#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pt6 s LYS 42 N 0.00 0.75 -0.04 1.97 2.47 -1.26 -5.05 119.74 118.58 2pt6 s LYS 42 Ca 0.00 -0.99 0.06 0.00 -1.56 0.00 0.00 55.97 53.48 2pt6 s LYS 42 Cb 0.00 -0.55 -0.02 0.00 -1.46 0.00 0.00 37.83 35.80 2pt6 s LYS 42 CO 0.00 0.10 -0.22 -1.58 0.16 0.00 0.00 175.35 173.82 2pt6 s TRP 43 N -1.82 2.49 -0.19 4.03 0.52 -1.26 -0.55 118.94 122.16 2pt6 s TRP 43 Ca -0.01 -0.44 -0.18 0.00 0.02 0.00 0.00 56.10 55.50 2pt6 s TRP 43 Cb -0.07 -1.58 -0.04 0.00 -1.15 0.00 0.00 33.47 30.64 2pt6 s TRP 43 CO 0.01 -0.03 0.49 0.12 0.02 0.00 0.00 176.95 177.56 2pt6 s PHE 44 N -0.49 3.39 -0.12 -1.98 5.36 0.46 -4.92 117.98 119.68 2pt6 s PHE 44 Ca 0.06 0.76 0.03 0.00 -0.96 0.00 0.00 56.93 56.81 2pt6 s PHE 44 Cb -0.11 -2.62 0.00 0.00 -0.34 0.00 0.00 43.02 39.95 2pt6 s PHE 44 CO 0.01 -0.04 -0.21 -1.12 -1.46 0.00 0.00 175.22 172.40 2pt6 s SER 45 N 1.05 3.29 -1.05 6.13 0.01 -1.26 -0.68 113.70 121.19 2pt6 s SER 45 Ca 0.23 -0.53 -0.14 0.00 1.31 0.00 0.00 55.95 56.82 2pt6 s SER 45 Cb -0.15 -1.47 0.19 0.00 0.21 0.00 0.00 66.02 64.80 2pt6 s SER 45 CO 0.09 0.13 1.18 -0.70 0.41 0.00 0.00 173.24 174.35 2pt6 s GLU 46 N 0.53 3.90 0.16 12.44 2.12 -0.06 -5.00 118.70 132.79 2pt6 s GLU 46 Ca -0.13 -2.47 -0.16 0.00 0.36 0.00 0.00 54.97 52.57 2pt6 s GLU 46 Cb -0.17 -4.82 -0.07 0.00 0.26 0.00 0.00 34.13 29.33 2pt6 s GLU 46 CO 0.05 -1.58 0.59 -0.06 -0.54 0.00 0.00 175.26 173.71 2pt6 s PHE 47 N 1.07 3.62 -0.15 5.30 0.08 -1.26 -4.17 117.98 122.47 2pt6 s PHE 47 Ca 0.34 1.15 -0.29 0.00 0.12 0.00 0.00 56.93 58.25 2pt6 s PHE 47 Cb -0.06 -2.43 0.09 0.00 -0.57 0.00 0.00 43.02 40.04 2pt6 s PHE 47 CO -0.06 0.41 0.78 0.45 -0.10 0.00 0.00 175.22 176.71 2pt6 s SER 48 N -1.67 -0.61 0.35 1.36 0.15 -1.26 -4.93 113.70 107.09 2pt6 s SER 48 Ca 0.39 0.85 0.25 0.00 0.70 0.00 0.00 55.95 58.14 2pt6 s SER 48 Cb -0.16 0.76 1.22 0.00 -1.71 0.00 0.00 66.02 66.13 2pt6 s SER 48 CO 0.20 -0.43 1.77 0.16 1.20 0.00 0.00 173.24 176.14 2pt6 h ILE 49 N 3.22 0.00 0.00 6.45 3.07 -1.98 -2.38 117.51 125.89 2pt6 h ILE 49 Ca -0.26 -0.14 0.00 0.00 1.55 0.00 0.00 64.86 66.01 2pt6 h ILE 49 Cb 1.15 0.81 0.00 0.00 -0.27 0.00 0.00 36.82 38.51 2pt6 h ILE 49 CO 0.26 0.00 -0.01 0.24 -1.05 0.00 0.00 178.15 177.59 2pt6 h MET 50 N 0.00 0.00 -2.13 0.16 2.86 -2.01 -3.35 114.93 110.46 2pt6 h MET 50 Ca 0.00 0.00 -0.57 0.00 -2.06 0.00 0.00 59.70 57.07 2pt6 h MET 50 Cb 0.19 0.00 -0.38 0.00 0.06 0.00 0.00 31.60 31.47 2pt6 h MET 50 CO 0.00 0.00 -1.04 -2.67 1.06 0.00 0.00 176.91 174.26 2pt6 n TRP 51 N -2.37 -0.70 -2.17 -0.22 2.14 -0.90 -4.93 117.44 108.29 2pt6 n TRP 51 Ca 0.05 -3.40 -0.41 0.00 2.07 0.00 0.00 57.50 55.81 2pt6 n TRP 51 Cb 0.44 -0.03 -0.03 0.00 -0.81 0.00 0.00 31.31 30.89 2pt6 n TRP 51 CO 0.00 0.00 0.00 -1.25 2.07 0.00 0.00 177.69 178.51 2pt6 s PRO 52 N -0.58 4.39 0.00 -2.67 0.04 -1.21 -3.20 135.00 131.77 2pt6 s PRO 52 Ca 0.34 2.14 0.00 0.00 0.04 0.00 0.00 61.00 63.53 2pt6 s PRO 52 Cb 0.11 -3.11 0.00 0.00 0.04 0.00 0.00 34.50 31.54 2pt6 s PRO 52 CO -0.15 -0.17 0.00 0.41 0.04 0.00 0.00 177.00 177.13 2pt6 n GLY 53 N 1.24 0.53 3.04 0.56 0.00 -1.26 -5.01 105.19 104.29 2pt6 n GLY 53 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 2pt6 n GLY 53 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2pt6 s GLN 54 N -0.00 0.48 -0.28 1.61 -2.07 -1.19 -5.16 119.66 113.04 2pt6 s GLN 54 Ca 0.00 -0.94 -0.20 0.00 -1.82 0.00 0.00 55.36 52.40 2pt6 s GLN 54 Cb 0.00 0.14 0.08 0.00 -1.09 0.00 0.00 33.01 32.14 2pt6 s GLN 54 CO 0.00 -0.08 0.71 0.00 -1.32 0.00 0.00 175.29 174.61 2pt6 s ALA 55 N -2.75 -1.84 -0.11 2.60 0.00 -1.26 -4.66 121.76 113.74 2pt6 s ALA 55 Ca -0.04 2.24 -0.06 0.00 0.00 0.00 0.00 51.96 54.10 2pt6 s ALA 55 Cb -0.01 -1.32 -0.04 0.00 0.00 0.00 0.00 23.12 21.75 2pt6 s ALA 55 CO -0.06 -0.36 0.13 0.12 0.00 0.00 0.00 175.76 175.59 2pt6 s PHE 56 N 1.04 3.55 0.09 0.00 5.36 -1.26 -4.91 117.98 121.85 2pt6 s PHE 56 Ca -0.05 0.48 0.08 0.00 -0.96 0.00 0.00 56.93 56.48 2pt6 s PHE 56 Cb -0.05 -1.92 -0.03 0.00 -0.34 0.00 0.00 43.02 40.68 2pt6 s PHE 56 CO -0.10 0.70 -0.21 -1.12 -1.46 0.00 0.00 175.22 173.03 2pt6 s SER 57 N -1.06 2.56 -0.03 6.13 0.01 -1.26 -0.88 113.70 119.16 2pt6 s SER 57 Ca 0.15 -0.65 0.03 0.00 1.31 0.00 0.00 55.95 56.80 2pt6 s SER 57 Cb -0.12 -0.16 0.00 0.00 0.21 0.00 0.00 66.02 65.95 2pt6 s SER 57 CO 0.05 0.09 -0.13 -0.76 0.41 0.00 0.00 173.24 172.90 2pt6 s LEU 58 N -1.73 1.83 0.15 2.44 1.43 0.14 -4.98 118.68 117.97 2pt6 s LEU 58 Ca 0.07 -0.26 -0.30 0.00 -1.03 0.00 0.00 54.13 52.60 2pt6 s LEU 58 Cb -0.10 -0.75 -0.07 0.00 0.03 0.00 0.00 46.19 45.30 2pt6 s LEU 58 CO 0.04 0.10 1.20 -0.75 0.23 0.00 0.00 176.35 177.17 2pt6 s LYS 59 N 0.15 4.48 -0.20 1.70 2.20 -1.26 -0.40 119.74 126.40 2pt6 s LYS 59 Ca -0.04 1.84 -0.19 0.00 -0.36 0.00 0.00 55.97 57.23 2pt6 s LYS 59 Cb -0.10 -3.27 -0.03 0.00 -1.51 0.00 0.00 37.83 32.92 2pt6 s LYS 59 CO 0.01 -0.13 0.55 0.42 -0.36 0.00 0.00 175.35 175.84 2pt6 s ILE 60 N 0.25 5.08 -0.10 5.43 1.01 0.29 -1.63 121.20 131.53 2pt6 s ILE 60 Ca 0.54 1.02 -0.11 0.00 0.00 0.00 0.00 60.65 62.11 2pt6 s ILE 60 Cb -0.32 -3.87 -0.09 0.00 0.01 0.00 0.00 42.46 38.19 2pt6 s ILE 60 CO 0.34 0.16 0.32 0.50 0.00 0.00 0.00 174.94 176.27 2pt6 h LYS 61 N 7.45 -0.04 -2.61 2.79 3.64 -0.14 -3.39 116.57 124.27 2pt6 h LYS 61 Ca -0.33 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 58.95 2pt6 h LYS 61 Cb 1.15 0.01 -0.21 0.00 -0.41 0.00 0.00 32.23 32.77 2pt6 h LYS 61 CO 0.75 0.29 -0.12 -1.59 -2.27 0.00 0.00 179.45 176.51 2pt6 s LYS 62 N -1.98 0.70 0.00 1.90 -2.85 -0.92 -5.00 119.74 111.59 2pt6 s LYS 62 Ca -0.07 0.30 -0.30 0.00 -1.00 0.00 0.00 55.97 54.90 2pt6 s LYS 62 Cb -0.01 0.33 -0.04 0.00 -2.06 0.00 0.00 37.83 36.05 2pt6 s LYS 62 CO 0.25 -0.16 1.17 0.42 0.10 0.00 0.00 175.35 177.13 2pt6 s ILE 63 N -0.57 4.25 -0.26 3.79 1.01 -1.26 -0.24 121.20 127.92 2pt6 s ILE 63 Ca -0.07 1.60 -0.02 0.00 0.00 0.00 0.00 60.65 62.17 2pt6 s ILE 63 Cb -0.03 -4.03 -0.16 0.00 0.01 0.00 0.00 42.46 38.25 2pt6 s ILE 63 CO 0.04 0.07 -0.26 0.18 0.00 0.00 0.00 174.94 174.97 2pt6 n LEU 64 N 4.46 2.74 -3.67 2.97 4.77 -0.42 -4.93 117.00 122.92 2pt6 n LEU 64 Ca 0.09 -0.03 -0.12 0.00 -0.03 0.00 0.00 56.01 55.92 2pt6 n LEU 64 Cb 0.47 -0.88 -0.08 0.00 -2.33 0.00 0.00 43.42 40.60 2pt6 n LEU 64 CO 0.55 0.85 0.27 -0.47 -1.33 0.00 0.00 177.39 177.26 2pt6 s TYR 65 N -2.51 -0.72 -0.08 -1.77 5.04 -0.82 -4.99 117.35 111.49 2pt6 s TYR 65 Ca -0.35 1.65 -0.04 0.00 -2.44 0.00 0.00 57.07 55.89 2pt6 s TYR 65 Cb 0.10 0.30 0.04 0.00 0.35 0.00 0.00 41.96 42.75 2pt6 s TYR 65 CO 0.57 -0.35 0.19 -1.21 -1.34 0.00 0.00 175.55 173.40 2pt6 s GLU 66 N 0.67 0.14 0.22 4.97 2.02 -1.26 -0.02 118.70 125.44 2pt6 s GLU 66 Ca -0.03 0.44 -0.20 0.00 0.02 0.00 0.00 54.97 55.20 2pt6 s GLU 66 Cb -0.05 -0.15 0.04 0.00 0.10 0.00 0.00 34.13 34.07 2pt6 s GLU 66 CO -0.04 -0.16 0.62 -0.08 0.02 0.00 0.00 175.26 175.61 2pt6 s THR 67 N 1.21 0.01 -0.31 3.63 -1.32 -0.56 -5.02 115.64 113.28 2pt6 s THR 67 Ca -0.09 -0.65 -0.07 0.00 -1.21 0.00 0.00 61.69 59.67 2pt6 s THR 67 Cb -0.11 -1.58 0.01 0.00 -1.51 0.00 0.00 72.50 69.31 2pt6 s THR 67 CO -0.07 -0.04 0.09 -0.75 -2.21 0.00 0.00 174.62 171.65 2pt6 s LYS 68 N -3.86 3.02 0.45 7.08 2.20 -1.26 -0.43 119.74 126.93 2pt6 s LYS 68 Ca 0.08 -0.91 -0.06 0.00 -0.36 0.00 0.00 55.97 54.71 2pt6 s LYS 68 Cb -0.03 -3.41 0.10 0.00 -1.51 0.00 0.00 37.83 32.98 2pt6 s LYS 68 CO -0.02 -0.49 0.62 -1.13 -0.36 0.00 0.00 175.35 173.97 2pt6 n SER 69 N 4.87 0.20 0.28 1.43 3.41 -0.13 -4.94 113.62 118.75 2pt6 n SER 69 Ca -0.14 -1.32 0.15 0.00 -0.26 0.00 0.00 58.87 57.31 2pt6 n SER 69 Cb 0.47 -0.46 0.90 0.00 -0.26 0.00 0.00 64.21 64.87 2pt6 n SER 69 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2pt6 h LYS 70 N 0.00 0.00 0.00 4.33 1.57 -1.99 -3.34 116.57 117.14 2pt6 h LYS 70 Ca -0.20 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.52 2pt6 h LYS 70 Cb 0.59 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 2pt6 h LYS 70 CO 0.16 0.00 -1.24 0.66 -0.57 0.00 0.00 179.45 178.45 2pt6 n TYR 71 N -3.84 0.00 -3.58 -1.35 4.01 -1.26 -5.11 117.16 106.04 2pt6 n TYR 71 Ca -0.02 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.61 2pt6 n TYR 71 Cb 0.12 -0.17 -0.04 0.00 -0.31 0.00 0.00 39.34 38.94 2pt6 n TYR 71 CO 0.00 0.00 0.00 1.14 -0.46 0.00 0.00 176.86 177.54 2pt6 s GLN 72 N -2.09 1.12 -0.01 -0.72 -2.07 -1.26 -4.75 119.66 109.89 2pt6 s GLN 72 Ca -0.02 -0.64 -0.30 0.00 -1.82 0.00 0.00 55.36 52.57 2pt6 s GLN 72 Cb 0.01 0.50 -0.03 0.00 -1.09 0.00 0.00 33.01 32.40 2pt6 s GLN 72 CO 0.14 -0.46 1.04 -0.80 -1.32 0.00 0.00 175.29 173.90 2pt6 s ASN 73 N -2.79 7.27 -0.18 12.60 0.02 -1.26 -0.95 114.94 129.65 2pt6 s ASN 73 Ca 0.02 1.72 -0.02 0.00 -1.02 0.00 0.00 52.86 53.56 2pt6 s ASN 73 Cb 0.01 -2.57 -0.01 0.00 0.02 0.00 0.00 41.25 38.71 2pt6 s ASN 73 CO -0.12 -0.36 -0.10 -0.69 0.02 0.00 0.00 177.10 175.85 2pt6 s VAL 74 N 1.29 3.07 -0.06 1.60 1.01 0.43 -0.93 120.40 126.82 2pt6 s VAL 74 Ca 0.53 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.92 2pt6 s VAL 74 Cb -0.22 -2.35 0.01 0.00 0.00 0.00 0.00 36.38 33.81 2pt6 s VAL 74 CO 0.26 0.48 -0.14 -0.22 0.00 0.00 0.00 175.10 175.47 2pt6 s LEU 75 N 1.05 1.78 -0.10 3.92 2.96 -0.02 -1.50 118.68 126.77 2pt6 s LEU 75 Ca -0.00 -0.32 0.04 0.00 -0.22 0.00 0.00 54.13 53.62 2pt6 s LEU 75 Cb -0.15 -0.89 0.00 0.00 0.50 0.00 0.00 46.19 45.66 2pt6 s LEU 75 CO -0.02 0.08 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.18 2pt6 s VAL 76 N 