#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qm0 s THR 3 N 0.00 2.89 0.36 3.41 -1.32 -1.26 -5.15 115.64 114.56 2qm0 s THR 3 Ca 0.00 -1.64 0.07 0.00 -1.21 0.00 0.00 61.69 58.92 2qm0 s THR 3 Cb 0.00 -2.37 -0.02 0.00 -1.51 0.00 0.00 72.50 68.60 2qm0 s THR 3 CO 0.00 -0.00 0.38 0.28 -2.21 0.00 0.00 174.62 173.07 2qm0 s THR 4 N -1.41 3.50 0.03 5.08 -1.32 -1.26 -5.15 115.64 115.10 2qm0 s THR 4 Ca 0.21 -1.23 0.03 0.00 -1.21 0.00 0.00 61.69 59.49 2qm0 s THR 4 Cb -0.10 -3.20 -0.02 0.00 -1.51 0.00 0.00 72.50 67.68 2qm0 s THR 4 CO 0.12 -0.13 -0.10 0.68 -2.21 0.00 0.00 174.62 172.98 2qm0 s VAL 5 N -2.30 0.74 -0.40 5.08 -7.23 -1.26 -5.12 120.40 109.91 2qm0 s VAL 5 Ca 0.44 -0.86 -0.29 0.00 -1.81 0.00 0.00 61.98 59.47 2qm0 s VAL 5 Cb -0.07 -0.71 0.00 0.00 0.56 0.00 0.00 36.38 36.16 2qm0 s VAL 5 CO 0.29 -0.12 1.53 -0.70 -0.31 0.00 0.00 175.10 175.78 2qm0 s GLU 6 N -1.09 3.48 -0.07 4.82 2.12 -1.26 -5.00 118.70 121.70 2qm0 s GLU 6 Ca -0.03 1.04 -0.19 0.00 0.36 0.00 0.00 54.97 56.16 2qm0 s GLU 6 Cb -0.07 -4.08 -0.05 0.00 0.26 0.00 0.00 34.13 30.19 2qm0 s GLU 6 CO 0.01 -1.68 0.51 0.21 -0.54 0.00 0.00 175.26 173.76 2qm0 s LYS 7 N 5.20 4.28 0.32 4.30 2.20 -1.26 -5.07 119.74 129.71 2qm0 s LYS 7 Ca 0.66 0.54 0.06 0.00 -0.36 0.00 0.00 55.97 56.87 2qm0 s LYS 7 Cb -0.16 -3.38 -0.02 0.00 -1.51 0.00 0.00 37.83 32.76 2qm0 s LYS 7 CO 0.32 0.29 0.21 0.94 -0.36 0.00 0.00 175.35 176.76 2qm0 n GLN 8 N 3.13 0.45 -4.09 4.03 7.27 -1.26 -5.17 117.38 121.74 2qm0 n GLN 8 Ca -0.08 -3.04 -0.31 0.00 0.07 0.00 0.00 57.00 53.64 2qm0 n GLN 8 Cb 0.52 2.19 -0.07 0.00 2.41 0.00 0.00 30.24 35.28 2qm0 n GLN 8 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 2qm0 s GLN 9 N -3.29 2.91 -0.05 3.69 -1.52 -1.26 -5.09 119.66 115.06 2qm0 s GLN 9 Ca 0.30 -0.63 -0.30 0.00 -1.95 0.00 0.00 55.36 52.77 2qm0 s GLN 9 Cb 0.01 -2.75 -0.04 0.00 -0.22 0.00 0.00 33.01 30.02 2qm0 s GLN 9 CO 0.21 0.59 1.31 0.42 -0.25 0.00 0.00 175.29 177.57 2qm0 s ILE 10 N -1.31 4.02 -0.21 1.08 1.01 -1.26 -5.00 121.20 119.53 2qm0 s ILE 10 Ca 0.27 1.35 0.01 0.00 0.00 0.00 0.00 60.65 62.28 2qm0 s ILE 10 Cb -0.12 -3.87 0.04 0.00 0.01 0.00 0.00 42.46 38.52 2qm0 s ILE 10 CO 0.19 -0.02 -0.13 -0.63 0.00 0.00 0.00 174.94 174.34 2qm0 s ILE 11 N 2.54 1.90 -0.08 2.92 1.01 -1.26 -5.11 121.20 123.12 2qm0 s ILE 11 Ca 0.60 -1.17 -0.27 0.00 0.00 0.00 0.00 60.65 59.81 2qm0 s ILE 11 Cb -0.27 -1.91 -0.03 0.00 0.01 0.00 0.00 42.46 40.26 2qm0 s ILE 11 CO 0.23 0.21 0.85 -0.89 0.00 0.00 0.00 174.94 175.34 2qm0 s THR 12 N 1.29 4.92 0.64 2.92 2.01 -1.26 -5.05 115.64 121.11 2qm0 s THR 12 Ca -0.02 1.74 -0.16 0.00 0.31 0.00 0.00 61.69 63.57 2qm0 s THR 12 Cb -0.16 -4.18 -0.01 0.00 0.01 0.00 0.00 72.50 68.16 2qm0 s THR 12 CO -0.08 0.13 1.12 -0.55 -0.69 0.00 0.00 174.62 174.55 2qm0 s SER 13 N 0.99 5.14 -1.43 3.53 0.15 -1.26 -3.41 113.70 117.41 2qm0 s SER 13 Ca 0.43 2.07 -0.02 0.00 0.70 0.00 0.00 55.95 59.14 2qm0 s SER 13 Cb -0.18 -2.56 0.01 0.00 -1.71 0.00 0.00 66.02 61.57 2qm0 s SER 13 CO 0.19 -1.61 0.14 0.59 1.20 0.00 0.00 173.24 173.75 2qm0 n ASN 14 N -2.22 -5.00 -4.28 5.45 4.13 -1.26 -4.96 115.26 107.11 2qm0 n ASN 14 Ca 0.11 -0.01 -0.15 0.00 1.68 0.00 0.00 54.58 56.20 2qm0 n ASN 14 Cb 0.52 -4.16 -0.10 0.00 -1.54 0.00 0.00 39.78 34.49 2qm0 n ASN 14 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 2qm0 s THR 15 N -2.89 1.01 0.24 3.41 -4.23 -1.22 -1.32 115.64 110.63 2qm0 s THR 15 Ca 0.08 -2.03 -0.21 0.00 -1.18 0.00 0.00 61.69 58.35 2qm0 s THR 15 Cb -0.04 -2.12 0.03 0.00 1.34 0.00 0.00 72.50 71.71 2qm0 s THR 15 CO 0.10 -0.51 0.66 -1.83 -0.54 0.00 0.00 174.62 172.50 2qm0 s GLU 16 N -3.83 1.60 0.01 3.99 -1.05 -0.54 -4.98 118.70 113.89 2qm0 s GLU 16 Ca 0.23 -0.84 0.07 0.00 -0.15 0.00 0.00 54.97 54.28 2qm0 s GLU 16 Cb 0.05 0.59 -0.02 0.00 -0.44 0.00 0.00 34.13 34.31 2qm0 s GLU 16 CO 0.05 -0.72 -0.20 -1.14 0.95 0.00 0.00 175.26 174.20 2qm0 s GLN 17 N -3.87 1.47 -0.11 -4.83 0.74 -1.26 -0.45 119.66 111.35 2qm0 s GLN 17 Ca 0.08 -0.81 0.03 0.00 0.05 0.00 0.00 55.36 54.71 2qm0 s GLN 17 Cb -0.04 -1.49 -0.00 0.00 1.10 0.00 0.00 33.01 32.58 2qm0 s GLN 17 CO 0.00 0.40 -0.22 -1.58 -0.55 0.00 0.00 175.29 173.34 2qm0 s TRP 18 N -0.63 2.61 0.21 1.67 0.51 0.25 -4.96 118.94 118.60 2qm0 s TRP 18 Ca 0.07 -1.00 -0.04 0.00 -2.12 0.00 0.00 56.10 53.02 2qm0 s TRP 18 Cb -0.08 -1.74 -0.05 0.00 -0.81 0.00 0.00 33.47 30.79 2qm0 s TRP 18 CO 0.00 -0.40 0.44 0.21 -0.51 0.00 0.00 176.95 176.70 2qm0 s LYS 19 N 0.37 3.60 -0.20 4.98 2.20 -1.26 0.09 119.74 129.51 2qm0 s LYS 19 Ca -0.17 -0.14 -0.16 0.00 -0.36 0.00 0.00 55.97 55.15 2qm0 s LYS 19 Cb -0.18 -2.78 0.06 0.00 -1.51 0.00 0.00 37.83 33.42 2qm0 s LYS 19 CO 0.08 0.37 0.51 0.71 -0.36 0.00 0.00 175.35 176.66 2qm0 s TYR 21 N -1.85 -0.63 0.33 4.03 2.02 -1.26 -5.01 117.35 114.97 2qm0 s TYR 21 Ca 0.41 1.45 -0.29 0.00 -0.37 0.00 0.00 57.07 58.28 2qm0 s TYR 21 Cb -0.11 0.26 -0.10 0.00 -0.40 0.00 0.00 41.96 41.61 2qm0 s TYR 21 CO 0.27 -0.32 1.27 -1.54 -1.57 0.00 0.00 175.55 173.67 2qm0 s SER 22 N 0.67 6.83 0.17 2.29 1.04 0.57 -4.84 113.70 120.43 2qm0 s SER 22 Ca -0.03 2.61 -0.14 0.00 0.48 0.00 0.00 55.95 58.87 2qm0 s SER 22 Cb -0.05 -2.64 0.07 0.00 0.10 0.00 0.00 66.02 63.49 2qm0 s SER 22 CO -0.04 -0.49 1.83 0.11 0.98 0.00 0.00 173.24 175.63 2qm0 h LYS 23 N 3.40 0.67 -0.11 4.02 1.57 -1.97 0.18 116.57 124.33 2qm0 h LYS 23 Ca -0.49 -0.04 -0.21 0.00 -1.87 0.00 0.00 60.65 58.05 2qm0 h LYS 23 Cb 1.22 -0.15 0.01 0.00 0.08 0.00 0.00 32.23 33.39 2qm0 h LYS 23 CO 0.65 0.44 -0.75 1.25 -0.57 0.00 0.00 179.45 180.48 2qm0 h LEU 24 N 0.69 0.84 0.00 2.94 5.85 -1.97 -3.37 115.31 120.29 2qm0 h LEU 24 Ca 0.19 -0.66 0.00 0.00 0.84 0.00 0.00 57.88 58.25 2qm0 h LEU 24 Cb -0.07 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.71 2qm0 h LEU 24 CO -0.05 1.37 -0.23 -0.62 -0.34 0.00 0.00 178.44 178.58 2qm0 n GLU 25 N -4.01 5.49 -1.94 1.25 1.02 -1.23 -5.00 120.64 116.22 2qm0 n GLU 25 Ca -0.08 -0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 56.93 2qm0 n GLU 25 Cb 0.73 -0.69 -0.02 0.00 -0.02 0.00 0.00 31.44 31.44 2qm0 n GLU 25 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qm0 n GLY 26 N 1.16 0.37 3.71 0.62 0.00 0.62 -4.96 105.19 106.70 2qm0 n GLY 26 Ca 0.01 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 2qm0 n GLY 26 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qm0 s LYS 27 N -4.09 4.42 -0.09 1.61 2.20 -1.25 -4.58 119.74 117.95 2qm0 s LYS 27 Ca 0.00 1.77 -0.26 0.00 -0.36 0.00 0.00 55.97 57.12 2qm0 s LYS 27 Cb 0.00 -3.37 -0.03 0.00 -1.51 0.00 0.00 37.83 32.92 2qm0 s LYS 27 CO 0.00 -0.28 0.82 -2.00 -0.36 0.00 0.00 175.35 173.53 2qm0 s GLU 28 N 1.19 4.41 0.15 4.03 2.12 -1.26 -0.31 118.70 129.02 2qm0 s GLU 28 Ca 0.59 1.06 0.10 0.00 0.36 0.00 0.00 54.97 57.08 2qm0 s GLU 28 Cb -0.29 -3.50 -0.04 0.00 0.26 0.00 0.00 34.13 30.56 2qm0 s GLU 28 CO 0.29 -0.12 -0.19 0.71 -0.54 0.00 0.00 175.26 175.41 2qm0 s TYR 29 N 1.40 2.48 -0.23 5.30 2.02 -1.26 -4.52 117.35 122.54 2qm0 s TYR 29 Ca 0.41 -0.29 0.02 0.00 -0.37 0.00 0.00 57.07 56.84 2qm0 s TYR 29 Cb -0.18 -1.27 0.05 0.00 -0.40 0.00 0.00 41.96 40.15 2qm0 s TYR 29 CO 0.18 0.43 -0.13 -1.14 -1.57 0.00 0.00 175.55 173.32 2qm0 s GLN 30 N -2.40 2.36 -0.23 -0.62 0.74 -0.32 -4.39 119.66 114.80 2qm0 s GLN 30 Ca 0.20 -1.11 -0.09 0.00 0.05 0.00 0.00 55.36 54.41 2qm0 s GLN 30 Cb -0.09 -2.71 -0.04 0.00 1.10 0.00 0.00 33.01 31.26 2qm0 s GLN 30 CO 0.11 -0.45 0.11 0.42 -0.55 0.00 0.00 175.29 174.92 2qm0 s ILE 31 N 1.22 4.95 -0.16 -2.34 -1.09 0.11 -1.29 121.20 122.61 2qm0 s ILE 31 Ca -0.04 0.04 -0.08 0.00 -2.23 0.00 0.00 60.65 58.34 2qm0 s ILE 31 Cb -0.17 -3.29 -0.04 0.00 -1.58 0.00 0.00 42.46 37.37 2qm0 s ILE 31 CO -0.08 0.37 0.12 -1.00 -1.23 0.00 0.00 174.94 173.13 2qm0 s HIS 32 N 1.03 3.47 -0.04 3.97 3.76 0.01 -0.58 115.29 126.91 2qm0 s HIS 32 Ca 0.06 0.39 0.03 0.00 -0.15 0.00 0.00 55.06 55.38 2qm0 s HIS 32 Cb -0.14 -2.04 0.01 0.00 1.11 0.00 0.00 32.58 31.52 2qm0 s HIS 32 CO 0.04 0.49 -0.10 0.42 -0.85 0.00 0.00 174.74 174.73 2qm0 s ILE 33 N -0.31 0.92 -0.12 0.60 1.01 0.41 0.35 121.20 124.05 2qm0 s ILE 33 Ca 0.11 -0.41 0.03 0.00 0.00 0.00 0.00 60.65 60.38 2qm0 s ILE 33 Cb -0.12 -0.83 0.00 0.00 0.01 0.00 0.00 42.46 41.53 2qm0 s ILE 33 CO 0.01 0.29 -0.23 -0.55 0.00 0.00 0.00 174.94 174.46 2qm0 s SER 34 N 0.35 3.11 -0.08 3.58 0.15 -0.10 -1.47 113.70 119.25 2qm0 s SER 34 Ca -0.07 -0.58 0.01 0.00 0.70 0.00 0.00 55.95 56.02 2qm0 s SER 34 Cb -0.11 -1.43 -0.02 0.00 -1.71 0.00 0.00 66.02 62.74 2qm0 s SER 34 CO 0.01 0.12 -0.11 -0.75 1.20 0.00 0.00 173.24 173.72 2qm0 s LYS 35 N 0.58 2.90 0.62 5.44 2.20 -0.43 -1.41 119.74 129.63 2qm0 s LYS 35 Ca -0.13 -0.63 -0.19 0.00 -0.36 0.00 0.00 55.97 54.66 2qm0 s LYS 35 Cb -0.17 -2.56 -0.02 0.00 -1.51 0.00 0.00 37.83 33.57 2qm0 s LYS 35 CO 0.04 0.51 1.31 -2.14 -0.36 0.00 0.00 175.35 174.71 2qm0 s PRO 36 N -0.40 2.73 0.17 4.03 0.02 -1.26 -4.83 135.00 135.45 2qm0 s PRO 36 Ca 