#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n1a s PRO 17 N 0.00 2.71 0.32 0.00 0.02 -1.26 -4.70 135.00 132.09 1n1a s PRO 17 Ca 0.00 -0.84 0.25 0.00 0.02 0.00 0.00 61.00 60.43 1n1a s PRO 17 Cb 0.00 -2.28 0.86 0.00 0.02 0.00 0.00 34.50 33.10 1n1a s PRO 17 CO 0.00 0.38 0.84 1.28 -0.33 0.00 0.00 177.00 179.16 1n1a n LEU 18 N 2.98 0.00 0.29 -5.54 4.77 -1.26 -1.45 117.00 116.79 1n1a n LEU 18 Ca -0.18 0.52 0.19 0.00 -0.03 0.00 0.00 56.01 56.51 1n1a n LEU 18 Cb 0.52 -0.25 0.83 0.00 -2.33 0.00 0.00 43.42 42.19 1n1a n LEU 18 CO 0.26 -0.52 1.04 -0.65 -1.33 0.00 0.00 177.39 176.19 1n1a h PRO 19 N 0.00 0.00 -6.21 3.23 0.11 -2.02 -3.42 132.00 123.69 1n1a h PRO 19 Ca 0.47 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 66.01 1n1a h PRO 19 Cb 2.01 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 33.07 1n1a h PRO 19 CO -0.00 0.00 0.64 -1.64 -0.21 0.00 0.00 178.00 176.78 1n1a s MET 20 N -3.79 4.37 -0.08 1.05 -1.94 -0.53 -5.05 119.30 113.33 1n1a s MET 20 Ca -0.00 1.38 -0.01 0.00 -1.71 0.00 0.00 55.69 55.35 1n1a s MET 20 Cb 0.10 -3.57 -0.03 0.00 2.01 0.00 0.00 34.83 33.34 1n1a s MET 20 CO 0.50 -0.41 -0.02 -2.00 -0.01 0.00 0.00 175.02 173.08 1n1a s GLU 21 N 2.37 2.95 -0.06 2.03 2.12 -1.26 -4.90 118.70 121.94 1n1a s GLU 21 Ca 0.47 -0.45 -0.29 0.00 0.36 0.00 0.00 54.97 55.05 1n1a s GLU 21 Cb -0.17 -2.74 -0.07 0.00 0.26 0.00 0.00 34.13 31.40 1n1a s GLU 21 CO 0.14 0.67 2.07 0.20 -0.54 0.00 0.00 175.26 177.80 1n1a s GLY 22 N -0.80 1.10 -0.03 -1.50 0.00 -1.26 -4.64 107.32 100.19 1n1a s GLY 22 Ca 0.12 1.12 -0.19 0.00 0.00 0.00 0.00 44.72 45.78 1n1a s GLY 22 CO 0.02 3.60 0.53 0.14 0.00 0.00 0.00 173.10 177.40 1n1a s VAL 23 N 5.92 4.99 -0.36 1.40 1.01 0.10 -4.72 120.40 128.75 1n1a s VAL 23 Ca 0.93 1.10 -0.29 0.00 0.00 0.00 0.00 61.98 63.73 1n1a s VAL 23 Cb -0.39 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.13 1n1a s VAL 23 CO 0.39 0.43 1.37 -0.62 0.00 0.00 0.00 175.10 176.67 1n1a s ASP 24 N -0.17 6.48 0.00 3.32 3.68 -1.26 -0.32 116.67 128.39 1n1a s ASP 24 Ca 0.28 1.01 0.19 0.00 2.13 0.00 0.00 52.55 56.17 1n1a s ASP 24 Cb -0.17 -2.54 0.13 0.00 -1.45 0.00 0.00 42.92 38.89 1n1a s ASP 24 CO 0.15 -1.28 1.09 2.30 0.13 0.00 0.00 175.17 177.56 1n1a n ILE 25 N 6.69 0.00 -1.64 4.11 -5.35 -0.31 -4.93 119.36 117.93 1n1a n ILE 25 Ca 0.16 -0.47 -0.48 0.00 -0.27 0.00 0.00 62.75 61.70 1n1a n ILE 25 Cb 0.47 1.38 -0.04 0.00 -1.74 0.00 0.00 39.64 39.71 1n1a n ILE 25 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1n1a n SER 26 N 0.90 2.40 0.29 7.28 3.41 -1.23 -4.80 113.62 121.87 1n1a n SER 26 Ca 0.11 