#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p42 s LEU 3 N 0.00 4.18 0.80 0.99 1.43 -1.26 0.18 118.68 125.01 1p42 s LEU 3 Ca 0.00 1.12 -0.14 0.00 -1.03 0.00 0.00 54.13 54.09 1p42 s LEU 3 Cb 0.00 -3.73 0.07 0.00 0.03 0.00 0.00 46.19 42.56 1p42 s LEU 3 CO 0.00 -0.08 1.16 -0.62 0.23 0.00 0.00 176.35 177.05 1p42 n GLU 4 N 0.04 0.20 -4.00 1.70 1.02 0.58 -4.72 120.64 115.46 1p42 n GLU 4 Ca 0.00 0.14 -0.09 0.00 -0.02 0.00 0.00 57.16 57.20 1p42 n GLU 4 Cb 0.52 -2.40 -0.10 0.00 -0.02 0.00 0.00 31.44 29.44 1p42 n GLU 4 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1p42 s LYS 5 N -4.02 0.45 0.00 3.49 1.02 -1.26 -0.39 119.74 119.03 1p42 s LYS 5 Ca 0.73 -0.81 0.00 0.00 0.02 0.00 0.00 55.97 55.91 1p42 s LYS 5 Cb -0.29 0.16 0.00 0.00 -0.52 0.00 0.00 37.83 37.18 1p42 s LYS 5 CO 0.51 -0.09 0.00 -2.37 -0.92 0.00 0.00 175.35 172.48 1p42 n THR 6 N 1.01 0.00 -3.93 2.17 5.66 -0.56 -0.98 114.28 117.66 1p42 n THR 6 Ca -0.20 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.48 1p42 n THR 6 Cb 0.57 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.31 1p42 n THR 6 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 1p42 s VAL 7 N -1.94 5.34 0.35 1.08 -7.23 -1.26 -0.83 120.40 115.92 1p42 s VAL 7 Ca 0.00 -0.35 0.06 0.00 -1.81 0.00 0.00 61.98 59.87 1p42 s VAL 7 Cb 0.00 -3.58 0.16 0.00 0.56 0.00 0.00 36.38 33.53 1p42 s VAL 7 CO 0.00 0.19 1.89 0.11 -0.31 0.00 0.00 175.10 176.98 1p42 h LYS 8 N 3.29 0.45 -3.36 4.82 1.57 -0.63 -3.42 116.57 119.29 1p42 h LYS 8 Ca -0.46 -0.10 -0.00 0.00 -1.87 0.00 0.00 60.65 58.22 1p42 h LYS 8 Cb 1.17 -0.07 -0.07 0.00 0.08 0.00 0.00 32.23 33.34 1p42 h LYS 8 CO 0.73 0.50 0.04 -1.83 -0.57 0.00 0.00 179.45 178.32 1p42 s GLU 9 N -4.92 1.65 0.33 3.15 -1.05 -1.26 -5.02 118.70 111.58 1p42 s GLU 9 Ca -0.07 -1.13 -0.29 0.00 -0.15 0.00 0.00 54.97 53.33 1p42 s GLU 9 Cb 0.15 0.53 -0.12 0.00 -0.44 0.00 0.00 34.13 34.26 1p42 s GLU 9 CO 0.76 -0.72 1.51 1.63 0.95 0.00 0.00 175.26 179.38 1p42 n LYS 10 N -0.42 2.59 -5.02 -4.83 5.02 -1.26 -4.76 118.16 109.48 1p42 n LYS 10 Ca -0.03 0.91 -0.28 0.00 -2.02 0.00 0.00 58.31 56.90 1p42 n LYS 10 Cb 0.61 -2.64 -0.16 0.00 -0.02 0.00 0.00 35.03 32.81 1p42 n LYS 10 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1p42 s LEU 11 N -1.16 2.02 0.07 -0.35 1.43 -0.75 -4.93 118.68 115.01 1p42 s LEU 11 Ca 0.59 -0.39 0.08 0.00 -1.03 0.00 0.00 54.13 53.38 1p42 s LEU 11 Cb -0.50 -1.09 -0.03 0.00 0.03 0.00 0.00 46.19 44.59 1p42 s LEU 11 CO 0.57 0.24 -0.22 -0.44 0.23 0.00 0.00 176.35 176.72 1p42 s SER 12 N -0.35 2.64 0.01 2.29 0.01 -1.26 0.51 113.70 117.54 1p42 s SER 12 Ca 0.04 -0.59 -0.05 0.00 1.31 0.00 0.00 55.95 56.67 1p42 s SER 12 Cb -0.09 -0.20 -0.01 0.00 0.21 0.00 0.00 66.02 65.93 1p42 s SER 12 CO 0.00 0.15 0.08 -0.36 0.41 0.00 0.00 173.24 173.52 1p42 s PHE 13 N -0.91 0.14 0.11 2.43 0.40 -0.82 -4.98 117.98 114.35 1p42 s PHE 13 Ca 0.08 -0.32 -0.17 0.00 -0.60 0.00 0.00 56.93 55.92 1p42 s PHE 13 Cb -0.09 -0.11 0.04 0.00 0.51 0.00 0.00 43.02 43.36 1p42 s PHE 13 CO 0.03 -0.27 0.40 -1.83 0.70 0.00 0.00 175.22 174.25 1p42 s GLU 14 N -1.61 1.04 0.00 0.44 -1.05 -1.26 -0.01 118.70 116.24 1p42 s GLU 14 Ca -0.14 -0.63 0.00 0.00 -0.15 0.00 0.00 54.97 54.06 1p42 s GLU 14 Cb -0.07 0.46 0.00 0.00 -0.44 0.00 0.00 34.13 34.07 1p42 s GLU 14 CO -0.00 -0.39 0.00 0.41 0.95 0.00 0.00 175.26 176.22 1p42 n GLY 15 N -0.06 -2.41 3.80 -3.83 0.00 -0.63 -4.91 105.19 97.15 1p42 n GLY 15 Ca -0.17 -1.40 -0.33 0.00 0.00 0.00 0.00 46.02 44.13 1p42 n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p42 s VAL 16 N -1.94 3.86 -0.05 1.61 0.11 -1.26 -1.06 120.40 121.66 1p42 s VAL 16 Ca 0.00 0.94 -0.15 0.00 -2.93 0.00 0.00 61.98 59.84 1p42 s VAL 16 Cb 0.00 -3.42 -0.05 0.00 -1.53 0.00 0.00 36.38 31.38 1p42 s VAL 16 CO 0.00 -0.46 0.39 -0.83 -3.33 0.00 0.00 175.10 170.87 1p42 s GLY 17 N -2.64 2.41 0.43 6.54 0.00 0.15 -1.78 107.32 112.43 1p42 s GLY 17 Ca 0.64 -0.26 0.09 0.00 0.00 0.00 0.00 44.72 45.18 1p42 s GLY 17 CO 0.33 0.28 2.06 1.19 0.00 0.00 0.00 173.10 176.95 1p42 h ILE 18 N 4.04 1.10 0.06 0.90 2.10 -1.83 -1.04 117.51 122.83 1p42 h ILE 18 Ca -0.48 -0.23 -0.36 0.00 1.08 0.00 0.00 64.86 64.87 1p42 h ILE 18 Cb 1.20 0.67 -0.04 0.00 -1.09 0.00 0.00 36.82 37.57 1p42 h ILE 18 CO 0.66 0.10 -2.05 1.41 -1.08 0.00 0.00 178.15 177.19 1p42 n HIS 19 N -4.46 0.79 0.10 2.19 8.25 -1.26 0.14 115.22 120.98 1p42 n HIS 19 Ca 0.02 0.21 -0.02 0.00 -0.26 0.00 0.00 57.72 57.66 1p42 n HIS 19 Cb 0.09 -1.10 -0.03 0.00 1.12 0.00 0.00 29.99 30.08 1p42 n HIS 19 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 1p42 h THR 20 N -0.23 1.30 0.00 1.59 1.35 -1.90 -0.58 112.91 114.44 1p42 h THR 20 Ca -0.48 -2.77 0.00 0.00 -0.55 0.00 0.00 66.41 62.61 1p42 h THR 20 Cb 1.84 2.60 0.00 0.00 -1.73 0.00 0.00 68.15 70.86 1p42 h THR 20 CO -0.05 0.73 0.00 0.61 -0.25 0.00 0.00 175.52 176.55 1p42 n GLY 21 N 1.21 0.40 3.95 5.82 0.00 -0.40 -4.67 105.19 111.50 1p42 n GLY 21 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1p42 n GLY 21 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1p42 s GLU 22 N -0.55 3.46 0.25 1.61 2.02 -1.26 -4.74 118.70 119.50 1p42 s GLU 22 Ca 0.00 -0.56 -0.30 0.00 0.02 0.00 0.00 54.97 54.14 1p42 s GLU 22 Cb 0.00 -2.87 -0.09 0.00 0.10 0.00 0.00 34.13 31.26 1p42 s GLU 22 CO 0.00 0.42 0.98 -0.47 0.02 0.00 0.00 175.26 176.20 1p42 s TYR 23 N -1.92 3.88 0.07 1.61 5.04 -1.26 -0.68 117.35 124.09 1p42 s TYR 23 Ca 0.36 1.86 -0.07 0.00 -2.44 0.00 0.00 57.07 56.78 1p42 s TYR 23 Cb -0.10 -3.04 -0.01 0.00 0.35 0.00 0.00 41.96 39.15 1p42 s TYR 23 CO 0.30 0.22 0.14 -1.54 -1.34 0.00 0.00 175.55 173.32 1p42 s SER 24 N -1.14 0.18 0.04 4.32 1.04 -0.23 -4.78 113.70 113.13 1p42 s SER 24 Ca 0.42 -0.64 0.02 0.00 0.48 0.00 0.00 55.95 56.23 1p42 s SER 24 Cb -0.27 0.29 -0.02 0.00 0.10 0.00 0.00 66.02 66.12 1p42 s SER 24 CO 0.34 -0.64 -0.08 -0.75 0.98 0.00 0.00 173.24 173.09 1p42 s LYS 25 N -3.44 0.54 0.08 4.02 2.20 -0.83 -1.61 119.74 120.70 1p42 s LYS 25 Ca 0.02 -0.67 0.10 0.00 -0.36 0.00 0.00 55.97 55.06 1p42 s LYS 25 Cb 0.03 -0.37 -0.03 0.00 -1.51 0.00 0.00 37.83 35.96 1p42 s LYS 25 CO -0.09 0.07 -0.26 -0.51 -0.36 0.00 0.00 175.35 174.21 1p42 s LEU 26 N -1.33 2.24 -0.16 5.43 1.43 0.98 -1.50 118.68 125.79 1p42 s LEU 26 Ca -0.07 -0.65 -0.03 0.00 -1.03 0.00 0.00 54.13 52.35 1p42 s LEU 26 Cb -0.09 -1.27 0.05 0.00 0.03 0.00 0.00 46.19 44.92 1p42 s LEU 26 CO 0.00 0.23 0.04 -0.63 0.23 0.00 0.00 176.35 176.22 1p42 s ILE 27 N -0.91 0.36 -0.36 -0.59 1.01 -0.65 -1.94 121.20 118.12 1p42 s ILE 27 Ca 0.13 -0.30 -0.19 0.00 0.00 0.00 0.00 60.65 60.29 1p42 s ILE 27 Cb -0.10 -0.81 0.00 0.00 0.01 0.00 0.00 42.46 41.56 1p42 s ILE 27 CO 0.04 -0.10 0.54 -0.63 0.00 0.00 0.00 174.94 174.78 1p42 s ILE 28 N 1.94 4.98 -0.08 2.92 1.01 0.18 -0.51 121.20 131.65 1p42 s ILE 28 Ca 0.01 0.34 -0.05 0.00 0.00 0.00 0.00 60.65 60.95 1p42 s ILE 28 Cb -0.16 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 38.27 1p42 s ILE 28 CO -0.07 -0.27 0.12 -1.00 0.00 0.00 0.00 174.94 173.71 1p42 s HIS 29 N 2.47 3.48 0.61 3.97 3.76 0.68 -1.80 115.29 128.47 1p42 s HIS 29 Ca 0.20 0.41 -0.17 0.00 -0.15 0.00 0.00 55.06 55.35 1p42 s HIS 29 Cb -0.15 -1.87 -0.02 0.00 1.11 0.00 0.00 32.58 31.64 1p42 s HIS 29 CO 0.14 0.66 1.12 -2.14 -0.85 0.00 0.00 174.74 173.67 1p42 s PRO 30 N -1.24 3.01 0.03 8.40 0.02 -1.26 -1.59 135.00 142.36 1p42 s PRO 30 Ca 0.18 1.51 -0.04 0.00 0.02 0.00 0.00 61.00 62.67 1p42 s PRO 30 Cb -0.12 -1.97 -0.01 0.00 0.02 0.00 0.00 34.50 32.42 1p42 s PRO 30 CO 0.07 -1.11 0.06 -1.21 -0.33 0.00 0.00 177.00 174.48 1p42 s GLU 31 N -3.73 0.49 0.92 5.54 0.41 -1.23 -4.72 118.70 116.38 1p42 s GLU 31 Ca 0.70 -0.68 -0.12 0.00 -0.41 0.00 0.00 54.97 54.46 1p42 s GLU 31 Cb -0.23 0.19 0.14 0.00 -1.78 0.00 0.00 34.13 32.46 1p42 s GLU 31 CO 0.35 -0.11 1.12 -1.59 -0.49 0.00 0.00 175.26 174.55 1p42 s LYS 32 N -2.15 1.06 0.43 1.61 -2.85 -1.26 -4.74 119.74 111.85 1p42 s LYS 32 Ca -0.09 0.39 -0.23 0.00 -1.00 0.00 0.00 55.97 55.03 1p42 s LYS 32 Cb -0.04 -1.82 -0.11 0.00 -2.06 0.00 0.00 37.83 33.80 1p42 s LYS 32 CO -0.03 -2.27 0.91 0.39 0.10 0.00 0.00 175.35 174.45 1p42 n GLU 33 N -3.83 1.14 -0.91 1.78 4.71 -1.26 -2.51 120.64 119.76 1p42 n GLU 33 Ca 0.06 0.41 0.00 0.00 -0.01 0.00 0.00 57.16 57.62 1p42 n GLU 33 Cb 0.58 -1.93 0.00 0.00 -1.01 0.00 0.00 31.44 29.08 1p42 n GLU 33 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1p42 n GLY 34 N 1.32 0.66 0.15 0.62 0.00 -1.26 -4.90 105.19 101.78 1p42 n GLY 34 Ca 0.10 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.96 1p42 n GLY 34 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1p42 h THR 35 N 0.00 1.40 0.00 2.61 2.02 -1.80 -3.50 112.91 113.63 1p42 h THR 35 Ca 0.00 -1.92 0.00 0.00 0.77 0.00 0.00 66.41 65.26 1p42 h THR 35 Cb 0.06 2.37 0.00 0.00 -1.74 0.00 0.00 68.15 68.85 1p42 h THR 35 CO 0.00 0.57 0.00 0.61 0.37 0.00 0.00 175.52 177.07 1p42 n GLY 36 N 0.86 -3.16 3.70 2.16 0.00 -1.15 -4.89 105.19 102.71 1p42 n GLY 36 Ca -0.09 -1.78 -0.36 0.00 0.00 0.00 0.00 46.02 43.78 1p42 n GLY 36 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p42 s ILE 37 N -0.98 5.33 0.08 -0.61 -1.09 -1.16 -2.50 