0.05 2.12 -0.10 0.00 0.02 0.00 0.00 61.00 63.09 2qm0 s PRO 36 Cb -0.12 -1.97 0.05 0.00 0.02 0.00 0.00 34.50 32.48 2qm0 s PRO 36 CO 0.02 -1.48 1.63 -0.22 -0.33 0.00 0.00 177.00 176.63 2qm0 h LYS 37 N 0.82 1.01 -6.94 5.54 1.63 -1.97 -3.45 116.57 113.21 2qm0 h LYS 37 Ca -0.51 -0.32 -0.54 0.00 -0.85 0.00 0.00 60.65 58.44 2qm0 h LYS 37 Cb 1.33 -0.09 0.10 0.00 -0.60 0.00 0.00 32.23 32.96 2qm0 h LYS 37 CO 0.54 1.00 0.73 -0.65 -3.45 0.00 0.00 179.45 177.62 2qm0 s GLN 38 N -5.04 4.08 0.50 1.90 1.11 -1.26 -4.98 119.66 115.97 2qm0 s GLN 38 Ca -0.12 2.45 -0.23 0.00 0.01 0.00 0.00 55.36 57.47 2qm0 s GLN 38 Cb 0.13 -2.93 -0.07 0.00 -1.01 0.00 0.00 33.01 29.13 2qm0 s GLN 38 CO 0.85 -0.51 1.26 -2.30 0.01 0.00 0.00 175.29 174.60 2qm0 n PRO 39 N 0.40 1.67 -1.74 2.91 -0.02 -1.26 -4.96 135.00 132.00 2qm0 n PRO 39 Ca 0.02 0.61 -0.39 0.00 -2.02 0.00 0.00 63.50 61.71 2qm0 n PRO 39 Cb 0.40 -2.42 0.03 0.00 -0.02 0.00 0.00 33.50 31.49 2qm0 n PRO 39 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qm0 n ALA 40 N -0.78 1.61 -0.97 3.55 0.00 -1.26 -5.00 120.51 117.66 2qm0 n ALA 40 Ca 0.09 0.18 -0.29 0.00 0.00 0.00 0.00 53.44 53.42 2qm0 n ALA 40 Cb 0.43 -2.34 0.22 0.00 0.00 0.00 0.00 19.45 17.75 2qm0 n ALA 40 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2qm0 s PRO 41 N -2.66 -0.51 0.31 0.00 0.02 -1.26 -4.87 135.00 126.04 2qm0 s PRO 41 Ca 0.67 0.40 -0.00 0.00 0.02 0.00 0.00 61.00 62.08 2qm0 s PRO 41 Cb -0.44 -1.64 0.50 0.00 0.02 0.00 0.00 34.50 32.94 2qm0 s PRO 41 CO 0.53 -3.34 1.95 0.22 -0.33 0.00 0.00 177.00 176.04 2qm0 h ASP 42 N -2.33 0.84 0.19 2.53 3.58 -2.02 -1.43 116.42 117.79 2qm0 h ASP 42 Ca -0.54 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 56.87 2qm0 h ASP 42 Cb 1.33 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 42.17 2qm0 h ASP 42 CO 0.49 0.65 0.00 -1.20 -2.88 0.00 0.00 179.24 176.30 2qm0 n SER 43 N -4.39 0.00 0.00 2.28 7.64 -1.26 -5.01 113.62 112.88 2qm0 n SER 43 Ca 0.07 -0.55 0.00 0.00 1.01 0.00 0.00 58.87 59.41 2qm0 n SER 43 Cb 0.07 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 2qm0 n SER 43 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qm0 n GLY 44 N 0.79 1.45 3.75 0.23 0.00 -0.54 -3.49 105.19 107.38 2qm0 n GLY 44 Ca 0.17 -2.01 -0.40 0.00 0.00 0.00 0.00 46.02 43.78 2qm0 n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qm0 s TYR 45 N -2.00 3.72 0.88 1.61 2.02 0.73 -4.10 117.35 120.22 2qm0 s TYR 45 Ca 0.00 1.77 -0.13 0.00 -0.37 0.00 0.00 57.07 58.35 2qm0 s TYR 45 Cb 0.00 -3.18 0.07 0.00 -0.40 0.00 0.00 41.96 38.45 2qm0 s TYR 45 CO 0.00 -0.20 0.80 -2.30 -1.57 0.00 0.00 175.55 172.28 2qm0 n PRO 46 N 1.35 -0.16 -3.92 -1.71 -0.02 -1.26 -0.37 135.00 128.91 2qm0 n PRO 46 Ca -0.01 0.01 -0.13 0.00 -2.02 0.00 0.00 63.50 61.35 2qm0 n PRO 46 Cb 0.46 -2.12 -0.14 0.00 -0.02 0.00 0.00 33.50 31.67 2qm0 n PRO 46 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2qm0 s VAL 47 N -2.34 0.08 -0.22 -1.45 0.11 -0.48 -1.86 120.40 114.24 2qm0 s VAL 47 Ca 0.64 -0.03 0.01 0.00 -2.93 0.00 0.00 61.98 59.67 2qm0 s VAL 47 Cb -0.25 -0.08 0.03 0.00 -1.53 0.00 0.00 36.38 34.55 2qm0 s VAL 47 CO 0.60 0.03 -0.15 -0.63 -3.33 0.00 0.00 175.10 171.62 2qm0 s ILE 48 N 0.06 2.25 -0.22 7.04 1.01 0.15 -0.71 121.20 130.78 2qm0 s ILE 48 Ca -0.00 -1.15 -0.18 0.00 0.00 0.00 0.00 60.65 59.32 2qm0 s ILE 48 Cb -0.01 -2.09 -0.03 0.00 0.01 0.00 0.00 42.46 40.33 2qm0 s ILE 48 CO -0.00 0.32 0.49 -0.31 0.00 0.00 0.00 174.94 175.44 2qm0 s TYR 49 N 1.24 3.34 -0.29 3.97 2.02 0.31 -0.29 117.35 127.65 2qm0 s TYR 49 Ca 0.00 0.69 0.00 0.00 -0.37 0.00 0.00 57.07 57.40 2qm0 s TYR 49 Cb -0.16 -2.66 0.06 0.00 -0.40 0.00 0.00 41.96 38.80 2qm0 s TYR 49 CO -0.09 -0.14 -0.03 0.08 -1.57 0.00 0.00 175.55 173.79 2qm0 s VAL 50 N 1.80 2.69 0.71 0.71 1.01 0.56 -0.43 120.40 127.44 2qm0 s VAL 50 Ca 0.22 -1.51 -0.11 0.00 0.00 0.00 0.00 61.98 60.57 2qm0 s VAL 50 Cb -0.15 -2.58 0.02 0.00 0.00 0.00 0.00 36.38 33.67 2qm0 s VAL 50 CO 0.09 -0.11 1.07 -0.76 0.00 0.00 0.00 175.10 175.39 2qm0 s LEU 51 N 1.19 3.14 -1.33 3.92 1.43 -0.69 -0.37 118.68 125.97 2qm0 s LEU 51 Ca -0.06 1.69 -0.02 0.00 -1.03 0.00 0.00 54.13 54.72 2qm0 s LEU 51 Cb -0.20 -4.51 -0.00 0.00 0.03 0.00 0.00 46.19 41.51 2qm0 s LEU 51 CO -0.03 -1.57 0.58 0.47 0.23 0.00 0.00 176.35 176.03 2qm0 n ASP 52 N -3.13 -1.17 -0.36 2.29 8.00 -1.18 -4.81 116.55 116.20 2qm0 n ASP 52 Ca 0.08 -0.92 0.07 0.00 0.71 0.00 0.00 54.79 54.73 2qm0 n ASP 52 Cb 0.53 -3.57 0.23 0.00 -0.02 0.00 0.00 41.12 38.30 2qm0 n ASP 52 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2qm0 h GLY 53 N -1.85 1.63 1.48 0.44 0.00 -1.22 -0.19 103.07 103.35 2qm0 h GLY 53 Ca -0.62 -0.43 0.07 0.00 0.00 0.00 0.00 47.33 46.35 2qm0 h GLY 53 CO 0.58 0.18 0.19 3.43 0.00 0.00 0.00 176.54 180.92 2qm0 h ASN 54 N 1.01 0.00 0.80 0.19 2.35 -1.82 -0.85 115.58 117.26 2qm0 h ASN 54 Ca 0.49 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 56.00 2qm0 h ASN 54 Cb 0.45 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.79 2qm0 h ASN 54 CO -0.26 0.00 -1.27 0.00 -1.65 0.00 0.00 177.43 174.25 2qm0 h ALA 55 N 1.86 0.50 0.00 -0.83 0.00 -0.52 -3.43 119.26 116.85 2qm0 h ALA 55 Ca 0.12 -1.12 0.00 0.00 0.00 0.00 0.00 54.91 53.91 2qm0 h ALA 55 Cb 0.50 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2qm0 h ALA 55 CO -0.00 1.37 -0.05 1.19 0.00 0.00 0.00 179.25 181.76 2qm0 n PHE 56 N -3.24 0.00 0.08 0.00 3.72 -1.10 -4.87 117.46 112.04 2qm0 n PHE 56 Ca -0.07 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.22 2qm0 n PHE 56 Cb 0.98 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 39.47 2qm0 n PHE 56 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 2qm0 h PHE 57 N 0.00 -0.67 -0.62 1.38 3.57 -1.40 -2.43 116.94 116.77 2qm0 h PHE 57 Ca 0.00 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 2qm0 h PHE 57 Cb 0.00 0.29 -0.03 0.00 2.79 0.00 0.00 35.95 39.00 2qm0 h PHE 57 CO 0.00 -0.34 0.28 1.96 -2.23 0.00 0.00 178.31 177.98 2qm0 h GLN 58 N -0.41 0.88 -0.09 1.11 1.08 -1.89 -0.05 115.11 115.73 2qm0 h GLN 58 Ca 0.05 -0.12 0.00 0.00 -1.45 0.00 0.00 58.65 57.14 2qm0 h GLN 58 Cb 0.47 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 27.73 2qm0 h GLN 58 CO -0.19 0.69 0.05 1.15 -0.95 0.00 0.00 178.83 179.57 2qm0 h THR 59 N 0.87 1.01 -0.31 -0.54 2.02 -1.84 0.19 112.91 114.31 2qm0 h THR 59 Ca 0.21 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.34 2qm0 h THR 59 Cb 0.11 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 2qm0 h THR 59 CO -0.03 0.02 0.13 -0.26 0.37 0.00 0.00 175.52 175.76 2qm0 h PHE 60 N 0.11 0.46 -0.09 3.16 -1.00 -1.06 -2.37 116.94 116.14 2qm0 h PHE 60 Ca 0.03 -0.03 0.03 0.00 2.81 0.00 0.00 57.97 60.81 2qm0 h PHE 60 Cb -0.00 -0.14 -0.03 0.00 3.61 0.00 0.00 35.95 39.39 2qm0 h PHE 60 CO -0.08 0.43 -0.06 1.25 -1.61 0.00 0.00 178.31 178.24 2qm0 h HIS 61 N 0.35 -0.14 -0.40 -0.55 2.76 -0.72 -1.34 115.15 115.12 2qm0 h HIS 61 Ca 0.10 0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 58.18 2qm0 h HIS 61 Cb 0.16 0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.18 2qm0 h HIS 61 CO -0.01 -0.09 -0.16 0.93 -1.30 0.00 0.00 177.93 177.29 2qm0 h GLU 62 N -0.06 0.82 -0.27 5.26 5.08 -0.62 -0.24 114.58 124.55 2qm0 h GLU 62 Ca 0.06 -0.34 -0.01 0.00 -1.00 0.00 0.00 59.36 58.07 2qm0 h GLU 62 Cb 0.15 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2qm0 h GLU 62 CO -0.13 0.97 0.13 0.00 -1.00 0.00 0.00 179.01 178.97 2qm0 h ALA 63 N 0.82 0.35 -0.52 3.43 0.00 -1.33 -1.74 119.26 120.26 2qm0 h ALA 63 Ca 0.09 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2qm0 h ALA 63 Cb 0.71 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2qm0 h ALA 63 CO 0.05 -0.09 0.24 0.28 0.00 0.00 0.00 179.25 179.73 2qm0 h VAL 64 N 0.30 1.20 -0.80 0.00 2.07 -1.15 0.98 116.25 118.85 2qm0 h VAL 64 Ca 0.09 -0.60 0.03 0.00 0.82 0.00 0.00 66.70 67.04 2qm0 h VAL 64 Cb 0.13 0.63 -0.05 0.00 -1.52 0.00 0.00 31.29 30.48 2qm0 h VAL 64 CO -0.01 0.23 0.52 0.50 0.02 0.00 0.00 177.57 178.83 2qm0 h LYS 65 N 0.70 0.99 0.02 1.57 3.64 -0.93 -0.79 116.57 121.76 2qm0 h LYS 65 Ca 0.18 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2qm0 h LYS 65 Cb 0.15 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 2qm0 h LYS 65 CO -0.02 0.65 -0.01 0.82 -2.27 0.00 0.00 179.45 178.62 2qm0 h ILE 66 N 1.02 1.39 0.00 2.00 2.04 -1.21 -3.39 117.51 119.37 2qm0 h ILE 66 Ca 0.32 -1.84 -0.12 0.00 1.00 0.00 0.00 64.86 64.22 2qm0 h ILE 66 Cb -0.02 2.54 -0.02 0.00 -0.74 0.00 0.00 36.82 38.58 2qm0 h ILE 66 CO -0.10 0.44 -0.58 1.56 0.00 0.00 0.00 178.15 179.47 2qm0 h GLN 67 N -0.90 0.00 0.00 2.37 4.20 -0.77 -3.11 115.11 116.91 2qm0 h GLN 67 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2qm0 h GLN 67 Cb 0.74 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.52 2qm0 h GLN 67 CO 0.01 0.58 0.00 -1.13 -0.67 0.00 0.00 178.83 177.61 2qm0 n SER 68 N -3.72 0.00 -0.17 1.46 3.41 -0.31 -3.29 113.62 111.00 2qm0 n SER 68 Ca -0.01 