0.39 2.00 0.04 1.68 1.01 0.97 0.05 120.40 126.54 2pt6 s VAL 76 Ca -0.10 -0.98 -0.03 0.00 0.00 0.00 0.00 61.98 60.87 2pt6 s VAL 76 Cb -0.14 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 2pt6 s VAL 76 CO 0.03 0.55 0.02 0.72 0.00 0.00 0.00 175.10 176.42 2pt6 s PHE 77 N 0.43 0.30 -0.18 5.22 -0.12 -0.76 -1.30 117.98 121.58 2pt6 s PHE 77 Ca -0.17 -0.66 -0.20 0.00 -0.05 0.00 0.00 56.93 55.85 2pt6 s PHE 77 Cb -0.17 -0.22 -0.03 0.00 -0.63 0.00 0.00 43.02 41.96 2pt6 s PHE 77 CO 0.07 -0.32 0.60 -2.00 -0.05 0.00 0.00 175.22 173.53 2pt6 s GLU 78 N -2.60 4.24 0.34 1.99 2.12 0.67 -0.20 118.70 125.27 2pt6 s GLU 78 Ca -0.05 0.59 0.02 0.00 0.36 0.00 0.00 54.97 55.89 2pt6 s GLU 78 Cb -0.01 -3.55 -0.02 0.00 0.26 0.00 0.00 34.13 30.80 2pt6 s GLU 78 CO -0.05 -0.15 0.53 -1.54 -0.54 0.00 0.00 175.26 173.50 2pt6 s SER 79 N 1.09 6.18 0.28 -1.70 1.04 -0.34 0.55 113.70 120.80 2pt6 s SER 79 Ca 0.28 0.28 0.06 0.00 0.48 0.00 0.00 55.95 57.06 2pt6 s SER 79 Cb -0.16 -1.83 0.39 0.00 0.10 0.00 0.00 66.02 64.53 2pt6 s SER 79 CO 0.11 -0.34 1.66 0.71 0.98 0.00 0.00 173.24 176.36 2pt6 h THR 80 N 0.78 1.34 0.00 2.02 1.35 -1.60 -3.35 112.91 113.45 2pt6 h THR 80 Ca -0.49 -1.69 0.00 0.00 -0.55 0.00 0.00 66.41 63.68 2pt6 h THR 80 Cb 1.23 1.81 0.00 0.00 -1.73 0.00 0.00 68.15 69.46 2pt6 h THR 80 CO 0.60 0.50 0.00 0.35 -0.25 0.00 0.00 175.52 176.72 2pt6 n THR 81 N -3.97 0.00 -0.31 6.82 -2.24 -1.26 -4.77 114.28 108.56 2pt6 n THR 81 Ca -0.02 -0.23 0.05 0.00 -2.27 0.00 0.00 64.05 61.58 2pt6 n THR 81 Cb 0.53 1.29 0.13 0.00 -2.10 0.00 0.00 70.33 70.17 2pt6 n THR 81 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2pt6 n TYR 82 N -0.22 0.39 -4.66 4.78 4.02 -1.26 -4.97 117.16 115.25 2pt6 n TYR 82 Ca 0.00 -0.59 0.00 0.00 -0.01 0.00 0.00 57.90 57.30 2pt6 n TYR 82 Cb 0.07 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.31 2pt6 n TYR 82 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2pt6 n GLY 83 N -0.01 0.36 3.77 2.72 0.00 -1.26 -2.43 105.19 108.35 2pt6 n GLY 83 Ca 0.10 -0.87 -0.36 0.00 0.00 0.00 0.00 46.02 44.90 2pt6 n GLY 83 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pt6 s LYS 84 N 0.00 3.59 -0.05 1.61 1.02 -1.26 -1.20 119.74 123.46 2pt6 s LYS 84 Ca 0.00 1.71 0.02 0.00 0.02 0.00 0.00 55.97 57.72 2pt6 s LYS 84 Cb 0.00 -2.24 0.01 0.00 -0.52 0.00 0.00 37.83 35.08 2pt6 s LYS 84 CO 0.00 -0.67 -0.08 0.08 -0.92 0.00 0.00 175.35 173.75 2pt6 s VAL 85 N -1.64 0.80 -0.22 3.17 1.01 0.73 -1.18 120.40 123.07 2pt6 s VAL 85 Ca 0.67 -0.31 -0.08 0.00 0.00 0.00 0.00 61.98 62.27 2pt6 s VAL 85 Cb -0.27 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 2pt6 s VAL 85 CO 0.31 0.27 0.08 -0.22 0.00 0.00 0.00 175.10 175.54 2pt6 s LEU 86 N 0.62 3.69 -0.11 3.92 2.96 -0.40 -1.83 118.68 127.52 2pt6 s LEU 86 Ca -0.10 -0.04 0.02 0.00 -0.22 0.00 0.00 54.13 53.79 2pt6 s LEU 86 Cb -0.13 -1.96 -0.01 0.00 0.50 0.00 0.00 46.19 44.59 2pt6 s LEU 86 CO 0.01 0.07 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.23 2pt6 s VAL 87 N 1.00 2.51 -0.12 1.68 1.01 0.11 -0.09 120.40 126.50 2pt6 s VAL 87 Ca 0.04 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.19 2pt6 s VAL 87 Cb -0.14 -2.01 0.01 0.00 0.00 0.00 0.00 36.38 34.24 2pt6 s VAL 87 CO 0.03 0.54 -0.19 -0.76 0.00 0.00 0.00 175.10 174.72 2pt6 s LEU 88 N 0.35 1.94 -1.63 3.92 1.43 -0.02 -0.84 118.68 123.82 2pt6 s LEU 88 Ca -0.15 -0.51 -0.15 0.00 -1.03 0.00 0.00 54.13 52.28 2pt6 s LEU 88 Cb -0.17 -1.27 0.13 0.00 0.03 0.00 0.00 46.19 44.91 2pt6 s LEU 88 CO 0.07 0.07 0.79 0.47 0.23 0.00 0.00 176.35 177.98 2pt6 n ASP 89 N 3.99 -3.25 0.00 2.29 8.00 -0.10 -1.05 116.55 126.42 2pt6 n ASP 89 Ca -0.20 -0.96 0.00 0.00 0.71 0.00 0.00 54.79 54.34 2pt6 n ASP 89 Cb 0.52 -3.03 0.00 0.00 -0.02 0.00 0.00 41.12 38.59 2pt6 n ASP 89 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2pt6 n GLY 90 N -1.53 0.76 3.43 0.44 0.00 -1.26 -5.01 105.19 102.01 2pt6 n GLY 90 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 2pt6 n GLY 90 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2pt6 s VAL 91 N -3.04 3.44 0.03 1.61 1.01 -0.22 -4.64 120.40 118.59 2pt6 s VAL 91 Ca 0.00 -0.52 -0.30 0.00 0.00 0.00 0.00 61.98 61.16 2pt6 s VAL 91 Cb 0.00 -2.48 -0.08 0.00 0.00 0.00 0.00 36.38 33.82 2pt6 s VAL 91 CO 0.00 0.51 1.85 -0.63 0.00 0.00 0.00 175.10 176.83 2pt6 s ILE 92 N 0.37 3.08 -0.19 2.22 1.01 -1.26 -0.84 121.20 125.59 2pt6 s ILE 92 Ca -0.08 0.21 -0.00 0.00 0.00 0.00 0.00 60.65 60.79 2pt6 s ILE 92 Cb -0.15 -3.14 -0.22 0.00 0.01 0.00 0.00 42.46 38.96 2pt6 s ILE 92 CO 0.04 -0.01 0.09 0.00 0.00 0.00 0.00 174.94 175.05 2pt6 n GLN 93 N 7.03 0.70 -3.51 2.79 1.13 0.87 -4.93 117.38 121.47 2pt6 n GLN 93 Ca 0.19 0.20 -0.10 0.00 -1.94 0.00 0.00 57.00 55.34 2pt6 n GLN 93 Cb 0.41 -1.61 -0.03 0.00 0.11 0.00 0.00 30.24 29.12 2pt6 n GLN 93 CO 0.00 0.00 0.00 -0.48 -1.44 0.00 0.00 177.06 175.14 2pt6 s LEU 94 N -6.66 -0.42 0.12 1.08 0.05 -1.14 -5.01 118.68 106.71 2pt6 s LEU 94 Ca -0.27 0.16 0.06 0.00 0.05 0.00 0.00 54.13 54.13 2pt6 s LEU 94 Cb 0.08 2.11 -0.04 0.00 -2.05 0.00 0.00 46.19 46.29 2pt6 s LEU 94 CO 0.70 -0.60 -0.14 0.42 -0.55 0.00 0.00 176.35 176.17 2pt6 s THR 95 N -2.58 1.34 0.48 5.48 -4.23 -1.26 -1.27 115.64 113.60 2pt6 s THR 95 Ca 0.01 -1.73 0.14 0.00 -1.18 0.00 0.00 61.69 58.94 2pt6 s THR 95 Cb -0.01 -1.55 0.23 0.00 1.34 0.00 0.00 72.50 72.52 2pt6 s THR 95 CO -0.05 -0.42 2.07 -0.33 -0.54 0.00 0.00 174.62 175.35 2pt6 h GLU 96 N 3.49 0.07 -0.36 3.99 5.08 -1.00 -2.72 114.58 123.13 2pt6 h GLU 96 Ca -0.40 -0.01 -0.17 0.00 -1.00 0.00 0.00 59.36 57.79 2pt6 h GLU 96 Cb 1.20 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 2pt6 h GLU 96 CO 0.51 0.12 -0.42 -0.22 -1.00 0.00 0.00 179.01 178.00 2pt6 h LYS 97 N 0.07 0.92 0.00 2.33 3.64 -1.77 -3.37 116.57 118.39 2pt6 h LYS 97 Ca 0.02 -0.51 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 2pt6 h LYS 97 Cb 0.13 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2pt6 h LYS 97 CO 0.01 1.16 0.00 -0.40 -2.27 0.00 0.00 179.45 177.95 2pt6 n ASP 98 N -4.06 0.94 -0.06 4.20 5.75 -1.22 -4.78 116.55 117.33 2pt6 n ASP 98 Ca -0.03 -1.07 0.17 0.00 -0.01 0.00 0.00 54.79 53.86 2pt6 n ASP 98 Cb 0.56 0.00 0.60 0.00 -1.03 0.00 0.00 41.12 41.26 2pt6 n ASP 98 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 2pt6 h GLU 99 N 0.00 0.18 0.00 0.11 -0.00 -1.64 -1.44 114.58 111.79 2pt6 h GLU 99 Ca 0.00 -0.01 -0.00 0.00 -0.00 0.00 0.00 59.36 59.35 2pt6 h GLU 99 Cb 0.10 -0.04 -0.00 0.00 -0.00 0.00 0.00 28.75 28.81 2pt6 h GLU 99 CO 0.00 0.12 -0.00 0.27 -0.00 0.00 0.00 179.01 179.40 2pt6 h PHE 100 N 0.19 0.00 0.29 2.06 -5.15 -1.86 -2.01 116.94 110.46 2pt6 h PHE 100 Ca 0.29 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 58.05 2pt6 h PHE 100 Cb 0.89 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.05 2pt6 h PHE 100 CO -0.00 0.00 -0.17 0.00 -2.00 0.00 0.00 178.31 176.14 2pt6 h ALA 101 N 2.00 -0.43 0.18 12.09 0.00 -1.61 -1.62 119.26 129.87 2pt6 h ALA 101 Ca -0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2pt6 h ALA 101 Cb 0.01 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2pt6 h ALA 101 CO 0.00 -0.75 -0.08 -0.92 0.00 0.00 0.00 179.25 177.50 2pt6 h TYR 102 N -0.43 -0.22 -0.77 0.00 3.20 -1.67 -2.50 116.97 114.58 2pt6 h TYR 102 Ca -0.03 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.86 2pt6 h TYR 102 Cb 0.35 0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.65 2pt6 h TYR 102 CO -0.08 0.17 0.51 0.45 -1.64 0.00 0.00 178.16 177.57 2pt6 h HIS 103 N -0.69 0.92 -0.08 -3.82 3.86 -1.42 -1.05 115.15 112.86 2pt6 h HIS 103 Ca -0.02 0.02 -0.16 0.00 -1.16 0.00 0.00 60.37 59.05 2pt6 h HIS 103 Cb 0.49 -0.31 0.01 0.00 1.06 0.00 0.00 27.41 28.66 2pt6 h HIS 103 CO 0.06 0.54 -0.56 0.93 0.86 0.00 0.00 177.93 179.76 2pt6 h GLU 104 N 0.96 0.52 -0.24 2.45 5.08 -1.37 -2.25 114.58 119.72 2pt6 h GLU 104 Ca 0.30 -0.45 -0.16 0.00 -1.00 0.00 0.00 59.36 58.06 2pt6 h GLU 104 Cb 0.03 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2pt6 h GLU 104 CO -0.09 1.08 -0.46 0.52 -1.00 0.00 0.00 179.01 179.07 2pt6 h MET 105 N 0.10 0.73 -0.78 2.33 2.86 -1.30 0.34 114.93 119.21 2pt6 h MET 105 Ca -0.05 -0.47 -0.01 0.00 -2.06 0.00 0.00 59.70 57.12 2pt6 h MET 105 Cb 1.22 0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.89 2pt6 h MET 105 CO 0.11 1.09 0.45 0.52 1.06 0.00 0.00 176.91 180.15 2pt6 h MET 106 N 0.46 1.06 0.00 1.72 2.86 -1.27 -2.66 114.93 117.10 2pt6 h MET 106 Ca 0.01 -0.10 -0.03 0.00 -2.06 0.00 0.00 59.70 57.51 2pt6 h MET 106 Cb 1.06 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.50 2pt6 h MET 106 CO 0.10 0.76 -0.19 1.15 1.06 0.00 0.00 176.91 179.79 2pt6 h THR 107 N 1.08 1.59 0.00 2.22 2.02 -1.34 -3.40 112.91 115.09 2pt6 h THR 107 Ca 0.28 -2.27 0.00 0.00 0.77 0.00 0.00 66.41 65.19 2pt6 h THR 107 Cb -0.01 3.09 0.00 0.00 -1.74 0.00 0.00 68.15 69.48 2pt6 h THR 107 CO -0.05 0.54 -0.42 0.45 0.37 0.00 0.00 175.52 176.41 2pt6 h HIS 108 N -1.00 0.00 0.85 3.16 -0.00 -0.97 -2.57 115.15 114.62 2pt6 h HIS 108 Ca -0.05 0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.28 2pt6 h HIS 108 Cb 1.01 0.00 0.01 0.00 -0.00 0.00 0.00 27.41 28.43 2pt6 h HIS 108 CO 0.24 0.00 -0.41 0.28 -0.00 0.00 0.00 177.93 178.04 2pt6 h VAL 109 N 0.00 0.00 -0.35 2.45 2.07 -1.64 -2.20 116.25 116.58 2pt6 h VAL 109 Ca 0.00 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.42 2pt6 h VAL 109 Cb 0.83 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 2pt6 h VAL 109 CO 0.00 0.00 -0.21 1.55 0.02 0.00 0.00 