121.20 120.26 1p42 s ILE 37 Ca 0.00 0.39 -0.12 0.00 -2.23 0.00 0.00 60.65 58.69 1p42 s ILE 37 Cb 0.00 -3.57 0.01 0.00 -1.58 0.00 0.00 42.46 37.32 1p42 s ILE 37 CO 0.00 0.37 0.26 0.00 -1.23 0.00 0.00 174.94 174.34 1p42 s ARG 38 N 0.75 0.86 0.28 2.79 1.70 -1.00 -1.29 118.95 123.03 1p42 s ARG 38 Ca 0.12 -0.75 0.07 0.00 -0.47 0.00 0.00 55.73 54.70 1p42 s ARG 38 Cb -0.13 0.36 -0.03 0.00 -0.57 0.00 0.00 34.95 34.58 1p42 s ARG 38 CO 0.03 -0.29 0.28 -0.06 -1.08 0.00 0.00 175.30 174.19 1p42 s PHE 39 N -3.36 3.13 -0.05 5.89 0.40 0.10 -0.58 117.98 123.52 1p42 s PHE 39 Ca 0.01 -0.15 -0.01 0.00 -0.60 0.00 0.00 56.93 56.18 1p42 s PHE 39 Cb 0.02 -1.60 0.03 0.00 0.51 0.00 0.00 43.02 41.98 1p42 s PHE 39 CO -0.08 0.36 0.02 0.12 0.70 0.00 0.00 175.22 176.34 1p42 s PHE 40 N -2.15 0.36 -0.08 0.36 5.36 -0.34 -0.28 117.98 121.21 1p42 s PHE 40 Ca 0.36 0.02 -0.04 0.00 -0.96 0.00 0.00 56.93 56.31 1p42 s PHE 40 Cb -0.08 -0.56 0.04 0.00 -0.34 0.00 0.00 43.02 42.08 1p42 s PHE 40 CO 0.27 -0.21 0.18 0.21 -1.46 0.00 0.00 175.22 174.21 1p42 s LYS 41 N 1.67 0.14 -1.54 10.12 2.20 -0.29 -0.53 119.74 131.51 1p42 s LYS 41 Ca -0.01 0.42 -0.03 0.00 -0.36 0.00 0.00 55.97 55.99 1p42 s LYS 41 Cb -0.13 -0.14 0.03 0.00 -1.51 0.00 0.00 37.83 36.08 1p42 s LYS 41 CO -0.03 -0.16 0.25 0.09 -0.36 0.00 0.00 175.35 175.14 1p42 n ASN 42 N 4.14 -0.03 0.00 1.43 3.02 -1.26 -0.31 115.26 122.25 1p42 n ASN 42 Ca -0.25 -1.16 0.00 0.00 -0.03 0.00 0.00 54.58 53.14 1p42 n ASN 42 Cb 0.53 -2.19 0.00 0.00 -0.61 0.00 0.00 39.78 37.50 1p42 n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p42 n GLY 43 N -2.17 0.68 3.37 7.41 0.00 -1.26 -5.02 105.19 108.20 1p42 n GLY 43 Ca -0.26 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 1p42 n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1p42 s VAL 44 N -2.89 2.83 -0.14 1.61 1.01 0.58 -5.10 120.40 118.30 1p42 s VAL 44 Ca 0.00 -0.76 -0.19 0.00 0.00 0.00 0.00 61.98 61.02 1p42 s VAL 44 Cb 0.00 -2.14 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 1p42 s VAL 44 CO 0.00 0.55 0.54 -0.31 0.00 0.00 0.00 175.10 175.88 1p42 s TYR 45 N 0.03 3.47 -0.31 5.22 1.51 -1.26 -1.14 117.35 124.87 1p42 s TYR 45 Ca -0.06 0.91 0.03 0.00 -1.01 0.00 0.00 57.07 56.94 1p42 s TYR 45 Cb -0.15 -2.65 0.08 0.00 -0.11 0.00 0.00 41.96 39.13 1p42 s TYR 45 CO 0.05 0.04 -0.01 0.42 -1.11 0.00 0.00 175.55 174.93 1p42 s ILE 46 N 1.07 2.36 0.48 2.71 1.01 0.62 -4.94 121.20 124.51 1p42 s ILE 46 Ca 0.27 -1.93 -0.24 0.00 0.00 0.00 0.00 60.65 58.75 1p42 s ILE 46 Cb -0.16 -2.55 -0.07 0.00 0.01 0.00 0.00 42.46 39.69 1p42 s ILE 46 CO 0.11 -0.31 1.39 -2.84 0.00 0.00 0.00 174.94 173.29 1p42 s PRO 47 N 1.04 3.53 -1.43 2.79 0.02 -1.26 0.02 135.00 139.70 1p42 s PRO 47 Ca 0.01 2.33 -0.13 0.00 0.02 0.00 0.00 61.00 63.22 1p42 s PRO 47 Cb -0.20 -2.53 0.06 0.00 0.02 0.00 0.00 34.50 31.85 1p42 s PRO 47 CO -0.06 -0.91 2.18 0.00 -0.33 0.00 0.00 177.00 177.88 1p42 n ALA 48 N -0.45 5.55 -2.68 -1.55 0.00 -0.41 -4.77 120.51 116.20 1p42 n ALA 48 Ca 0.07 -3.96 -0.13 0.00 0.00 0.00 0.00 53.44 49.42 1p42 n ALA 48 Cb 0.43 -3.43 -0.11 0.00 0.00 0.00 0.00 19.45 16.34 1p42 n ALA 48 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1p42 s ARG 49 N 2.66 0.63 0.56 0.00 0.52 -1.26 -4.35 118.95 117.70 1p42 s ARG 49 Ca 0.46 -0.92 0.27 0.00 -0.52 0.00 0.00 55.73 55.02 1p42 s ARG 49 Cb 0.13 -0.32 1.47 0.00 0.52 0.00 0.00 34.95 36.76 1p42 s ARG 49 CO -0.07 0.05 2.00 1.12 0.02 0.00 0.00 175.30 178.41 1p42 h HIS 50 N 4.10 0.00 0.00 -0.53 2.07 -1.44 -1.03 115.15 118.32 1p42 h HIS 50 Ca -0.36 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.16 1p42 h HIS 50 Cb 1.19 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.17 1p42 h HIS 50 CO 0.63 0.00 -0.01 0.93 -3.07 0.00 0.00 177.93 176.42 1p42 h GLU 51 N 0.00 0.00 -0.47 5.12 3.07 -1.94 -2.47 114.58 117.89 1p42 h GLU 51 Ca 0.21 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 1p42 h GLU 51 Cb 0.93 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.84 1p42 h GLU 51 CO -0.00 0.01 0.00 1.19 -1.40 0.00 0.00 179.01 178.80 1p42 n PHE 52 N -3.14 0.61 -2.23 4.33 3.01 -0.39 -4.96 117.46 114.70 1p42 n PHE 52 Ca -0.02 -0.33 -0.42 0.00 1.01 0.00 0.00 57.45 57.70 1p42 n PHE 52 Cb 0.13 -0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.57 1p42 n PHE 52 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1p42 s VAL 53 N -1.30 3.33 0.00 -4.37 1.01 -0.93 -0.61 120.40 117.53 1p42 s VAL 53 Ca 0.39 1.04 0.00 0.00 0.00 0.00 0.00 61.98 63.41 1p42 s VAL 53 Cb 0.22 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.94 1p42 s VAL 53 CO 0.30 0.13 0.04 1.33 0.00 0.00 0.00 175.10 176.90 1p42 n VAL 54 N 3.13 0.00 -3.62 2.92 0.24 0.14 -4.88 118.33 116.27 1p42 n VAL 54 Ca 0.08 -0.40 -0.14 0.00 -2.04 0.00 0.00 64.34 61.84 1p42 n VAL 54 Cb 0.43 1.02 -0.07 0.00 -1.47 0.00 0.00 33.84 33.75 1p42 n VAL 54 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1p42 s HIS 55 N -0.71 -0.76 0.00 6.34 5.65 -1.22 -5.00 115.29 119.59 1p42 s HIS 55 Ca 0.00 1.80 0.00 0.00 0.25 0.00 0.00 55.06 57.11 1p42 s HIS 55 Cb 0.00 0.29 0.00 0.00 -1.18 0.00 0.00 32.58 31.69 1p42 s HIS 55 CO 0.00 -0.39 0.06 0.25 -0.65 0.00 0.00 174.74 174.00 1p42 n THR 56 N 2.48 0.00 0.04 0.89 -2.24 -1.22 -1.05 114.28 113.18 1p42 n THR 56 Ca -0.14 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.51 1p42 n THR 56 Cb 0.55 1.79 -0.08 0.00 -2.10 0.00 0.00 70.33 70.50 1p42 n THR 56 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1p42 h ASN 57 N 0.00 -0.02 0.00 3.42 4.21 -1.97 -3.31 115.58 117.91 1p42 h ASN 57 Ca 0.00 -0.09 0.00 0.00 1.21 0.00 0.00 56.30 57.42 1p42 h ASN 57 Cb 0.56 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.76 1p42 h ASN 57 CO 0.00 0.07 -0.09 1.41 -1.29 0.00 0.00 177.43 177.54 1p42 n HIS 58 N -5.06 0.00 0.00 1.19 8.25 -1.26 -4.93 115.22 113.41 1p42 n HIS 58 Ca -0.07 -0.62 0.00 0.00 -0.26 0.00 0.00 57.72 56.76 1p42 n HIS 58 Cb 0.08 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.09 1p42 n HIS 58 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1p42 n SER 59 N -0.85 0.00 -4.43 0.41 3.41 -1.25 -5.03 113.62 105.88 1p42 n SER 59 Ca 0.08 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.30 1p42 n SER 59 Cb 0.55 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.38 1p42 n SER 59 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1p42 s THR 60 N -2.00 4.58 0.01 6.66 2.01 -1.26 -3.40 115.64 122.24 1p42 s THR 60 Ca 0.00 -0.48 0.06 0.00 0.31 0.00 0.00 61.69 61.57 1p42 s THR 60 Cb 0.00 -3.36 -0.03 0.00 0.01 0.00 0.00 72.50 69.12 1p42 s THR 60 CO 0.00 0.03 -0.16 -1.81 -0.69 0.00 0.00 174.62 171.99 1p42 s ASP 61 N 1.60 3.94 0.23 3.53 1.01 -0.21 -1.56 116.67 125.21 1p42 s ASP 61 Ca 0.04 -0.33 0.10 0.00 0.71 0.00 0.00 52.55 53.08 1p42 s ASP 61 Cb -0.17 -0.73 -0.04 0.00 1.01 0.00 0.00 42.92 42.98 1p42 s ASP 61 CO 0.06 0.29 -0.14 -0.76 0.21 0.00 0.00 175.17 174.83 1p42 s LEU 62 N -1.20 2.78 -0.00 1.23 1.43 -0.55 -0.68 118.68 121.69 1p42 s LEU 62 Ca 0.14 -0.79 -0.28 0.00 -1.03 0.00 0.00 54.13 52.17 1p42 s LEU 62 Cb -0.11 -1.40 0.08 0.00 0.03 0.00 0.00 46.19 44.80 1p42 s LEU 62 CO 0.04 0.07 0.74 -0.83 0.23 0.00 0.00 176.35 176.60 1p42 s GLY 63 N -3.15 -0.53 -0.28 -3.19 0.00 0.22 -0.74 107.32 99.66 1p42 s GLY 63 Ca 0.27 1.15 -0.23 0.00 0.00 0.00 0.00 44.72 45.91 1p42 s GLY 63 CO 0.15 0.65 0.88 -0.12 0.00 0.00 0.00 173.10 174.66 1p42 s PHE 69 N -2.18 -0.67 -1.60 1.90 5.36 0.06 -4.73 117.98 116.11 1p42 s PHE 69 Ca -0.04 1.55 -0.13 0.00 -0.96 0.00 0.00 56.93 57.35 1p42 s PHE 69 Cb -0.00 0.36 0.11 0.00 -0.34 0.00 0.00 43.02 43.15 1p42 s PHE 69 CO -0.01 -0.32 0.72 1.63 -1.46 0.00 0.00 175.22 175.78 1p42 n LYS 70 N 2.82 -3.56 -0.61 10.12 4.76 -1.26 -1.29 118.16 129.14 1p42 n LYS 70 Ca -0.15 0.41 0.00 0.00 -2.87 0.00 0.00 58.31 55.71 1p42 n LYS 70 Cb 0.56 -5.01 0.00 0.00 -1.84 0.00 0.00 35.03 28.74 1p42 n LYS 70 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1p42 n GLY 71 N -1.60 1.16 3.52 0.72 0.00 -1.26 -5.03 105.19 102.70 1p42 n GLY 71 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 1p42 n GLY 71 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1p42 s GLN 72 N -0.24 3.20 0.06 1.61 -1.52 -0.41 -5.12 119.66 117.24 1p42 s GLN 72 Ca 0.00 -0.55 0.05 0.00 -1.95 0.00 0.00 55.36 52.91 1p42 s GLN 72 Cb 0.00 -2.72 -0.03 0.00 -0.22 0.00 0.00 33.01 30.04 1p42 s GLN 72 CO 0.00 0.44 -0.15 1.03 -0.25 0.00 0.00 175.29 176.36 1p42 s ARG 73 N -0.20 0.90 -0.06 2.91 0.52 -1.26 -0.76 118.95 120.99 1p42 s ARG 73 Ca 0.03 -0.91 -0.01 0.00 -0.52 0.00 0.00 55.73 54.31 1p42 s ARG 73 Cb -0.13 -0.93 0.03 0.00 0.52 0.00 0.00 34.95 34.43 1p42 s ARG 73 CO 0.03 0.22 0.01 0.42 0.02 0.00 0.00 175.30 175.99 1p42 s ILE 74 N -1.11 0.28 0.28 1.52 1.01 0.08 -4.78 121.20 118.47 1p42 s ILE 74 Ca 0.00 0.17 -0.05 0.00 0.00 0.00 0.00 60.65 60.78 1p42 s ILE 74 Cb -0.09 -0.45 -0.05 0.00 0.01 0.00 0.00 42.46 41.88 1p42 s ILE 74 CO 0.02 0.24 0.54 -0.54 0.00 0.00 0.00 174.94 175.20 1p42 s LYS 75 N 1.92 3.63 -1.05 2.79 1.02 -0.57 -1.48 119.74 126.00 1p42 s LYS 75 Ca 0.04 -0.01 -0.08 0.00 0.02 0.00 0.00 55.97 55.93 1p42 s LYS 75 Cb -0.12 -2.66 -0.06 0.00 -0.52 