0.38 -0.09 0.00 -0.26 0.00 0.00 58.87 58.89 2qm0 n SER 68 Cb 0.60 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 2qm0 n SER 68 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2qm0 h VAL 69 N 0.00 1.23 -2.38 -3.33 2.07 -1.72 -3.27 116.25 108.84 2qm0 h VAL 69 Ca 0.00 -0.79 -0.66 0.00 0.82 0.00 0.00 66.70 66.08 2qm0 h VAL 69 Cb 0.39 0.84 -0.38 0.00 -1.52 0.00 0.00 31.29 30.62 2qm0 h VAL 69 CO 0.00 0.28 -0.22 -1.14 0.02 0.00 0.00 177.57 176.51 2qm0 n ARG 70 N -4.51 3.08 -0.14 1.57 0.63 -1.21 -4.93 116.66 111.16 2qm0 n ARG 70 Ca 0.01 -4.65 0.10 0.00 -0.92 0.00 0.00 57.85 52.39 2qm0 n ARG 70 Cb 0.20 -2.33 0.44 0.00 0.45 0.00 0.00 32.46 31.23 2qm0 n ARG 70 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2qm0 h ALA 71 N 4.48 1.90 0.00 5.13 0.00 -1.70 0.26 119.26 129.34 2qm0 h ALA 71 Ca 0.20 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 2qm0 h ALA 71 Cb 0.64 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2qm0 h ALA 71 CO 0.97 -0.05 -0.26 0.93 0.00 0.00 0.00 179.25 180.84 2qm0 h GLU 72 N 0.55 0.00 0.14 0.00 4.39 -1.91 0.57 114.58 118.31 2qm0 h GLU 72 Ca 0.31 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.79 2qm0 h GLU 72 Cb 0.49 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.16 2qm0 h GLU 72 CO -0.10 0.26 -1.00 0.87 -1.16 0.00 0.00 179.01 177.89 2qm0 h LYS 73 N 0.00 0.30 0.00 2.33 1.79 -1.66 -3.40 116.57 115.93 2qm0 h LYS 73 Ca -0.00 -0.51 0.00 0.00 -2.18 0.00 0.00 60.65 57.96 2qm0 h LYS 73 Cb 1.00 0.19 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 2qm0 h LYS 73 CO 0.03 1.25 -1.08 0.25 -1.08 0.00 0.00 179.45 178.81 2qm0 n THR 74 N -4.06 0.39 -1.15 -0.16 -2.24 -0.03 -4.96 114.28 102.08 2qm0 n THR 74 Ca -0.17 -0.43 -0.05 0.00 -2.27 0.00 0.00 64.05 61.13 2qm0 n THR 74 Cb 0.86 -0.13 -0.02 0.00 -2.10 0.00 0.00 70.33 68.94 2qm0 n THR 74 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qm0 n GLY 75 N 1.26 0.72 3.38 3.38 0.00 0.20 -4.83 105.19 109.31 2qm0 n GLY 75 Ca 0.00 -0.30 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 2qm0 n GLY 75 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qm0 s VAL 76 N -1.97 3.73 0.22 1.61 1.01 -1.24 -4.41 120.40 119.35 2qm0 s VAL 76 Ca 0.00 -0.38 -0.28 0.00 0.00 0.00 0.00 61.98 61.32 2qm0 s VAL 76 Cb 0.00 -2.70 -0.09 0.00 0.00 0.00 0.00 36.38 33.60 2qm0 s VAL 76 CO 0.00 0.41 0.88 -0.44 0.00 0.00 0.00 175.10 175.95 2qm0 s SER 77 N 1.29 7.52 0.16 3.32 0.01 -1.26 -4.17 113.70 120.58 2qm0 s SER 77 Ca 0.04 1.82 -0.34 0.00 1.31 0.00 0.00 55.95 58.78 2qm0 s SER 77 Cb -0.15 -2.56 -0.14 0.00 0.21 0.00 0.00 66.02 63.38 2qm0 s SER 77 CO 0.00 0.15 1.60 -2.65 0.41 0.00 0.00 173.24 172.76 2qm0 n PRO 78 N 1.42 2.23 -3.94 12.44 -0.02 -1.26 -4.88 135.00 141.00 2qm0 n PRO 78 Ca -0.03 0.80 -0.10 0.00 -2.02 0.00 0.00 63.50 62.16 2qm0 n PRO 78 Cb 0.48 -2.58 -0.11 0.00 -0.02 0.00 0.00 33.50 31.26 2qm0 n PRO 78 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qm0 s ALA 79 N 0.99 -0.00 0.16 3.55 0.00 -1.26 -4.33 121.76 120.86 2qm0 s ALA 79 Ca 0.78 -0.38 -0.30 0.00 0.00 0.00 0.00 51.96 52.07 2qm0 s ALA 79 Cb -0.66 0.10 -0.07 0.00 0.00 0.00 0.00 23.12 22.49 2qm0 s ALA 79 CO 0.37 -0.14 1.15 0.42 0.00 0.00 0.00 175.76 177.56 2qm0 s ILE 80 N -1.17 3.80 -0.16 0.00 1.01 -0.78 -4.40 121.20 119.51 2qm0 s ILE 80 Ca -0.13 1.48 -0.05 0.00 0.00 0.00 0.00 60.65 61.96 2qm0 s ILE 80 Cb -0.08 -3.95 -0.03 0.00 0.01 0.00 0.00 42.46 38.41 2qm0 s ILE 80 CO -0.00 0.22 0.00 -0.63 0.00 0.00 0.00 174.94 174.53 2qm0 s ILE 81 N 0.08 4.24 -0.34 2.92 -1.09 -0.50 -0.67 121.20 125.85 2qm0 s ILE 81 Ca 0.52 -0.23 0.04 0.00 -2.23 0.00 0.00 60.65 58.74 2qm0 s ILE 81 Cb -0.30 -2.87 0.10 0.00 -1.58 0.00 0.00 42.46 37.80 2qm0 s ILE 81 CO 0.34 0.49 0.04 -0.69 -1.23 0.00 0.00 174.94 173.90 2qm0 s VAL 82 N 0.26 2.33 -0.14 2.92 1.01 0.60 -0.92 120.40 126.46 2qm0 s VAL 82 Ca -0.00 -2.27 -0.27 0.00 0.00 0.00 0.00 61.98 59.44 2qm0 s VAL 82 Cb -0.13 -2.68 -0.01 0.00 0.00 0.00 0.00 36.38 33.55 2qm0 s VAL 82 CO 0.02 -0.55 0.91 -0.83 0.00 0.00 0.00 175.10 174.65 2qm0 s GLY 83 N 0.97 2.22 -0.70 4.51 0.00 0.15 -0.32 107.32 114.14 2qm0 s GLY 83 Ca 0.09 0.19 -0.16 0.00 0.00 0.00 0.00 44.72 44.84 2qm0 s GLY 83 CO -0.07 1.77 0.69 0.14 0.00 0.00 0.00 173.10 175.63 2qm0 s VAL 84 N 2.07 5.31 0.00 1.40 1.01 0.51 -0.81 120.40 129.89 2qm0 s VAL 84 Ca 0.43 -1.87 0.00 0.00 0.00 0.00 0.00 61.98 60.54 2qm0 s VAL 84 Cb -0.17 -4.45 0.00 0.00 0.00 0.00 0.00 36.38 31.76 2qm0 s VAL 84 CO 0.15 -1.02 0.00 0.61 0.00 0.00 0.00 175.10 174.84 2qm0 n GLY 85 N 4.70 6.61 3.14 4.51 0.00 -0.41 -1.34 105.19 122.40 2qm0 n GLY 85 Ca 0.02 -1.97 -0.13 0.00 0.00 0.00 0.00 46.02 43.93 2qm0 n GLY 85 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qm0 s TYR 86 N 0.21 0.90 -1.25 1.61 2.02 -1.25 -1.18 117.35 118.41 2qm0 s TYR 86 Ca 0.00 -0.70 -0.19 0.00 -0.37 0.00 0.00 57.07 55.82 2qm0 s TYR 86 Cb 0.00 -0.51 0.00 0.00 -0.40 0.00 0.00 41.96 41.05 2qm0 s TYR 86 CO 0.00 -0.07 1.92 -0.35 -1.57 0.00 0.00 175.55 175.48 2qm0 n PRO 87 N 0.61 2.56 -4.14 -1.71 -0.04 -1.26 -4.59 135.00 126.43 2qm0 n PRO 87 Ca -0.17 -2.76 -0.09 0.00 -0.04 0.00 0.00 63.50 60.44 2qm0 n PRO 87 Cb 0.58 -3.42 -0.10 0.00 -0.04 0.00 0.00 33.50 30.52 2qm0 n PRO 87 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2qm0 s ILE 88 N 5.49 0.25 -0.14 0.52 -4.36 -1.26 -5.07 121.20 116.63 2qm0 s ILE 88 Ca 0.56 -1.89 0.20 0.00 -0.26 0.00 0.00 60.65 59.26 2qm0 s ILE 88 Cb 0.07 -1.86 -0.16 0.00 1.25 0.00 0.00 42.46 41.76 2qm0 s ILE 88 CO 0.06 -0.67 0.73 -0.62 0.24 0.00 0.00 174.94 174.68 2qm0 n GLU 89 N -0.04 0.63 -0.85 0.37 1.02 -1.26 -4.97 120.64 115.54 2qm0 n GLU 89 Ca -0.09 0.07 -0.08 0.00 -0.02 0.00 0.00 57.16 57.04 2qm0 n GLU 89 Cb 0.63 -1.72 0.05 0.00 -0.02 0.00 0.00 31.44 30.38 2qm0 n GLU 89 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qm0 n GLY 90 N 1.34 -0.32 0.12 0.62 0.00 -1.26 -5.05 105.19 100.64 2qm0 n GLY 90 Ca -0.08 -1.82 -0.20 0.00 0.00 0.00 0.00 46.02 43.92 2qm0 n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qm0 h ALA 91 N -1.27 -0.03 -4.47 4.61 0.00 -1.93 -3.44 119.26 112.72 2qm0 h ALA 91 Ca -0.11 -0.79 -0.65 0.00 0.00 0.00 0.00 54.91 53.36 2qm0 h ALA 91 Cb 0.35 0.19 -0.29 0.00 0.00 0.00 0.00 17.79 18.04 2qm0 h ALA 91 CO 0.10 0.48 -0.87 -0.06 0.00 0.00 0.00 179.25 178.90 2qm0 s PHE 92 N -2.44 2.08 -0.77 0.00 0.08 -1.26 -2.18 117.98 113.49 2qm0 s PHE 92 Ca -0.15 -0.39 -0.14 0.00 0.12 0.00 0.00 56.93 56.36 2qm0 s PHE 92 Cb 0.02 -1.33 0.20 0.00 -0.57 0.00 0.00 43.02 41.34 2qm0 s PHE 92 CO 0.82 -0.02 0.71 0.45 -0.10 0.00 0.00 175.22 177.08 2qm0 s SER 93 N -0.63 6.64 0.14 1.36 0.15 -1.26 -4.99 113.70 115.11 2qm0 s SER 93 Ca 0.09 -2.50 -0.32 0.00 0.70 0.00 0.00 55.95 53.92 2qm0 s SER 93 Cb -0.09 -2.21 -0.10 0.00 -1.71 0.00 0.00 66.02 61.91 2qm0 s SER 93 CO -0.01 -0.63 1.55 1.23 1.20 0.00 0.00 173.24 176.58 2qm0 h GLY 94 N 8.02 -0.96 0.57 9.45 0.00 -1.99 -0.97 103.07 117.19 2qm0 h GLY 94 Ca 0.02 0.72 -0.04 0.00 0.00 0.00 0.00 47.33 48.03 2qm0 h GLY 94 CO 0.81 -0.10 -0.12 0.83 0.00 0.00 0.00 176.54 177.96 2qm0 h GLU 95 N -0.35 0.18 -0.25 4.80 5.08 -1.98 -2.66 114.58 119.40 2qm0 h GLU 95 Ca 0.09 -0.12 0.05 0.00 -1.00 0.00 0.00 59.36 58.37 2qm0 h GLU 95 Cb 0.58 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.80 2qm0 h GLU 95 CO -0.64 0.72 -0.01 0.93 -1.00 0.00 0.00 179.01 179.01 2qm0 h GLU 96 N -0.32 0.06 -0.25 2.33 3.07 -1.93 -2.53 114.58 115.00 2qm0 h GLU 96 Ca 0.00 -0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.76 2qm0 h GLU 96 Cb 0.71 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.60 2qm0 h GLU 96 CO 0.03 0.04 -0.27 0.07 -1.40 0.00 0.00 179.01 177.48 2qm0 h ARG 97 N 0.06 0.49 -0.82 2.33 0.11 -1.23 -1.28 114.38 114.05 2qm0 h ARG 97 Ca 0.12 -0.19 -0.01 0.00 0.10 0.00 0.00 59.98 60.00 2qm0 h ARG 97 Cb 0.16 -0.03 -0.04 0.00 1.11 0.00 0.00 29.97 31.18 2qm0 h ARG 97 CO -0.22 0.72 0.48 0.00 0.10 0.00 0.00 179.97 181.05 2qm0 h TYR 99 N 1.12 0.07 -0.26 0.00 3.20 -1.27 -3.16 116.97 116.67 2qm0 h TYR 99 Ca 0.29 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.10 2qm0 h TYR 99 Cb -0.02 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 2qm0 h TYR 99 CO -0.00 0.48 -0.03 -0.44 -1.64 0.00 0.00 178.16 176.53 2qm0 h ASP 100 N -0.36 0.37 0.54 -2.11 3.32 -1.00 0.31 116.42 117.48 2qm0 h ASP 100 Ca 0.01 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.99 2qm0 h ASP 100 Cb 0.46 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.92 2qm0 h ASP 100 CO 0.00 0.45 -0.98 0.49 -1.72 0.00 0.00 179.24 177.48 2qm0 n PHE 101 N -4.31 0.37 -3.48 4.55 3.72 -0.16 -3.17 117.46 114.99 2qm0 n PHE 101 Ca 0.01 0.11 -0.38 0.00 -0.05 0.00 0.00 57.45 57.13 2qm0 n PHE 101 Cb 0.23 -0.52 -0.09 0.00 -0.94 0.00 0.00 39.48 38.16 2qm0 n PHE 101 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2qm0 s THR 102 N -3.22 5.24 0.19 4.37 -4.23 -1.19 -3.80 115.64 113.01 2qm0 s THR 102 Ca 0.03 