177.57 178.93 2pt6 h PRO 110 N -1.14 0.68 0.00 1.57 0.13 -1.76 -3.11 132.00 128.36 2pt6 h PRO 110 Ca -0.12 -0.26 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2pt6 h PRO 110 Cb 0.88 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.97 2pt6 h PRO 110 CO 0.19 0.83 0.00 0.52 -0.23 0.00 0.00 178.00 179.31 2pt6 h MET 111 N 0.60 0.00 0.00 0.86 2.86 -1.52 0.29 114.93 118.01 2pt6 h MET 111 Ca 0.09 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 2pt6 h MET 111 Cb 0.68 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.34 2pt6 h MET 111 CO 0.05 0.00 -0.87 0.25 1.06 0.00 0.00 176.91 177.40 2pt6 n THR 112 N -3.08 0.31 -0.07 2.22 -2.24 -0.83 -4.29 114.28 106.29 2pt6 n THR 112 Ca 0.01 -0.30 -0.21 0.00 -2.27 0.00 0.00 64.05 61.28 2pt6 n THR 112 Cb 0.32 -0.02 -0.12 0.00 -2.10 0.00 0.00 70.33 68.41 2pt6 n THR 112 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2pt6 h VAL 113 N 0.00 1.01 -2.31 2.28 2.07 -1.33 0.42 116.25 118.40 2pt6 h VAL 113 Ca 0.00 -2.25 -0.57 0.00 0.82 0.00 0.00 66.70 64.70 2pt6 h VAL 113 Cb 0.78 2.48 0.04 0.00 -1.52 0.00 0.00 31.29 33.07 2pt6 h VAL 113 CO 0.00 0.47 0.97 -0.24 0.02 0.00 0.00 177.57 178.79 2pt6 n SER 114 N -4.27 3.50 -0.02 0.57 2.88 0.03 -4.54 113.62 111.76 2pt6 n SER 114 Ca -0.28 1.03 -0.13 0.00 -1.33 0.00 0.00 58.87 58.16 2pt6 n SER 114 Cb 0.73 -1.46 -0.10 0.00 -0.75 0.00 0.00 64.21 62.63 2pt6 n SER 114 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2pt6 h LYS 115 N 7.44 -0.02 -2.05 -1.46 1.79 -1.87 -3.39 116.57 117.01 2pt6 h LYS 115 Ca -0.46 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 57.50 2pt6 h LYS 115 Cb 1.25 0.00 -0.40 0.00 -1.58 0.00 0.00 32.23 31.50 2pt6 h LYS 115 CO 0.92 0.58 -1.08 0.39 -1.08 0.00 0.00 179.45 179.18 2pt6 n GLU 116 N -4.81 1.30 -1.90 3.15 -0.58 -1.26 -5.08 120.64 111.45 2pt6 n GLU 116 Ca -0.09 -3.61 -0.42 0.00 -0.42 0.00 0.00 57.16 52.63 2pt6 n GLU 116 Cb 0.30 -1.71 -0.03 0.00 -0.57 0.00 0.00 31.44 29.43 2pt6 n GLU 116 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2pt6 s PRO 117 N -2.35 4.20 -0.03 3.49 0.04 -1.26 -4.90 135.00 134.18 2pt6 s PRO 117 Ca 0.40 2.41 0.01 0.00 0.04 0.00 0.00 61.00 63.86 2pt6 s PRO 117 Cb 0.30 -3.13 -0.03 0.00 0.04 0.00 0.00 34.50 31.68 2pt6 s PRO 117 CO -0.09 -0.61 -0.01 1.63 0.04 0.00 0.00 177.00 177.95 2pt6 n LYS 118 N 3.71 1.61 -4.29 4.56 4.76 -1.26 -4.23 118.16 123.02 2pt6 n LYS 118 Ca 0.13 0.01 -0.30 0.00 -2.87 0.00 0.00 58.31 55.28 2pt6 n LYS 118 Cb 0.38 -1.08 -0.17 0.00 -1.84 0.00 0.00 35.03 32.33 2pt6 n LYS 118 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2pt6 s ASN 119 N -3.93 2.66 -0.03 4.39 2.47 -1.26 -0.87 114.94 118.38 2pt6 s ASN 119 Ca -0.04 -0.49 0.03 0.00 0.42 0.00 0.00 52.86 52.79 2pt6 s ASN 119 Cb 0.01 -1.19 -0.00 0.00 -1.45 0.00 0.00 41.25 38.62 2pt6 s ASN 119 CO 0.10 -0.01 -0.13 -0.69 -3.72 0.00 0.00 177.10 172.66 2pt6 s VAL 120 N 1.18 1.07 -0.11 -5.21 1.01 -0.62 -1.12 120.40 116.60 2pt6 s VAL 120 Ca -0.01 -0.52 -0.02 0.00 0.00 0.00 0.00 61.98 61.43 2pt6 s VAL 120 Cb -0.14 -0.93 -0.03 0.00 0.00 0.00 0.00 36.38 35.28 2pt6 s VAL 120 CO -0.06 0.32 -0.04 -0.22 0.00 0.00 0.00 175.10 175.10 2pt6 s LEU 121 N 0.09 3.28 -0.21 3.92 2.96 -0.67 -0.86 118.68 127.20 2pt6 s LEU 121 Ca -0.03 -0.03 -0.06 0.00 -0.22 0.00 0.00 54.13 53.79 2pt6 s LEU 121 Cb -0.09 -1.75 -0.03 0.00 0.50 0.00 0.00 46.19 44.82 2pt6 s LEU 121 CO 0.01 0.28 0.02 -0.69 -1.32 0.00 0.00 176.35 174.65 2pt6 s VAL 122 N -0.33 4.06 -0.18 1.68 1.01 0.23 -0.32 120.40 126.54 2pt6 s VAL 122 Ca 0.05 -0.27 -0.12 0.00 0.00 0.00 0.00 61.98 61.64 2pt6 s VAL 122 Cb -0.12 -2.85 -0.05 0.00 0.00 0.00 0.00 36.38 33.36 2pt6 s VAL 122 CO 0.02 0.41 0.23 -0.69 0.00 0.00 0.00 175.10 175.08 2pt6 s VAL 123 N 1.11 5.34 0.00 2.92 1.01 0.06 -0.81 120.40 130.03 2pt6 s VAL 123 Ca 0.03 0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.41 2pt6 s VAL 123 Cb -0.14 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.66 2pt6 s VAL 123 CO 0.02 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.12 2pt6 n GLY 124 N 3.55 1.47 2.31 4.51 0.00 0.39 -0.93 105.19 116.50 2pt6 n GLY 124 Ca -0.13 -0.60 -0.11 0.00 0.00 0.00 0.00 46.02 45.17 2pt6 n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pt6 n GLY 125 N 0.00 1.14 0.33 -0.02 0.00 -0.62 -4.34 105.19 101.67 2pt6 n GLY 125 Ca 0.00 -0.51 0.17 0.00 0.00 0.00 0.00 46.02 45.68 2pt6 n GLY 125 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2pt6 h GLY 126 N 0.00 1.79 0.04 -0.02 0.00 -1.91 -0.07 103.07 102.90 2pt6 h GLY 126 Ca -0.23 -0.22 0.28 0.00 0.00 0.00 0.00 47.33 47.15 2pt6 h GLY 126 CO 0.33 -0.32 0.70 1.29 0.00 0.00 0.00 176.54 178.53 2pt6 h ASP 127 N 0.43 0.07 0.00 0.19 3.04 -1.91 -3.37 116.42 114.87 2pt6 h ASP 127 Ca 0.63 0.01 0.00 0.00 -3.24 0.00 0.00 57.03 54.43 2pt6 h ASP 127 Cb 1.27 -0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.56 2pt6 h ASP 127 CO -0.54 0.02 0.00 0.61 -2.04 0.00 0.00 179.24 177.29 2pt6 n GLY 128 N -1.69 0.48 0.28 7.15 0.00 -0.04 -3.33 105.19 108.04 2pt6 n GLY 128 Ca 0.21 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.19 2pt6 n GLY 128 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2pt6 h GLY 129 N 0.00 1.04 0.98 -0.02 0.00 -1.77 -0.67 103.07 102.63 2pt6 h GLY 129 Ca 0.00 -0.36 -0.05 0.00 0.00 0.00 0.00 47.33 46.92 2pt6 h GLY 129 CO 0.00 0.32 0.10 -2.22 0.00 0.00 0.00 176.54 174.75 2pt6 h ILE 130 N 0.93 1.24 -0.79 2.60 1.08 -1.87 -2.82 117.51 117.89 2pt6 h ILE 130 Ca 0.28 -0.88 0.10 0.00 -0.39 0.00 0.00 64.86 63.98 2pt6 h ILE 130 Cb -0.03 0.87 -0.08 0.00 -3.07 0.00 0.00 36.82 34.51 2pt6 h ILE 130 CO -0.09 0.31 0.43 0.40 -0.69 0.00 0.00 178.15 178.51 2pt6 h ILE 131 N 0.68 0.86 -0.50 -0.67 2.04 -1.67 -0.51 117.51 117.75 2pt6 h ILE 131 Ca 0.15 -0.24 0.01 0.00 1.00 0.00 0.00 64.86 65.79 2pt6 h ILE 131 Cb 0.36 0.10 -0.03 0.00 -0.74 0.00 0.00 36.82 36.50 2pt6 h ILE 131 CO 0.00 0.13 0.31 -0.09 0.00 0.00 0.00 178.15 178.50 2pt6 h ARG 132 N 0.70 0.61 -0.18 2.37 2.43 -0.96 -0.80 114.38 118.54 2pt6 h ARG 132 Ca 0.39 -0.04 -0.16 0.00 -0.81 0.00 0.00 59.98 59.37 2pt6 h ARG 132 Cb 0.41 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 2pt6 h ARG 132 CO -0.27 0.40 -0.53 0.93 -1.51 0.00 0.00 179.97 178.99 2pt6 h GLU 133 N 0.63 0.53 -0.39 0.20 4.39 -1.18 -3.07 114.58 115.69 2pt6 h GLU 133 Ca 0.19 -0.32 -0.08 0.00 0.34 0.00 0.00 59.36 59.49 2pt6 h GLU 133 Cb -0.03 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 2pt6 h GLU 133 CO -0.07 0.93 -0.07 -0.07 -1.16 0.00 0.00 179.01 178.57 2pt6 h LEU 134 N 0.41 0.64 -1.55 1.33 3.38 -0.79 -3.02 115.31 115.70 2pt6 h LEU 134 Ca 0.01 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.82 2pt6 h LEU 134 Cb 1.07 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.65 2pt6 h LEU 134 CO 0.10 0.75 0.00 0.00 0.09 0.00 0.00 178.44 179.38 2pt6 h LYS 136 N 0.00 0.00 -5.39 0.00 1.57 -1.57 -3.38 116.57 107.80 2pt6 h LYS 136 Ca 0.00 0.00 -0.63 0.00 -1.87 0.00 0.00 60.65 58.15 2pt6 h LYS 136 Cb 0.24 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 32.40 2pt6 h LYS 136 CO 0.00 0.06 0.53 0.71 -0.57 0.00 0.00 179.45 180.18 2pt6 s TYR 137 N -3.73 2.70 0.55 -1.35 2.02 -0.82 -4.87 117.35 111.85 2pt6 s TYR 137 Ca 0.00 -0.59 0.23 0.00 -0.37 0.00 0.00 57.07 56.34 2pt6 s TYR 137 Cb 0.10 -4.28 1.50 0.00 -0.40 0.00 0.00 41.96 38.88 2pt6 s TYR 137 CO 0.56 -1.63 2.15 0.87 -1.57 0.00 0.00 175.55 175.93 2pt6 h LYS 138 N 9.53 0.00 0.00 -0.62 1.57 -1.86 -2.74 116.57 122.45 2pt6 h LYS 138 Ca -0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 2pt6 h LYS 138 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 2pt6 h LYS 138 CO 1.18 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 178.93 2pt6 n SER 139 N -4.20 0.72 -4.74 0.86 3.41 -1.26 -4.78 113.62 103.62 2pt6 n SER 139 Ca -0.01 0.62 -0.41 0.00 -0.26 0.00 0.00 58.87 58.81 2pt6 n SER 139 Cb 0.20 -0.79 -0.03 0.00 -0.26 0.00 0.00 64.21 63.33 2pt6 n SER 139 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2pt6 s VAL 140 N -3.20 2.89 -0.20 -3.33 1.01 -1.04 -4.78 120.40 111.76 2pt6 s VAL 140 Ca 0.08 0.73 0.15 0.00 0.00 0.00 0.00 61.98 62.94 2pt6 s VAL 140 Cb 0.11 -3.47 -0.24 0.00 0.00 0.00 0.00 36.38 32.79 2pt6 s VAL 140 CO 0.49 0.11 0.06 -0.62 0.00 0.00 0.00 175.10 175.14 2pt6 n GLU 141 N 2.56 0.68 -3.77 2.72 1.02 -0.05 -5.00 120.64 118.82 2pt6 n GLU 141 Ca 0.07 0.04 -0.13 0.00 -0.02 0.00 0.00 57.16 57.12 2pt6 n GLU 141 Cb 0.41 -1.54 -0.11 0.00 -0.02 0.00 0.00 31.44 30.18 2pt6 n GLU 141 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2pt6 s ASN 142 N -5.71 -0.33 -0.19 1.62 2.47 -0.28 -4.80 114.94 107.71 2pt6 s ASN 142 Ca -0.14 0.63 -0.01 0.00 0.42 0.00 0.00 52.86 53.76 2pt6 s ASN 142 Cb 0.07 0.64 0.05 0.00 -1.45 0.00 0.00 41.25 40.56 2pt6 s ASN 142 CO 0.79 -0.11 -0.03 -0.63 -3.72 0.00 0.00 177.10 173.40 2pt6 s ILE 143 N 0.15 1.07 -0.05 -5.21 1.01 0.27 -1.58 121.20 116.86 2pt6 s ILE 143 Ca -0.00 -0.77 -0.09 0.00 0.00 0.00 0.00 60.65 59.79 2pt6 s ILE 143 Cb -0.02 -1.36 -0.05 0.00 0.01 0.00 0.00 42.46 41.04 2pt6 s ILE 143 CO 0.00 -0.02 0.25 -1.81 0.00 0.00 0.00 174.94 173.36 2pt6 s ASP 144 N 1.63 6.54 -0.05 3.58 1.01 -0.04 -0.07 116.67 129.26 2pt6 s ASP 144 Ca -0.02 0.63 0.03 0.00 0.71 0.00 0.00 52.55 53.91 2pt6 s ASP 144 Cb -0.17 -2.12 0.00 0.00 1.01 0.00 0.00 42.92 41.64 2pt6 s ASP 144 CO -0.07 0.34 -0.15 -0.51 0.21 0.00 0.00 175.17 174.98 2pt6 s ILE 145 N -1.13 1.30 -0.34 0.77 2.07 -0.18 -0.60 121.20 123.09 2pt6 s ILE 145 Ca 0.21 -0.62 0.03 0.00 -1.41 0.00 0.00 60.65 58.86 2pt6 s ILE 145 Cb -0.14 -1.15 0.10 0.00 0.13 0.00 0.00 42.46 41.41 2pt6 s ILE 145 CO 0.10 0.39 0.06 0.00 -1.91 0.00 0.00 174.94 173.58 2pt6 s GLU 147 N 0.97 2.98 0.29 0.00 2.56 -0.77 -0.46 118.70 124.27 2pt6 s GLU 147 Ca 0.08 -0.85 0.14 0.00 0.00 0.00 0.00 54.97 54.34 2pt6 s GLU 147 Cb -0.20 -2.32 0.32 0.00 2.00 0.00 0.00 34.13 33.93 2pt6 s GLU 147 CO -0.07 0.24 1.57 0.97 -0.56 0.00 0.00 175.26 177.40 2pt6 h ILE 148 N 5.50 1.14 -3.69 -3.70 2.10 -1.83 -2.55 117.51 114.49 2pt6 h ILE 148 Ca -0.23 -2.13 -0.66 0.00 1.08 0.00 0.00 64.86 62.92 2pt6 h ILE 148 Cb 1.22 2.24 -0.40 0.00 -1.09 0.00 0.00 36.82 38.80 2pt6 h ILE 148 CO 0.48 0.55 -0.73 -0.62 -1.08 0.00 0.00 178.15 176.75 2pt6 s ASP 149 N -6.58 4.69 0.55 2.19 -1.08 -1.26 -4.49 116.67 110.70 2pt6 s ASP 149 Ca 0.01 -2.03 0.31 0.00 -0.52 0.00 0.00 52.55 50.31 2pt6 s ASP 149 Cb 0.10 -1.58 1.61 0.00 -1.46 0.00 0.00 42.92 41.59 2pt6 s ASP 149 CO 0.74 -0.36 2.12 1.05 0.52 0.00 0.00 175.17 179.24 2pt6 h GLU 150 N 7.66 0.00 -0.46 4.34 4.11 -1.98 -1.77 114.58 126.48 2pt6 h GLU 150 Ca -0.06 0.00 0.03 0.00 0.07 0.00 0.00 59.36 59.40 2pt6 h GLU 150 Cb 1.02 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 2pt6 h GLU 150 CO 0.51 0.08 0.31 1.15 0.07 0.00 0.00 179.01 181.12 2pt6 h THR 151 N 0.00 1.04 -0.43 -1.06 2.02 -1.99 -0.95 112.91 111.54 2pt6 h THR 151 Ca -0.00 -0.18 -0.08 0.00 0.77 0.00 0.00 66.41 66.92 2pt6 h THR 151 Cb 0.29 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 2pt6 h THR 151 CO 0.01 0.09 -0.06 0.58 0.37 0.00 0.00 175.52 176.52 2pt6 h VAL 152 N 0.51 1.27 -0.30 3.16 2.07 -1.70 -0.71 116.25 120.54 2pt6 h VAL 152 Ca 0.19 -1.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.56 2pt6 h VAL 152 Cb 0.11 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 2pt6 h VAL 152 CO -0.05 0.39 0.16 0.40 0.02 0.00 0.00 177.57 178.49 2pt6 h ILE 153 N 0.63 1.14 0.00 4.57 2.04 -1.45 -1.53 117.51 122.91 2pt6 h ILE 153 Ca 0.12 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.61 2pt6 h ILE 153 Cb 0.57 0.82 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 2pt6 h ILE 153 CO 0.03 0.14 -0.00 -0.33 0.00 0.00 0.00 178.15 177.99 2pt6 h GLU 154 N 0.37 -0.00 -0.85 2.37 5.08 -1.01 -1.07 114.58 119.46 2pt6 h GLU 154 Ca 0.11 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.53 2pt6 h GLU 154 Cb 0.08 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.27 2pt6 h GLU 154 CO -0.02 0.04 0.56 0.28 -1.00 0.00 0.00 179.01 178.88 2pt6 h VAL 155 N -0.05 1.07 -0.03 3.13 2.07 -1.13 -2.12 116.25 119.19 2pt6 h VAL 155 Ca -0.00 -0.33 -0.13 0.00 0.82 0.00 0.00 66.70 67.06 2pt6 h VAL 155 Cb 0.05 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 29.81 2pt6 h VAL 155 CO 0.00 0.18 -0.58 -1.28 0.02 0.00 0.00 177.57 175.91 2pt6 h SER 156 N 0.97 0.11 0.25 0.57 0.87 -0.82 -0.76 113.55 114.74 2pt6 h SER 156 Ca 0.36 -0.06 -0.15 0.00 -1.23 0.00 0.00 61.79 60.72 2pt6 h SER 156 Cb 0.18 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 2pt6 h SER 156 CO -0.13 0.66 -0.57 0.11 -0.53 0.00 0.00 176.83 176.38 2pt6 h LYS 157 N 0.07 0.34 0.16 2.24 1.57 -0.59 -1.44 116.57 118.92 2pt6 h LYS 157 Ca -0.00 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.55 2pt6 h LYS 157 Cb 1.04 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.38 2pt6 h LYS 157 CO 0.08 0.81 -0.08 0.82 -0.57 0.00 0.00 179.45 180.52 2pt6 h ILE 158 N 0.25 0.59 0.00 1.86 2.04 -1.28 -3.41 117.51 117.57 2pt6 h ILE 158 Ca 0.00 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 64.73 2pt6 h ILE 158 Cb 1.07 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 38.19 2pt6 h ILE 158 CO 0.09 0.17 -0.93 -1.22 0.00 0.00 0.00 178.15 176.27 2pt6 n TYR 159 N -4.90 0.00 -2.77 1.37 4.01 -0.30 -4.61 117.16 109.96 2pt6 n TYR 159 Ca -0.06 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.51 2pt6 n TYR 159 Cb 0.22 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.22 2pt6 n TYR 159 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2pt6 n PHE 160 N -1.48 1.76 0.22 -0.72 3.72 -0.54 -4.94 117.46 115.48 2pt6 n PHE 160 Ca 0.03 -3.22 0.07 0.00 -0.05 0.00 0.00 57.45 54.28 2pt6 n PHE 160 Cb 0.30 -0.33 0.59 0.00 -0.94 0.00 0.00 39.48 39.09 2pt6 n PHE 160 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2pt6 h LYS 161 N 2.90 0.06 0.00 -1.08 1.57 -1.79 0.25 116.57 118.49 2pt6 h LYS 161 Ca 0.06 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2pt6 h LYS 161 Cb 1.00 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.30 2pt6 h LYS 161 CO 0.61 0.07 0.00 0.09 -0.57 0.00 0.00 179.45 179.65 2pt6 n ASN 162 N -4.50 0.38 -0.13 0.86 3.02 -1.26 -2.33 115.26 111.30 2pt6 n ASN 162 Ca -0.02 0.58 -0.21 0.00 -0.03 0.00 0.00 54.58 54.90 2pt6 n ASN 162 Cb 0.11 -0.66 -0.11 0.00 -0.61 0.00 0.00 39.78 38.51 2pt6 n ASN 162 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2pt6 n ILE 163 N -1.90 1.44 0.72 2.41 5.41 0.67 -4.63 119.36 123.48 2pt6 n ILE 163 Ca 0.04 -0.50 0.07 0.00 1.00 0.00 0.00 62.75 63.36 2pt6 n ILE 163 Cb 0.25 -1.52 0.21 0.00 -0.71 0.00 0.00 39.64 37.88 2pt6 n ILE 163 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2pt6 n SER 164 N -3.50 2.23 0.31 4.38 3.41 -0.03 -3.49 113.62 116.93 2pt6 n SER 164 Ca -0.47 -1.96 0.19 0.00 -0.26 0.00 0.00 58.87 56.37 2pt6 n SER 164 Cb 0.94 -0.26 1.01 0.00 -0.26 0.00 0.00 64.21 65.65 2pt6 n SER 164 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2pt6 h GLY 166 N 0.32 0.00 2.00 0.00 0.00 -1.85 -2.89 103.07 100.65 2pt6 h GLY 166 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2pt6 h GLY 166 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 176.54 175.57 2pt6 h TYR 167 N 0.00 0.00 0.00 5.60 0.05 -1.79 -0.92 116.97 119.90 2pt6 h TYR 167 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2pt6 h TYR 167 Cb 0.33 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.07 2pt6 h TYR 167 CO 0.00 0.00 0.00 0.93 -1.05 0.00 0.00 178.16 178.04 2pt6 h GLU 168 N 0.00 0.00 -6.72 4.88 4.39 -1.75 -3.46 114.58 111.91 2pt6 h GLU 168 Ca 0.00 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.17 2pt6 h GLU 168 Cb 0.11 0.00 0.05 0.00 -0.10 0.00 0.00 28.75 28.81 2pt6 h GLU 168 CO 0.00 0.00 0.74 0.34 -1.16 0.00 0.00 179.01 178.93 2pt6 s ASP 169 N -6.07 6.71 0.56 1.42 -1.08 -0.35 -4.90 116.67 112.96 2pt6 s ASP 169 Ca 0.06 2.60 0.34 0.00 -0.52 0.00 0.00 52.55 55.04 2pt6 s ASP 169 Cb 0.06 -2.62 1.52 0.00 -1.46 0.00 0.00 42.92 40.42 2pt6 s ASP 169 CO 0.65 -0.67 2.04 0.11 0.52 0.00 0.00 175.17 177.82 2pt6 h LYS 170 N 5.20 0.00 0.00 4.34 1.57 -1.89 -2.39 116.57 123.40 2pt6 h LYS 170 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 2pt6 h LYS 170 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 2pt6 h LYS 170 CO 0.78 0.03 0.00 0.54 -0.57 0.00 0.00 179.45 180.23 2pt6 n ARG 171 N -3.16 0.30 -3.32 3.15 1.74 -1.26 -4.84 116.66 109.27 2pt6 n ARG 171 Ca -0.00 0.05 -0.39 0.00 -0.77 0.00 0.00 57.85 56.74 2pt6 n ARG 171 Cb 0.27 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.14 2pt6 n ARG 171 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2pt6 s VAL 172 N -2.65 5.16 -0.14 1.55 1.01 -0.90 -0.57 120.40 123.86 2pt6 s VAL 172 Ca 0.22 0.85 0.02 0.00 0.00 0.00 0.00 61.98 63.06 2pt6 s VAL 172 Cb 0.17 -3.79 0.02 0.00 0.00 0.00 0.00 36.38 32.78 2pt6 s VAL 172 CO 0.40 0.23 -0.18 0.20 0.00 0.00 0.00 175.10 175.75 2pt6 s ASN 173 N 1.02 2.88 -0.20 3.32 -0.87 0.90 -4.98 114.94 117.01 2pt6 s ASN 173 Ca 0.22 -0.55 -0.08 0.00 -1.57 0.00 0.00 52.86 50.88 2pt6 s ASN 173 Cb -0.15 -1.32 -0.04 0.00 -0.02 0.00 0.00 41.25 39.72 2pt6 s ASN 173 CO 0.09 0.02 0.09 -0.69 -2.57 0.00 0.00 177.10 174.04 2pt6 s VAL 174 N 1.10 4.96 -0.14 1.60 1.01 -1.26 -1.01 120.40 126.65 2pt6 s VAL 174 Ca -0.02 0.03 0.02 0.00 0.00 0.00 0.00 61.98 62.02 2pt6 s VAL 174 Cb -0.14 -3.26 0.01 0.00 0.00 0.00 0.00 36.38 32.99 2pt6 s VAL 174 CO -0.06 0.43 -0.21 -0.36 0.00 0.00 0.00 175.10 174.90 2pt6 s PHE 175 N 0.56 2.59 -0.64 5.22 0.08 0.29 -4.98 117.98 121.09 2pt6 s PHE 175 Ca 0.05 -1.33 -0.17 0.00 0.12 0.00 0.00 56.93 55.60 2pt6 s PHE 175 Cb -0.12 -1.78 0.14 0.00 -0.57 0.00 0.00 43.02 40.69 2pt6 s PHE 175 CO 0.01 -0.62 0.67 0.42 -0.10 0.00 0.00 175.22 175.59 2pt6 s ILE 176 N 0.91 5.12 -0.05 0.64 -1.09 -1.26 -1.85 121.20 123.63 2pt6 s ILE 176 Ca -0.05 -1.53 -0.29 0.00 -2.23 0.00 0.00 60.65 56.55 2pt6 s ILE 176 Cb -0.15 -4.45 0.10 0.00 -1.58 0.00 0.00 42.46 36.38 2pt6 s ILE 176 CO -0.04 -1.03 0.86 -0.70 -1.23 0.00 0.00 174.94 172.80 2pt6 s GLU 177 N 1.76 0.84 0.02 2.79 2.12 -0.96 -4.94 118.70 120.32 2pt6 s GLU 177 Ca 0.11 -0.07 -0.30 0.00 0.36 0.00 0.00 54.97 55.07 2pt6 s GLU 177 Cb -0.22 0.39 -0.07 0.00 0.26 0.00 0.00 34.13 34.49 2pt6 s GLU 177 CO 0.01 -0.32 1.63 0.34 -0.54 0.00 0.00 175.26 176.38 2pt6 s ASP 178 N -1.82 6.66 0.65 -1.70 -1.08 -1.26 -3.11 116.67 115.00 2pt6 s ASP 178 Ca -0.01 2.35 0.42 0.00 -0.52 0.00 0.00 52.55 54.80 2pt6 s ASP 178 Cb -0.01 -2.55 2.24 0.00 -1.46 0.00 0.00 42.92 41.14 2pt6 s ASP 178 CO -0.02 -0.88 2.31 0.00 0.52 0.00 0.00 175.17 177.09 2pt6 h ALA 179 N 8.75 1.03 -0.19 3.66 0.00 -1.95 -1.21 119.26 129.35 2pt6 h ALA 179 Ca -0.41 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.40 2pt6 h ALA 179 Cb 1.19 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2pt6 h ALA 179 CO 0.93 0.00 -0.30 1.03 0.00 0.00 0.00 179.25 180.91 2pt6 h SER 180 N 0.00 0.39 0.31 0.00 0.87 -1.89 -1.66 113.55 111.55 2pt6 h SER 180 Ca -0.00 -0.14 -0.33 0.00 -1.23 0.00 