0.00 0.00 37.83 34.47 1p42 s LYS 75 CO -0.04 0.24 0.89 2.41 -0.92 0.00 0.00 175.35 177.92 1p42 n THR 76 N -0.87 -8.65 1.17 2.17 -1.04 -0.97 -1.69 114.28 104.40 1p42 n THR 76 Ca -0.02 -1.24 0.12 0.00 -2.04 0.00 0.00 64.05 60.88 1p42 n THR 76 Cb 0.54 -6.16 0.28 0.00 -1.82 0.00 0.00 70.33 63.17 1p42 n THR 76 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1p42 n VAL 77 N -3.33 0.00 -0.29 12.58 0.24 -0.60 -4.32 118.33 122.60 1p42 n VAL 77 Ca -0.07 -0.13 0.10 0.00 -2.04 0.00 0.00 64.34 62.19 1p42 n VAL 77 Cb 0.61 0.55 0.33 0.00 -1.47 0.00 0.00 33.84 33.86 1p42 n VAL 77 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 1p42 h GLU 78 N 1.24 0.77 0.07 7.34 9.09 -1.92 -1.95 114.58 129.23 1p42 h GLU 78 Ca 0.00 -0.05 -0.16 0.00 0.05 0.00 0.00 59.36 59.21 1p42 h GLU 78 Cb 0.55 -0.17 0.02 0.00 -1.65 0.00 0.00 28.75 27.49 1p42 h GLU 78 CO 0.00 0.51 -0.65 0.45 0.05 0.00 0.00 179.01 179.37 1p42 h HIS 79 N 0.80 0.52 -0.55 2.06 3.86 -1.93 -1.94 115.15 117.97 1p42 h HIS 79 Ca 0.45 -0.33 -0.08 0.00 -1.16 0.00 0.00 60.37 59.25 1p42 h HIS 79 Cb 0.60 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 29.01 1p42 h HIS 79 CO -0.00 1.21 0.02 0.97 0.86 0.00 0.00 177.93 180.99 1p42 h ILE 80 N -0.31 1.25 -0.25 2.45 6.09 -1.85 -2.23 117.51 122.66 1p42 h ILE 80 Ca -0.10 -1.04 -0.10 0.00 -1.37 0.00 0.00 64.86 62.25 1p42 h ILE 80 Cb 1.44 0.80 -0.01 0.00 0.47 0.00 0.00 36.82 39.52 1p42 h ILE 80 CO 0.12 0.38 -0.26 -0.07 -3.07 0.00 0.00 178.15 175.25 1p42 h LEU 81 N 0.85 0.49 -0.46 2.19 3.38 -1.42 -2.06 115.31 118.28 1p42 h LEU 81 Ca 0.16 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1p42 h LEU 81 Cb 0.47 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 1p42 h LEU 81 CO 0.02 0.75 -0.03 -1.28 0.09 0.00 0.00 178.44 177.98 1p42 h SER 82 N 0.43 0.82 -0.65 -0.43 0.87 -0.99 -0.90 113.55 112.70 1p42 h SER 82 Ca 0.06 -0.32 -0.04 0.00 -1.23 0.00 0.00 61.79 60.25 1p42 h SER 82 Cb 0.68 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 62.39 1p42 h SER 82 CO 0.05 0.95 0.24 0.58 -0.53 0.00 0.00 176.83 178.12 1p42 h VAL 83 N 0.68 1.24 -0.40 2.23 2.07 -1.26 0.14 116.25 120.96 1p42 h VAL 83 Ca 0.13 -0.79 -0.07 0.00 0.82 0.00 0.00 66.70 66.79 1p42 h VAL 83 Cb 0.55 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1p42 h VAL 83 CO 0.03 0.31 -0.04 -0.07 0.02 0.00 0.00 177.57 177.82 1p42 h LEU 84 N 0.92 0.62 -0.14 2.57 3.38 -1.21 -1.80 115.31 119.65 1p42 h LEU 84 Ca 0.21 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 1p42 h LEU 84 Cb 0.24 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1p42 h LEU 84 CO -0.01 0.72 -0.08 -0.74 0.09 0.00 0.00 178.44 178.42 1p42 h HIS 85 N 0.61 0.36 -0.33 1.13 2.76 -0.74 -0.10 115.15 118.84 1p42 h HIS 85 Ca 0.12 -0.09 -0.01 0.00 -2.20 0.00 0.00 60.37 58.19 1p42 h HIS 85 Cb 0.44 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.30 1p42 h HIS 85 CO 0.02 0.64 0.16 -0.07 -1.30 0.00 0.00 177.93 177.37 1p42 h LEU 86 N -0.03 0.40 -1.45 0.26 3.38 -0.76 -1.64 115.31 115.48 1p42 h LEU 86 Ca 0.03 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1p42 h LEU 86 Cb 0.55 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1p42 h LEU 86 CO 0.02 0.35 0.00 0.18 0.09 0.00 0.00 178.44 179.08 1p42 n LEU 87 N -4.43 2.23 -3.82 1.67 4.77 -0.70 -4.96 117.00 111.77 1p42 n LEU 87 Ca 0.02 -0.78 -0.28 0.00 -0.03 0.00 0.00 56.01 54.94 1p42 n LEU 87 Cb 0.12 -0.03 0.04 0.00 -2.33 0.00 0.00 43.42 41.22 1p42 n LEU 87 CO 0.36 0.39 0.11 -0.62 -1.33 0.00 0.00 177.39 176.30 1p42 n GLU 88 N 0.74 -5.91 -2.70 3.23 1.02 -0.50 -4.94 120.64 111.57 1p42 n GLU 88 Ca 0.17 0.65 -0.43 0.00 -0.02 0.00 0.00 57.16 57.53 1p42 n GLU 88 Cb 0.47 -5.52 -0.03 0.00 -0.02 0.00 0.00 31.44 26.34 1p42 n GLU 88 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1p42 s ILE 89 N -3.36 4.76 -0.03 -3.67 -1.09 -0.17 -4.10 121.20 113.53 1p42 s ILE 89 Ca 0.54 1.99 0.12 0.00 -2.23 0.00 0.00 60.65 61.07 1p42 s ILE 89 Cb -0.26 -4.29 -0.19 0.00 -1.58 0.00 0.00 42.46 36.14 1p42 s ILE 89 CO 0.81 -0.06 0.24 0.35 -1.23 0.00 0.00 174.94 175.05 1p42 n THR 90 N 4.86 0.13 -3.79 2.92 -2.24 -0.15 -4.70 114.28 111.31 1p42 n THR 90 Ca 0.09 -0.32 -0.29 0.00 -2.27 0.00 0.00 64.05 61.26 1p42 n THR 90 Cb 0.48 0.06 -0.16 0.00 -2.10 0.00 0.00 70.33 68.61 1p42 n THR 90 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1p42 s ASN 91 N -3.62 3.30 0.03 3.42 0.01 -0.78 -2.92 114.94 114.38 1p42 s ASN 91 Ca -0.05 -1.01 -0.27 0.00 -0.71 0.00 0.00 52.86 50.82 1p42 s ASN 91 Cb 0.07 -0.79 0.09 0.00 0.41 0.00 0.00 41.25 41.03 1p42 s ASN 91 CO 0.52 -0.30 0.76 0.68 -1.51 0.00 0.00 177.10 177.25 1p42 s VAL 92 N 1.70 0.00 -0.16 1.60 -7.23 -1.04 -3.53 120.40 111.74 1p42 s VAL 92 Ca -0.01 0.00 0.01 0.00 -1.81 0.00 0.00 61.98 60.17 1p42 s VAL 92 Cb -0.18 -1.00 0.01 0.00 0.56 0.00 0.00 36.38 35.77 1p42 s VAL 92 CO -0.09 0.00 -0.18 -0.89 -0.31 0.00 0.00 175.10 173.63 1p42 s THR 93 N -2.74 2.35 -0.58 5.32 2.01 -0.62 -2.38 115.64 119.00 1p42 s THR 93 Ca -0.00 -0.87 -0.15 0.00 0.31 0.00 0.00 61.69 60.98 1p42 s THR 93 Cb -0.01 -1.98 0.14 0.00 0.01 0.00 0.00 72.50 70.67 1p42 s THR 93 CO -0.06 0.53 0.52 -0.63 -0.69 0.00 0.00 174.62 174.29 1p42 s ILE 94 N 0.99 5.13 0.01 1.82 1.01 0.25 -0.23 121.20 130.19 1p42 s ILE 94 Ca -0.02 -1.71 -0.30 0.00 0.00 0.00 0.00 60.65 58.62 1p42 s ILE 94 Cb -0.15 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.00 1p42 s ILE 94 CO -0.04 -0.88 1.14 -0.70 0.00 0.00 0.00 174.94 174.45 1p42 s GLU 95 N 1.32 4.44 -0.19 2.79 2.12 0.33 -1.20 118.70 128.32 1p42 s GLU 95 Ca 0.06 1.65 0.00 0.00 0.36 0.00 0.00 54.97 57.04 1p42 s GLU 95 Cb -0.26 -3.43 0.02 0.00 0.26 0.00 0.00 34.13 30.71 1p42 s GLU 95 CO 0.01 -0.25 -0.17 0.08 -0.54 0.00 0.00 175.26 174.38 1p42 s VAL 96 N 1.35 2.29 -0.69 3.70 1.01 0.31 -1.64 120.40 126.73 1p42 s VAL 96 Ca 0.56 -0.87 -0.07 0.00 0.00 0.00 0.00 61.98 61.59 1p42 s VAL 96 Cb -0.26 -1.98 0.18 0.00 0.00 0.00 0.00 36.38 34.32 1p42 s VAL 96 CO 0.27 0.51 0.56 -0.63 0.00 0.00 0.00 175.10 175.81 1p42 s ILE 97 N 1.32 4.46 -5.00 2.22 1.01 -0.56 -4.54 121.20 120.10 1p42 s ILE 97 Ca 0.05 -2.70 0.00 0.00 0.00 0.00 0.00 60.65 58.00 1p42 s ILE 97 Cb -0.13 -3.84 0.00 0.00 0.01 0.00 0.00 42.46 38.50 1p42 s ILE 97 CO -0.11 -0.93 0.00 0.61 0.00 0.00 0.00 174.94 174.51 1p42 n GLY 98 N 3.76 0.10 0.38 6.18 0.00 -1.26 -1.97 105.19 112.38 1p42 n GLY 98 Ca 0.09 -1.65 0.04 0.00 0.00 0.00 0.00 46.02 44.49 1p42 n GLY 98 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1p42 n ASN 99 N 2.98 2.24 -3.47 1.61 3.02 -1.26 -4.98 115.26 115.40 1p42 n ASN 99 Ca 0.00 -1.74 -0.15 0.00 -0.03 0.00 0.00 54.58 52.66 1p42 n ASN 99 Cb 0.00 -0.10 -0.04 0.00 -0.61 0.00 0.00 39.78 39.03 1p42 n ASN 99 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1p42 s GLU 100 N -0.86 1.16 0.16 3.52 2.12 -1.26 -1.51 118.70 122.03 1p42 s GLU 100 Ca 0.13 -0.11 -0.30 0.00 0.36 0.00 0.00 54.97 55.05 1p42 s GLU 100 Cb 0.07 0.54 -0.07 0.00 0.26 0.00 0.00 34.13 34.93 1p42 s GLU 100 CO 0.10 -0.44 1.11 0.42 -0.54 0.00 0.00 175.26 175.91 1p42 s ILE 101 N -2.49 3.91 0.33 -3.70 -1.09 -0.68 -4.76 121.20 112.72 1p42 s ILE 101 Ca -0.05 1.61 -0.29 0.00 -2.23 0.00 0.00 60.65 59.69 1p42 s ILE 101 Cb -0.01 -4.03 -0.12 0.00 -1.58 0.00 0.00 42.46 36.73 1p42 s ILE 101 CO -0.02 0.26 1.44 -2.65 -1.23 0.00 0.00 174.94 172.73 1p42 n PRO 102 N 2.57 2.42 0.12 2.79 -0.02 -1.26 -4.59 135.00 137.03 1p42 n PRO 102 Ca 0.03 0.85 0.03 0.00 -2.02 0.00 0.00 63.50 62.40 1p42 n PRO 102 Cb 0.46 -2.54 0.01 0.00 -0.02 0.00 0.00 33.50 31.42 1p42 n PRO 102 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1p42 h ILE 103 N 2.91 0.72 0.00 4.25 6.09 -1.65 -3.49 117.51 126.34 1p42 h ILE 103 Ca -0.48 -2.07 0.00 0.00 -1.37 0.00 0.00 64.86 60.94 1p42 h ILE 103 Cb 1.26 2.30 0.00 0.00 0.47 0.00 0.00 36.82 40.85 1p42 h ILE 103 CO 0.68 0.41 0.00 0.18 -3.07 0.00 0.00 178.15 176.35 1p42 n LEU 104 N -3.14 0.00 -0.63 2.19 4.77 -1.26 -1.18 117.00 117.76 1p42 n LEU 104 Ca -0.00 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.06 1p42 n LEU 104 Cb 0.74 0.00 0.26 0.00 -2.33 0.00 0.00 43.42 42.09 1p42 n LEU 104 CO 0.41 0.00 0.70 -0.90 -1.33 0.00 0.00 177.39 176.27 1p42 n ASP 105 N 5.13 1.84 0.00 -1.43 5.75 -1.26 -4.54 116.55 122.04 1p42 n ASP 105 Ca 0.00 -1.87 0.00 0.00 -0.01 0.00 0.00 54.79 52.91 1p42 n ASP 105 Cb 0.00 -0.18 0.00 0.00 -1.03 0.00 0.00 41.12 39.91 1p42 n ASP 105 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1p42 n GLY 106 N 1.11 0.70 0.00 6.12 0.00 -0.32 -4.46 105.19 108.33 1p42 n GLY 106 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1p42 n GLY 106 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1p42 n SER 107 N 0.00 1.98 -0.96 1.61 3.41 -1.26 -1.01 113.62 117.38 1p42 n SER 107 Ca 0.00 -0.95 0.09 0.00 -0.26 0.00 0.00 58.87 57.75 1p42 n SER 107 Cb 0.00 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.16 1p42 n SER 107 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1p42 n GLY 108 N 4.95 2.16 0.46 5.00 0.00 -0.34 -4.75 105.19 112.66 1p42 n GLY 108 Ca 0.00 -0.59 -0.15 0.00 0.00 0.00 0.00 46.02 45.29 1p42 n GLY 108 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1p42 