0.48 0.17 0.00 -1.18 0.00 0.00 61.69 61.19 2qm0 s THR 102 Cb 0.14 -3.64 0.09 0.00 1.34 0.00 0.00 72.50 70.43 2qm0 s THR 102 CO 0.79 0.25 1.70 -0.65 -0.54 0.00 0.00 174.62 176.17 2qm0 h PRO 103 N 7.75 0.00 -5.06 3.99 0.11 -1.88 -1.88 132.00 135.02 2qm0 h PRO 103 Ca -0.35 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.40 2qm0 h PRO 103 Cb 1.17 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.13 2qm0 h PRO 103 CO 0.66 0.44 -0.68 -1.54 -0.21 0.00 0.00 178.00 176.67 2qm0 s SER 104 N -6.55 1.78 0.15 -2.05 1.04 -1.26 -4.72 113.70 102.09 2qm0 s SER 104 Ca -0.00 -1.15 -0.30 0.00 0.48 0.00 0.00 55.95 54.98 2qm0 s SER 104 Cb 0.11 0.01 -0.08 0.00 0.10 0.00 0.00 66.02 66.17 2qm0 s SER 104 CO 0.71 -0.45 1.28 -0.69 0.98 0.00 0.00 173.24 175.06 2qm0 s VAL 105 N -3.40 3.49 0.26 5.02 1.01 -1.26 -2.77 120.40 122.74 2qm0 s VAL 105 Ca 0.24 1.16 -0.30 0.00 0.00 0.00 0.00 61.98 63.08 2qm0 s VAL 105 Cb 0.05 -3.74 -0.14 0.00 0.00 0.00 0.00 36.38 32.55 2qm0 s VAL 105 CO 0.06 0.14 1.20 2.30 0.00 0.00 0.00 175.10 178.79 2qm0 n ILE 106 N 3.18 1.47 -0.75 2.22 -5.35 -1.26 -4.94 119.36 113.93 2qm0 n ILE 106 Ca 0.08 -0.37 -0.32 0.00 -0.27 0.00 0.00 62.75 61.86 2qm0 n ILE 106 Cb 0.44 -1.19 0.13 0.00 -1.74 0.00 0.00 39.64 37.28 2qm0 n ILE 106 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 2qm0 n SER 107 N 1.57 -2.61 -4.76 7.28 2.88 -1.26 -5.12 113.62 111.61 2qm0 n SER 107 Ca 0.10 -0.12 -0.36 0.00 -1.33 0.00 0.00 58.87 57.16 2qm0 n SER 107 Cb 0.31 -0.80 -0.08 0.00 -0.75 0.00 0.00 64.21 62.89 2qm0 n SER 107 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2qm0 s LYS 108 N -3.02 3.60 0.03 -1.46 -2.85 -1.26 -5.19 119.74 109.59 2qm0 s LYS 108 Ca 0.47 -0.25 0.07 0.00 -1.00 0.00 0.00 55.97 55.27 2qm0 s LYS 108 Cb -0.04 -3.15 -0.03 0.00 -2.06 0.00 0.00 37.83 32.54 2qm0 s LYS 108 CO 0.62 0.57 -0.20 -1.25 0.10 0.00 0.00 175.35 175.18 2qm0 s PRO 118 N -0.44 2.03 1.11 1.78 0.04 -1.26 -5.21 135.00 133.05 2qm0 s PRO 118 Ca 0.11 -1.00 -0.14 0.00 0.04 0.00 0.00 61.00 60.01 2qm0 s PRO 118 Cb -0.12 -2.14 0.21 0.00 0.04 0.00 0.00 34.50 32.49 2qm0 s PRO 118 CO 0.02 0.54 0.75 0.91 0.04 0.00 0.00 177.00 179.25 2qm0 n TRP 119 N 1.69 -1.00 -2.42 0.56 7.02 -1.26 -4.99 117.44 117.04 2qm0 n TRP 119 Ca -0.16 0.03 -0.35 0.00 -1.02 0.00 0.00 57.50 55.99 2qm0 n TRP 119 Cb 0.52 -1.72 -0.02 0.00 -2.42 0.00 0.00 31.31 27.67 2qm0 n TRP 119 CO 0.00 0.00 0.00 -1.25 -2.02 0.00 0.00 177.69 174.42 2qm0 s PRO 120 N -4.15 3.71 0.17 -0.99 0.04 -1.26 -4.95 135.00 127.57 2qm0 s PRO 120 Ca 0.64 1.51 -0.33 0.00 0.04 0.00 0.00 61.00 62.85 2qm0 s PRO 120 Cb -0.22 -2.16 -0.15 0.00 0.04 0.00 0.00 34.50 32.01 2qm0 s PRO 120 CO 0.65 -0.54 1.31 1.17 0.04 0.00 0.00 177.00 179.63 2qm0 n LYS 121 N -0.90 1.48 -4.54 4.56 4.81 -1.26 -4.97 118.16 117.34 2qm0 n LYS 121 Ca 0.09 0.53 -0.25 0.00 -0.87 0.00 0.00 58.31 57.81 2qm0 n LYS 121 Cb 0.51 -2.13 -0.11 0.00 0.02 0.00 0.00 35.03 33.32 2qm0 n LYS 121 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 2qm0 s THR 122 N 0.14 1.62 0.00 3.15 -4.23 -1.26 -3.47 115.64 111.58 2qm0 s THR 122 Ca 0.75 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.26 2qm0 s THR 122 Cb -0.81 -2.90 0.00 0.00 1.34 0.00 0.00 72.50 70.13 2qm0 s THR 122 CO 0.48 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.17 2qm0 n GLY 123 N -0.84 0.96 1.14 3.99 0.00 -1.02 -4.44 105.19 104.99 2qm0 n GLY 123 Ca -0.04 -0.40 0.11 0.00 0.00 0.00 0.00 46.02 45.69 2qm0 n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qm0 n GLY 124 N -1.93 1.83 0.33 -0.02 0.00 0.11 -4.49 105.19 101.03 2qm0 n GLY 124 Ca 0.00 -0.69 0.02 0.00 0.00 0.00 0.00 46.02 45.35 2qm0 n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qm0 h ALA 125 N 4.26 1.57 -0.20 4.61 0.00 -1.36 -0.53 119.26 127.61 2qm0 h ALA 125 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2qm0 h ALA 125 Cb 0.87 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2qm0 h ALA 125 CO 0.00 0.40 0.10 1.25 0.00 0.00 0.00 179.25 180.99 2qm0 h HIS 126 N 0.83 0.29 -0.18 0.00 -0.00 -1.85 0.91 115.15 115.15 2qm0 h HIS 126 Ca 0.23 -0.01 -0.05 0.00 -0.00 0.00 0.00 60.37 60.53 2qm0 h HIS 126 Cb -0.08 -0.09 -0.01 0.00 -0.00 0.00 0.00 27.41 27.22 2qm0 h HIS 126 CO -0.00 0.30 -0.13 -0.91 -0.00 0.00 0.00 177.93 177.19 2qm0 h ASN 127 N 0.20 0.28 -0.10 3.26 2.35 -1.76 -0.45 115.58 119.36 2qm0 h ASN 127 Ca 0.07 -0.06 -0.19 0.00 -0.55 0.00 0.00 56.30 55.57 2qm0 h ASN 127 Cb 0.12 -0.07 0.01 0.00 0.05 0.00 0.00 38.32 38.42 2qm0 h ASN 127 CO -0.01 0.44 -0.69 0.15 -1.65 0.00 0.00 177.43 175.67 2qm0 h PHE 128 N 0.28 0.88 -0.60 1.19 3.57 -0.84 -1.38 116.94 120.04 2qm0 h PHE 128 Ca 0.06 -0.41 -0.03 0.00 3.53 0.00 0.00 57.97 61.12 2qm0 h PHE 128 Cb 0.40 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 2qm0 h PHE 128 CO 0.01 1.22 0.28 0.35 -2.23 0.00 0.00 178.31 177.94 2qm0 h PHE 129 N 0.29 0.88 -0.33 0.41 3.57 -0.59 -1.05 116.94 120.12 2qm0 h PHE 129 Ca -0.06 -0.05 0.06 0.00 3.53 0.00 0.00 57.97 61.45 2qm0 h PHE 129 Cb 1.34 -0.27 -0.06 0.00 2.79 0.00 0.00 35.95 39.75 2qm0 h PHE 129 CO 0.11 0.68 -0.04 1.15 -2.23 0.00 0.00 178.31 177.98 2qm0 h THR 130 N 0.83 0.72 -0.23 4.41 2.02 -1.04 -1.26 112.91 118.36 2qm0 h THR 130 Ca 0.21 -0.02 0.06 0.00 0.77 0.00 0.00 66.41 67.43 2qm0 h THR 130 Cb 0.14 0.66 -0.07 0.00 -1.74 0.00 0.00 68.15 67.15 2qm0 h THR 130 CO -0.02 0.01 -0.21 0.15 0.37 0.00 0.00 175.52 175.82 2qm0 h PHE 131 N 0.05 -0.54 0.14 3.16 3.57 -0.79 0.32 116.94 122.83 2qm0 h PHE 131 Ca 0.16 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.70 2qm0 h PHE 131 Cb 0.23 0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.23 2qm0 h PHE 131 CO -0.27 -0.29 -0.18 0.82 -2.23 0.00 0.00 178.31 176.17 2qm0 h ILE 132 N -0.22 0.60 -0.12 1.41 2.04 -1.00 -0.60 117.51 119.63 2qm0 h ILE 132 Ca 0.13 0.00 -0.20 0.00 1.00 0.00 0.00 64.86 65.79 2qm0 h ILE 132 Cb 0.42 0.60 0.01 0.00 -0.74 0.00 0.00 36.82 37.11 2qm0 h ILE 132 CO -0.35 0.00 -0.73 -0.33 0.00 0.00 0.00 178.15 176.74 2qm0 h GLU 133 N -0.36 0.70 0.00 2.37 4.39 -1.13 0.44 114.58 120.98 2qm0 h GLU 133 Ca 0.01 -0.60 0.00 0.00 0.34 0.00 0.00 59.36 59.12 2qm0 h GLU 133 Cb 0.36 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.14 2qm0 h GLU 133 CO -0.07 1.21 -1.48 0.39 -1.16 0.00 0.00 179.01 177.89 2qm0 n GLU 134 N -4.02 0.49 0.05 2.33 1.02 0.09 -4.39 120.64 116.21 2qm0 n GLU 134 Ca -0.08 -0.07 0.00 0.00 -0.02 0.00 0.00 57.16 56.99 2qm0 n GLU 134 Cb 0.72 -1.59 0.00 0.00 -0.02 0.00 0.00 31.44 30.55 2qm0 n GLU 134 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2qm0 n GLU 135 N -2.18 0.00 0.13 3.49 1.02 -0.37 -4.67 120.64 118.06 2qm0 n GLU 135 Ca -0.01 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.00 2qm0 n GLU 135 Cb 0.51 -0.41 -0.08 0.00 -0.02 0.00 0.00 31.44 31.44 2qm0 n GLU 135 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2qm0 h LEU 136 N 0.00 -0.28 -0.22 -4.62 5.85 -1.16 -3.14 115.31 111.73 2qm0 h LEU 136 Ca 0.00 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.56 2qm0 h LEU 136 Cb 0.20 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 2qm0 h LEU 136 CO 0.00 0.04 0.06 0.11 -0.34 0.00 0.00 178.44 178.31 2qm0 h LYS 137 N -0.62 0.15 -0.81 1.25 1.57 -1.12 -1.44 116.57 115.54 2qm0 h LYS 137 Ca -0.03 -0.01 0.10 0.00 -1.87 0.00 0.00 60.65 58.84 2qm0 h LYS 137 Cb 0.45 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.67 2qm0 h LYS 137 CO 0.06 0.10 0.53 -1.35 -0.57 0.00 0.00 179.45 178.21 2qm0 h PRO 138 N 0.16 0.71 -0.38 3.15 0.11 -1.77 0.18 132.00 134.16 2qm0 h PRO 138 Ca 0.10 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 66.07 2qm0 h PRO 138 Cb 0.08 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.02 2qm0 h PRO 138 CO -0.11 0.47 -0.12 1.96 -0.21 0.00 0.00 178.00 179.98 2qm0 h GLN 139 N 0.73 0.75 -0.53 1.05 1.08 -1.36 -1.54 115.11 115.30 2qm0 h GLN 139 Ca 0.37 -0.30 -0.04 0.00 -1.45 0.00 0.00 58.65 57.23 2qm0 h GLN 139 Cb 0.47 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.84 2qm0 h GLN 139 CO -0.15 0.91 0.18 0.82 -0.95 0.00 0.00 178.83 179.64 2qm0 h ILE 140 N 0.55 1.23 0.00 2.54 5.03 -0.74 -1.62 117.51 124.49 2qm0 h ILE 140 Ca 0.09 -0.75 -0.07 0.00 -0.12 0.00 0.00 64.86 64.01 2qm0 h ILE 140 Cb 0.65 0.72 -0.01 0.00 -3.03 0.00 0.00 36.82 35.15 2qm0 h ILE 140 CO 0.04 0.28 -0.34 -0.33 -0.68 0.00 0.00 178.15 177.13 2qm0 h GLU 141 N 0.72 0.00 0.00 2.37 5.08 -0.89 0.11 114.58 121.97 2qm0 h GLU 141 Ca 0.17 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.30 2qm0 h GLU 141 Cb 0.25 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.47 2qm0 h GLU 141 CO -0.01 0.34 -1.18 1.57 -1.00 0.00 0.00 179.01 178.73 2qm0 h LYS 142 N 0.00 0.00 0.00 2.33 2.10 -1.14 -3.35 116.57 116.51 2qm0 h LYS 142 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2qm0 h LYS 142 Cb 0.72 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.05 2qm0 h LYS 142 CO 0.04 0.87 -0.91 0.09 -2.00 0.00 0.00 