0.00 61.79 60.09 2pt6 h SER 180 Cb 0.08 -0.11 0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2pt6 h SER 180 CO 0.00 0.68 -1.61 0.11 -0.53 0.00 0.00 176.83 175.48 2pt6 h LYS 181 N 0.33 0.37 -0.68 2.24 1.79 -1.65 -3.32 116.57 115.65 2pt6 h LYS 181 Ca 0.04 -0.64 0.09 0.00 -2.18 0.00 0.00 60.65 57.97 2pt6 h LYS 181 Cb 0.71 0.24 -0.07 0.00 -1.58 0.00 0.00 32.23 31.52 2pt6 h LYS 181 CO 0.05 1.27 0.32 0.35 -1.08 0.00 0.00 179.45 180.37 2pt6 h PHE 182 N 0.10 0.58 -0.00 -1.35 3.57 -1.20 -2.41 116.94 116.23 2pt6 h PHE 182 Ca -0.29 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.24 2pt6 h PHE 182 Cb 2.08 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 40.67 2pt6 h PHE 182 CO 0.09 0.20 -0.03 1.28 -2.23 0.00 0.00 178.31 177.63 2pt6 n LEU 183 N -4.89 0.06 -0.21 0.59 4.77 -0.63 -4.10 117.00 112.58 2pt6 n LEU 183 Ca 0.10 0.35 0.01 0.00 -0.03 0.00 0.00 56.01 56.44 2pt6 n LEU 183 Cb 0.27 -0.38 0.09 0.00 -2.33 0.00 0.00 43.42 41.07 2pt6 n LEU 183 CO 0.24 0.01 0.78 -0.33 -1.33 0.00 0.00 177.39 176.77 2pt6 h GLU 184 N 0.04 0.05 -1.13 3.23 5.08 -1.52 -2.76 114.58 117.56 2pt6 h GLU 184 Ca 0.00 -0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.78 2pt6 h GLU 184 Cb 0.40 -0.01 -0.42 0.00 0.50 0.00 0.00 28.75 29.22 2pt6 h GLU 184 CO 0.00 0.03 -0.68 0.09 -1.00 0.00 0.00 179.01 177.45 2pt6 n ASN 185 N -5.37 4.98 -4.22 1.42 3.02 -1.26 -4.96 115.26 108.87 2pt6 n ASN 185 Ca 0.09 -3.74 -0.33 0.00 -0.03 0.00 0.00 54.58 50.56 2pt6 n ASN 185 Cb 0.35 -0.43 -0.15 0.00 -0.61 0.00 0.00 39.78 38.94 2pt6 n ASN 185 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2pt6 s VAL 186 N -5.04 2.57 -0.02 2.41 1.01 -1.04 -5.11 120.40 115.17 2pt6 s VAL 186 Ca 0.50 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.72 2pt6 s VAL 186 Cb 0.41 -2.10 0.00 0.00 0.00 0.00 0.00 36.38 34.69 2pt6 s VAL 186 CO -0.08 0.51 -0.09 -0.89 0.00 0.00 0.00 175.10 174.55 2pt6 s THR 187 N 1.12 0.77 -1.44 3.92 2.01 -1.26 -3.32 115.64 117.44 2pt6 s THR 187 Ca 0.00 -0.36 -0.09 0.00 0.31 0.00 0.00 61.69 61.55 2pt6 s THR 187 Cb -0.14 -0.68 0.05 0.00 0.01 0.00 0.00 72.50 71.73 2pt6 s THR 187 CO -0.05 0.24 0.93 -3.20 -0.69 0.00 0.00 174.62 171.84 2pt6 n ASN 188 N 3.24 -3.87 -0.02 3.53 5.15 -0.32 -4.88 115.26 118.09 2pt6 n ASN 188 Ca -0.18 -0.76 -0.04 0.00 -0.60 0.00 0.00 54.58 53.00 2pt6 n ASN 188 Cb 0.55 -4.11 -0.02 0.00 -0.53 0.00 0.00 39.78 35.67 2pt6 n ASN 188 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 2pt6 n THR 189 N -4.59 0.26 -4.03 -0.44 -1.04 0.13 -4.69 114.28 99.87 2pt6 n THR 189 Ca -0.07 -0.08 -0.36 0.00 -2.04 0.00 0.00 64.05 61.50 2pt6 n THR 189 Cb 0.58 -1.19 -0.08 0.00 -1.82 0.00 0.00 70.33 67.81 2pt6 n THR 189 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 2pt6 s TYR 190 N -2.09 3.38 0.15 -1.42 2.02 -0.79 -4.78 117.35 113.82 2pt6 s TYR 190 Ca -0.06 0.31 -0.03 0.00 -0.37 0.00 0.00 57.07 56.91 2pt6 s TYR 190 Cb 0.02 -1.95 -0.04 0.00 -0.40 0.00 0.00 41.96 39.59 2pt6 s TYR 190 CO 0.09 0.48 1.35 -0.44 -1.57 0.00 0.00 175.55 175.47 2pt6 h ASP 191 N 5.60 0.52 -3.61 2.29 3.32 -1.47 0.61 116.42 123.67 2pt6 h ASP 191 Ca -0.48 -0.38 -0.28 0.00 0.02 0.00 0.00 57.03 55.91 2pt6 h ASP 191 Cb 1.20 -0.16 -0.32 0.00 0.22 0.00 0.00 39.33 40.28 2pt6 h ASP 191 CO 0.62 1.16 -0.73 -0.69 -1.72 0.00 0.00 179.24 177.88 2pt6 s VAL 192 N -3.41 -0.01 -0.08 -1.35 1.01 -1.24 -1.56 120.40 113.76 2pt6 s VAL 192 Ca -0.06 0.12 0.04 0.00 0.00 0.00 0.00 61.98 62.08 2pt6 s VAL 192 Cb 0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 36.38 36.39 2pt6 s VAL 192 CO 0.86 0.06 -0.21 -0.63 0.00 0.00 0.00 175.10 175.18 2pt6 s ILE 193 N 0.63 2.43 -0.22 2.22 1.01 -0.30 -1.66 121.20 125.32 2pt6 s ILE 193 Ca -0.05 -0.92 0.02 0.00 0.00 0.00 0.00 60.65 59.70 2pt6 s ILE 193 Cb -0.08 -1.93 0.04 0.00 0.01 0.00 0.00 42.46 40.50 2pt6 s ILE 193 CO -0.02 0.56 -0.16 -0.63 0.00 0.00 0.00 174.94 174.70 2pt6 s ILE 194 N -0.08 2.10 -0.77 2.92 1.01 0.56 -1.71 121.20 125.24 2pt6 s ILE 194 Ca -0.05 -1.26 -0.17 0.00 0.00 0.00 0.00 60.65 59.18 2pt6 s ILE 194 Cb -0.14 -2.05 0.16 0.00 0.01 0.00 0.00 42.46 40.44 2pt6 s ILE 194 CO 0.04 0.27 0.82 -0.69 0.00 0.00 0.00 174.94 175.39 2pt6 s VAL 195 N 1.21 5.15 -1.08 2.92 1.01 0.92 -0.76 120.40 129.77 2pt6 s VAL 195 Ca -0.01 -1.77 -0.07 0.00 0.00 0.00 0.00 61.98 60.12 2pt6 s VAL 195 Cb -0.16 -4.54 0.28 0.00 0.00 0.00 0.00 36.38 31.95 2pt6 s VAL 195 CO -0.09 -1.16 1.17 -0.67 0.00 0.00 0.00 175.10 174.34 2pt6 n ASP 196 N 5.36 5.58 -4.96 3.32 2.03 -0.11 -1.54 116.55 126.22 2pt6 n ASP 196 Ca 0.08 -3.15 -0.20 0.00 0.52 0.00 0.00 54.79 52.05 2pt6 n ASP 196 Cb 0.46 -1.31 -0.01 0.00 -0.72 0.00 0.00 41.12 39.54 2pt6 n ASP 196 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2pt6 s SER 197 N 0.34 5.92 1.01 1.67 1.04 -1.26 -1.59 113.70 120.84 2pt6 s SER 197 Ca 0.31 -0.19 -0.12 0.00 0.48 0.00 0.00 55.95 56.43 2pt6 s SER 197 Cb -0.06 -1.29 0.16 0.00 0.10 0.00 0.00 66.02 64.93 2pt6 s SER 197 CO -0.04 -0.36 0.90 -1.54 0.98 0.00 0.00 173.24 173.19 2pt6 n SER 198 N -1.56 -0.09 -4.78 7.02 3.41 -1.26 -4.93 113.62 111.44 2pt6 n SER 198 Ca -0.02 -1.30 -0.30 0.00 -0.26 0.00 0.00 58.87 56.99 2pt6 n SER 198 Cb 0.58 -0.70 0.09 0.00 -0.26 0.00 0.00 64.21 63.92 2pt6 n SER 198 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2pt6 s ASP 199 N -4.27 4.50 0.25 4.04 1.01 -1.26 -4.83 116.67 116.11 2pt6 s ASP 199 Ca 0.51 1.58 0.17 0.00 0.71 0.00 0.00 52.55 55.52 2pt6 s ASP 199 Cb -0.02 -2.33 0.91 0.00 1.01 0.00 0.00 42.92 42.49 2pt6 s ASP 199 CO 0.36 -2.00 1.51 -2.65 0.21 0.00 0.00 175.17 172.61 2pt6 n PRO 200 N -3.48 0.11 -3.41 8.23 -0.02 -1.26 -4.30 135.00 130.87 2pt6 n PRO 200 Ca 0.08 0.61 -0.40 0.00 -2.02 0.00 0.00 63.50 61.76 2pt6 n PRO 200 Cb 0.54 -1.85 -0.09 0.00 -0.02 0.00 0.00 33.50 32.08 2pt6 n PRO 200 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2pt6 s ILE 201 N -3.42 5.18 0.00 4.25 1.01 -1.26 -3.32 121.20 123.63 2pt6 s ILE 201 Ca -0.02 0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.87 2pt6 s ILE 201 Cb 0.05 -3.76 0.00 0.00 0.01 0.00 0.00 42.46 38.76 2pt6 s ILE 201 CO 0.15 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.71 2pt6 n GLY 202 N 4.87 -0.15 0.28 6.18 0.00 -1.26 -4.77 105.19 110.35 2pt6 n GLY 202 Ca -0.09 -2.23 0.19 0.00 0.00 0.00 0.00 46.02 43.89 2pt6 n GLY 202 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2pt6 h PRO 203 N 2.49 0.00 0.00 1.61 0.13 -1.87 -1.40 132.00 132.96 2pt6 h PRO 203 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2pt6 h PRO 203 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2pt6 h PRO 203 CO 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 177.77 2pt6 n ALA 204 N -1.99 2.59 -0.29 -0.56 0.00 -1.26 -3.77 120.51 115.24 2pt6 n ALA 204 Ca -0.02 -0.18 0.17 0.00 0.00 0.00 0.00 53.44 53.40 2pt6 n ALA 204 Cb 0.08 -1.49 0.44 0.00 0.00 0.00 0.00 19.45 18.48 2pt6 n ALA 204 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2pt6 h GLU 205 N 0.00 0.53 0.00 0.00 4.11 -1.25 -0.96 114.58 117.02 2pt6 h GLU 205 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.40 2pt6 h GLU 205 Cb 0.04 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.17 2pt6 h GLU 205 CO 0.00 0.35 0.00 0.25 0.07 0.00 0.00 179.01 179.68 2pt6 n THR 206 N -4.59 0.12 0.64 -1.06 -2.24 -1.25 -2.98 114.28 102.92 2pt6 n THR 206 Ca 0.21 0.03 0.08 0.00 -2.27 0.00 0.00 64.05 62.09 2pt6 n THR 206 Cb 0.65 -0.65 -0.10 0.00 -2.10 0.00 0.00 70.33 68.13 2pt6 n THR 206 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2pt6 n LEU 207 N -1.12 0.64 -3.26 3.22 4.77 -0.36 -4.63 117.00 116.26 2pt6 n LEU 207 Ca 0.15 -0.43 -0.37 0.00 -0.03 0.00 0.00 56.01 55.33 2pt6 n LEU 207 Cb 0.12 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.23 2pt6 n LEU 207 CO 0.15 0.16 1.13 0.49 -1.33 0.00 0.00 177.39 177.99 2pt6 n PHE 208 N -1.47 3.11 -3.86 -1.77 3.72 -1.16 -4.83 117.46 111.20 2pt6 n PHE 208 Ca 0.02 -2.81 -0.09 0.00 -0.05 0.00 0.00 57.45 54.51 2pt6 n PHE 208 Cb 0.27 -0.98 -0.05 0.00 -0.94 0.00 0.00 39.48 37.79 2pt6 n PHE 208 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2pt6 s ASN 209 N -1.85 -0.16 0.20 4.37 2.20 -1.26 -5.06 114.94 113.38 2pt6 s ASN 209 Ca 0.44 -0.68 -0.11 0.00 -0.94 0.00 0.00 52.86 51.58 2pt6 s ASN 209 Cb 0.28 0.57 0.13 0.00 -2.00 0.00 0.00 41.25 40.22 2pt6 s ASN 209 CO -0.20 -1.07 1.83 -0.61 -2.94 0.00 0.00 177.10 174.11 2pt6 h GLN 210 N 2.26 0.97 -0.77 3.55 5.75 -1.94 -2.88 115.11 122.04 2pt6 h GLN 210 Ca -0.28 -0.10 0.07 0.00 -0.15 0.00 0.00 58.65 58.20 2pt6 h GLN 210 Cb 1.25 -0.20 -0.06 0.00 1.07 0.00 0.00 27.48 29.54 2pt6 h GLN 210 CO 0.38 0.70 0.45 -0.97 -2.65 0.00 0.00 178.83 176.74 2pt6 h ASN 211 N 0.96 0.66 -0.76 -0.69 -1.24 -1.97 -1.85 115.58 110.69 2pt6 h ASN 211 Ca 0.25 0.03 -0.02 0.00 0.71 0.00 0.00 56.30 57.27 2pt6 h ASN 211 Cb -0.00 -0.10 -0.04 0.00 0.73 0.00 0.00 38.32 38.91 2pt6 h ASN 211 CO -0.04 0.41 0.39 0.15 -1.29 0.00 0.00 177.43 177.04 2pt6 h PHE 212 N 0.79 1.09 0.00 0.67 3.57 -1.77 -2.30 116.94 118.99 2pt6 h PHE 212 Ca 0.36 -0.04 -0.11 0.00 3.53 0.00 0.00 57.97 61.71 2pt6 h PHE 212 Cb 0.26 -0.34 -0.02 0.00 2.79 0.00 0.00 35.95 38.64 2pt6 h PHE 212 CO -0.06 0.78 -0.50 1.88 -2.23 0.00 0.00 178.31 178.17 2pt6 h TYR 213 N 1.09 0.00 -0.49 0.41 -1.99 -1.35 -0.68 116.97 113.96 2pt6 h TYR 213 Ca 0.27 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.95 2pt6 h TYR 213 Cb 0.08 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.79 2pt6 h TYR 213 CO 0.01 0.50 0.13 