h TRP 109 N 3.31 -1.52 -0.59 1.61 -0.00 -1.30 0.12 115.95 117.58 1p42 h TRP 109 Ca 0.00 0.06 0.04 0.00 -0.00 0.00 0.00 58.89 58.99 1p42 h TRP 109 Cb 0.85 0.68 -0.05 0.00 -0.00 0.00 0.00 29.16 30.64 1p42 h TRP 109 CO 0.30 -0.54 0.32 1.49 -0.00 0.00 0.00 178.44 180.01 1p42 h GLU 110 N -0.59 0.60 -0.11 2.65 4.81 -1.89 -0.07 114.58 119.99 1p42 h GLU 110 Ca 0.04 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1p42 h GLU 110 Cb 0.68 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 1p42 h GLU 110 CO -0.41 0.40 0.04 0.74 -0.73 0.00 0.00 179.01 179.05 1p42 h PHE 111 N 0.62 0.06 0.03 0.92 0.05 -1.82 -2.62 116.94 114.19 1p42 h PHE 111 Ca 0.25 0.01 0.01 0.00 3.82 0.00 0.00 57.97 62.06 1p42 h PHE 111 Cb 0.12 -0.01 -0.02 0.00 2.00 0.00 0.00 35.95 38.04 1p42 h PHE 111 CO -0.08 0.03 -0.09 -0.92 -0.18 0.00 0.00 178.31 177.07 1p42 h TYR 112 N 0.09 -0.22 -0.66 -0.55 3.20 -0.20 -1.51 116.97 117.11 1p42 h TYR 112 Ca 0.04 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.93 1p42 h TYR 112 Cb 0.02 0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.36 1p42 h TYR 112 CO -0.10 -0.14 0.44 0.93 -1.64 0.00 0.00 178.16 177.65 1p42 h GLU 113 N -0.17 0.87 -0.03 1.82 4.39 -1.00 -1.32 114.58 119.13 1p42 h GLU 113 Ca 0.02 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 1p42 h GLU 113 Cb 0.19 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1p42 h GLU 113 CO -0.07 0.57 -0.02 0.00 -1.16 0.00 0.00 179.01 178.34 1p42 h ALA 114 N 1.24 0.04 -0.48 3.43 0.00 -1.37 -3.18 119.26 118.94 1p42 h ALA 114 Ca 0.24 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1p42 h ALA 114 Cb -0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1p42 h ALA 114 CO -0.05 -0.22 -0.19 0.82 0.00 0.00 0.00 179.25 179.60 1p42 h ILE 115 N -0.36 1.27 -0.36 0.00 2.04 -1.28 -3.07 117.51 115.75 1p42 h ILE 115 Ca 0.01 -1.34 0.03 0.00 1.00 0.00 0.00 64.86 64.56 1p42 h ILE 115 Cb 0.46 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 1p42 h ILE 115 CO 0.00 0.46 0.24 -0.09 0.00 0.00 0.00 178.15 178.77 1p42 h ARG 116 N 0.84 0.35 -0.00 2.37 2.43 -1.32 -0.35 114.38 118.69 1p42 h ARG 116 Ca 0.12 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1p42 h ARG 116 Cb 0.75 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.22 1p42 h ARG 116 CO 0.06 0.23 -0.10 1.63 -1.51 0.00 0.00 179.97 180.28 1p42 n LYS 117 N -4.48 0.53 -1.39 0.20 5.02 -1.16 -3.97 118.16 112.91 1p42 n LYS 117 Ca 0.04 -0.14 -0.03 0.00 -2.02 0.00 0.00 58.31 56.15 1p42 n LYS 117 Cb 0.17 -1.50 0.11 0.00 -0.02 0.00 0.00 35.03 33.79 1p42 n LYS 117 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1p42 n ASN 118 N -1.11 2.42 -4.75 4.39 3.02 -0.15 -5.03 115.26 114.05 1p42 n ASN 118 Ca 0.13 -3.31 -0.40 0.00 -0.03 0.00 0.00 54.58 50.97 1p42 n ASN 118 Cb 0.28 -0.43 -0.06 0.00 -0.61 0.00 0.00 39.78 38.96 1p42 n ASN 118 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1p42 s ILE 120 N -3.07 3.94 -0.18 2.41 1.01 -1.15 0.07 121.20 124.23 1p42 s ILE 120 Ca 0.40 1.95 -0.01 0.00 0.00 0.00 0.00 60.65 62.99 1p42 s ILE 120 Cb 0.38 -4.24 0.05 0.00 0.01 0.00 0.00 42.46 38.66 1p42 s ILE 120 CO -0.06 0.46 -0.04 -0.22 0.00 0.00 0.00 174.94 175.09 1p42 s LEU 121 N -1.20 1.71 0.48 2.97 2.96 -0.01 -4.65 118.68 120.94 1p42 s LEU 121 Ca 0.42 -0.77 -0.22 0.00 -0.22 0.00 0.00 54.13 53.35 1p42 s LEU 121 Cb -0.27 -0.91 -0.07 0.00 0.50 0.00 0.00 46.19 45.43 1p42 s LEU 121 CO 0.34 -0.21 1.11 0.20 -1.32 0.00 0.00 176.35 176.47 1p42 s ASN 122 N 1.63 6.20 0.25 3.68 -0.87 -1.26 -1.49 114.94 123.08 1p42 s ASN 122 Ca -0.01 2.15 0.00 0.00 -1.57 0.00 0.00 52.86 53.43 1p42 s ASN 122 Cb -0.16 -2.59 0.00 0.00 -0.02 0.00 0.00 41.25 38.49 1p42 s ASN 122 CO -0.07 -0.89 0.03 0.00 -2.57 0.00 0.00 177.10 173.60 1p42 n GLN 123 N -0.72 1.35 -2.38 -0.60 6.02 0.48 -4.91 117.38 116.62 1p42 n GLN 123 Ca 0.08 -1.80 -0.40 0.00 -0.01 0.00 0.00 57.00 54.87 1p42 n GLN 123 Cb 0.50 0.44 0.03 0.00 1.02 0.00 0.00 30.24 32.22 1p42 n GLN 123 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1p42 n ASN 124 N -1.28 7.38 -3.63 1.08 3.02 -1.26 -4.53 115.26 116.03 1p42 n ASN 124 Ca -0.09 -3.75 -0.11 0.00 -0.03 0.00 0.00 54.58 50.60 1p42 n ASN 124 Cb 0.31 -1.12 -0.07 0.00 -0.61 0.00 0.00 39.78 38.29 1p42 n ASN 124 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1p42 s ARG 125 N -4.23 0.71 0.23 3.52 3.52 -1.26 -5.04 118.95 116.39 1p42 s ARG 125 Ca 0.44 0.89 -0.30 0.00 -0.13 0.00 0.00 55.73 56.63 1p42 s ARG 125 Cb 0.28 0.32 -0.09 0.00 -1.56 0.00 0.00 34.95 33.90 1p42 s ARG 125 CO -0.24 -0.09 1.19 -2.00 -0.81 0.00 0.00 175.30 173.35 1p42 s GLU 126 N 0.52 4.51 0.32 5.12 2.56 -1.26 -0.31 118.70 130.15 1p42 s GLU 126 Ca -0.01 1.91 -0.29 0.00 0.00 0.00 0.00 54.97 56.58 1p42 s GLU 126 Cb -0.05 -3.20 -0.10 0.00 2.00 0.00 0.00 34.13 32.77 1p42 s GLU 126 CO -0.04 -0.03 1.34 0.42 -0.56 0.00 0.00 175.26 176.38 1p42 s ILE 127 N -0.45 2.68 -0.74 -3.70 1.01 0.13 -4.72 121.20 115.40 1p42 s ILE 127 Ca 0.50 0.66 -0.12 0.00 0.00 0.00 0.00 60.65 61.70 1p42 s ILE 127 Cb -0.34 -3.42 0.19 0.00 0.01 0.00 0.00 42.46 38.91 1p42 s ILE 127 CO 0.40 0.15 0.65 -0.62 0.00 0.00 0.00 174.94 175.52 1p42 s ASP 128 N -0.31 6.34 0.61 3.58 -1.08 -1.26 -4.81 116.67 119.74 1p42 s ASP 128 Ca 0.51 -2.61 -0.17 0.00 -0.52 0.00 0.00 52.55 49.76 1p42 s ASP 128 Cb -0.40 -2.13 -0.03 0.00 -1.46 0.00 0.00 42.92 38.90 1p42 s ASP 128 CO 0.52 -0.56 1.14 -0.31 0.52 0.00 0.00 175.17 176.47 1p42 s TYR 129 N 0.31 2.57 -0.34 -5.34 1.51 -1.26 -4.67 117.35 110.12 1p42 s TYR 129 Ca 0.16 1.55 -0.19 0.00 -1.01 0.00 0.00 57.07 57.57 1p42 s TYR 129 Cb -0.15 -3.28 -0.00 0.00 -0.11 0.00 0.00 41.96 38.42 1p42 s TYR 129 CO -0.06 -1.77 0.58 0.12 -1.11 0.00 0.00 175.55 173.31 1p42 s PHE 130 N -1.98 3.17 -0.24 2.71 5.36 0.34 -4.97 117.98 122.37 1p42 s PHE 130 Ca 0.71 0.31 -0.06 0.00 -0.96 0.00 0.00 56.93 56.93 1p42 s PHE 130 Cb -0.24 -3.01 -0.02 0.00 -0.34 0.00 0.00 43.02 39.41 1p42 s PHE 130 CO 0.34 -0.56 0.03 0.08 -1.46 0.00 0.00 175.22 173.66 1p42 s VAL 131 N 2.54 3.99 -0.01 3.12 1.01 -1.26 -1.00 120.40 128.80 1p42 s VAL 131 Ca 0.22 -0.31 -0.30 0.00 0.00 0.00 0.00 61.98 61.59 1p42 s VAL 131 Cb -0.15 -2.86 -0.07 0.00 0.00 0.00 0.00 36.38 33.30 1p42 s VAL 131 CO 0.14 0.35 1.72 -0.69 0.00 0.00 0.00 175.10 176.62 1p42 s VAL 132 N 1.56 3.34 -0.12 2.92 1.01 -0.79 -4.84 120.40 123.49 1p42 s VAL 132 Ca 0.06 0.51 0.17 0.00 0.00 0.00 0.00 61.98 62.71 1p42 s VAL 132 Cb -0.15 -3.33 -0.21 0.00 0.00 0.00 0.00 36.38 32.69 1p42 s VAL 132 CO 0.01 -0.04 0.54 -0.62 0.00 0.00 0.00 175.10 175.00 1p42 n GLU 133 N 6.89 0.65 -3.82 2.72 1.02 -1.26 -3.97 120.64 122.87 1p42 n GLU 133 Ca 0.18 0.14 -0.09 0.00 -0.02 0.00 0.00 57.16 57.36 1p42 n GLU 133 Cb 0.42 -1.70 -0.07 0.00 -0.02 0.00 0.00 31.44 30.07 1p42 n GLU 133 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 1p42 s GLU 134 N -2.78 0.87 0.65 3.49 -1.05 -1.26 -4.76 118.70 113.87 1p42 s GLU 134 Ca -0.06 -0.92 -0.18 0.00 -0.15 0.00 0.00 54.97 53.67 1p42 s GLU 134 Cb 0.08 0.36 -0.01 0.00 -0.44 0.00 0.00 34.13 34.13 1p42 s GLU 134 CO 0.83 -0.29 1.28 -2.14 0.95 0.00 0.00 175.26 175.89 1p42 s PRO 135 N -3.84 2.53 -0.08 -4.83 0.02 -1.26 -4.60 135.00 122.95 1p42 s PRO 135 Ca 0.05 2.03 -0.23 0.00 0.02 0.00 0.00 61.00 62.87 1p42 s PRO 135 Cb 0.04 -1.85 0.05 0.00 0.02 0.00 0.00 34.50 32.77 1p42 s PRO 135 CO -0.11 -1.61 0.53 -1.50 -0.33 0.00 0.00 177.00 173.98 1p42 s ILE 136 N -1.45 0.02 -0.02 2.83 2.07 -0.12 -4.98 121.20 119.55 1p42 s ILE 136 Ca 0.82 -0.16 0.00 0.00 -1.41 0.00 0.00 60.65 59.90 1p42 s ILE 136 Cb -0.37 -0.82 0.02 0.00 0.13 0.00 0.00 42.46 41.42 1p42 s ILE 136 CO 0.40 -0.09 0.01 -0.63 -1.91 0.00 0.00 174.94 172.72 1p42 s ILE 137 N -0.89 0.08 0.02 2.00 1.01 -1.26 -1.15 121.20 121.01 1p42 s ILE 137 Ca -0.09 0.08 0.08 0.00 0.00 0.00 0.00 60.65 60.72 1p42 s ILE 137 Cb -0.03 -0.16 -0.02 0.00 0.01 0.00 0.00 42.46 42.26 1p42 s ILE 137 CO 0.06 0.09 -0.22 0.68 0.00 0.00 0.00 174.94 175.55 1p42 s VAL 138 N 0.71 1.78 0.15 2.92 -7.23 -0.71 -5.00 120.40 113.01 1p42 s VAL 138 Ca -0.06 -1.15 0.01 0.00 -1.81 0.00 0.00 61.98 58.96 1p42 s VAL 138 Cb -0.09 -1.52 -0.04 0.00 0.56 0.00 0.00 36.38 35.28 1p42 s VAL 138 CO -0.02 0.33 0.01 -1.61 -0.31 0.00 0.00 175.10 173.51 1p42 s GLU 139 N -0.97 1.01 -0.30 4.82 2.02 -1.26 -1.54 118.70 122.47 1p42 s GLU 139 Ca 0.09 -1.47 -0.14 0.00 0.02 0.00 0.00 54.97 53.47 1p42 s GLU 139 Cb -0.09 -0.09 0.18 0.00 0.10 0.00 0.00 34.13 34.23 1p42 s GLU 139 CO 0.01 -0.16 1.06 0.34 0.02 0.00 0.00 175.26 176.53 1p42 s ASP 140 N -3.11 -0.44 -1.24 -0.19 -1.08 -0.21 -4.98 116.67 105.41 1p42 s ASP 140 Ca 0.22 0.32 -0.19 0.00 -0.52 0.00 0.00 52.55 52.38 1p42 s ASP 140 Cb 0.07 1.39 0.01 0.00 -1.46 0.00 0.00 42.92 42.92 1p42 s ASP 140 CO 0.02 -0.08 0.64 -0.62 0.52 0.00 0.00 175.17 175.65 1p42 n GLU 141 N 5.38 -1.38 0.00 4.34 -0.58 -1.26 -0.85 120.64 126.29 1p42 n GLU 141 Ca -0.07 0.33 0.00 0.00 -0.42 0.00 0.00 57.16 56.99 1p42 n GLU 141 Cb 0.54 -3.76 0.00 0.00 -0.57 0.00 0.00 31.44 27.65 1p42 n GLU 141 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1p42 n GLY 142 N -1.90 2.95 3.83 0.62 0.00 -1.26 -5.00 