179.45 177.54 2qm0 n ASN 143 N -3.27 0.77 -4.13 7.07 3.02 -0.62 -4.94 115.26 113.16 2qm0 n ASN 143 Ca -0.04 0.20 -0.10 0.00 -0.03 0.00 0.00 54.58 54.60 2qm0 n ASN 143 Cb 0.97 0.42 -0.10 0.00 -0.61 0.00 0.00 39.78 40.46 2qm0 n ASN 143 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2qm0 s PHE 144 N -3.29 0.74 -0.83 3.10 0.08 0.35 -5.08 117.98 113.05 2qm0 s PHE 144 Ca 0.02 -0.88 -0.23 0.00 0.12 0.00 0.00 56.93 55.96 2qm0 s PHE 144 Cb 0.11 -0.46 0.07 0.00 -0.57 0.00 0.00 43.02 42.18 2qm0 s PHE 144 CO 0.77 -0.20 1.21 -2.00 -0.10 0.00 0.00 175.22 174.90 2qm0 s GLU 145 N -3.43 3.36 -0.16 0.44 2.12 -1.26 -4.49 118.70 115.28 2qm0 s GLU 145 Ca 0.06 -0.96 -0.08 0.00 0.36 0.00 0.00 54.97 54.36 2qm0 s GLU 145 Cb 0.03 -4.67 -0.04 0.00 0.26 0.00 0.00 34.13 29.71 2qm0 s GLU 145 CO -0.05 -2.00 0.10 0.42 -0.54 0.00 0.00 175.26 173.19 2qm0 s ILE 146 N 4.43 5.11 -0.61 -3.70 -1.09 -1.26 -0.19 121.20 123.88 2qm0 s ILE 146 Ca 0.34 0.07 -0.26 0.00 -2.23 0.00 0.00 60.65 58.57 2qm0 s ILE 146 Cb -0.08 -3.28 0.04 0.00 -1.58 0.00 0.00 42.46 37.56 2qm0 s ILE 146 CO 0.02 0.51 1.12 -0.62 -1.23 0.00 0.00 174.94 174.74 2qm0 s ASP 147 N -0.11 6.33 0.05 3.58 -1.08 0.51 -4.64 116.67 121.30 2qm0 s ASP 147 Ca 0.09 -0.25 0.22 0.00 -0.52 0.00 0.00 52.55 52.08 2qm0 s ASP 147 Cb -0.12 -2.51 0.90 0.00 -1.46 0.00 0.00 42.92 39.73 2qm0 s ASP 147 CO 0.01 -1.49 1.69 0.29 0.52 0.00 0.00 175.17 176.19 2qm0 n LYS 148 N 8.30 0.05 -0.13 4.34 5.02 -1.26 -1.37 118.16 133.11 2qm0 n LYS 148 Ca 0.04 0.18 0.09 0.00 -2.02 0.00 0.00 58.31 56.60 2qm0 n LYS 148 Cb 0.48 -1.57 0.29 0.00 -0.02 0.00 0.00 35.03 34.21 2qm0 n LYS 148 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qm0 n GLY 149 N 0.66 0.57 2.48 0.72 0.00 -1.26 -4.45 105.19 103.91 2qm0 n GLY 149 Ca 0.05 -0.44 -0.18 0.00 0.00 0.00 0.00 46.02 45.45 2qm0 n GLY 149 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qm0 n LYS 150 N 0.52 1.66 -4.33 1.61 5.02 -0.47 -4.78 118.16 117.38 2qm0 n LYS 150 Ca 0.15 -3.71 -0.35 0.00 -2.02 0.00 0.00 58.31 52.38 2qm0 n LYS 150 Cb 0.35 -1.73 -0.10 0.00 -0.02 0.00 0.00 35.03 33.53 2qm0 n LYS 150 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2qm0 s GLN 151 N -2.91 3.25 -0.02 1.97 -0.21 -1.26 -1.38 119.66 119.10 2qm0 s GLN 151 Ca 0.39 -0.42 0.08 0.00 0.02 0.00 0.00 55.36 55.42 2qm0 s GLN 151 Cb 0.37 -2.87 -0.02 0.00 1.00 0.00 0.00 33.01 31.49 2qm0 s GLN 151 CO -0.07 0.56 -0.25 0.99 -2.12 0.00 0.00 175.29 174.40 2qm0 s THR 152 N -0.48 2.17 -0.19 -0.19 2.01 0.11 -0.80 115.64 118.27 2qm0 s THR 152 Ca 0.08 -1.08 -0.03 0.00 0.31 0.00 0.00 61.69 60.97 2qm0 s THR 152 Cb -0.12 -1.77 -0.01 0.00 0.01 0.00 0.00 72.50 70.61 2qm0 s THR 152 CO 0.02 0.57 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.25 2qm0 s LEU 153 N -0.66 2.97 -0.12 4.42 2.96 0.15 -0.53 118.68 127.87 2qm0 s LEU 153 Ca 0.10 -0.31 -0.01 0.00 -0.22 0.00 0.00 54.13 53.68 2qm0 s LEU 153 Cb -0.10 -1.74 -0.02 0.00 0.50 0.00 0.00 46.19 44.83 2qm0 s LEU 153 CO -0.01 0.05 -0.07 0.12 -1.32 0.00 0.00 176.35 175.12 2qm0 s PHE 154 N 1.06 2.94 -0.07 5.38 5.36 0.42 -0.55 117.98 132.52 2qm0 s PHE 154 Ca 0.01 -0.30 -0.09 0.00 -0.96 0.00 0.00 56.93 55.59 2qm0 s PHE 154 Cb -0.15 -1.86 0.02 0.00 -0.34 0.00 0.00 43.02 40.70 2qm0 s PHE 154 CO -0.00 0.02 0.24 0.20 -1.46 0.00 0.00 175.22 174.23 2qm0 s GLY 155 N 0.02 -0.15 -0.25 13.12 0.00 -0.72 -1.71 107.32 117.64 2qm0 s GLY 155 Ca -0.01 0.53 0.10 0.00 0.00 0.00 0.00 44.72 45.33 2qm0 s GLY 155 CO 0.03 0.41 1.29 1.57 0.00 0.00 0.00 173.10 176.40 2qm0 n HIS 156 N 2.47 0.75 0.00 1.90 -0.00 -1.26 -1.16 115.22 117.93 2qm0 n HIS 156 Ca -0.16 -1.67 0.00 0.00 0.46 0.00 0.00 57.72 56.35 2qm0 n HIS 156 Cb 0.57 -0.34 0.00 0.00 -0.12 0.00 0.00 29.99 30.10 2qm0 n HIS 156 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 2qm0 n LEU 158 N -1.05 0.00 -0.23 0.27 4.77 -1.26 -3.06 117.00 116.44 2qm0 n LEU 158 Ca 0.27 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.24 2qm0 n LEU 158 Cb 0.82 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 42.11 2qm0 n LEU 158 CO 0.10 0.00 1.18 1.23 -1.33 0.00 0.00 177.39 178.57 2qm0 h GLY 159 N 0.00 1.09 1.09 -0.72 0.00 -1.92 -1.94 103.07 100.67 2qm0 h GLY 159 Ca 0.00 -0.46 -0.15 0.00 0.00 0.00 0.00 47.33 46.73 2qm0 h GLY 159 CO 0.00 0.44 -0.33 -1.33 0.00 0.00 0.00 176.54 175.32 2qm0 h GLY 160 N 1.06 0.98 0.04 4.60 0.00 -1.46 -1.05 103.07 107.26 2qm0 h GLY 160 Ca 0.27 -0.98 0.07 0.00 0.00 0.00 0.00 47.33 46.68 2qm0 h GLY 160 CO -0.05 0.89 -0.27 -2.00 0.00 0.00 0.00 176.54 175.11 2qm0 h LEU 161 N 0.72 -0.88 -0.50 3.11 5.85 -1.83 -0.36 115.31 121.43 2qm0 h LEU 161 Ca 0.07 0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.97 2qm0 h LEU 161 Cb 0.92 0.41 -0.03 0.00 0.37 0.00 0.00 40.66 42.33 2qm0 h LEU 161 CO 0.09 -0.30 0.29 0.15 -0.34 0.00 0.00 178.44 178.33 2qm0 h PHE 162 N -0.26 0.55 -0.72 1.25 3.57 -1.24 -0.11 116.94 119.99 2qm0 h PHE 162 Ca 0.15 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.60 2qm0 h PHE 162 Cb 0.49 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 2qm0 h PHE 162 CO -0.44 0.31 0.20 0.00 -2.23 0.00 0.00 178.31 176.15 2qm0 h ALA 163 N 1.22 0.99 -0.56 2.41 0.00 -0.93 -0.87 119.26 121.53 2qm0 h ALA 163 Ca 0.20 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2qm0 h ALA 163 Cb 0.03 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 2qm0 h ALA 163 CO -0.09 0.66 0.27 1.25 0.00 0.00 0.00 179.25 181.33 2qm0 h LEU 164 N 1.07 0.73 -0.64 0.00 5.85 -0.70 -0.69 115.31 120.94 2qm0 h LEU 164 Ca 0.23 -0.13 0.07 0.00 0.84 0.00 0.00 57.88 58.89 2qm0 h LEU 164 Cb 0.34 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.12 2qm0 h LEU 164 CO -0.00 0.66 0.32 -0.74 -0.34 0.00 0.00 178.44 178.34 2qm0 h HIS 165 N 0.76 0.58 -0.21 1.25 2.76 -0.46 -1.32 115.15 118.51 2qm0 h HIS 165 Ca 0.19 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.35 2qm0 h HIS 165 Cb 0.12 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 28.91 2qm0 h HIS 165 CO -0.00 0.25 -0.00 0.82 -1.30 0.00 0.00 177.93 177.69 2qm0 h ILE 166 N 0.58 1.25 -0.94 6.26 1.08 -0.92 -1.29 117.51 123.54 2qm0 h ILE 166 Ca 0.30 -0.88 0.19 0.00 -0.39 0.00 0.00 64.86 64.08 2qm0 h ILE 166 Cb 0.25 1.42 -0.11 0.00 -3.07 0.00 0.00 36.82 35.31 2qm0 h ILE 166 CO -0.22 0.27 0.53 0.25 -0.69 0.00 0.00 178.15 178.29 2qm0 h LEU 167 N 0.13 0.62 -0.28 1.44 5.85 -0.87 0.65 115.31 122.86 2qm0 h LEU 167 Ca 0.06 0.11 -0.06 0.00 0.84 0.00 0.00 57.88 58.83 2qm0 h LEU 167 Cb 0.40 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 2qm0 h LEU 167 CO 0.01 0.19 -0.30 -0.26 -0.34 0.00 0.00 178.44 177.74 2qm0 h PHE 168 N 0.64 0.00 0.00 1.25 0.04 -0.86 -3.34 116.94 114.67 2qm0 h PHE 168 Ca 0.55 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.32 2qm0 h PHE 168 Cb 0.91 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.06 2qm0 h PHE 168 CO -0.05 0.30 -0.87 0.25 -0.60 0.00 0.00 178.31 177.34 2qm0 n THR 169 N -3.22 0.00 -2.69 -1.55 -2.24 -0.52 -4.52 114.28 99.53 2qm0 n THR 169 Ca 0.02 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.73 2qm0 n THR 169 Cb 0.61 -0.44 0.03 0.00 -2.10 0.00 0.00 70.33 68.43 2qm0 n THR 169 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2qm0 n ASN 170 N -1.64 1.68 -0.32 3.42 3.02 0.22 -4.98 115.26 116.67 2qm0 n ASN 170 Ca 0.00 -2.56 0.18 0.00 -0.03 0.00 0.00 54.58 52.17 2qm0 n ASN 170 Cb 0.29 -0.51 0.44 0.00 -0.61 0.00 0.00 39.78 39.39 2qm0 n ASN 170 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2qm0 h LEU 171 N 2.85 0.57 -0.21 3.41 6.46 -1.60 -0.42 115.31 126.37 2qm0 h LEU 171 Ca -0.09 0.09 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2qm0 h LEU 171 Cb 1.20 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 41.12 2qm0 h LEU 171 CO 0.42 0.16 0.00 0.59 -0.62 0.00 0.00 178.44 178.99 2qm0 n ASN 172 N -4.68 0.23 0.26 1.25 4.13 -1.26 -3.20 115.26 111.99 2qm0 n ASN 172 Ca 0.24 0.55 0.12 0.00 1.68 0.00 0.00 54.58 57.17 2qm0 n ASN 172 Cb 0.73 -0.60 0.71 0.00 -1.54 0.00 0.00 39.78 39.08 2qm0 n ASN 172 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2qm0 h ALA 173 N 2.46 1.39 -3.19 5.41 0.00 -1.44 -3.43 119.26 120.47 2qm0 h ALA 173 Ca 0.00 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.63 2qm0 h ALA 173 Cb 0.32 -0.02 -0.25 0.00 0.00 0.00 0.00 17.79 17.84 2qm0 h ALA 173 CO 0.00 0.15 -0.53 -0.06 0.00 0.00 0.00 179.25 178.80 2qm0 s PHE 174 N -4.34 -0.09 -0.95 0.00 0.08 -1.19 -4.97 117.98 106.52 2qm0 s PHE 174 Ca -0.03 0.22 0.23 0.00 0.12 0.00 0.00 56.93 57.48 2qm0 s PHE 174 Cb 0.14 0.02 0.22 0.00 -0.57 0.00 0.00 43.02 42.83 2qm0 s PHE 174 CO 0.60 -0.14 1.21 1.04 -0.10 0.00 0.00 175.22 177.83 2qm0 n GLN 175 N 2.53 0.04 -3.96 0.44 3.00 0.02 -4.89 117.38 114.56 2qm0 n GLN 175 Ca -0.16 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.73 2qm0 n GLN 175 Cb 0.58 -1.51 -0.12 0.00 0.00 0.00 0.00 30.24 29.18 2qm0 n GLN 175 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 