0.93 -0.00 0.00 0.00 178.16 179.74 2pt6 h GLU 214 N 0.00 0.78 -0.65 4.88 5.08 -0.93 -0.17 114.58 123.57 2pt6 h GLU 214 Ca -0.01 -0.18 -0.05 0.00 -1.00 0.00 0.00 59.36 58.12 2pt6 h GLU 214 Cb 0.92 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.04 2pt6 h GLU 214 CO 0.07 0.75 0.20 0.87 -1.00 0.00 0.00 179.01 179.89 2pt6 h LYS 215 N 0.67 1.01 -0.47 2.33 1.57 -0.96 -1.52 116.57 119.19 2pt6 h LYS 215 Ca 0.16 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2pt6 h LYS 215 Cb 0.31 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 2pt6 h LYS 215 CO -0.00 0.88 0.31 0.82 -0.57 0.00 0.00 179.45 180.90 2pt6 h ILE 216 N 0.94 1.12 -0.28 1.86 2.04 -1.03 -1.21 117.51 120.95 2pt6 h ILE 216 Ca 0.21 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.84 2pt6 h ILE 216 Cb 0.30 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 2pt6 h ILE 216 CO -0.01 0.12 0.17 0.22 0.00 0.00 0.00 178.15 178.65 2pt6 h TYR 217 N 0.64 0.37 -0.71 1.37 3.20 -0.77 -2.08 116.97 118.99 2pt6 h TYR 217 Ca 0.17 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.97 2pt6 h TYR 217 Cb -0.07 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.05 2pt6 h TYR 217 CO -0.04 0.28 0.17 -0.97 -1.64 0.00 0.00 178.16 175.96 2pt6 h ASN 218 N 0.35 1.08 0.52 -2.11 -0.73 -1.19 -3.02 115.58 110.47 2pt6 h ASN 218 Ca 0.10 -0.23 -0.06 0.00 1.87 0.00 0.00 56.30 57.98 2pt6 h ASN 218 Cb 0.02 -0.28 -0.01 0.00 0.27 0.00 0.00 38.32 38.32 2pt6 h ASN 218 CO -0.02 1.03 -0.30 0.00 -0.37 0.00 0.00 177.43 177.78 2pt6 h ALA 219 N 1.10 1.24 -2.39 1.57 0.00 -0.96 -0.84 119.26 118.98 2pt6 h ALA 219 Ca 0.22 -0.27 -0.48 0.00 0.00 0.00 0.00 54.91 54.38 2pt6 h ALA 219 Cb 0.37 -0.05 0.04 0.00 0.00 0.00 0.00 17.79 18.16 2pt6 h ALA 219 CO 0.00 0.37 0.39 -0.51 0.00 0.00 0.00 179.25 179.51 2pt6 s LEU 220 N -7.58 3.74 1.01 0.00 1.43 -0.80 -0.69 118.68 115.79 2pt6 s LEU 220 Ca -0.02 1.95 -0.12 0.00 -1.03 0.00 0.00 54.13 54.91 2pt6 s LEU 220 Cb 0.13 -4.56 0.20 0.00 0.03 0.00 0.00 46.19 41.99 2pt6 s LEU 220 CO 0.67 -0.97 1.08 -0.54 0.23 0.00 0.00 176.35 176.82 2pt6 s LYS 221 N -3.45 0.29 0.54 1.70 1.02 0.21 -3.89 119.74 116.16 2pt6 s LYS 221 Ca 0.67 0.70 0.22 0.00 0.02 0.00 0.00 55.97 57.58 2pt6 s LYS 221 Cb -0.18 -1.71 1.46 0.00 -0.52 0.00 0.00 37.83 36.88 2pt6 s LYS 221 CO 0.26 -2.87 2.17 -1.35 -0.92 0.00 0.00 175.35 172.63 2pt6 h PRO 222 N -2.00 0.00 -0.43 -1.68 0.11 -1.94 -1.05 132.00 125.02 2pt6 h PRO 222 Ca -0.55 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.36 2pt6 h PRO 222 Cb 1.32 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.31 2pt6 h PRO 222 CO 0.54 0.03 0.02 0.09 -0.21 0.00 0.00 178.00 178.47 2pt6 n ASN 223 N -4.20 2.80 -4.78 -2.05 3.02 -1.26 -4.69 115.26 104.09 2pt6 n ASN 223 Ca -0.03 -3.68 -0.29 0.00 -0.03 0.00 0.00 54.58 50.55 2pt6 n ASN 223 Cb 0.11 -0.65 0.12 0.00 -0.61 0.00 0.00 39.78 38.75 2pt6 n ASN 223 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2pt6 s GLY 224 N -2.31 1.60 0.03 7.41 0.00 -0.40 -4.83 107.32 108.82 2pt6 s GLY 224 Ca 0.46 -0.35 0.04 0.00 0.00 0.00 0.00 44.72 44.87 2pt6 s GLY 224 CO 0.02 0.15 -0.12 -0.19 0.00 0.00 0.00 173.10 172.97 2pt6 s TYR 225 N -3.18 1.02 -0.02 1.90 2.02 -0.60 -3.14 117.35 115.34 2pt6 s TYR 225 Ca 0.63 -0.34 0.04 0.00 -0.37 0.00 0.00 57.07 57.03 2pt6 s TYR 225 Cb -0.15 -0.61 -0.01 0.00 -0.40 0.00 0.00 41.96 40.79 2pt6 s TYR 225 CO 0.54 0.01 -0.15 0.00 -1.57 0.00 0.00 175.55 174.38 2pt6 s VAL 227 N -0.17 1.68 -0.05 0.00 -7.23 -0.69 -0.16 120.40 113.78 2pt6 s VAL 227 Ca 0.02 -1.40 -0.05 0.00 -1.81 0.00 0.00 61.98 58.74 2pt6 s VAL 227 Cb -0.08 -1.50 0.01 0.00 0.56 0.00 0.00 36.38 35.37 2pt6 s VAL 227 CO 0.00 0.04 0.14 0.00 -0.31 0.00 0.00 175.10 174.97 2pt6 s ALA 228 N -1.02 -0.35 0.23 1.32 0.00 -0.45 -0.05 121.76 121.44 2pt6 s ALA 228 Ca 0.07 0.37 -0.32 0.00 0.00 0.00 0.00 51.96 52.08 2pt6 s ALA 228 Cb -0.09 -0.22 -0.13 0.00 0.00 0.00 0.00 23.12 22.68 2pt6 s ALA 228 CO 0.03 -0.07 1.54 0.94 0.00 0.00 0.00 175.76 178.19 2pt6 n GLN 229 N 2.92 2.31 -2.72 0.00 0.00 -0.59 -0.26 117.38 119.04 2pt6 n GLN 229 Ca -0.13 0.82 -0.05 0.00 -0.00 0.00 0.00 57.00 57.65 2pt6 n GLN 229 Cb 0.59 -2.56 0.07 0.00 0.00 0.00 0.00 30.24 28.33 2pt6 n GLN 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2pt6 n GLU 231 N -0.55 -1.03 -3.75 0.00 -0.58 -1.26 -4.16 120.64 109.30 2pt6 n GLU 231 Ca 0.02 0.68 -0.35 0.00 -0.42 0.00 0.00 57.16 57.09 2pt6 n GLU 231 Cb 0.83 -1.26 -0.09 0.00 -0.57 0.00 0.00 31.44 30.35 2pt6 n GLU 231 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2pt6 s SER 232 N -4.81 6.11 0.16 1.62 0.15 -1.26 0.06 113.70 115.73 2pt6 s SER 232 Ca 0.00 0.18 0.18 0.00 0.70 0.00 0.00 55.95 57.01 2pt6 s SER 232 Cb 0.00 -2.08 0.79 0.00 -1.71 0.00 0.00 66.02 63.02 2pt6 s SER 232 CO 0.00 0.15 1.54 0.00 1.20 0.00 0.00 173.24 176.14 2pt6 n LEU 233 N 3.70 0.38 0.19 3.45 -0.00 -1.26 -0.94 117.00 122.51 2pt6 n LEU 233 Ca -0.16 0.61 0.12 0.00 -0.00 0.00 0.00 56.01 56.59 2pt6 n LEU 233 Cb 0.52 -0.59 0.15 0.00 -0.00 0.00 0.00 43.42 43.50 2pt6 n LEU 233 CO 0.36 -0.53 0.66 -0.50 -0.00 0.00 0.00 177.39 177.39 2pt6 h TRP 234 N 0.00 0.00 0.00 1.47 4.06 -1.94 -3.41 115.95 116.13 2pt6 h TRP 234 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2pt6 h TRP 234 Cb 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.38 2pt6 h TRP 234 CO 0.00 0.00 -0.07 0.44 -3.56 0.00 0.00 178.44 175.25 2pt6 n ILE 235 N -2.97 0.00 -1.60 1.49 -5.35 -1.03 -4.91 119.36 104.98 2pt6 n ILE 235 Ca 0.03 -0.01 -0.15 0.00 -0.27 0.00 0.00 62.75 62.34 2pt6 n ILE 235 Cb 0.53 0.33 0.13 0.00 -1.74 0.00 0.00 39.64 38.89 2pt6 n ILE 235 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 2pt6 n HIS 236 N -0.13 1.95 -0.16 4.28 8.25 -0.12 -4.76 115.22 124.53 2pt6 n HIS 236 Ca 0.00 -2.03 -0.01 0.00 -0.26 0.00 0.00 57.72 55.41 2pt6 n HIS 236 Cb 0.00 -0.62 0.22 0.00 1.12 0.00 0.00 29.99 30.71 2pt6 n HIS 236 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2pt6 h VAL 237 N 1.33 1.21 -0.33 1.59 2.07 -1.80 -1.29 116.25 119.03 2pt6 h VAL 237 Ca 0.34 -0.63 0.06 0.00 0.82 0.00 0.00 66.70 67.29 2pt6 h VAL 237 Cb 1.50 0.46 -0.06 0.00 -1.52 0.00 0.00 31.29 31.68 2pt6 h VAL 237 CO 0.71 0.26 -0.04 1.23 0.02 0.00 0.00 177.57 179.75 2pt6 h GLY 238 N 0.97 0.29 0.96 2.17 0.00 -1.97 -0.36 103.07 105.13 2pt6 h GLY 238 Ca 0.21 0.07 -0.02 0.00 0.00 0.00 0.00 47.33 47.59 2pt6 h GLY 238 CO -0.02 -0.10 0.20 -0.84 0.00 0.00 0.00 176.54 175.77 2pt6 h THR 239 N 0.05 1.19 -0.39 4.70 2.02 -1.81 -1.97 112.91 116.70 2pt6 h THR 239 Ca 0.16 -0.56 0.05 0.00 0.77 0.00 0.00 66.41 66.83 2pt6 h THR 239 Cb 0.23 0.75 -0.05 0.00 -1.74 0.00 0.00 68.15 67.34 2pt6 h THR 239 CO -0.30 0.21 0.11 0.40 0.37 0.00 0.00 175.52 176.31 2pt6 h ILE 240 N 0.57 0.85 -0.74 3.11 2.04 -1.00 -0.62 117.51 121.72 2pt6 h ILE 240 Ca 0.15 -0.09 -0.03 0.00 1.00 0.00 0.00 64.86 65.89 2pt6 h ILE 240 Cb 0.15 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 2pt6 h ILE 240 CO -0.02 0.05 0.34 0.11 0.00 0.00 0.00 178.15 178.63 2pt6 h LYS 241 N 0.26 1.08 -0.33 2.37 1.57 -0.92 -0.46 116.57 120.14 2pt6 h LYS 241 Ca 0.18 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 2pt6 h LYS 241 Cb 0.18 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 2pt6 h LYS 241 CO -0.21 0.85 0.14 -0.91 -0.57 0.00 0.00 179.45 178.75 2pt6 h ASN 242 N 1.05 0.45 -0.31 0.86 2.35 -0.93 -0.71 115.58 118.33 2pt6 h ASN 242 Ca 0.25 -0.15 -0.08 0.00 -0.55 0.00 0.00 56.30 55.76 2pt6 h ASN 242 Cb 0.14 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 2pt6 h ASN 242 CO -0.03 0.48 -0.13 0.24 -1.65 0.00 0.00 177.43 176.34 2pt6 h MET 243 N 0.39 0.65 -0.74 0.81 2.86 -0.86 -1.27 114.93 116.77 2pt6 h MET 243 Ca 0.11 -0.27 0.04 0.00 -2.06 0.00 0.00 59.70 57.52 2pt6 h MET 243 Cb 0.17 -0.02 -0.05 0.00 0.06 0.00 0.00 31.60 31.75 2pt6 h MET 243 CO -0.01 0.86 0.46 0.82 1.06 0.00 0.00 176.91 180.09 2pt6 h ILE 244 N 0.41 1.07 -0.37 -1.22 2.04 -1.06 -2.09 117.51 116.29 2pt6 h ILE 244 Ca 0.07 -0.30 0.04 0.00 1.00 0.00 0.00 64.86 65.67 2pt6 h ILE 244 Cb 0.65 0.12 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 2pt6 h ILE 244 CO 0.04 0.16 0.13 1.23 0.00 0.00 0.00 178.15 179.71 2pt6 h GLY 245 N 0.87 0.47 1.00 5.37 0.00 -0.82 0.04 103.07 110.01 2pt6 h GLY 245 Ca 0.31 -0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.56 2pt6 h GLY 245 CO -0.13 0.03 0.44 -0.97 0.00 0.00 0.00 176.54 175.92 2pt6 h TYR 246 N 0.29 0.93 -0.12 5.60 0.05 -1.03 -2.95 116.97 119.74 2pt6 h TYR 246 Ca 0.17 0.00 -0.16 0.00 0.05 0.00 0.00 58.73 58.79 2pt6 h TYR 246 Cb 0.14 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 37.56 2pt6 h TYR 246 CO -0.14 0.62 -0.61 0.00 -1.05 0.00 0.00 178.16 176.98 2pt6 h ALA 247 N 1.24 0.73 0.00 3.88 0.00 -1.12 -3.22 119.26 120.78 2pt6 h ALA 247 Ca 0.26 -0.54 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 2pt6 h ALA 247 Cb -0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2pt6 h ALA 247 CO -0.05 0.72 -0.20 0.87 0.00 0.00 0.00 179.25 180.59 2pt6 h LYS 248 N 0.30 0.00 0.00 0.00 1.57 -0.82 0.79 116.57 118.41 2pt6 h LYS 248 Ca -0.01 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2pt6 h LYS 248 Cb 1.14 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.45 2pt6 h LYS 248 CO 0.10 0.20 -0.09 0.87 -0.57 0.00 0.00 179.45 179.96 2pt6 h LYS 249 N 0.00 0.00 0.00 3.15 1.79 -1.53 -3.38 116.57 116.60 2pt6 h LYS 249 Ca -0.00 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.30 2pt6 h LYS 249 Cb 0.42 