105.19 104.44 1p42 n GLY 142 Ca -0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 1p42 n GLY 142 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p42 s ARG 143 N -0.05 4.10 -0.07 1.61 0.52 -0.03 -4.92 118.95 120.13 1p42 s ARG 143 Ca 0.00 0.69 -0.14 0.00 -0.52 0.00 0.00 55.73 55.75 1p42 s ARG 143 Cb 0.00 -2.82 0.03 0.00 0.52 0.00 0.00 34.95 32.68 1p42 s ARG 143 CO 0.00 0.38 0.34 -1.17 0.02 0.00 0.00 175.30 174.88 1p42 s LEU 144 N -2.15 0.72 -0.03 2.53 0.20 -0.50 -1.05 118.68 118.40 1p42 s LEU 144 Ca 0.43 0.37 0.00 0.00 0.69 0.00 0.00 54.13 55.63 1p42 s LEU 144 Cb -0.15 1.29 0.02 0.00 -0.43 0.00 0.00 46.19 46.92 1p42 s LEU 144 CO 0.20 -0.31 0.00 -0.63 -0.29 0.00 0.00 176.35 175.31 1p42 s ILE 145 N -0.68 0.16 -0.01 6.68 1.01 -0.59 0.84 121.20 128.61 1p42 s ILE 145 Ca -0.08 0.08 0.07 0.00 0.00 0.00 0.00 60.65 60.72 1p42 s ILE 145 Cb -0.04 -0.24 -0.02 0.00 0.01 0.00 0.00 42.46 42.17 1p42 s ILE 145 CO 0.03 0.13 -0.23 -0.75 0.00 0.00 0.00 174.94 174.11 1p42 s LYS 146 N 0.89 2.11 0.03 2.79 2.20 0.11 -1.75 119.74 126.12 1p42 s LYS 146 Ca -0.09 -0.93 0.04 0.00 -0.36 0.00 0.00 55.97 54.63 1p42 s LYS 146 Cb -0.12 -2.10 -0.02 0.00 -1.51 0.00 0.00 37.83 34.08 1p42 s LYS 146 CO -0.02 0.56 -0.13 0.00 -0.36 0.00 0.00 175.35 175.40 1p42 s ALA 147 N -0.71 1.08 0.14 3.13 0.00 -0.30 -0.58 121.76 124.52 1p42 s ALA 147 Ca 0.11 -0.73 -0.17 0.00 0.00 0.00 0.00 51.96 51.17 1p42 s ALA 147 Cb -0.10 -0.19 0.04 0.00 0.00 0.00 0.00 23.12 22.87 1p42 s ALA 147 CO 0.01 0.21 0.43 -1.83 0.00 0.00 0.00 175.76 174.58 1p42 s GLU 148 N -0.93 1.12 0.42 0.00 -1.05 -0.41 -0.94 118.70 116.91 1p42 s GLU 148 Ca 0.02 -0.71 -0.24 0.00 -0.15 0.00 0.00 54.97 53.89 1p42 s GLU 148 Cb -0.07 0.48 -0.11 0.00 -0.44 0.00 0.00 34.13 33.99 1p42 s GLU 148 CO 0.01 -0.45 0.88 -2.30 0.95 0.00 0.00 175.26 174.35 1p42 n PRO 149 N -0.25 1.10 -3.64 -4.83 -0.02 -1.25 -0.55 135.00 125.56 1p42 n PRO 149 Ca -0.15 0.40 -0.08 0.00 -2.02 0.00 0.00 63.50 61.65 1p42 n PRO 149 Cb 0.64 -1.88 -0.07 0.00 -0.02 0.00 0.00 33.50 32.16 1p42 n PRO 149 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1p42 s SER 150 N -0.82 -0.35 0.47 2.55 0.15 -1.26 -4.38 113.70 110.06 1p42 s SER 150 Ca 0.64 0.67 0.28 0.00 0.70 0.00 0.00 55.95 58.23 1p42 s SER 150 Cb -0.57 0.67 0.86 0.00 -1.71 0.00 0.00 66.02 65.27 1p42 s SER 150 CO 0.57 -0.13 1.79 0.44 1.20 0.00 0.00 173.24 177.12 1p42 h ASP 151 N 3.87 0.00 -3.67 5.45 3.32 -1.93 -3.24 116.42 120.22 1p42 h ASP 151 Ca -0.27 0.00 -0.44 0.00 0.02 0.00 0.00 57.03 56.34 1p42 h ASP 151 Cb 1.18 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 40.57 1p42 h ASP 151 CO 0.13 0.00 -0.75 0.42 -1.72 0.00 0.00 179.24 177.32 1p42 s THR 152 N -3.42 1.54 -0.22 0.35 -4.23 -1.26 -4.88 115.64 103.52 1p42 s THR 152 Ca 0.04 -1.96 -0.29 0.00 -1.18 0.00 0.00 61.69 58.31 1p42 s THR 152 Cb 0.07 -1.80 -0.00 0.00 1.34 0.00 0.00 72.50 72.11 1p42 s THR 152 CO 0.60 -0.49 1.22 -0.22 -0.54 0.00 0.00 174.62 175.19 1p42 s LEU 153 N -2.85 4.08 -0.06 4.79 2.96 -1.26 -3.41 118.68 122.93 1p42 s LEU 153 Ca 0.15 1.49 0.01 0.00 -0.22 0.00 0.00 54.13 55.57 1p42 s LEU 153 Cb -0.03 -3.54 0.02 0.00 0.50 0.00 0.00 46.19 43.14 1p42 s LEU 153 CO 0.05 -0.83 -0.09 -0.70 -1.32 0.00 0.00 176.35 173.46 1p42 s GLU 154 N 3.61 1.37 -0.07 1.98 2.12 -0.45 -3.42 118.70 123.85 1p42 s GLU 154 Ca 0.53 -0.28 -0.00 0.00 0.36 0.00 0.00 54.97 55.57 1p42 s GLU 154 Cb -0.19 -1.23 0.02 0.00 0.26 0.00 0.00 34.13 33.00 1p42 s GLU 154 CO 0.15 -0.05 -0.04 0.08 -0.54 0.00 0.00 175.26 174.87 1p42 s VAL 155 N 0.89 0.59 -0.07 3.70 1.01 -0.67 -0.04 120.40 125.81 1p42 s VAL 155 Ca -0.11 -0.07 0.05 0.00 0.00 0.00 0.00 61.98 61.85 1p42 s VAL 155 Cb -0.15 -0.66 -0.01 0.00 0.00 0.00 0.00 36.38 35.56 1p42 s VAL 155 CO 0.01 0.27 -0.21 -0.89 0.00 0.00 0.00 175.10 174.28 1p42 s THR 156 N 1.46 2.42 -0.07 3.92 2.01 0.04 -0.07 115.64 125.34 1p42 s THR 156 Ca -0.02 -0.93 0.04 0.00 0.31 0.00 0.00 61.69 61.08 1p42 s THR 156 Cb -0.13 -1.92 0.00 0.00 0.01 0.00 0.00 72.50 70.46 1p42 s THR 156 CO -0.03 0.57 -0.18 -0.47 -0.69 0.00 0.00 174.62 173.81 1p42 s TYR 157 N -0.22 1.98 -0.15 4.92 5.04 -0.35 -0.83 117.35 127.75 1p42 s TYR 157 Ca -0.01 -0.72 0.02 0.00 -2.44 0.00 0.00 57.07 53.91 1p42 s TYR 157 Cb -0.13 -1.36 0.01 0.00 0.35 0.00 0.00 41.96 40.83 1p42 s TYR 157 CO 0.03 -0.30 -0.21 -2.00 -1.34 0.00 0.00 175.55 171.74 1p42 s GLU 158 N 0.35 2.92 0.19 4.97 2.12 0.48 -1.75 118.70 127.98 1p42 s GLU 158 Ca -0.13 -0.81 0.07 0.00 0.36 0.00 0.00 54.97 54.46 1p42 s GLU 158 Cb -0.16 -2.41 -0.04 0.00 0.26 0.00 0.00 34.13 31.79 1p42 s GLU 158 CO 0.05 -0.07 0.06 0.20 -0.54 0.00 0.00 175.26 174.96 1p42 s GLY 159 N 0.97 1.67 -0.38 -1.50 0.00 0.09 -1.18 107.32 106.98 1p42 s GLY 159 Ca -0.04 -1.37 0.01 0.00 0.00 0.00 0.00 44.72 43.32 1p42 s GLY 159 CO -0.05 -1.40 0.25 1.85 0.00 0.00 0.00 173.10 173.75 1p42 s GLU 160 N -3.20 0.76 0.21 2.90 2.12 -1.26 -2.15 118.70 118.07 1p42 s GLU 160 Ca 0.30 -1.63 -0.15 0.00 0.36 0.00 0.00 54.97 53.84 1p42 s GLU 160 Cb -0.09 -1.49 -0.08 0.00 0.26 0.00 0.00 34.13 32.74 1p42 s GLU 160 CO 0.21 -1.25 0.63 -0.06 -0.54 0.00 0.00 175.26 174.25 1p42 s PHE 161 N 0.69 3.56 -1.68 5.30 0.40 0.24 -4.97 117.98 121.52 1p42 s PHE 161 Ca 0.22 1.15 0.30 0.00 -0.60 0.00 0.00 56.93 58.00 1p42 s PHE 161 Cb -0.16 -2.45 1.63 0.00 0.51 0.00 0.00 43.02 42.55 1p42 s PHE 161 CO -0.05 0.33 2.08 1.63 0.70 0.00 0.00 175.22 179.91 1p42 n LYS 162 N 0.48 0.65 -0.10 0.44 5.02 -1.26 -3.60 118.16 119.78 1p42 n LYS 162 Ca -0.02 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1p42 n LYS 162 Cb 0.52 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.03 1p42 n LYS 162 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1p42 n ASN 163 N -1.16 0.87 0.30 4.39 6.94 -1.26 -4.98 115.26 120.35 1p42 n ASN 163 Ca 0.18 -0.07 0.19 0.00 -0.02 0.00 0.00 54.58 54.85 1p42 n ASN 163 Cb 0.18 0.00 0.98 0.00 -2.36 0.00 0.00 39.78 38.58 1p42 n ASN 163 CO 0.00 0.00 0.00 2.19 -1.03 0.00 0.00 177.26 178.42 1p42 h PHE 167 N 0.03 0.00 -0.78 -2.53 -5.15 -1.44 -2.53 116.94 104.54 1p42 h PHE 167 Ca 0.00 0.00 -0.00 0.00 -0.20 0.00 0.00 57.97 57.77 1p42 h PHE 167 Cb 0.00 0.00 -0.04 0.00 0.22 0.00 0.00 35.95 36.13 1p42 h PHE 167 CO 0.00 0.00 0.48 -0.07 -2.00 0.00 0.00 178.31 176.72 1p42 h LEU 168 N 0.00 0.93 0.00 2.10 3.38 -1.87 -3.47 115.31 116.37 1p42 h LEU 168 Ca 0.03 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1p42 h LEU 168 Cb 0.31 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1p42 h LEU 168 CO -0.00 0.70 0.00 0.61 0.09 0.00 0.00 178.44 179.84 1p42 n GLY 169 N -1.32 3.18 3.61 0.83 0.00 -0.95 -4.49 105.19 106.04 1p42 n GLY 169 Ca 0.08 -0.27 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 1p42 n GLY 169 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p42 s ARG 170 N 0.00 4.00 0.06 1.61 0.52 -1.26 -0.59 118.95 123.28 1p42 s ARG 170 Ca 0.00 -0.16 0.01 0.00 -0.52 0.00 0.00 55.73 55.06 1p42 s ARG 170 Cb 0.00 -3.64 -0.03 0.00 0.52 0.00 0.00 34.95 31.80 1p42 s ARG 170 CO 0.00 -0.18 -0.05 -0.65 0.02 0.00 0.00 175.30 174.44 1p42 s GLN 171 N 1.77 0.62 -0.05 3.54 -0.21 -0.91 -5.01 119.66 119.40 1p42 s GLN 171 Ca 0.11 -1.07 -0.09 0.00 0.02 0.00 0.00 55.36 54.33 1p42 s GLN 171 Cb -0.16 -0.03 0.02 0.00 1.00 0.00 0.00 33.01 33.84 1p42 s GLN 171 CO 0.10 -0.04 0.22 0.21 -2.12 0.00 0.00 175.29 173.66 1p42 s LYS 172 N -3.04 0.40 -0.08 2.91 2.20 -1.26 -0.73 119.74 120.14 1p42 s LYS 172 Ca 0.01 0.04 -0.06 0.00 -0.36 0.00 0.00 55.97 55.60 1p42 s LYS 172 Cb 0.01 0.18 0.02 0.00 -1.51 0.00 0.00 37.83 36.53 1p42 s LYS 172 CO -0.05 -0.08 0.20 0.12 -0.36 0.00 0.00 175.35 175.18 1p42 s PHE 173 N -0.54 -0.23 -0.13 4.03 5.36 -0.72 -5.01 117.98 120.74 1p42 s PHE 173 Ca -0.06 0.56 0.03 0.00 -0.96 0.00 0.00 56.93 56.50 1p42 s PHE 173 Cb -0.04 0.06 0.01 0.00 -0.34 0.00 0.00 43.02 42.71 1p42 s PHE 173 CO 0.01 -0.13 -0.22 0.99 -1.46 0.00 0.00 175.22 174.42 1p42 s THR 174 N 0.32 2.12 -0.12 0.12 2.01 -1.26 -1.21 115.64 117.61 1p42 s THR 174 Ca -0.02 -0.97 -0.06 0.00 0.31 0.00 0.00 61.69 60.96 1p42 s THR 174 Cb -0.03 -1.84 -0.04 0.00 0.01 0.00 0.00 72.50 70.60 1p42 s THR 174 CO -0.01 0.55 0.10 0.12 -0.69 0.00 0.00 174.62 174.68 1p42 s PHE 175 N 0.68 3.44 0.05 4.92 5.36 0.89 -4.98 117.98 128.35 1p42 s PHE 175 Ca -0.10 0.40 0.03 0.00 -0.96 0.00 0.00 56.93 56.29 1p42 s PHE 175 Cb -0.16 -1.92 -0.03 0.00 -0.34 0.00 0.00 43.02 40.58 1p42 s PHE 175 CO 0.01 0.60 -0.09 0.14 -1.46 0.00 0.00 175.22 174.43 1p42 s VAL 179 N -0.83 0.64 0.24 3.12 -7.23 -1.26 -1.68 120.40 113.40 1p42 s VAL 179 Ca 0.13 -1.13 -0.30 0.00 -1.81 0.00 0.00 61.98 58.88 1p42 s VAL 179 Cb -0.12 -0.70 -0.15 0.00 0.56 0.00 0.00 36.38 35.97 1p42 s VAL 179 CO 0.03 -0.36 1.00 -0.62 -0.31 0.00 0.00 175.10 174.84 1p42 n GLU 180 N 1.41 1.13 0.00 4.82 1.02 -1.22 -1.60 120.64 126.20 1p42 n GLU 180 Ca -0.22 0.40 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 1p42 n GLU 180 Cb 0.55 -1.77 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 1p42 n GLU 180 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1p42 n GLY 181 N 1.57 3.38 1.84 0.62 0.00 -1.26 -4.90 105.19 106.45 