2qm0 s ASN 176 N -3.12 0.23 -0.11 1.08 -0.87 -0.64 -1.39 114.94 110.11 2qm0 s ASN 176 Ca 0.09 -0.32 0.00 0.00 -1.57 0.00 0.00 52.86 51.07 2qm0 s ASN 176 Cb 0.17 0.05 0.02 0.00 -0.02 0.00 0.00 41.25 41.47 2qm0 s ASN 176 CO 0.77 -0.17 -0.09 -0.31 -2.57 0.00 0.00 177.10 174.72 2qm0 s TYR 177 N -0.90 1.59 -0.38 2.20 2.02 0.15 -0.68 117.35 121.36 2qm0 s TYR 177 Ca -0.09 -0.78 -0.02 0.00 -0.37 0.00 0.00 57.07 55.81 2qm0 s TYR 177 Cb -0.06 -1.26 0.10 0.00 -0.40 0.00 0.00 41.96 40.33 2qm0 s TYR 177 CO -0.01 -0.50 0.14 0.12 -1.57 0.00 0.00 175.55 173.74 2qm0 s PHE 178 N 1.49 3.56 -0.35 2.71 5.99 0.28 -0.70 117.98 130.95 2qm0 s PHE 178 Ca 0.01 -2.40 -0.05 0.00 0.00 0.00 0.00 56.93 54.49 2qm0 s PHE 178 Cb -0.13 -2.96 0.06 0.00 0.00 0.00 0.00 43.02 39.99 2qm0 s PHE 178 CO -0.06 -0.94 0.12 0.42 -0.00 0.00 0.00 175.22 174.76 2qm0 s ILE 179 N 1.13 3.54 -0.15 3.12 1.01 0.11 -1.76 121.20 128.19 2qm0 s ILE 179 Ca 0.06 -1.42 -0.03 0.00 0.00 0.00 0.00 60.65 59.27 2qm0 s ILE 179 Cb -0.22 -3.12 -0.02 0.00 0.01 0.00 0.00 42.46 39.11 2qm0 s ILE 179 CO -0.04 -0.31 -0.06 -0.55 0.00 0.00 0.00 174.94 173.98 2qm0 s SER 180 N 1.55 4.60 -0.84 3.58 0.15 -0.31 -1.57 113.70 120.87 2qm0 s SER 180 Ca -0.00 -0.18 -0.15 0.00 0.70 0.00 0.00 55.95 56.31 2qm0 s SER 180 Cb -0.21 -1.74 0.02 0.00 -1.71 0.00 0.00 66.02 62.38 2qm0 s SER 180 CO 0.00 0.16 0.29 -1.20 1.20 0.00 0.00 173.24 173.70 2qm0 n SER 181 N 3.57 -1.56 -4.76 5.45 7.64 -0.17 -4.19 113.62 119.60 2qm0 n SER 181 Ca -0.18 -0.82 -0.41 0.00 1.01 0.00 0.00 58.87 58.47 2qm0 n SER 181 Cb 0.52 -1.00 -0.02 0.00 -1.01 0.00 0.00 64.21 62.71 2qm0 n SER 181 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2qm0 s PRO 182 N -6.33 4.22 -1.40 1.43 0.04 -1.26 -4.69 135.00 127.00 2qm0 s PRO 182 Ca 0.21 2.41 -0.13 0.00 0.04 0.00 0.00 61.00 63.53 2qm0 s PRO 182 Cb -0.12 -3.05 -0.03 0.00 0.04 0.00 0.00 34.50 31.33 2qm0 s PRO 182 CO 0.62 -0.45 2.44 0.43 0.04 0.00 0.00 177.00 180.08 2qm0 n SER 183 N 1.65 5.49 0.23 6.66 7.64 -1.26 -4.67 113.62 129.35 2qm0 n SER 183 Ca 0.05 -2.69 0.11 0.00 1.01 0.00 0.00 58.87 57.35 2qm0 n SER 183 Cb 0.40 -1.52 0.46 0.00 -1.01 0.00 0.00 64.21 62.53 2qm0 n SER 183 CO 0.00 0.00 0.00 0.16 -3.01 0.00 0.00 175.04 172.19 2qm0 h ILE 184 N 3.66 0.44 0.00 0.44 3.07 -1.96 -2.24 117.51 120.92 2qm0 h ILE 184 Ca 0.65 -1.06 0.00 0.00 1.55 0.00 0.00 64.86 66.00 2qm0 h ILE 184 Cb 0.48 1.77 0.00 0.00 -0.27 0.00 0.00 36.82 38.80 2qm0 h ILE 184 CO 1.83 0.18 0.00 0.79 -1.05 0.00 0.00 178.15 179.90 2qm0 n TRP 185 N -3.31 0.00 -1.91 0.16 7.02 -1.26 -3.75 117.44 114.39 2qm0 n TRP 185 Ca 0.01 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.07 2qm0 n TRP 185 Cb 0.43 -0.05 -0.02 0.00 -2.42 0.00 0.00 31.31 29.25 2qm0 n TRP 185 CO 0.00 0.00 0.00 -0.46 -2.02 0.00 0.00 177.69 175.21 2qm0 s TRP 186 N -2.10 2.97 -1.24 -5.99 -0.00 -0.84 -3.52 118.94 108.22 2qm0 s TRP 186 Ca 0.32 0.76 -0.07 0.00 -0.00 0.00 0.00 56.10 57.11 2qm0 s TRP 186 Cb 0.16 -3.94 -0.01 0.00 -0.00 0.00 0.00 33.47 29.67 2qm0 s TRP 186 CO 0.28 -3.30 0.71 -1.71 -0.00 0.00 0.00 176.95 172.93 2qm0 n ASN 187 N 3.10 -2.89 -3.91 5.86 5.15 -1.26 -2.17 115.26 119.15 2qm0 n ASN 187 Ca 0.11 -0.89 -0.28 0.00 -0.60 0.00 0.00 54.58 52.91 2qm0 n ASN 187 Cb 0.38 -3.84 0.01 0.00 -0.53 0.00 0.00 39.78 35.80 2qm0 n ASN 187 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2qm0 n ASN 188 N -2.95 -2.92 -3.49 1.20 3.02 -1.23 -2.03 115.26 106.87 2qm0 n ASN 188 Ca -0.21 -0.86 -0.25 0.00 -0.03 0.00 0.00 54.58 53.22 2qm0 n ASN 188 Cb 0.65 -3.64 0.03 0.00 -0.61 0.00 0.00 39.78 36.21 2qm0 n ASN 188 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2qm0 n LYS 189 N -4.49 -5.33 0.00 3.52 5.02 -0.92 -4.89 118.16 111.07 2qm0 n LYS 189 Ca -0.10 0.70 0.01 0.00 -2.02 0.00 0.00 58.31 56.90 2qm0 n LYS 189 Cb 0.59 -5.58 0.34 0.00 -0.02 0.00 0.00 35.03 30.36 2qm0 n LYS 189 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2qm0 h SER 190 N -1.76 0.48 -0.84 4.39 4.64 -1.29 -1.98 113.55 117.19 2qm0 h SER 190 Ca -0.53 -0.06 0.05 0.00 -0.47 0.00 0.00 61.79 60.77 2qm0 h SER 190 Cb 1.35 -0.12 -0.05 0.00 -0.31 0.00 0.00 62.40 63.27 2qm0 h SER 190 CO 0.59 0.49 0.55 1.62 -0.87 0.00 0.00 176.83 179.21 2qm0 h VAL 191 N 0.52 1.09 0.00 0.95 3.04 -1.84 -1.95 116.25 118.06 2qm0 h VAL 191 Ca 0.12 -0.33 0.00 0.00 -1.01 0.00 0.00 66.70 65.48 2qm0 h VAL 191 Cb 0.20 0.03 0.00 0.00 -2.01 0.00 0.00 31.29 29.51 2qm0 h VAL 191 CO -0.00 0.18 0.00 -0.07 -1.01 0.00 0.00 177.57 176.66 2qm0 h LEU 192 N 0.97 0.00 -1.03 3.16 3.38 -1.65 -2.15 115.31 117.99 2qm0 h LEU 192 Ca 0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.32 2qm0 h LEU 192 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2qm0 h LEU 192 CO -0.12 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.79 2qm0 n GLU 193 N -2.65 0.18 0.00 1.13 1.02 -0.73 -2.18 120.64 117.41 2qm0 n GLU 193 Ca -0.00 0.51 0.10 0.00 -0.02 0.00 0.00 57.16 57.75 2qm0 n GLU 193 Cb 0.17 -1.93 -0.01 0.00 -0.02 0.00 0.00 31.44 29.65 2qm0 n GLU 193 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2qm0 n LYS 194 N -2.29 1.34 -0.30 3.49 5.02 -0.81 -4.50 118.16 120.12 2qm0 n LYS 194 Ca 0.01 -0.93 0.14 0.00 -2.02 0.00 0.00 58.31 55.51 2qm0 n LYS 194 Cb 0.16 -1.42 0.39 0.00 -0.02 0.00 0.00 35.03 34.14 2qm0 n LYS 194 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 2qm0 h GLU 195 N 2.22 0.64 -0.65 1.97 4.81 -1.56 0.10 114.58 122.10 2qm0 h GLU 195 Ca 0.00 -0.04 0.27 0.00 -0.13 0.00 0.00 59.36 59.46 2qm0 h GLU 195 Cb 0.69 -0.14 -0.12 0.00 0.63 0.00 0.00 28.75 29.81 2qm0 h GLU 195 CO 0.00 0.42 0.33 0.39 -0.73 0.00 0.00 179.01 179.43 2qm0 n GLU 196 N -4.62 -0.04 0.23 1.92 1.02 -1.26 -1.55 120.64 116.34 2qm0 n GLU 196 Ca 0.20 0.91 0.11 0.00 -0.02 0.00 0.00 57.16 58.36 2qm0 n GLU 196 Cb 0.57 -1.62 0.50 0.00 -0.02 0.00 0.00 31.44 30.87 2qm0 n GLU 196 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2qm0 h ASN 197 N 0.00 0.00 -0.00 1.62 2.35 -1.06 -3.36 115.58 115.14 2qm0 h ASN 197 Ca 0.55 0.00 0.01 0.00 -0.55 0.00 0.00 56.30 56.31 2qm0 h ASN 197 Cb 1.44 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.79 2qm0 h ASN 197 CO -0.51 0.20 -0.08 0.25 -1.65 0.00 0.00 177.43 175.64 2qm0 h LEU 198 N 0.00 -0.22 -1.41 1.61 5.85 -1.44 1.00 115.31 120.69 2qm0 h LEU 198 Ca -0.00 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 2qm0 h LEU 198 Cb 0.70 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 2qm0 h LEU 198 CO 0.03 -0.11 0.00 0.16 -0.34 0.00 0.00 178.44 178.17 2qm0 h ILE 199 N -0.13 1.16 -0.20 4.05 -2.65 -1.79 0.14 117.51 118.08 2qm0 h ILE 199 Ca 0.03 -0.62 -0.03 0.00 1.03 0.00 0.00 64.86 65.27 2qm0 h ILE 199 Cb 0.17 0.97 -0.01 0.00 -2.05 0.00 0.00 36.82 35.90 2qm0 h ILE 199 CO -0.08 0.21 -0.01 0.40 0.03 0.00 0.00 178.15 178.70 2qm0 h ILE 200 N 0.37 1.26 -0.66 0.16 2.04 -1.51 -1.81 117.51 117.36 2qm0 h ILE 200 Ca 0.09 -0.90 0.04 0.00 1.00 0.00 0.00 64.86 65.08 2qm0 h ILE 200 Cb 0.25 1.46 -0.04 0.00 -0.74 0.00 0.00 36.82 37.75 2qm0 h ILE 200 CO 0.01 0.28 0.40 -0.33 0.00 0.00 0.00 178.15 178.50 2qm0 h GLU 201 N 0.11 0.75 -0.96 2.37 5.08 -0.18 -2.84 114.58 118.90 2qm0 h GLU 201 Ca 0.06 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2qm0 h GLU 201 Cb 0.41 -0.17 -0.05 0.00 0.50 0.00 0.00 28.75 29.45 2qm0 h GLU 201 CO 0.01 0.49 0.62 -0.07 -1.00 0.00 0.00 179.01 179.06 2qm0 h LEU 202 N 0.77 1.13 -2.47 1.33 3.38 -0.48 -1.36 115.31 117.60 2qm0 h LEU 202 Ca 0.27 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.20 2qm0 h LEU 202 Cb 0.06 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 2qm0 h LEU 202 CO -0.12 0.83 0.18 0.78 0.09 0.00 0.00 178.44 180.20 2qm0 h ASN 203 N 1.32 0.00 -0.00 -0.43 2.35 -1.08 -2.24 115.58 115.49 2qm0 h ASN 203 Ca 0.35 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.10 2qm0 h ASN 203 Cb -0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.25 2qm0 h ASN 203 CO -0.07 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 176.30 2qm0 n ASN 204 N -3.00 2.04 -4.77 5.81 4.13 -0.82 -5.07 115.26 113.58 2qm0 n ASN 204 Ca -0.02 -2.10 -0.40 0.00 1.68 0.00 0.00 54.58 53.74 2qm0 n ASN 204 Cb 0.24 -0.04 -0.01 0.00 -1.54 0.00 0.00 39.78 38.43 2qm0 n ASN 204 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2qm0 s ALA 205 N -1.17 3.43 0.07 5.41 0.00 -0.58 -4.94 121.76 123.99 2qm0 s ALA 205 Ca 0.03 1.38 -0.15 0.00 0.00 0.00 0.00 51.96 53.23 2qm0 s ALA 205 Cb 0.03 -3.54 -0.20 0.00 0.00 0.00 0.00 23.12 19.40 2qm0 s ALA 205 CO 0.00 -0.89 1.22 -0.22 0.00 0.00 0.00 175.76 175.87 2qm0 h LYS 206 N 2.95 0.68 -5.36 0.00 1.63 -1.90 -3.47 116.57 111.10 2qm0 h LYS 206 Ca -0.50 -0.65 -0.41 0.00 -0.85 0.00 0.00 60.65 58.24 2qm0 h LYS 206 Cb 1.24 0.17 -0.19 0.00 -0.60 0.00 0.00 32.23 32.85 2qm0 h LYS 206 CO 0.64 1.25 -0.76 -0.06 -3.45 0.00 0.00 179.45 177.07 2qm0 s PHE 207 N -3.47 1.32 0.16 1.91 0.08 -1.26 -5.10 117.98 111.61 2qm0 s PHE 207 Ca -0.11 -0.54 -0.33 