0.06 0.00 0.50 0.00 0.00 46.19 44.85 1i2m s LEU 414 CO 0.04 0.00 -0.02 0.68 -1.32 0.00 0.00 176.35 175.73 1i2m s VAL 415 N 1.33 1.49 0.04 1.68 -7.23 -0.06 0.17 120.40 117.83 1i2m s VAL 415 Ca 0.04 -2.08 -0.00 0.00 -1.81 0.00 0.00 61.98 58.13 1i2m s VAL 415 Cb -0.14 -2.54 -0.03 0.00 0.56 0.00 0.00 36.38 34.23 1i2m s VAL 415 CO -0.04 -0.23 -0.04 -0.75 -0.31 0.00 0.00 175.10 173.74 1i2m s LYS 416 N -3.78 0.51 0.00 4.82 2.20 -0.19 0.32 119.74 123.62 1i2m s LYS 416 Ca 0.31 -0.96 0.23 0.00 -0.36 0.00 0.00 55.97 55.19 1i2m s LYS 416 Cb 0.05 0.10 1.37 0.00 -1.51 0.00 0.00 37.83 37.85 1i2m s LYS 416 CO 0.13 -0.07 1.74 -0.25 -0.36 0.00 0.00 175.35 176.54