1p42 n GLY 181 Ca 0.12 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.99 1p42 n GLY 181 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1p42 n ASN 182 N 0.00 3.43 -0.33 1.61 3.02 -0.63 -4.70 115.26 117.67 1p42 n ASN 182 Ca 0.00 -3.62 0.08 0.00 -0.03 0.00 0.00 54.58 51.01 1p42 n ASN 182 Cb 0.00 -0.76 0.24 0.00 -0.61 0.00 0.00 39.78 38.65 1p42 n ASN 182 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1p42 h GLU 183 N 1.17 0.79 0.00 3.52 3.07 -1.91 -1.16 114.58 120.06 1p42 h GLU 183 Ca 0.46 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.27 1p42 h GLU 183 Cb 2.41 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 30.14 1p42 h GLU 183 CO 0.83 0.52 0.00 0.39 -1.40 0.00 0.00 179.01 179.35 1p42 n GLU 184 N -4.74 0.10 0.11 2.33 1.02 -1.26 -1.99 120.64 116.22 1p42 n GLU 184 Ca 0.19 0.46 0.13 0.00 -0.02 0.00 0.00 57.16 57.91 1p42 n GLU 184 Cb 0.42 -1.75 0.39 0.00 -0.02 0.00 0.00 31.44 30.48 1p42 n GLU 184 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1p42 h GLU 185 N 0.00 0.00 0.00 3.49 5.08 -1.59 -3.37 114.58 118.20 1p42 h GLU 185 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1p42 h GLU 185 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1p42 h GLU 185 CO 0.00 0.00 -0.62 0.44 -1.00 0.00 0.00 179.01 177.83 1p42 n ILE 186 N -2.32 0.00 0.79 3.13 -5.35 -0.84 -4.69 119.36 110.07 1p42 n ILE 186 Ca 0.05 -0.20 0.11 0.00 -0.27 0.00 0.00 62.75 62.44 1p42 n ILE 186 Cb 0.43 0.69 0.48 0.00 -1.74 0.00 0.00 39.64 39.50 1p42 n ILE 186 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 1p42 n VAL 187 N -1.31 0.47 0.91 7.28 0.24 -1.06 -2.78 118.33 122.07 1p42 n VAL 187 Ca -0.00 0.12 0.10 0.00 -2.04 0.00 0.00 64.34 62.52 1p42 n VAL 187 Cb 0.01 -0.74 -0.10 0.00 -1.47 0.00 0.00 33.84 31.54 1p42 n VAL 187 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1p42 n LEU 188 N -1.48 0.88 -4.68 1.34 4.77 -1.26 -0.75 117.00 115.81 1p42 n LEU 188 Ca 0.06 -0.41 -0.42 0.00 -0.03 0.00 0.00 56.01 55.20 1p42 n LEU 188 Cb 0.25 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.30 1p42 n LEU 188 CO 0.20 0.22 1.18 0.00 -1.33 0.00 0.00 177.39 177.66 1p42 s ALA 189 N -3.05 3.61 0.33 -1.18 0.00 -1.12 -4.81 121.76 115.54 1p42 s ALA 189 Ca 0.07 0.84 -0.11 0.00 0.00 0.00 0.00 51.96 52.76 1p42 s ALA 189 Cb 0.16 -3.64 -0.07 0.00 0.00 0.00 0.00 23.12 19.57 1p42 s ALA 189 CO 0.86 -1.07 0.69 1.03 0.00 0.00 0.00 175.76 177.27 1p42 s ARG 190 N 2.95 3.85 0.66 0.00 0.52 -1.26 -4.36 118.95 121.32 1p42 s ARG 190 Ca 0.65 0.46 -0.17 0.00 -0.52 0.00 0.00 55.73 56.15 1p42 s ARG 190 Cb -0.31 -2.48 0.00 0.00 0.52 0.00 0.00 34.95 32.68 1p42 s ARG 190 CO 0.26 0.13 1.22 -0.08 0.02 0.00 0.00 175.30 176.85 1p42 s THR 191 N -2.09 2.40 0.08 0.02 -1.32 -0.18 -4.80 115.64 109.75 1p42 s THR 191 Ca 0.51 0.23 -0.02 0.00 -1.21 0.00 0.00 61.69 61.20 1p42 s THR 191 Cb -0.10 -2.95 -0.04 0.00 -1.51 0.00 0.00 72.50 67.90 1p42 s THR 191 CO 0.24 -0.08 0.02 0.72 -2.21 0.00 0.00 174.62 173.31 1p42 s PHE 192 N -1.74 0.57 0.01 9.09 -0.12 -1.26 -1.34 117.98 123.18 1p42 s PHE 192 Ca 0.77 -1.06 -0.15 0.00 -0.05 0.00 0.00 56.93 56.45 1p42 s PHE 192 Cb -0.31 -0.37 0.02 0.00 -0.63 0.00 0.00 43.02 41.73 1p42 s PHE 192 CO 0.40 -0.44 0.31 0.00 -0.05 0.00 0.00 175.22 175.44 1p42 s ALA 193 N -3.95 -0.76 0.05 1.99 0.00 -0.22 -4.90 121.76 113.97 1p42 s ALA 193 Ca 0.11 0.22 -0.08 0.00 0.00 0.00 0.00 51.96 52.21 1p42 s ALA 193 Cb 0.07 0.17 -0.05 0.00 0.00 0.00 0.00 23.12 23.31 1p42 s ALA 193 CO -0.07 -0.32 0.34 -0.06 0.00 0.00 0.00 175.76 175.65 1p42 s PHE 194 N -1.78 3.58 0.48 0.00 0.40 -1.26 -1.04 117.98 118.35 1p42 s PHE 194 Ca -0.10 0.68 0.19 0.00 -0.60 0.00 0.00 56.93 57.10 1p42 s PHE 194 Cb -0.04 -2.07 1.20 0.00 0.51 0.00 0.00 43.02 42.62 1p42 s PHE 194 CO 0.02 0.56 1.98 0.38 0.70 0.00 0.00 175.22 178.85 1p42 h ASP 195 N 3.81 0.21 0.37 1.36 3.04 -1.16 -0.97 116.42 123.08 1p42 h ASP 195 Ca -0.49 0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.31 1p42 h ASP 195 Cb 1.19 -0.03 0.00 0.00 -1.04 0.00 0.00 39.33 39.45 1p42 h ASP 195 CO 0.67 0.11 0.00 -2.67 -2.04 0.00 0.00 179.24 175.31 1p42 n TRP 196 N -4.44 0.00 0.58 4.15 2.14 -1.26 -2.76 117.44 115.85 1p42 n TRP 196 Ca 0.11 0.00 0.06 0.00 2.07 0.00 0.00 57.50 59.74 1p42 n TRP 196 Cb 0.51 -0.28 -0.02 0.00 -0.81 0.00 0.00 31.31 30.70 1p42 n TRP 196 CO 0.00 0.00 0.00 -0.85 2.07 0.00 0.00 177.69 178.91 1p42 n GLU 197 N -1.28 2.19 -0.28 -2.67 0.28 -0.37 -4.59 120.64 113.92 1p42 n GLU 197 Ca 0.09 -0.49 -0.05 0.00 -0.16 0.00 0.00 57.16 56.56 1p42 n GLU 197 Cb 0.16 -1.15 0.07 0.00 1.43 0.00 0.00 31.44 31.94 1p42 n GLU 197 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 1p42 h ILE 198 N 1.01 1.21 -0.33 3.84 2.04 -1.53 -2.26 117.51 121.49 1p42 h ILE 198 Ca 0.00 -0.45 0.06 0.00 1.00 0.00 0.00 64.86 65.47 1p42 h ILE 198 Cb 0.40 0.12 -0.06 0.00 -0.74 0.00 0.00 36.82 36.55 1p42 h ILE 198 CO 0.00 0.22 -0.04 -0.08 0.00 0.00 0.00 178.15 178.25 1p42 h GLU 199 N 1.05 0.04 -0.22 2.37 4.81 -1.81 -1.24 114.58 119.58 1p42 h GLU 199 Ca 0.28 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.49 1p42 h GLU 199 Cb -0.06 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 1p42 h GLU 199 CO -0.05 0.03 0.08 1.25 -0.73 0.00 0.00 179.01 179.59 1p42 h HIS 200 N 0.04 0.34 -0.70 0.92 2.76 -1.80 -1.72 115.15 114.99 1p42 h HIS 200 Ca 0.16 -0.03 0.03 0.00 -2.20 0.00 0.00 60.37 58.33 1p42 h HIS 200 Cb 0.23 -0.10 -0.05 0.00 1.55 0.00 0.00 27.41 29.04 1p42 h HIS 200 CO -0.27 0.39 0.43 0.82 -1.30 0.00 0.00 177.93 178.00 1p42 h ILE 201 N 0.20 1.08 -0.36 6.26 2.04 -1.08 -1.84 117.51 123.81 1p42 h ILE 201 Ca 0.07 -0.29 -0.12 0.00 1.00 0.00 0.00 64.86 65.52 1p42 h ILE 201 Cb 0.19 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.43 1p42 h ILE 201 CO -0.00 0.15 -0.27 0.11 0.00 0.00 0.00 178.15 178.14 1p42 h LYS 202 N 0.84 0.74 -0.18 2.37 1.79 -1.15 -1.31 116.57 119.67 1p42 h LYS 202 Ca 0.28 -0.32 -0.09 0.00 -2.18 0.00 0.00 60.65 58.35 1p42 h LYS 202 Cb 0.04 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.65 1p42 h LYS 202 CO -0.12 0.93 -0.29 1.57 -1.08 0.00 0.00 179.45 180.46 1p42 h LYS 203 N 0.64 0.34 -0.68 3.15 2.10 -0.73 -2.58 116.57 118.81 1p42 h LYS 203 Ca 0.08 -0.13 0.00 0.00 -2.00 0.00 0.00 60.65 58.60 1p42 h LYS 203 Cb 0.78 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.09 1p42 h LYS 203 CO 0.06 0.60 0.00 1.33 -2.00 0.00 0.00 179.45 179.45 1p42 n VAL 204 N -4.11 0.54 -1.03 0.07 0.24 -0.75 -4.86 118.33 108.43 1p42 n VAL 204 Ca -0.01 -0.31 -0.01 0.00 -2.04 0.00 0.00 64.34 61.97 1p42 n VAL 204 Cb 0.41 -0.27 -0.00 0.00 -1.47 0.00 0.00 33.84 32.50 1p42 n VAL 204 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1p42 n GLY 205 N 0.35 0.49 1.85 7.63 0.00 -0.97 -5.05 105.19 109.49 1p42 n GLY 205 Ca 0.07 -0.84 -0.14 0.00 0.00 0.00 0.00 46.02 45.10 1p42 n GLY 205 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1p42 n LEU 206 N -0.13 0.00 -1.76 0.99 4.77 -0.50 -4.76 117.00 115.61 1p42 n LEU 206 Ca -0.01 -1.50 -0.16 0.00 -0.03 0.00 0.00 56.01 54.31 1p42 n LEU 206 Cb 0.04 0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.16 1p42 n LEU 206 CO 0.02 -0.33 -0.17 0.61 -1.33 0.00 0.00 177.39 176.19 1p42 n GLY 207 N 1.84 0.95 0.29 -0.72 0.00 -1.21 -3.96 105.19 102.38 1p42 n GLY 207 Ca -0.06 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.14 1p42 n GLY 207 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p42 h LYS 208 N 0.00 0.00 -0.30 1.61 1.57 -0.91 -2.65 116.57 115.90 1p42 h LYS 208 Ca -0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 1p42 h LYS 208 Cb 1.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1p42 h LYS 208 CO 0.48 0.04 0.00 0.41 -0.57 0.00 0.00 179.45 179.81 1p42 n GLY 209 N -0.52 1.62 3.77 3.86 0.00 0.12 -4.46 105.19 109.58 1p42 n GLY 209 Ca -0.01 -0.50 -0.39 0.00 0.00 0.00 0.00 46.02 45.12 1p42 n GLY 209 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1p42 s GLY 210 N -1.14 2.91 0.31 -0.02 0.00 -0.97 -4.68 107.32 103.73 1p42 s GLY 210 Ca 0.27 1.08 -0.18 0.00 0.00 0.00 0.00 44.72 45.89 1p42 s GLY 210 CO 0.21 1.63 0.73 -1.35 0.00 0.00 0.00 173.10 174.32 1p42 s SER 211 N -0.94 -0.14 0.00 1.64 1.04 -1.26 -5.01 113.70 109.03 1p42 s SER 211 Ca 0.56 -0.82 0.17 0.00 0.48 0.00 0.00 55.95 56.34 1p42 s SER 211 Cb -0.34 0.76 0.83 0.00 0.10 0.00 0.00 66.02 67.37 1p42 s SER 211 CO 0.43 -1.45 1.53 0.18 0.98 0.00 0.00 173.24 174.91 1p42 n LEU 212 N -0.48 0.00 0.14 2.42 4.77 -1.26 -0.84 117.00 121.75 1p42 n LEU 212 Ca -0.05 0.35 0.11 0.00 -0.03 0.00 0.00 56.01 56.39 1p42 n LEU 212 Cb 0.59 -0.35 0.06 0.00 -2.33 0.00 0.00 43.42 41.39 1p42 n LEU 212 CO 0.19 -0.15 0.31 0.11 -1.33 0.00 0.00 177.39 176.52 1p42 h LYS 213 N 0.00 0.00 0.00 3.23 1.57 -1.95 -3.37 116.57 116.04 1p42 h LYS 213 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1p42 h LYS 213 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1p42 h LYS 213 CO 0.00 0.04 0.00 0.27 -0.57 0.00 0.00 179.45 179.19 1p42 n ASN 214 N -2.87 0.64 -3.85 0.86 0.23 -0.92 -4.61 115.26 104.75 1p42 n ASN 214 Ca 0.01 -1.02 -0.14 0.00 -0.53 0.00 0.00 54.58 52.90 1p42 n ASN 214 Cb 0.57 0.00 -0.15 0.00 -2.08 0.00 0.00 39.78 38.12 1p42 n ASN 214 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 1p42 s THR 215 N -0.02 0.09 -0.39 5.53 2.01 -0.02 -3.70 115.64 119.15 1p42 s THR 215 Ca 0.00 0.03 -0.23 0.00 0.31 0.00 0.00 61.69 61.80 1p42 s THR 215 Cb 0.00 -0.14 0.01 0.00 0.01 0.00 0.00 72.50 72.39 1p42 s THR 215 CO 0.00 0.07 0.78 -0.22 -0.69 0.00 0.00 174.62 174.56 1p42 s LEU 216 N 0.43 4.17 -0.24 4.42 2.96 -0.45 -4.36 118.68 125.61 1p42 s LEU 216 Ca -0.04 0.21 -0.09 0.00 -0.22 0.00 0.00 54.13 54.00 1p42 s LEU 216 Cb -0.06 -3.00 -0.04 0.00 0.50 0.00 0.00 46.19 43.59 1p42 s LEU 216 CO -0.01 -0.78 0.11 -0.69 -1.32 0.00 0.00 176.35 173.66 1p42 s VAL 217 N 3.14 4.79 0.05 1.68 1.01 -1.26 -1.05 120.40 128.76 1p42 s VAL 217 Ca 0.31 -0.02 0.07 0.00 0.00 0.00 0.00 61.98 62.34 1p42 s VAL 217 Cb -0.13 -3.23 -0.03 0.00 0.00 0.00 0.00 36.38 32.99 1p42 s VAL 217 CO 0.18 0.35 -0.17 -0.76 0.00 0.00 0.00 175.10 174.71 1p42 s LEU 218 N 1.25 2.68 0.00 3.92 1.43 -0.20 -1.70 118.68 126.06 1p42 s LEU 218 Ca 0.06 -0.43 0.04 0.00 -1.03 0.00 0.00 54.13 52.77 1p42 s LEU 218 Cb -0.14 -1.55 0.04 0.00 0.03 0.00 0.00 46.19 44.57 1p42 s LEU 218 CO 0.05 0.24 0.37 0.61 0.23 0.00 0.00 176.35 177.85 1p42 n GLY 219 N 1.39 2.79 0.39 -3.19 0.00 0.15 -0.51 105.19 106.22 1p42 n GLY 219 Ca -0.16 -2.29 0.16 0.00 0.00 0.00 0.00 46.02 43.73 1p42 n GLY 219 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1p42 h LYS 220 N 0.00 0.45 0.00 1.61 3.64 -1.98 -3.22 116.57 117.07 1p42 h LYS 220 Ca -0.33 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 58.95 1p42 h LYS 220 Cb 1.20 -0.10 -0.14 0.00 -0.41 0.00 0.00 32.23 32.77 1p42 h LYS 220 CO 0.52 0.30 -0.59 -0.40 -2.27 0.00 0.00 179.45 177.01 1p42 n ASP 221 N -4.51 0.23 -3.92 4.20 5.75 -1.26 -1.30 116.55 115.74 1p42 n ASP 221 Ca 0.17 -1.86 -0.09 0.00 -0.01 0.00 0.00 54.79 53.00 1p42 n ASP 221 Cb 0.58 -0.15 -0.08 0.00 -1.03 0.00 0.00 41.12 40.43 1p42 n ASP 221 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1p42 s LYS 222 N 0.00 0.72 -0.25 0.11 -2.85 -1.22 -4.99 119.74 111.27 1p42 s LYS 222 Ca 0.11 -0.94 0.01 0.00 -1.00 0.00 0.00 55.97 54.15 1p42 s LYS 222 Cb 0.13 0.28 0.04 0.00 -2.06 0.00 0.00 37.83 36.23 1p42 s LYS 222 CO -0.06 -0.20 -0.10 0.08 0.10 0.00 0.00 175.35 175.18 1p42 s VAL 223 N -3.49 2.46 0.22 1.79 1.01 -1.26 0.33 120.40 121.45 1p42 s VAL 223 Ca 0.02 -1.33 -0.04 0.00 0.00 0.00 0.00 61.98 60.63 1p42 s VAL 223 Cb 0.04 -2.32 0.02 0.00 0.00 0.00 0.00 36.38 34.11 1p42 s VAL 223 CO -0.09 0.11 1.61 1.88 0.00 0.00 0.00 175.10 178.61 1p42 h TYR 224 N 7.89 0.82 -2.44 5.22 -1.99 -1.71 -3.44 116.97 121.32 1p42 h TYR 224 Ca -0.27 -0.20 -0.53 0.00 2.00 0.00 0.00 58.73 59.72 1p42 h TYR 224 Cb 1.08 -0.19 0.03 0.00 2.00 0.00 0.00 36.73 39.65 1p42 h TYR 224 CO 0.59 0.92 1.15 0.09 -0.00 0.00 0.00 178.16 180.91 1p42 n ASN 225 N -4.09 4.08 0.27 3.88 4.13 -1.26 -4.86 115.26 117.41 1p42 n ASN 225 Ca -0.01 0.96 0.11 0.00 1.68 0.00 0.00 54.58 57.32 1p42 n ASN 225 Cb 0.46 -1.54 0.74 0.00 -1.54 0.00 0.00 39.78 37.91 1p42 n ASN 225 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 1p42 h PRO 226 N 9.18 0.00 0.00 3.52 0.13 -1.95 -1.03 132.00 141.85 1p42 h PRO 226 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1p42 h PRO 226 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1p42 h PRO 226 CO 0.95 0.03 0.00 -0.85 -0.23 0.00 0.00 178.00 177.89 1p42 n GLU 227 N -4.19 0.10 0.00 0.86 0.00 -1.26 -5.01 120.64 111.14 1p42 n GLU 227 Ca -0.03 0.09 0.00 0.00 0.00 0.00 0.00 57.16 57.23 1p42 n GLU 227 Cb 0.11 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.05 1p42 n GLU 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1p42 n GLY 228 N 0.82 -0.41 3.83 -1.84 0.00 -0.39 -4.81 105.19 102.39 1p42 n GLY 228 Ca 0.07 -1.07 -0.37 0.00 0.00 0.00 0.00 46.02 44.65 1p42 n GLY 228 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p42 s LEU 229 N 0.00 4.41 0.36 0.99 1.43 -1.26 -4.94 118.68 119.67 1p42 s LEU 229 Ca 0.00 1.20 0.18 0.00 -1.03 0.00 0.00 54.13 54.49 1p42 s LEU 229 Cb 0.00 -3.19 0.59 0.00 0.03 0.00 0.00 46.19 43.62 1p42 s LEU 229 CO 0.00 0.15 1.69 0.03 0.23 0.00 0.00 176.35 178.45 1p42 h ARG 230 N 3.89 0.00 -3.06 1.70 3.08 -1.96 -3.44 114.38 114.59 1p42 h ARG 230 Ca -0.49 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.44 1p42 h ARG 230 Cb 1.20 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 31.04 1p42 h ARG 230 CO 0.65 0.39 -0.30 0.71 -1.07 0.00 0.00 179.97 180.35 1p42 s TYR 231 N -3.50 -0.19 0.60 3.04 1.51 -1.26 -4.99 117.35 112.56 1p42 s TYR 231 Ca 0.01 0.33 0.31 0.00 -1.01 0.00 0.00 57.07 56.71 1p42 s TYR 231 Cb 0.10 0.09 1.86 0.00 -0.11 0.00 0.00 41.96 43.90 1p42 s TYR 231 CO 0.69 -0.35 2.24 1.05 -1.11 0.00 0.00 175.55 178.07 1p42 h GLU 232 N 4.16 0.00 -0.25 -0.62 9.09 -2.03 -0.70 114.58 124.23 1p42 h GLU 232 Ca -0.29 0.00 -0.14 0.00 0.05 0.00 0.00 59.36 58.98 1p42 h GLU 232 Cb 1.18 0.00 -0.09 0.00 -1.65 0.00 0.00 28.75 28.19 1p42 h GLU 232 CO 0.39 0.00 -0.25 0.27 0.05 0.00 0.00 179.01 179.47 1p42 n ASN 233 N -3.73 2.33 -0.31 3.06 0.23 -1.26 -4.77 115.26 110.80 1p42 n ASN 233 Ca -0.02 -3.84 0.08 0.00 -0.53 0.00 0.00 54.58 50.27 1p42 n ASN 233 Cb 0.13 -0.59 0.24 0.00 -2.08 0.00 0.00 39.78 37.48 1p42 n ASN 233 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1p42 h GLU 234 N 1.05 0.68 -0.57 -3.83 4.81 -1.51 -2.04 114.58 113.17 1p42 h GLU 234 Ca 0.16 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.39 1p42 h GLU 234 Cb 1.42 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 30.60 1p42 h GLU 234 CO 0.28 0.45 0.31 -1.35 -0.73 0.00 0.00 179.01 177.97 1p42 h PRO 235 N 0.70 0.58 -0.01 0.92 0.11 -1.86 -0.59 132.00 131.85 1p42 h PRO 235 Ca 0.48 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 66.43 1p42 h PRO 235 Cb 0.67 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.63 1p42 h PRO 235 CO -0.35 0.38 -0.61 -0.39 -0.21 0.00 0.00 178.00 176.82 1p42 h VAL 236 N 0.60 1.44 -0.54 3.15 -1.51 -1.78 -2.13 116.25 115.48 1p42 h VAL 236 Ca 0.25 -2.09 -0.08 0.00 -1.23 0.00 0.00 66.70 63.55 1p42 h VAL 236 Cb 0.12 2.12 -0.02 0.00 -2.13 0.00 0.00 31.29 31.39 1p42 h VAL 236 CO -0.15 0.60 0.03 0.03 -1.23 0.00 0.00 177.57 176.85 1p42 h ARG 237 N 0.02 0.90 -0.41 5.19 3.08 -0.87 -1.85 114.38 120.43 1p42 h ARG 237 Ca -0.01 -0.24 -0.10 0.00 0.07 0.00 0.00 59.98 59.70 1p42 h ARG 237 Cb 1.09 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 31.02 1p42 h ARG 237 CO 0.08 0.87 -0.15 1.25 -1.07 0.00 0.00 179.97 180.96 1p42 h HIS 238 N 0.84 0.85 -0.36 3.04 2.76 -0.78 -1.49 115.15 120.01 1p42 h HIS 238 Ca 0.16 -0.17 -0.06 0.00 -2.20 0.00 0.00 60.37 58.10 1p42 h HIS 238 Cb 0.46 -0.21 -0.02 0.00 1.55 0.00 0.00 27.41 29.18 1p42 h HIS 238 CO 0.03 0.86 -0.05 0.87 -1.30 0.00 0.00 177.93 178.34 1p42 h LYS 239 N 0.69 0.58 -0.45 5.26 1.79 -0.99 0.99 116.57 124.44 1p42 h LYS 239 Ca 0.11 -0.15 -0.06 0.00 -2.18 0.00 0.00 60.65 58.37 1p42 h LYS 239 Cb 0.63 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.20 1p42 h LYS 239 CO 0.04 0.64 0.04 0.28 -1.08 0.00 0.00 179.45 179.38 1p42 h VAL 240 N 0.54 1.25 -0.67 0.50 2.07 -0.97 -1.71 116.25 117.26 1p42 h VAL 240 Ca 0.11 -0.97 0.03 0.00 0.82 0.00 0.00 66.70 66.69 1p42 h VAL 240 Cb 0.42 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.15 1p42 h VAL 240 CO 0.02 0.34 0.42 0.15 0.02 0.00 0.00 177.57 178.52 1p42 h PHE 241 N 0.62 0.79 -0.20 1.57 3.57 -0.51 -1.95 116.94 120.83 1p42 h PHE 241 Ca 0.13 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 1p42 h PHE 241 Cb 0.43 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 1p42 h PHE 241 CO 0.03 0.46 0.10 -0.44 -2.23 0.00 0.00 178.31 176.23 1p42 h ASP 242 N 0.83 0.26 -0.89 0.41 3.32 -0.59 -2.46 116.42 117.31 1p42 h ASP 242 Ca 0.27 -0.11 0.03 0.00 0.02 0.00 0.00 57.03 57.23 1p42 h ASP 242 Cb 0.00 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.44 1p42 h ASP 242 CO -0.10 0.30 0.58 0.25 -1.72 0.00 0.00 179.24 178.55 1p42 h LEU 243 N 0.21 0.98 -1.34 1.55 5.85 -1.03 -0.10 115.31 121.43 1p42 h LEU 243 Ca 0.07 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.73 1p42 h LEU 243 Cb 0.10 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 1p42 h LEU 243 CO -0.01 0.69 -0.06 0.40 -0.34 0.00 0.00 178.44 179.12 1p42 h ILE 244 N 1.15 1.18 -0.19 4.05 2.04 -1.23 0.23 117.51 124.75 1p42 h ILE 244 Ca 0.35 -0.75 -0.10 0.00 1.00 0.00 0.00 64.86 65.36 1p42 h ILE 244 Cb -0.04 1.