0.00 0.12 0.00 0.00 56.93 56.07 2qm0 s PHE 207 Cb 0.07 -0.71 -0.13 0.00 -0.57 0.00 0.00 43.02 41.68 2qm0 s PHE 207 CO 0.90 0.11 1.67 -1.91 -0.10 0.00 0.00 175.22 175.88 2qm0 n GLU 208 N 0.73 2.43 -3.96 0.44 2.13 -1.26 -4.91 120.64 116.24 2qm0 n GLU 208 Ca -0.17 0.88 -0.35 0.00 0.66 0.00 0.00 57.16 58.18 2qm0 n GLU 208 Cb 0.56 -2.69 -0.13 0.00 0.27 0.00 0.00 31.44 29.45 2qm0 n GLU 208 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 2qm0 s THR 209 N 1.38 3.72 -0.13 6.31 2.01 0.13 -4.88 115.64 124.17 2qm0 s THR 209 Ca 0.79 -0.38 -0.16 0.00 0.31 0.00 0.00 61.69 62.24 2qm0 s THR 209 Cb -0.60 -2.70 -0.04 0.00 0.01 0.00 0.00 72.50 69.17 2qm0 s THR 209 CO 0.37 0.41 0.40 -0.83 -0.69 0.00 0.00 174.62 174.27 2qm0 s GLY 210 N 1.33 2.32 -0.16 4.40 0.00 -0.49 -0.27 107.32 114.45 2qm0 s GLY 210 Ca 0.04 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.46 2qm0 s GLY 210 CO -0.00 0.61 -0.12 0.14 0.00 0.00 0.00 173.10 173.73 2qm0 s VAL 211 N 0.52 1.50 -0.25 1.40 1.01 -0.03 -0.68 120.40 123.87 2qm0 s VAL 211 Ca 0.22 -0.69 -0.02 0.00 0.00 0.00 0.00 61.98 61.48 2qm0 s VAL 211 Cb -0.14 -1.48 0.02 0.00 0.00 0.00 0.00 36.38 34.78 2qm0 s VAL 211 CO 0.08 0.35 -0.05 0.12 0.00 0.00 0.00 175.10 175.59 2qm0 s PHE 212 N 1.50 3.07 -0.11 5.22 5.36 0.12 -0.83 117.98 132.31 2qm0 s PHE 212 Ca 0.03 -1.50 -0.01 0.00 -0.96 0.00 0.00 56.93 54.50 2qm0 s PHE 212 Cb -0.14 -2.07 -0.03 0.00 -0.34 0.00 0.00 43.02 40.44 2qm0 s PHE 212 CO -0.10 -0.71 -0.07 -1.17 -1.46 0.00 0.00 175.22 171.71 2qm0 s LEU 213 N 1.34 3.09 0.03 6.12 2.96 0.25 -0.72 118.68 131.75 2qm0 s LEU 213 Ca 0.01 -0.12 -0.01 0.00 -0.22 0.00 0.00 54.13 53.78 2qm0 s LEU 213 Cb -0.17 -1.70 -0.03 0.00 0.50 0.00 0.00 46.19 44.80 2qm0 s LEU 213 CO -0.04 0.26 -0.01 0.28 -1.32 0.00 0.00 176.35 175.52 2qm0 s THR 214 N -0.20 0.16 -0.09 3.68 -1.32 -0.61 -0.45 115.64 116.82 2qm0 s THR 214 Ca 0.02 -1.30 -0.28 0.00 -1.21 0.00 0.00 61.69 58.93 2qm0 s THR 214 Cb -0.13 -0.86 0.06 0.00 -1.51 0.00 0.00 72.50 70.06 2qm0 s THR 214 CO 0.03 -0.72 0.64 0.54 -2.21 0.00 0.00 174.62 172.90 2qm0 s VAL 215 N -2.62 0.01 0.02 5.08 0.11 -1.00 -0.99 120.40 121.00 2qm0 s VAL 215 Ca -0.05 -0.05 -0.25 0.00 -2.93 0.00 0.00 61.98 58.70 2qm0 s VAL 215 Cb -0.01 -0.94 -0.05 0.00 -1.53 0.00 0.00 36.38 33.84 2qm0 s VAL 215 CO -0.05 -0.03 0.76 -0.83 -3.33 0.00 0.00 175.10 171.62 2qm0 s GLY 216 N -0.87 2.76 0.55 6.54 0.00 -1.26 -0.23 107.32 114.81 2qm0 s GLY 216 Ca -0.09 0.26 0.23 0.00 0.00 0.00 0.00 44.72 45.12 2qm0 s GLY 216 CO 0.07 1.11 2.18 1.48 0.00 0.00 0.00 173.10 177.95 2qm0 h SER 217 N 5.88 0.00 -0.19 1.64 4.64 -1.02 -2.25 113.55 122.24 2qm0 h SER 217 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2qm0 h SER 217 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2qm0 h SER 217 CO 0.72 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.86 2qm0 n LEU 218 N -4.20 2.20 -4.66 5.97 4.77 -0.65 -4.92 117.00 115.51 2qm0 n LEU 218 Ca -0.02 -0.89 -0.30 0.00 -0.03 0.00 0.00 56.01 54.77 2qm0 n LEU 218 Cb 0.14 -0.12 0.17 0.00 -2.33 0.00 0.00 43.42 41.28 2qm0 n LEU 218 CO 0.31 0.45 0.66 -1.61 -1.33 0.00 0.00 177.39 175.86 2qm0 s GLU 219 N -1.76 0.89 0.42 3.23 2.02 -0.85 -4.87 118.70 117.77 2qm0 s GLU 219 Ca 0.34 1.33 -0.25 0.00 0.02 0.00 0.00 54.97 56.41 2qm0 s GLU 219 Cb 0.19 -1.73 -0.10 0.00 0.10 0.00 0.00 34.13 32.59 2qm0 s GLU 219 CO 0.29 -2.65 1.14 2.89 0.02 0.00 0.00 175.26 176.95 2qm0 n ARG 220 N -4.22 1.62 -0.28 1.61 1.85 -1.26 -4.61 116.66 111.36 2qm0 n ARG 220 Ca 0.10 0.58 0.10 0.00 -1.00 0.00 0.00 57.85 57.62 2qm0 n ARG 220 Cb 0.53 -2.20 0.23 0.00 -1.05 0.00 0.00 32.46 29.97 2qm0 n ARG 220 CO 0.00 0.00 0.00 1.49 -0.01 0.00 0.00 177.63 179.11 2qm0 h GLU 221 N 1.81 0.18 -0.80 2.89 4.81 -1.95 -1.88 114.58 119.63 2qm0 h GLU 221 Ca -0.46 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 2qm0 h GLU 221 Cb 1.32 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.66 2qm0 h GLU 221 CO 0.58 0.12 0.00 0.72 -0.73 0.00 0.00 179.01 179.70 2qm0 n HIS 222 N -5.25 0.00 0.00 0.92 8.25 -1.26 -0.53 115.22 117.34 2qm0 n HIS 222 Ca 0.18 -0.02 0.00 0.00 -0.26 0.00 0.00 57.72 57.62 2qm0 n HIS 222 Cb 0.59 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.65 2qm0 n HIS 222 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2qm0 n VAL 224 N 0.65 0.00 -0.00 1.59 0.31 -0.71 -1.14 118.33 119.04 2qm0 n VAL 224 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.21 2qm0 n VAL 224 Cb 0.03 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 32.89 2qm0 n VAL 224 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2qm0 h VAL 225 N 0.00 1.16 -0.80 2.52 2.07 -1.07 -1.75 116.25 118.37 2qm0 h VAL 225 Ca 0.00 -0.47 0.11 0.00 0.82 0.00 0.00 66.70 67.16 2qm0 h VAL 225 Cb 0.00 1.36 -0.08 0.00 -1.52 0.00 0.00 31.29 31.05 2qm0 h VAL 225 CO 0.00 0.13 0.43 1.23 0.02 0.00 0.00 177.57 179.38 2qm0 h GLY 226 N -0.08 1.25 1.23 2.17 0.00 -1.34 -0.38 103.07 105.92 2qm0 h GLY 226 Ca 0.02 -0.27 -0.17 0.00 0.00 0.00 0.00 47.33 46.91 2qm0 h GLY 226 CO -0.00 0.06 -0.50 0.00 0.00 0.00 0.00 176.54 176.10 2qm0 h ALA 227 N 1.48 0.56 -0.55 3.60 0.00 -1.77 -1.49 119.26 121.08 2qm0 h ALA 227 Ca 0.40 -0.49 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 2qm0 h ALA 227 Cb 0.45 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2qm0 h ALA 227 CO -0.29 0.68 0.01 -0.91 0.00 0.00 0.00 179.25 178.74 2qm0 h ASN 228 N 0.64 0.91 -0.36 0.00 2.35 -0.92 0.13 115.58 118.34 2qm0 h ASN 228 Ca 0.03 -0.24 -0.07 0.00 -0.55 0.00 0.00 56.30 55.47 2qm0 h ASN 228 Cb 1.08 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.20 2qm0 h ASN 228 CO 0.11 0.96 -0.05 -0.33 -1.65 0.00 0.00 177.43 176.47 2qm0 h GLU 229 N 0.87 0.66 -0.61 0.81 5.08 -0.95 -1.93 114.58 118.51 2qm0 h GLU 229 Ca 0.16 -0.24 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 2qm0 h GLU 229 Cb 0.50 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 2qm0 h GLU 229 CO 0.02 0.80 0.30 1.25 -1.00 0.00 0.00 179.01 180.38 2qm0 h LEU 230 N 0.46 0.79 -1.24 1.33 5.85 -1.19 -1.78 115.31 119.54 2qm0 h LEU 230 Ca 0.10 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 2qm0 h LEU 230 Cb 0.54 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 2qm0 h LEU 230 CO 0.03 0.70 0.36 0.77 -0.34 0.00 0.00 178.44 179.96 2qm0 h SER 231 N 0.83 0.79 0.28 1.25 4.64 -0.68 -0.97 113.55 119.69 2qm0 h SER 231 Ca 0.21 -0.05 -0.14 0.00 -0.47 0.00 0.00 61.79 61.33 2qm0 h SER 231 Cb 0.11 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 2qm0 h SER 231 CO -0.03 0.63 -0.57 -0.33 -0.87 0.00 0.00 176.83 175.66 2qm0 h GLU 232 N 0.90 0.31 -0.44 4.77 5.08 -0.73 -0.77 114.58 123.69 2qm0 h GLU 232 Ca 0.23 -0.20 -0.12 0.00 -1.00 0.00 0.00 59.36 58.28 2qm0 h GLU 232 Cb 0.01 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2qm0 h GLU 232 CO -0.04 0.79 -0.18 0.00 -1.00 0.00 0.00 179.01 178.58 2qm0 h ARG 233 N 0.23 0.90 -0.09 2.33 3.08 -0.67 -2.45 114.38 117.71 2qm0 h ARG 233 Ca -0.00 -0.38 -0.18 0.00 0.07 0.00 0.00 59.98 59.48 2qm0 h ARG 233 Cb 1.07 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 31.08 2qm0 h ARG 233 CO 0.09 1.03 -0.72 -0.07 -1.07 0.00 0.00 179.97 179.24 2qm0 h LEU 234 N 0.74 0.53 -1.20 3.04 3.38 -1.02 -2.85 115.31 117.93 2qm0 h LEU 234 Ca 0.10 -0.34 -0.08 0.00 0.09 0.00 0.00 57.88 57.66 2qm0 h LEU 234 Cb 0.74 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2qm0 h LEU 234 CO 0.06 1.08 -0.30 -0.07 0.09 0.00 0.00 178.44 179.30 2qm0 h LEU 235 N 0.31 0.17 -2.07 1.67 3.38 -1.15 -2.81 115.31 114.80 2qm0 h LEU 235 Ca -0.03 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 2qm0 h LEU 235 Cb 1.30 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 2qm0 h LEU 235 CO 0.13 0.47 -0.08 1.56 0.09 0.00 0.00 178.44 180.60 2qm0 h GLN 236 N 0.15 0.00 -6.84 1.13 4.20 -1.19 -3.43 115.11 109.13 2qm0 h GLN 236 Ca 0.02 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.21 2qm0 h GLN 236 Cb 0.61 0.00 0.05 0.00 0.30 0.00 0.00 27.48 28.44 2qm0 h GLN 236 CO 0.04 0.08 0.62 0.08 -0.67 0.00 0.00 178.83 178.99 2qm0 s VAL 237 N -4.26 2.89 -0.50 -0.54 1.01 -1.06 -4.97 120.40 112.97 2qm0 s VAL 237 Ca -0.03 0.87 0.03 0.00 0.00 0.00 0.00 61.98 62.85 2qm0 s VAL 237 Cb 0.13 -3.55 0.16 0.00 0.00 0.00 0.00 36.38 33.12 2qm0 s VAL 237 CO 0.57 0.19 0.34 0.21 0.00 0.00 0.00 175.10 176.41 2qm0 s ASN 238 N -0.40 3.21 -0.01 3.32 2.47 -1.26 -5.05 114.94 117.22 2qm0 s ASN 238 Ca 0.50 -3.07 0.01 0.00 0.42 0.00 0.00 52.86 50.72 2qm0 s ASN 238 Cb -0.38 -0.97 0.01 0.00 -1.45 0.00 0.00 41.25 38.46 2qm0 s ASN 238 CO 0.49 -0.19 -0.02 -2.28 -3.72 0.00 0.00 177.10 171.37 2qm0 s HIS 239 N -0.18 0.32 0.61 0.43 2.46 -1.26 -5.04 115.29 112.64 2qm0 s HIS 239 Ca 0.24 -0.05 0.30 0.00 0.47 0.00 0.00 55.06 56.03 2qm0 s HIS 239 Cb -0.10 -0.28 1.69 0.00 -0.13 0.00 0.00 32.58 33.76 2qm0 s HIS 239 CO -0.11 -0.05 2.06 -0.44 -2.47 0.00 0.00 174.74 173.73 2qm0 h ASP 240 N 6.47 0.00 -0.16 9.88 3.45 -1.98 -2.22 116.42 131.85 2qm0 h ASP 240 Ca -0.32 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.14 2qm0 h ASP 240 Cb 1.18 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.95 2qm0 h ASP 240 CO 0.50 0.00 0.00 0.29 -1.57 0.00 0.00 179.24 178.46 2qm0 n LYS 241 N -3.56 2.20 -4.14 3.56 4.76 -1.26 -4.75 118.16 114.97 2qm0 n LYS 241 Ca 0.02 -1.77 -0.28 0.00 -2.87 0.00 0.00 58.31 53.41 2qm0 n LYS 241 Cb 0.37 -1.47 -0.17 0.00 -1.84 0.00 0.00 35.03 31.92 2qm0 n LYS 241 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2qm0 s LEU 242 N -1.77 1.48 -0.27 -0.35 2.96 -0.84 0.19 118.68 120.08 2qm0 s LEU 242 Ca 0.34 -0.37 0.01 0.00 -0.22 0.00 0.00 54.13 53.88 2qm0 s LEU 242 Cb 0.21 -0.97 0.05 0.00 0.50 0.00 0.00 46.19 45.98 2qm0 s LEU 242 CO 0.31 -0.06 -0.07 -0.75 -1.32 0.00 0.00 176.35 174.46 2qm0 s LYS 243 N 1.36 2.41 -0.08 1.98 2.20 0.63 -4.64 119.74 123.61 2qm0 s LYS 243 Ca -0.00 -1.25 0.01 0.00 -0.36 0.00 0.00 55.97 54.36 2qm0 s LYS 243 Cb -0.14 -2.99 -0.03 0.00 -1.51 0.00 0.00 37.83 33.16 2qm0 s LYS 243 CO -0.06 -0.55 -0.07 0.12 -0.36 0.00 0.00 175.35 174.43 2qm0 s PHE 244 N 1.19 2.94 -0.01 4.03 5.36 -1.26 -0.85 117.98 129.37 2qm0 s PHE 244 Ca -0.06 -0.02 0.00 0.00 -0.96 0.00 0.00 56.93 55.89 2qm0 s PHE 244 Cb -0.19 -1.73 0.01 0.00 -0.34 0.00 0.00 43.02 40.77 2qm0 s PHE 244 CO -0.04 0.29 0.00 0.21 -1.46 0.00 0.00 175.22 174.22 2qm0 s LYS 245 N -0.69 0.09 -0.05 10.12 2.20 -0.01 -4.97 119.74 126.41 2qm0 s LYS 245 Ca 0.11 0.04 0.03 0.00 -0.36 0.00 0.00 55.97 55.79 2qm0 s LYS 245 Cb -0.11 -0.19 -0.03 0.00 -1.51 0.00 0.00 37.83 35.99 2qm0 s LYS 245 CO 0.02 -0.05 -0.14 0.12 -0.36 0.00 0.00 175.35 174.94 2qm0 s PHE 246 N 0.43 2.73 -0.14 4.03 5.36 -1.26 -0.59 117.98 128.54 2qm0 s PHE 246 Ca -0.04 -0.16 -0.04 0.00 -0.96 0.00 0.00 56.93 55.73 2qm0 s PHE 246 Cb -0.06 -1.65 0.06 0.00 -0.34 0.00 0.00 43.02 41.03 2qm0 s PHE 246 CO -0.01 0.18 0.10 -0.47 -1.46 0.00 0.00 175.22 173.56 2qm0 s TYR 247 N -0.69 0.10 -0.37 10.12 5.04 0.41 -4.97 117.35 126.99 2qm0 s TYR 247 Ca 0.11 -0.09 -0.20 0.00 -2.44 0.00 0.00 57.07 54.44 2qm0 s TYR 247 Cb -0.11 -0.60 0.01 0.00 0.35 0.00 0.00 41.96 41.61 2qm0 s TYR 247 CO 0.01 -0.43 0.64 -2.00 -1.34 0.00 0.00 175.55 172.42 2qm0 s GLU 248 N 2.17 3.61 -0.51 4.97 2.12 -1.26 -2.39 118.70 127.41 2qm0 s GLU 248 Ca 0.03 -0.02 -0.29 0.00 0.36 0.00 0.00 54.97 55.05 2qm0 s GLU 248 Cb -0.15 -3.83 0.03 0.00 0.26 0.00 0.00 34.13 30.43 2qm0 s GLU 248 CO -0.08 -0.79 1.22 0.00 -0.54 0.00 0.00 175.26 175.08 2qm0 s ALA 249 N 2.73 3.05 0.10 6.30 0.00 0.68 -4.85 121.76 129.77 2qm0 s ALA 249 Ca 0.24 -0.57 -0.31 0.00 0.00 0.00 0.00 51.96 51.32 2qm0 s ALA 249 Cb -0.14 -3.97 -0.07 0.00 0.00 0.00 0.00 23.12 18.93 2qm0 s ALA 249 CO 0.16 -2.48 1.33 -2.00 0.00 0.00 0.00 175.76 172.77 2qm0 s GLU 250 N 4.79 4.35 0.00 0.00 2.12 -1.26 -1.43 118.70 127.27 2qm0 s GLU 250 Ca 0.49 1.98 0.00 0.00 0.36 0.00 0.00 54.97 57.80 2qm0 s GLU 250 Cb -0.08 -3.28 0.00 0.00 0.26 0.00 0.00 34.13 31.02 2qm0 s GLU 250 CO 0.29 -0.39 0.00 0.41 -0.54 0.00 0.00 175.26 175.04 2qm0 n GLY 251 N 3.42 1.06 3.87 -1.50 0.00 -1.26 -4.92 105.19 105.86 2qm0 n GLY 251 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 2qm0 n GLY 251 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qm0 s GLU 252 N -0.33 3.24 0.42 1.61 0.41 -1.10 -4.84 118.70 118.12 2qm0 s GLU 252 Ca 0.00 -0.56 0.03 0.00 -0.41 0.00 0.00 54.97 54.03 2qm0 s GLU 252 Cb 0.00 -2.91 0.03 0.00 -1.78 0.00 0.00 34.13 29.47 2qm0 s GLU 252 CO 0.00 0.58 0.27 0.27 -0.49 0.00 0.00 175.26 175.89 2qm0 n ASN 253 N 0.17 2.48 -0.08 -0.19 0.23 -1.26 -1.63 115.26 114.98 2qm0 n ASN 253 Ca -0.07 -2.51 0.08 0.00 -0.53 0.00 0.00 54.58 51.55 2qm0 n ASN 253 Cb 0.52 0.01 0.44 0.00 -2.08 0.00 0.00 39.78 38.67 2qm0 n ASN 253 CO 0.00 0.00 0.00 -0.74 -0.93 0.00 0.00 177.26 175.59 2qm0 h HIS 254 N 0.72 0.54 0.00 -2.53 -0.00 -1.90 -2.19 115.15 109.79 2qm0 h HIS 254 Ca -0.28 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.10 2qm0 h HIS 254 Cb 0.99 -0.18 0.00 0.00 -0.00 0.00 0.00 27.41 28.22 2qm0 h HIS 254 CO 0.00 0.29 -0.66 0.00 -0.00 0.00 0.00 177.93 177.56 2qm0 h ALA 255 N 1.69 0.61 0.00 5.26 0.00 -2.02 -3.38 119.26 121.41 2qm0 h ALA 255 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2qm0 h ALA 255 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2qm0 h ALA 255 CO -0.07 0.00 -0.57 -1.13 0.00 0.00 0.00 179.25 177.48 2qm0 n SER 256 N -2.36 0.64 0.02 0.00 3.41 -0.94 -4.52 113.62 109.87 2qm0 n SER 256 Ca 0.02 -0.70 0.03 0.00 -0.26 0.00 0.00 58.87 57.97 2qm0 n SER 256 Cb 0.48 1.03 0.41 0.00 -0.26 0.00 0.00 64.21 65.87 2qm0 n SER 256 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 2qm0 h VAL 257 N 0.00 1.12 0.77 -3.33 3.04 -1.60 -2.96 116.25 113.29 2qm0 h VAL 257 Ca 0.00 -0.31 -0.04 0.00 -1.01 0.00 0.00 66.70 65.34 2qm0 h VAL 257 Cb 0.27 0.63 0.01 0.00 -2.01 0.00 0.00 31.29 30.19 2qm0 h VAL 257 CO 0.00 0.13 -0.37 0.58 -1.01 0.00 0.00 177.57 176.90 2qm0 h VAL 258 N 0.51 0.01 -0.55 1.51 2.07 -1.85 -0.72 116.25 117.23 2qm0 h VAL 258 Ca 0.13 -0.24 0.04 0.00 0.82 0.00 0.00 66.70 67.45 2qm0 h VAL 258 Cb 0.03 0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 29.78 2qm0 h VAL 258 CO -0.02 0.00 0.36 1.55 0.02 0.00 0.00 177.57 179.48 2qm0 h PRO 259 N -1.28 0.59 -0.49 1.57 0.13 -1.87 -1.35 132.00 129.31 2qm0 h PRO 259 Ca -0.11 -0.04 -0.05 0.00 -0.87 0.00 0.00 66.00 64.94 2qm0 h PRO 259 Cb 0.80 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.78 2qm0 h PRO 259 CO 0.17 0.39 0.10 1.15 -0.23 0.00 0.00 178.00 179.59 2qm0 h THR 260 N 0.61 1.24 -0.01 1.56 2.02 -1.38 -3.10 112.91 113.85 2qm0 h THR 260 Ca 0.22 -0.88 0.00 0.00 0.77 0.00 0.00 66.41 66.53 2qm0 h THR 260 Cb 0.13 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 2qm0 h THR 260 CO -0.06 0.31 -0.20 -1.20 0.37 0.00 0.00 175.52 174.74 2qm0 n SER 261 N -4.45 1.27 -0.17 4.18 7.64 -0.29 -4.50 113.62 117.29 2qm0 n SER 261 Ca 0.01 -1.12 -0.05 0.00 1.01 0.00 0.00 58.87 58.73 2qm0 n SER 261 Cb 0.23 0.12 0.05 0.00 -1.01 0.00 0.00 64.21 63.60 2qm0 n SER 261 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2qm0 h LEU 262 N 1.68 0.43 -0.17 -3.43 5.85 -1.17 -0.89 115.31 117.61 2qm0 h LEU 262 Ca 0.00 0.02 -0.22 0.00 0.84 0.00 0.00 57.88 58.52 2qm0 h LEU 262 Cb 0.54 -0.07 0.01 0.00 0.37 0.00 0.00 40.66 41.51 2qm0 h LEU 262 CO 0.00 0.30 -0.77 0.28 -0.34 0.00 0.00 178.44 177.91 2qm0 h SER 263 N 0.56 0.94 -0.57 1.25 0.02 -1.79 0.18 113.55 114.13 2qm0 h SER 263 Ca 0.22 -0.61 0.05 0.00 -0.84 0.00 0.00 61.79 60.61 2qm0 h SER 263 Cb 0.09 -0.28 -0.05 0.00 0.14 0.00 0.00 62.40 62.30 2qm0 h SER 263 CO -0.13 1.42 0.30 0.50 -1.14 0.00 0.00 176.83 177.78 2qm0 h LYS 264 N 0.54 0.56 -0.08 3.45 3.64 -1.81 0.39 116.57 123.27 2qm0 h LYS 264 Ca -0.05 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.31 2qm0 h LYS 264 Cb 1.40 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 33.09 2qm0 h LYS 264 CO 0.16 0.37 0.01 0.78 -2.27 0.00 0.00 179.45 178.50 2qm0 h GLY 265 N 0.58 0.09 0.99 5.01 0.00 -0.79 -1.31 103.07 107.63 2qm0 h GLY 265 Ca 0.25 -0.01 0.01 0.00 0.00 0.00 0.00 47.33 47.59 2qm0 h GLY 265 CO -0.17 0.00 0.56 1.41 0.00 0.00 0.00 176.54 178.35 2qm0 h LEU 266 N 0.05 0.97 -0.96 3.11 3.38 -0.31 -0.93 115.31 120.63 2qm0 h LEU 266 Ca 0.03 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2qm0 h LEU 266 Cb 0.03 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 2qm0 h LEU 266 CO -0.05 0.70 0.51 0.03 0.09 0.00 0.00 178.44 179.72 2qm0 h ARG 267 N 1.14 1.24 -0.34 1.13 3.08 -0.74 -2.46 114.38 117.43 2qm0 h ARG 267 Ca 0.32 -0.13 -0.11 0.00 0.07 0.00 0.00 59.98 60.13 2qm0 h ARG 267 Cb -0.11 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 29.68 2qm0 h ARG 267 CO -0.08 0.89 -0.21 0.35 -1.07 0.00 0.00 179.97 179.85 2qm0 h PHE 268 N 1.25 0.88 -0.00 3.04 3.57 -0.27 -3.09 116.94 122.31 2qm0 h PHE 268 Ca 0.32 -0.23 0.00 0.00 3.53 0.00 0.00 57.97 61.59 2qm0 h PHE 268 Cb -0.00 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 38.54 2qm0 h PHE 268 CO 0.01 0.97 -0.10 0.44 -2.23 0.00 0.00 178.31 177.40 2qm0 n ILE 269 N -4.28 0.00 -2.55 1.41 -5.35 -0.45 -4.93 119.36 103.21 2qm0 n ILE 269 Ca -0.03 -0.03 -0.25 0.00 -0.27 0.00 0.00 62.75 62.18 2qm0 n ILE 269 Cb 0.43 -0.25 0.03 0.00 -1.74 0.00 0.00 39.64 38.11 2qm0 n ILE 269 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 2qm0 s SER 270 N -2.65 5.46 -0.46 7.28 0.01 -0.93 -5.03 113.70 117.38 2qm0 s SER 270 Ca 0.24 0.43 0.06 0.00 1.31 0.00 0.00 55.95 57.99 2qm0 s SER 270 Cb 0.20 -1.41 0.41 0.00 0.21 0.00 0.00 66.02 65.43 2qm0 s SER 270 CO 0.50 -1.08 1.07 -1.22 0.41 0.00 0.00 173.24 172.92 2qm0 n TYR 271 N -2.47 3.36 0.46 2.43 4.01 -1.26 -4.97 117.16 118.71 2qm0 n TYR 271 Ca 0.05 -3.27 0.06 0.00 -0.16 0.00 0.00 57.90 54.57 2qm0 n TYR 271 Cb 0.58 -0.18 0.05 0.00 -0.31 0.00 0.00 39.34 39.48 2qm0 n TYR 271 CO 0.00 0.00 0.00 1.33 -0.46 0.00 0.00 176.86 177.73