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.05 2pt6 h LYS 249 CO 0.03 0.09 -1.46 1.28 -1.08 0.00 0.00 179.45 178.31 2pt6 n LEU 250 N -3.66 0.99 -4.84 2.94 4.77 -0.66 -5.06 117.00 111.49 2pt6 n LEU 250 Ca -0.02 0.17 -0.37 0.00 -0.03 0.00 0.00 56.01 55.76 2pt6 n LEU 250 Cb 0.21 -0.40 -0.06 0.00 -2.33 0.00 0.00 43.42 40.84 2pt6 n LEU 250 CO 0.29 0.10 0.20 -0.36 -1.33 0.00 0.00 177.39 176.30 2pt6 s PHE 251 N -2.26 3.68 0.37 -1.77 0.08 0.18 -5.00 117.98 113.26 2pt6 s PHE 251 Ca -0.17 1.07 0.05 0.00 0.12 0.00 0.00 56.93 58.01 2pt6 s PHE 251 Cb 0.06 -2.36 0.72 0.00 -0.57 0.00 0.00 43.02 40.87 2pt6 s PHE 251 CO 0.21 0.52 1.97 0.87 -0.10 0.00 0.00 175.22 178.69 2pt6 h LYS 252 N 4.03 0.56 -3.79 0.44 1.57 -1.68 -3.43 116.57 114.27 2pt6 h LYS 252 Ca -0.49 -0.07 -0.40 0.00 -1.87 0.00 0.00 60.65 57.81 2pt6 h LYS 252 Cb 1.20 -0.11 -0.36 0.00 0.08 0.00 0.00 32.23 33.05 2pt6 h LYS 252 CO 0.64 0.47 -0.76 0.21 -0.57 0.00 0.00 179.45 179.44 2pt6 s LYS 253 N -5.28 0.57 -0.08 3.15 2.47 -0.86 -4.94 119.74 114.77 2pt6 s LYS 253 Ca -0.08 0.05 -0.00 0.00 -1.56 0.00 0.00 55.97 54.37 2pt6 s LYS 253 Cb 0.17 -0.78 0.02 0.00 -1.46 0.00 0.00 37.83 35.78 2pt6 s LYS 253 CO 0.75 -0.19 -0.04 0.08 0.16 0.00 0.00 175.35 176.11 2pt6 s VAL 254 N 1.40 0.64 0.24 4.02 1.01 -1.26 -0.54 120.40 125.91 2pt6 s VAL 254 Ca -0.04 -0.08 0.02 0.00 0.00 0.00 0.00 61.98 61.89 2pt6 s VAL 254 Cb -0.13 -0.71 -0.05 0.00 0.00 0.00 0.00 36.38 35.48 2pt6 s VAL 254 CO -0.03 0.29 0.05 -1.61 0.00 0.00 0.00 175.10 173.81 2pt6 s GLU 255 N 1.62 1.35 -0.02 2.72 2.02 0.23 -4.98 118.70 121.65 2pt6 s GLU 255 Ca 0.01 -1.71 0.00 0.00 0.02 0.00 0.00 54.97 53.29 2pt6 s GLU 255 Cb -0.13 -0.38 0.03 0.00 0.10 0.00 0.00 34.13 33.75 2pt6 s GLU 255 CO -0.05 -0.21 0.02 -0.47 0.02 0.00 0.00 175.26 174.57 2pt6 s TYR 256 N -3.63 0.06 0.06 1.61 5.04 -1.26 -0.25 117.35 118.97 2pt6 s TYR 256 Ca 0.33 0.10 0.07 0.00 -2.44 0.00 0.00 57.07 55.13 2pt6 s TYR 256 Cb 0.07 -0.24 -0.03 0.00 0.35 0.00 0.00 41.96 42.12 2pt6 s TYR 256 CO 0.11 -0.08 -0.19 0.00 -1.34 0.00 0.00 175.55 174.04 2pt6 s ALA 257 N 0.96 1.63 -0.01 3.97 0.00 -0.71 -4.54 121.76 123.05 2pt6 s ALA 257 Ca -0.08 -1.06 0.02 0.00 0.00 0.00 0.00 51.96 50.84 2pt6 s ALA 257 Cb -0.12 -0.28 -0.03 0.00 0.00 0.00 0.00 23.12 22.69 2pt6 s ALA 257 CO -0.03 0.34 -0.03 1.21 0.00 0.00 0.00 175.76 177.26 2pt6 s ASN 258 N -1.36 4.93 -0.07 0.00 2.47 -0.25 0.20 114.94 120.86 2pt6 s ASN 258 Ca 0.06 -0.04 0.04 0.00 0.42 0.00 0.00 52.86 53.34 2pt6 s ASN 258 Cb -0.09 -1.25 0.00 0.00 -1.45 0.00 0.00 41.25 38.46 2pt6 s ASN 258 CO 0.02 0.30 -0.19 -0.63 -3.72 0.00 0.00 177.10 172.87 2pt6 s ILE 259 N -1.02 1.67 -0.29 -5.21 1.01 -0.35 -4.71 121.20 112.29 2pt6 s ILE 259 Ca 0.18 -0.81 -0.25 0.00 0.00 0.00 0.00 60.65 59.76 2pt6 s ILE 259 Cb -0.11 -1.45 0.00 0.00 0.01 0.00 0.00 42.46 40.91 2pt6 s ILE 259 CO 0.08 0.47 0.88 -0.55 0.00 0.00 0.00 174.94 175.82 2pt6 s SER 260 N 0.27 6.79 -0.24 3.58 0.15 -1.26 -1.97 113.70 121.01 2pt6 s SER 260 Ca -0.12 0.87 -0.03 0.00 0.70 0.00 0.00 55.95 57.37 2pt6 s SER 260 Cb -0.15 -2.45 0.13 0.00 -1.71 0.00 0.00 66.02 61.84 2pt6 s SER 260 CO 0.05 -0.66 0.40 -0.51 1.20 0.00 0.00 173.24 173.73 2pt6 s ILE 261 N 3.10 -0.65 -0.14 6.45 2.07 -0.43 -4.85 121.20 126.75 2pt6 s ILE 261 Ca 0.37 -0.02 0.29 0.00 -1.41 0.00 0.00 60.65 59.87 2pt6 s ILE 261 Cb -0.14 -0.80 0.31 0.00 0.13 0.00 0.00 42.46 41.96 2pt6 s ILE 261 CO 0.12 -0.07 1.86 1.55 -1.91 0.00 0.00 174.94 176.48 2pt6 h PRO 262 N 8.17 0.00 -0.68 3.50 0.13 -1.94 -3.03 132.00 138.15 2pt6 h PRO 262 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 2pt6 h PRO 262 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2pt6 h PRO 262 CO 0.24 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.26 2pt6 n THR 263 N -2.61 0.97 -4.10 1.56 -2.24 -1.26 -4.54 114.28 102.06 2pt6 n THR 263 Ca 0.01 -0.98 -0.32 0.00 -2.27 0.00 0.00 64.05 60.49 2pt6 n THR 263 Cb 0.22 0.53 -0.07 0.00 -2.10 0.00 0.00 70.33 68.91 2pt6 n THR 263 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2pt6 s TYR 264 N -1.03 3.21 0.16 4.78 2.02 -1.15 -4.84 117.35 120.51 2pt6 s TYR 264 Ca 0.46 0.13 -0.34 0.00 -0.37 0.00 0.00 57.07 56.95 2pt6 s TYR 264 Cb 0.24 -1.67 -0.15 0.00 -0.40 0.00 0.00 41.96 39.98 2pt6 s TYR 264 CO 0.32 0.53 1.42 -2.30 -1.57 0.00 0.00 175.55 173.94 2pt6 n PRO 265 N 0.84 1.72 -0.91 -1.71 -0.02 -1.26 -0.13 135.00 133.53 2pt6 n PRO 265 Ca -0.11 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 2pt6 n PRO 265 Cb 0.52 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 2pt6 n PRO 265 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2pt6 n GLY 267 N -2.01 0.58 3.33 0.00 0.00 0.82 -5.00 105.19 102.91 2pt6 n GLY 267 Ca 0.00 -0.42 -0.11 0.00 0.00 0.00 0.00 46.02 45.49 2pt6 n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pt6 s ILE 269 N -3.66 0.07 0.30 0.00 2.07 -0.83 -4.44 121.20 114.71 2pt6 s ILE 269 Ca 0.02 -0.58 0.07 0.00 -1.41 0.00 0.00 60.65 58.75 2pt6 s ILE 269 Cb 0.01 -0.49 -0.03 0.00 0.13 0.00 0.00 42.46 42.09 2pt6 s ILE 269 CO -0.11 -0.32 0.31 -0.83 -1.91 0.00 0.00 174.94 172.08 2pt6 s GLY 270 N -1.28 1.58 -0.18 1.50 0.00 0.11 -1.21 107.32 107.83 2pt6 s GLY 270 Ca -0.13 -1.50 0.01 0.00 0.00 0.00 0.00 44.72 43.09 2pt6 s GLY 270 CO 0.02 -1.47 -0.20 -0.42 0.00 0.00 0.00 173.10 171.04 2pt6 s ILE 271 N -2.20 2.06 -0.13 0.90 1.01 0.13 -0.80 121.20 122.18 2pt6 s ILE 271 Ca 0.39 -0.94 -0.29 0.00 0.00 0.00 0.00 60.65 59.80 2pt6 s ILE 271 Cb -0.07 -1.86 -0.01 0.00 0.01 0.00 0.00 42.46 40.52 2pt6 s ILE 271 CO 0.27 0.54 1.08 -0.22 0.00 0.00 0.00 174.94 176.61 2pt6 s LEU 272 N 1.29 4.21 -0.23 2.97 2.96 0.64 -1.74 118.68 128.79 2pt6 s LEU 272 Ca 0.05 1.57 0.00 0.00 -0.22 0.00 0.00 54.13 55.53 2pt6 s LEU 272 Cb -0.13 -3.55 0.03 0.00 0.50 0.00 0.00 46.19 43.04 2pt6 s LEU 272 CO -0.13 -0.55 -0.11 0.00 -1.32 0.00 0.00 176.35 174.23 2pt6 s SER 275 N 0.71 2.38 0.28 0.00 0.01 0.30 -1.45 113.70 115.93 2pt6 s SER 275 Ca -0.08 -0.37 0.18 0.00 1.31 0.00 0.00 55.95 56.99 2pt6 s SER 275 Cb -0.16 -0.39 0.10 0.00 0.21 0.00 0.00 66.02 65.78 2pt6 s SER 275 CO 0.01 0.23 1.37 0.11 0.41 0.00 0.00 173.24 175.37 2pt6 h LYS 276 N 5.81 0.00 -7.32 12.44 1.57 -1.83 -2.22 116.57 125.02 2pt6 h LYS 276 Ca -0.37 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 57.96 2pt6 h LYS 276 Cb 1.15 0.00 0.09 0.00 0.08 0.00 0.00 32.23 33.55 2pt6 h LYS 276 CO 0.48 0.32 0.23 0.95 -0.57 0.00 0.00 179.45 180.85 2pt6 s THR 277 N -3.04 2.23 -0.11 -0.16 -4.23 -1.26 -4.29 115.64 104.78 2pt6 s THR 277 Ca 0.03 -0.30 0.20 0.00 -1.18 0.00 0.00 61.69 60.45 2pt6 s THR 277 Cb 0.07 -2.93 0.19 0.00 1.34 0.00 0.00 72.50 71.17 2pt6 s THR 277 CO 0.74 0.00 1.62 0.44 -0.54 0.00 0.00 174.62 176.88 2pt6 h ASP 278 N -0.70 0.00 1.28 3.99 5.19 -1.92 -3.35 116.42 120.91 2pt6 h ASP 278 Ca -0.43 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 55.83 2pt6 h ASP 278 Cb 1.30 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.79 2pt6 h ASP 278 CO 0.54 0.29 -0.71 0.71 -3.12 0.00 0.00 179.24 176.95 2pt6 h THR 279 N 0.00 1.23 -0.32 0.35 1.35 -1.95 -3.46 112.91 110.11 2pt6 h THR 279 Ca -0.00 -2.73 0.00 0.00 -0.55 0.00 0.00 66.41 63.12 2pt6 h THR 279 Cb 1.07 2.60 0.00 0.00 -1.73 0.00 0.00 68.15 70.09 2pt6 h THR 279 CO 0.04 0.70 0.00 0.61 -0.25 0.00 0.00 175.52 176.62 2pt6 n GLY 280 N 1.27 -1.16 0.00 5.82 0.00 -1.26 -4.65 105.19 105.21 2pt6 n GLY 280 Ca 0.01 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.80 2pt6 n GLY 280 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2pt6 n LEU 281 N 0.00 1.38 0.05 0.99 4.77 -1.26 -4.72 117.00 118.21 2pt6 n LEU 281 Ca 0.00 -1.38 0.13 0.00 -0.03 0.00 0.00 56.01 54.73 2pt6 n LEU 281 Cb 0.00 0.00 0.35 0.00 -2.33 0.00 0.00 43.42 41.44 2pt6 n LEU 281 CO 0.00 0.35 0.66 0.35 -1.33 0.00 0.00 177.39 177.42 2pt6 n THR 282 N -0.26 0.28 -3.95 -5.08 -2.24 -1.26 -4.72 114.28 97.05 2pt6 n THR 282 Ca 0.00 -0.17 -0.30 0.00 -2.27 0.00 0.00 64.05 61.31 2pt6 n THR 282 Cb 0.18 -0.28 -0.16 0.00 -2.10 0.00 0.00 70.33 67.98 2pt6 n THR 282 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2pt6 s LYS 283 N -3.08 1.69 0.55 -0.78 1.02 -1.26 -3.94 119.74 113.94 2pt6 s LYS 283 Ca 0.10 -0.93 -0.21 0.00 0.02 0.00 0.00 55.97 54.95 2pt6 s LYS 283 Cb 0.15 -2.52 -0.04 0.00 -0.52 0.00 0.00 37.83 34.89 2pt6 s LYS 283 CO 0.64 -0.56 1.31 -1.25 -0.92 0.00 0.00 175.35 174.57 2pt6 s PRO 284 N 1.41 3.12 0.00 -1.68 0.04 -1.26 -4.75 135.00 131.88 2pt6 s PRO 284 Ca -0.05 2.11 0.19 0.00 0.04 0.00 0.00 61.00 63.28 2pt6 s PRO 284 Cb -0.18 -2.18 0.28 0.00 0.04 0.00 0.00 34.50 32.46 2pt6 s PRO 284 CO -0.07 -1.17 1.22 0.09 0.04 0.00 0.00 177.00 177.12 2pt6 n ASN 285 N -1.14 2.94 -3.83 6.66 5.03 0.15 -4.94 115.26 120.12 2pt6 n ASN 285 Ca 0.11 -1.86 -0.09 0.00 0.87 0.00 0.00 54.58 53.61 2pt6 n ASN 285 Cb 0.46 -0.14 -0.04 0.00 -1.02 0.00 0.00 39.78 39.04 2pt6 n ASN 285 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.26 173.84 2pt6 s LYS 286 N -1.36 1.43 0.10 3.52 -2.85 -1.14 -5.02 119.74 114.42 2pt6 s LYS 286 Ca 0.28 -1.00 0.10 0.00 -1.00 0.00 0.00 55.97 54.35 2pt6 s LYS 286 Cb 0.17 0.50 -0.04 0.00 -2.06 0.00 0.00 37.83 36.41 2pt6 s LYS 286 CO 0.25 -0.60 -0.25 0.15 0.10 0.00 0.00 175.35 175.00 2pt6 s LYS 287 N -3.92 1.37 -0.97 1.78 1.02 -1.26 -4.94 119.74 112.82 2pt6 s LYS 287 Ca 0.13 -1.23 -0.11 0.00 0.02 0.00 0.00 55.97 54.77 2pt6 s LYS 287 Cb -0.01 -1.73 0.25 0.00 -0.52 0.00 0.00 37.83 35.82 2pt6 s LYS 287 CO 0.01 0.42 0.93 -0.51 -0.92 0.00 