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 1p42 h ILE 244 CO -0.10 0.25 -0.26 1.23 0.00 0.00 0.00 178.15 179.26 1p42 h GLY 245 N 0.76 0.55 1.71 5.37 0.00 -0.75 -3.04 103.07 107.67 1p42 h GLY 245 Ca 0.08 -0.61 -0.08 0.00 0.00 0.00 0.00 47.33 46.71 1p42 h GLY 245 CO 0.01 0.55 -0.25 -0.55 0.00 0.00 0.00 176.54 176.31 1p42 h ASP 246 N 0.16 0.34 0.26 0.19 3.32 -0.56 -2.52 116.42 117.62 1p42 h ASP 246 Ca 0.02 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 56.94 1p42 h ASP 246 Cb 0.84 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.29 1p42 h ASP 246 CO 0.06 0.59 -0.12 -0.07 -1.72 0.00 0.00 179.24 177.98 1p42 h LEU 247 N 0.31 0.00 -0.17 1.55 3.38 -0.51 -1.58 115.31 118.29 1p42 h LEU 247 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1p42 h LEU 247 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1p42 h LEU 247 CO 0.04 0.12 0.00 0.00 0.09 0.00 0.00 178.44 178.69 1p42 n TYR 248 N -3.87 0.18 0.88 1.13 9.36 -0.95 -1.88 117.16 122.02 1p42 n TYR 248 Ca -0.02 0.07 0.08 0.00 3.32 0.00 0.00 57.90 61.35 1p42 n TYR 248 Cb 0.22 -0.61 0.44 0.00 -0.63 0.00 0.00 39.34 38.76 1p42 n TYR 248 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 1p42 n LEU 249 N -1.66 0.00 0.10 2.98 4.77 -0.60 -1.87 117.00 120.73 1p42 n LEU 249 Ca 0.03 0.16 0.12 0.00 -0.03 0.00 0.00 56.01 56.29 1p42 n LEU 249 Cb 0.17 -0.16 0.45 0.00 -2.33 0.00 0.00 43.42 41.56 1p42 n LEU 249 CO 0.14 -0.07 0.87 0.18 -1.33 0.00 0.00 177.39 177.17 1p42 n LEU 250 N -1.16 0.64 0.00 2.23 4.77 -0.79 -1.08 117.00 121.62 1p42 n LEU 250 Ca 0.10 0.61 0.00 0.00 -0.03 0.00 0.00 56.01 56.69 1p42 n LEU 250 Cb 0.10 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 1p42 n LEU 250 CO 0.11 -0.35 0.00 0.61 -1.33 0.00 0.00 177.39 176.43 1p42 n GLY 251 N 0.62 0.96 3.62 -0.72 0.00 -0.78 -4.97 105.19 103.92 1p42 n GLY 251 Ca 0.04 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.99 1p42 n GLY 251 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1p42 s SER 252 N -1.87 -0.33 0.26 1.61 1.04 -1.26 -4.84 113.70 108.31 1p42 s SER 252 Ca 0.00 -0.22 -0.29 0.00 0.48 0.00 0.00 55.95 55.91 1p42 s SER 252 Cb 0.00 0.51 -0.14 0.00 0.10 0.00 0.00 66.02 66.49 1p42 s SER 252 CO 0.00 -0.89 1.09 -2.65 0.98 0.00 0.00 173.24 171.76 1p42 n PRO 253 N -0.38 1.39 -4.13 4.02 -0.02 -1.26 -4.43 135.00 130.20 1p42 n PRO 253 Ca -0.09 0.49 -0.36 0.00 -2.02 0.00 0.00 63.50 61.53 1p42 n PRO 253 Cb 0.62 -1.92 -0.08 0.00 -0.02 0.00 0.00 33.50 32.09 1p42 n PRO 253 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1p42 s VAL 254 N -0.77 4.85 -0.23 -1.45 1.01 -1.26 -0.50 120.40 122.04 1p42 s VAL 254 Ca 0.63 -0.04 0.02 0.00 0.00 0.00 0.00 61.98 62.59 1p42 s VAL 254 Cb -0.73 -3.09 0.04 0.00 0.00 0.00 0.00 36.38 32.60 1p42 s VAL 254 CO 0.57 0.59 -0.13 -0.54 0.00 0.00 0.00 175.10 175.59 1p42 s LYS 255 N -0.77 2.53 0.00 2.72 -0.14 -0.17 -4.33 119.74 119.59 1p42 s LYS 255 Ca 0.12 -1.15 0.00 0.00 -1.36 0.00 0.00 55.97 53.58 1p42 s LYS 255 Cb -0.12 -2.80 0.00 0.00 -1.68 0.00 0.00 37.83 33.24 1p42 s LYS 255 CO 0.03 -0.44 0.00 0.41 -0.76 0.00 0.00 175.35 174.59 1p42 n GLY 256 N 4.51 0.58 3.35 -3.33 0.00 -1.22 -1.88 105.19 107.20 1p42 n GLY 256 Ca -0.16 -0.78 -0.35 0.00 0.00 0.00 0.00 46.02 44.72 1p42 n GLY 256 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1p42 s LYS 257 N -2.00 3.44 0.04 1.61 2.20 0.29 -1.34 119.74 123.97 1p42 s LYS 257 Ca 0.00 -0.60 0.09 0.00 -0.36 0.00 0.00 55.97 55.10 1p42 s LYS 257 Cb 0.00 -3.02 -0.03 0.00 -1.51 0.00 0.00 37.83 33.27 1p42 s LYS 257 CO 0.00 -0.13 -0.25 -0.06 -0.36 0.00 0.00 175.35 174.54 1p42 s PHE 258 N 1.33 2.36 -0.14 4.03 0.40 0.94 -1.29 117.98 125.61 1p42 s PHE 258 Ca 0.04 -0.39 -0.01 0.00 -0.60 0.00 0.00 56.93 55.97 1p42 s PHE 258 Cb -0.14 -1.42 0.04 0.00 0.51 0.00 0.00 43.02 42.01 1p42 s PHE 258 CO -0.01 0.13 -0.02 -0.47 0.70 0.00 0.00 175.22 175.54 1p42 s TYR 259 N -0.80 1.27 -0.17 0.36 5.04 0.26 -0.78 117.35 122.53 1p42 s TYR 259 Ca 0.12 -0.76 -0.01 0.00 -2.44 0.00 0.00 57.07 53.98 1p42 s TYR 259 Cb -0.10 -1.11 -0.00 0.00 0.35 0.00 0.00 41.96 41.09 1p42 s TYR 259 CO 0.02 -0.53 -0.12 0.45 -1.34 0.00 0.00 175.55 174.03 1p42 s SER 260 N 1.78 3.86 -0.38 4.32 0.15 -0.01 0.04 113.70 123.46 1p42 s SER 260 Ca 0.02 -0.44 -0.07 0.00 0.70 0.00 0.00 55.95 56.17 1p42 s SER 260 Cb -0.15 -1.61 0.06 0.00 -1.71 0.00 0.00 66.02 62.61 1p42 s SER 260 CO -0.07 0.06 0.17 0.12 1.20 0.00 0.00 173.24 174.72 1p42 s PHE 261 N 0.95 3.33 -1.85 3.44 5.36 0.25 -0.39 117.98 129.07 1p42 s PHE 261 Ca -0.02 -1.62 0.00 0.00 -0.96 0.00 0.00 56.93 54.33 1p42 s PHE 261 Cb -0.15 -2.65 0.00 0.00 -0.34 0.00 0.00 43.02 39.88 1p42 s PHE 261 CO -0.01 -0.81 0.00 0.54 -1.46 0.00 0.00 175.22 173.48 1p42 n ARG 262 N 4.81 -1.41 -1.23 10.12 1.74 -0.33 -1.41 116.66 128.95 1p42 n ARG 262 Ca -0.10 1.06 -0.30 0.00 -0.77 0.00 0.00 57.85 57.74 1p42 n ARG 262 Cb 0.43 -5.48 0.14 0.00 -1.02 0.00 0.00 32.46 26.53 1p42 n ARG 262 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1p42 s GLY 263 N -2.50 1.62 0.36 -0.13 0.00 -1.26 -4.79 107.32 100.60 1p42 s GLY 263 Ca 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 44.72 44.61 1p42 s GLY 263 CO 0.00 0.40 0.48 -0.32 0.00 0.00 0.00 173.10 173.66 1p42 s GLY 264 N -3.46 1.57 0.29 0.20 0.00 -1.26 -5.02 107.32 99.64 1p42 s GLY 264 Ca 0.63 -1.56 0.03 0.00 0.00 0.00 0.00 44.72 43.82 1p42 s GLY 264 CO 0.57 -1.02 1.77 0.45 0.00 0.00 0.00 173.10 174.88 1p42 h HIS 265 N 2.08 0.98 -0.09 1.90 3.86 -1.92 0.12 115.15 122.08 1p42 h HIS 265 Ca -0.28 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 58.96 1p42 h HIS 265 Cb 1.24 -0.29 -0.00 0.00 1.06 0.00 0.00 27.41 29.41 1p42 h HIS 265 CO 1.61 0.23 0.06 0.77 0.86 0.00 0.00 177.93 181.45 1p42 h SER 266 N 0.74 0.12 0.20 2.45 0.02 -1.92 -0.69 113.55 114.46 1p42 h SER 266 Ca 0.54 -0.06 -0.12 0.00 -0.84 0.00 0.00 61.79 61.31 1p42 h SER 266 Cb 0.80 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.30 1p42 h SER 266 CO -0.37 0.14 -0.46 0.25 -1.14 0.00 0.00 176.83 175.25 1p42 h LEU 267 N 0.08 0.33 -0.14 5.07 5.85 -1.76 -1.57 115.31 123.17 1p42 h LEU 267 Ca 0.03 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.60 1p42 h LEU 267 Cb 0.05 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1p42 h LEU 267 CO -0.01 0.75 0.07 0.78 -0.34 0.00 0.00 178.44 179.69 1p42 h ASN 268 N 0.25 0.18 -0.31 1.25 2.35 -0.50 -1.15 115.58 117.66 1p42 h ASN 268 Ca 0.02 -0.11 -0.08 0.00 -0.55 0.00 0.00 56.30 55.57 1p42 h ASN 268 Cb 0.91 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 39.21 1p42 h ASN 268 CO 0.07 0.24 -0.08 0.58 -1.65 0.00 0.00 177.43 176.59 1p42 h VAL 269 N 0.11 1.25 -0.71 2.81 2.07 -1.04 -0.81 116.25 119.93 1p42 h VAL 269 Ca 0.05 -1.09 0.02 0.00 0.82 0.00 0.00 66.70 66.50 1p42 h VAL 269 Cb 0.10 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 1p42 h VAL 269 CO -0.01 0.37 0.45 0.50 0.02 0.00 0.00 177.57 178.91 1p42 h LYS 270 N 0.65 0.87 -0.15 1.57 3.64 -0.96 -0.15 116.57 122.05 1p42 h LYS 270 Ca 0.12 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1p42 h LYS 270 Cb 0.53 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 1p42 h LYS 270 CO 0.03 0.58 0.04 1.25 -2.27 0.00 0.00 179.45 179.07 1p42 h LEU 271 N 0.90 0.22 -0.48 5.20 5.85 -0.73 -2.14 115.31 124.11 1p42 h LEU 271 Ca 0.27 -0.22 0.08 0.00 0.84 0.00 0.00 57.88 58.85 1p42 h LEU 271 Cb -0.03 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 40.88 1p42 h LEU 271 CO -0.09 0.39 0.11 0.58 -0.34 0.00 0.00 178.44 179.09 1p42 h VAL 272 N 0.04 0.76 -0.50 1.05 2.07 -0.68 0.66 116.25 119.64 1p42 h VAL 272 Ca 0.05 -0.09 -0.05 0.00 0.82 0.00 0.00 66.70 67.43 1p42 h VAL 272 Cb 0.25 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 1p42 h VAL 272 CO -0.00 0.05 0.10 0.11 0.02 0.00 0.00 177.57 177.85 1p42 h LYS 273 N 0.26 0.77 -0.24 1.57 1.57 -0.91 -0.46 116.57 119.11 1p42 h LYS 273 Ca 0.24 -0.16 -0.19 0.00 -1.87 0.00 0.00 60.65 58.67 1p42 h LYS 273 Cb 0.30 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1p42 h LYS 273 CO -0.30 0.71 -0.59 0.93 -0.57 0.00 0.00 179.45 179.63 1p42 h GLU 274 N 0.74 0.80 -0.70 3.15 5.08 -0.69 -1.56 114.58 121.39 1p42 h GLU 274 Ca 0.16 -0.53 -0.06 0.00 -1.00 0.00 0.00 59.36 57.93 1p42 h GLU 274 Cb 0.30 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 1p42 h GLU 274 CO 0.00 1.16 0.21 -0.07 -1.00 0.00 0.00 179.01 179.31 1p42 h LEU 275 N 0.60 1.02 -0.48 1.33 3.38 -0.59 -2.34 115.31 118.23 1p42 h LEU 275 Ca 0.00 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.69 1p42 h LEU 275 Cb 1.19 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 1p42 h LEU 275 CO 0.13 0.96 -0.04 0.00 0.09 0.00 0.00 178.44 179.57 1p42 h ALA 276 N 1.18 0.65 -0.21 1.53 0.00 -0.99 -2.79 119.26 118.63 1p42 h ALA 276 Ca 0.23 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.86 1p42 h ALA 276 Cb 0.31 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1p42 h ALA 276 CO -0.01 0.49 0.04 0.87 0.00 0.00 0.00 179.25 180.65 1p42 h LYS 277 N 0.73 0.12 0.00 0.00 1.57 -1.05 0.19 116.57 118.12 1p42 h LYS 277 Ca 0.13 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1p42 h LYS 277 Cb 0.57 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.85 1p42 h LYS 277 CO 0.03 0.08 0.00 1.63 -0.57 0.00 0.00 179.45 180.62 1p42 n LYS 278 N -5.09 0.34 -3.20 3.15 5.02 -0.90 -4.74 118.16 112.73 1p42 n LYS 278 Ca -0.02 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.08 1p42 n LYS 278 Cb 0.10 -1.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.07 1p42 n LYS 278 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1p42 n GLN 279 N -0.50 -1.70 0.00 1.97 10.64 0.66 -5.07 117.38 123.37 1p42 n GLN 279 Ca 0.00 0.06 0.10 0.00 -1.83 0.00 0.00 57.00 55.33 1p42 n GLN 279 Cb 0.00 -3.97 0.60 0.00 -0.86 0.00 0.00 30.24 26.01 1p42 n GLN 279 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.06 176.40