0.00 175.35 175.28 2pt6 s LEU 288 N -1.84 6.55 -0.00 3.17 1.43 -1.26 -4.75 118.68 121.97 2pt6 s LEU 288 Ca 0.11 -3.14 0.01 0.00 -1.03 0.00 0.00 54.13 50.07 2pt6 s LEU 288 Cb -0.10 -2.21 -0.01 0.00 0.03 0.00 0.00 46.19 43.91 2pt6 s LEU 288 CO 0.05 -0.43 0.02 -0.62 0.23 0.00 0.00 176.35 175.59 2pt6 n GLU 289 N 3.33 0.78 -1.25 1.70 1.02 -1.26 -4.82 120.64 120.15 2pt6 n GLU 289 Ca 0.19 -0.01 -0.29 0.00 -0.02 0.00 0.00 57.16 57.03 2pt6 n GLU 289 Cb 0.43 -0.96 0.16 0.00 -0.02 0.00 0.00 31.44 31.05 2pt6 n GLU 289 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2pt6 s SER 290 N -1.96 3.01 0.39 1.62 1.04 -1.26 -4.82 113.70 111.72 2pt6 s SER 290 Ca -0.00 1.22 0.13 0.00 0.48 0.00 0.00 55.95 57.79 2pt6 s SER 290 Cb 0.00 -1.88 0.96 0.00 0.10 0.00 0.00 66.02 65.21 2pt6 s SER 290 CO 0.03 -2.89 1.87 0.50 0.98 0.00 0.00 173.24 173.72 2pt6 h LYS 291 N -1.73 0.51 0.00 4.02 3.64 -2.00 -1.58 116.57 119.43 2pt6 h LYS 291 Ca -0.53 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 58.82 2pt6 h LYS 291 Cb 1.32 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 33.02 2pt6 h LYS 291 CO 0.58 0.34 -0.01 0.93 -2.27 0.00 0.00 179.45 179.02 2pt6 h GLU 292 N 0.53 0.00 -0.26 1.90 3.07 -1.91 -2.71 114.58 115.20 2pt6 h GLU 292 Ca 0.44 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.30 2pt6 h GLU 292 Cb 0.92 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.83 2pt6 h GLU 292 CO -0.18 0.01 0.00 1.19 -1.40 0.00 0.00 179.01 178.63 2pt6 n PHE 293 N -3.68 0.34 0.08 4.33 3.72 -0.60 -4.60 117.46 117.04 2pt6 n PHE 293 Ca -0.03 -0.41 0.19 0.00 -0.05 0.00 0.00 57.45 57.15 2pt6 n PHE 293 Cb 0.09 -0.02 0.74 0.00 -0.94 0.00 0.00 39.48 39.35 2pt6 n PHE 293 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2pt6 h ALA 294 N 1.85 2.23 -0.20 4.37 0.00 -1.41 -2.31 119.26 123.79 2pt6 h ALA 294 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2pt6 h ALA 294 Cb 0.66 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2pt6 h ALA 294 CO 0.00 -0.55 0.00 -0.40 0.00 0.00 0.00 179.25 178.30 2pt6 n ASP 295 N -4.08 1.45 -4.72 0.00 5.75 -1.26 -4.95 116.55 108.74 2pt6 n ASP 295 Ca 0.07 -1.80 -0.42 0.00 -0.01 0.00 0.00 54.79 52.63 2pt6 n ASP 295 Cb 0.53 -0.13 -0.03 0.00 -1.03 0.00 0.00 41.12 40.46 2pt6 n ASP 295 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2pt6 s LEU 296 N -1.33 4.38 0.00 -2.12 1.43 -0.87 -4.92 118.68 115.24 2pt6 s LEU 296 Ca 0.27 2.55 0.07 0.00 -1.03 0.00 0.00 54.13 55.99 2pt6 s LEU 296 Cb 0.14 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.73 2pt6 s LEU 296 CO 0.20 -0.74 0.42 0.29 0.23 0.00 0.00 176.35 176.76 2pt6 n LYS 297 N 3.49 3.32 0.06 1.70 5.02 -1.26 -4.89 118.16 125.60 2pt6 n LYS 297 Ca 0.11 -0.30 0.00 0.00 -2.02 0.00 0.00 58.31 56.10 2pt6 n LYS 297 Cb 0.40 -0.92 0.00 0.00 -0.02 0.00 0.00 35.03 34.49 2pt6 n LYS 297 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 2pt6 n TYR 298 N -0.66 -0.94 -1.69 2.13 9.36 -1.26 -5.00 117.16 119.10 2pt6 n TYR 298 Ca 0.02 0.17 -0.44 0.00 3.32 0.00 0.00 57.90 60.97 2pt6 n TYR 298 Cb 0.13 0.37 -0.03 0.00 -0.63 0.00 0.00 39.34 39.18 2pt6 n TYR 298 CO 0.00 0.00 0.00 0.98 0.22 0.00 0.00 176.86 178.06 2pt6 n TYR 299 N -3.03 2.32 -4.07 2.98 9.36 -1.26 -4.96 117.16 118.50 2pt6 n TYR 299 Ca 0.00 0.37 -0.11 0.00 3.32 0.00 0.00 57.90 61.48 2pt6 n TYR 299 Cb 0.00 -2.50 -0.06 0.00 -0.63 0.00 0.00 39.34 36.15 2pt6 n TYR 299 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2pt6 s ASN 300 N 0.41 0.14 0.24 2.98 2.20 -1.26 -4.96 114.94 114.69 2pt6 s ASN 300 Ca 0.69 -1.15 -0.09 0.00 -0.94 0.00 0.00 52.86 51.37 2pt6 s ASN 300 Cb -0.62 0.54 0.38 0.00 -2.00 0.00 0.00 41.25 39.56 2pt6 s ASN 300 CO 0.48 -1.09 1.63 0.22 -2.94 0.00 0.00 177.10 175.40 2pt6 h TYR 301 N 2.33 -0.16 -0.06 1.54 3.20 -1.95 -1.65 116.97 120.21 2pt6 h TYR 301 Ca -0.29 0.06 -0.24 0.00 3.14 0.00 0.00 58.73 61.40 2pt6 h TYR 301 Cb 1.25 0.19 0.01 0.00 1.54 0.00 0.00 36.73 39.72 2pt6 h TYR 301 CO 0.57 -0.26 -0.90 0.93 -1.64 0.00 0.00 178.16 176.85 2pt6 h GLU 302 N 0.06 0.64 -0.12 1.82 5.08 -2.00 -3.21 114.58 116.85 2pt6 h GLU 302 Ca 0.39 -0.61 -0.04 0.00 -1.00 0.00 0.00 59.36 58.09 2pt6 h GLU 302 Cb 0.65 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 2pt6 h GLU 302 CO -0.68 1.22 -0.11 -0.91 -1.00 0.00 0.00 179.01 177.53 2pt6 h ASN 303 N 0.40 0.17 -0.14 1.42 2.35 -1.87 -2.62 115.58 115.29 2pt6 h ASN 303 Ca -0.08 -0.03 0.02 0.00 -0.55 0.00 0.00 56.30 55.66 2pt6 h ASN 303 Cb 1.54 -0.04 -0.05 0.00 0.05 0.00 0.00 38.32 39.82 2pt6 h ASN 303 CO 0.17 0.31 -0.36 -0.74 -1.65 0.00 0.00 177.43 175.17 2pt6 h HIS 304 N 0.18 -1.07 -0.34 1.19 2.76 -1.31 -1.64 115.15 114.92 2pt6 h HIS 304 Ca 0.04 0.04 -0.09 0.00 -2.20 0.00 0.00 60.37 58.16 2pt6 h HIS 304 Cb 0.32 0.49 -0.02 0.00 1.55 0.00 0.00 27.41 29.75 2pt6 h HIS 304 CO 0.00 -0.34 -0.18 0.77 -1.30 0.00 0.00 177.93 176.88 2pt6 h SER 305 N -0.34 0.62 -0.94 3.26 0.02 -1.64 -3.15 113.55 111.37 2pt6 h SER 305 Ca 0.03 -0.20 0.03 0.00 -0.84 0.00 0.00 61.79 60.82 2pt6 h SER 305 Cb 0.42 -0.17 -0.05 0.00 0.14 0.00 0.00 62.40 62.74 2pt6 h SER 305 CO -0.32 0.81 0.62 0.00 -1.14 0.00 0.00 176.83 176.81 2pt6 h ALA 306 N 1.24 1.39 -0.86 3.77 0.00 -1.34 -2.66 119.26 120.80 2pt6 h ALA 306 Ca 0.09 -0.05 0.25 0.00 0.00 0.00 0.00 54.91 55.20 2pt6 h ALA 306 Cb 0.63 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 2pt6 h ALA 306 CO 0.04 0.53 0.71 0.00 0.00 0.00 0.00 179.25 180.53 2pt6 h ALA 307 N 1.44 2.74 -0.01 0.00 0.00 -1.25 -1.51 119.26 120.67 2pt6 h ALA 307 Ca 0.37 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2pt6 h ALA 307 Cb -0.01 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2pt6 h ALA 307 CO -0.11 -1.15 -0.23 1.19 0.00 0.00 0.00 179.25 178.95 2pt6 n PHE 308 N -3.97 0.00 -2.64 0.00 3.72 -1.00 -1.09 117.46 112.48 2pt6 n PHE 308 Ca 0.18 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.16 2pt6 n PHE 308 Cb 1.01 -0.09 -0.03 0.00 -0.94 0.00 0.00 39.48 39.43 2pt6 n PHE 308 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2pt6 s LYS 309 N -2.40 3.47 0.30 -1.08 -0.14 -0.57 -4.92 119.74 114.40 2pt6 s LYS 309 Ca 0.26 -1.01 -0.04 0.00 -1.36 0.00 0.00 55.97 53.83 2pt6 s LYS 309 Cb 0.19 -4.96 -0.05 0.00 -1.68 0.00 0.00 37.83 31.34 2pt6 s LYS 309 CO 0.49 -2.10 0.55 -0.51 -0.76 0.00 0.00 175.35 173.01 2pt6 s LEU 310 N 4.73 4.05 0.37 3.17 1.43 -1.26 -5.01 118.68 126.15 2pt6 s LEU 310 Ca 0.40 0.65 -0.28 0.00 -1.03 0.00 0.00 54.13 53.87 2pt6 s LEU 310 Cb -0.04 -3.48 -0.11 0.00 0.03 0.00 0.00 46.19 42.59 2pt6 s LEU 310 CO -0.03 -0.21 1.42 -2.65 0.23 0.00 0.00 176.35 175.11 2pt6 n PRO 311 N -1.11 2.49 -0.32 1.29 -0.02 -1.26 -4.83 135.00 131.25 2pt6 n PRO 311 Ca -0.02 0.87 0.16 0.00 -2.02 0.00 0.00 63.50 62.49 2pt6 n PRO 311 Cb 0.54 -2.56 0.33 0.00 -0.02 0.00 0.00 33.50 31.79 2pt6 n PRO 311 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2pt6 h ALA 312 N 2.80 1.35 -0.16 3.55 0.00 -2.00 -1.31 119.26 123.49 2pt6 h ALA 312 Ca -0.49 0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 2pt6 h ALA 312 Cb 1.26 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 2pt6 h ALA 312 CO 0.63 -0.58 -0.05 0.27 0.00 0.00 0.00 179.25 179.52 2pt6 h PHE 313 N 0.10 0.24 -0.02 0.00 -5.15 -2.00 -2.17 116.94 107.94 2pt6 h PHE 313 Ca 0.61 -0.02 -0.26 0.00 -0.20 0.00 0.00 57.97 58.11 2pt6 h PHE 313 Cb 1.32 -0.07 0.02 0.00 0.22 0.00 0.00 35.95 37.43 2pt6 h PHE 313 CO -0.33 0.30 -1.00 1.25 -2.00 0.00 0.00 178.31 176.53 2pt6 h LEU 314 N 0.24 0.87 -0.86 2.10 5.85 -1.61 -2.50 115.31 119.40 2pt6 h LEU 314 Ca 0.05 -0.68 0.10 0.00 0.84 0.00 0.00 57.88 58.19 2pt6 h LEU 314 Cb 0.26 -0.27 -0.08 0.00 0.37 0.00 0.00 40.66 40.94 2pt6 h LEU 314 CO 0.01 1.48 0.50 -0.07 -0.34 0.00 0.00 178.44 180.02 2pt6 h LEU 315 N 0.39 0.71 -0.84 2.25 3.38 -1.16 -0.75 115.31 119.31 2pt6 h LEU 315 Ca -0.12 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 2pt6 h LEU 315 Cb 1.65 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 42.30 2pt6 h LEU 315 CO 0.20 0.40 -0.27 0.11 0.09 0.00 0.00 178.44 178.97 2pt6 h LYS 316 N 0.82 0.57 -0.48 1.13 1.57 -1.33 -2.48 116.57 116.38 2pt6 h LYS 316 Ca 0.42 -0.23 -0.08 0.00 -1.87 0.00 0.00 60.65 58.89 2pt6 h LYS 316 Cb 0.39 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 2pt6 h LYS 316 CO -0.25 0.78 -0.01 0.93 -0.57 0.00 0.00 179.45 180.33 2pt6 h GLU 317 N 0.50 0.85 -0.25 3.15 4.39 -0.92 -3.13 114.58 119.17 2pt6 h GLU 317 Ca 0.07 -0.27 -0.04 0.00 0.34 0.00 0.00 59.36 59.46 2pt6 h GLU 317 Cb 0.72 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.28 2pt6 h GLU 317 CO 0.06 0.90 -0.00 0.82 -1.16 0.00 0.00 179.01 179.62 2pt6 h ILE 318 N 0.70 1.16 0.00 3.13 2.04 -0.99 -0.86 117.51 122.68 2pt6 h ILE 318 Ca 0.13 -0.61 -0.00 0.00 1.00 0.00 0.00 64.86 65.39 2pt6 h ILE 318 Cb 0.52 0.97 -0.00 0.00 -0.74 0.00 0.00 36.82 37.57 2pt6 h ILE 318 CO 0.03 0.20 -0.02 -0.33 0.00 0.00 0.00 178.15 178.03 2pt6 h GLU 319 N 0.36 0.00 -0.82 2.37 5.08 -1.39 -2.91 114.58 117.27 2pt6 h GLU 319 Ca 0.08 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.24 2pt6 h GLU 319 Cb 0.24 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 29.37 2pt6 h GLU 319 CO 0.01 0.02 0.26 0.09 -1.00 0.00 0.00 179.01 178.38 2pt6 n ASN 320 N -3.48 4.35 -0.54 1.42 3.02 -0.33 -5.12 115.26 114.58 2pt6 n ASN 320 Ca -0.03 -3.05 0.14 0.00 -0.03 0.00 0.00 54.58 51.61 2pt6 n ASN 320 Cb 0.11 -0.72 0.47 0.00 -0.61 0.00 0.00 39.78 39.04 2pt6 n ASN 320 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26