1.11 0.13 0.00 -0.26 0.00 0.00 58.87 59.96 1n1a n SER 26 Cb 0.47 -1.34 0.83 0.00 -0.26 0.00 0.00 64.21 63.91 1n1a n SER 26 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1n1a h PRO 27 N 4.80 0.00 -0.00 4.33 0.13 -1.96 0.47 132.00 139.76 1n1a h PRO 27 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1n1a h PRO 27 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1n1a h PRO 27 CO 0.80 0.01 -0.12 1.63 -0.23 0.00 0.00 178.00 180.09 1n1a n LYS 28 N -4.03 0.28 -3.64 0.86 5.02 -1.26 -4.92 118.16 110.48 1n1a n LYS 28 Ca -0.03 -0.07 -0.22 0.00 -2.02 0.00 0.00 58.31 55.97 1n1a n LYS 28 Cb 0.09 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 33.64 1n1a n LYS 28 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1n1a n GLN 29 N -1.30 -4.06 -0.45 1.97 1.13 0.15 -4.87 117.38 109.96 1n1a n GLN 29 Ca 0.10 0.63 0.06 0.00 -1.94 0.00 0.00 57.00 55.85 1n1a n GLN 29 Cb 0.30 -5.10 0.21 0.00 0.11 0.00 0.00 30.24 25.77 1n1a n GLN 29 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 1n1a n ASP 30 N -3.02 3.04 -0.64 1.08 5.75 -1.26 -4.93 116.55 116.56 1n1a n ASP 30 Ca -0.24 -3.27 -0.08 0.00 -0.01 0.00 0.00 54.79 51.18 1n1a n ASP 30 Cb 0.66 -0.54 -0.04 0.00 -1.03 0.00 0.00 41.12 40.17 1n1a n ASP 30 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 1n1a n GLU 31 N -0.93 -1.63 0.09 0.11 2.13 -1.26 -4.87 120.64 114.28 1n1a n GLU 31 Ca 0.23 0.77 0.09 0.00 0.66 0.00 0.00 57.16 58.91 1n1a n GLU 31 Cb 0.85 -5.13 0.40 0.00 0.27 0.00 0.00 31.44 27.83 1n1a n GLU 31 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1n1a n GLY 32 N 0.13 -1.03 2.87 8.31 0.00 -1.26 -4.41 105.19 109.80 1n1a n GLY 32 Ca -0.08 0.06 -0.11 0.00 0.00 0.00 0.00 46.02 45.88 1n1a n GLY 32 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n1a s VAL 33 N -3.24 -0.56 -0.24 1.61 1.01 -1.25 -1.54 120.40 116.19 1n1a s VAL 33 Ca 0.03 -0.31 -0.10 0.00 0.00 0.00 0.00 61.98 61.60 1n1a s VAL 33 Cb 0.08 -0.96 -0.05 0.00 0.00 0.00 0.00 36.38 35.45 1n1a s VAL 33 CO 0.27 -0.31 0.14 -0.76 0.00 0.00 0.00 175.10 174.45 1n1a s LEU 34 N 2.49 4.00 -0.07 3.92 1.43 -0.17 -1.16 118.68 129.12 1n1a s LEU 34 Ca 0.10 0.06 0.02 0.00 -1.03 0.00 0.00 54.13 53.28 1n1a s LEU 34 Cb -0.13 -2.07 -0.03 0.00 0.03 0.00 0.00 46.19 43.99 1n1a s LEU 34 CO -0.29 0.05 -0.10 -0.75 0.23 0.00 0.00 176.35 175.50 1n1a s LYS 35 N 1.12 2.71 -0.12 1.70 2.20 0.56 -0.07 119.74 127.85 1n1a s LYS 35 Ca 0.07 -0.62 -0.01 0.00 -0.36 0.00 0.00 55.97 55.05 1n1a s LYS 35 Cb -0.14 -2.52 0.04 0.00 -1.51 0.00 0.00 37.83 33.70 1n1a s LYS 35 CO 0.05 0.61 -0.01 0.08 -0.36 0.00 0.00 175.35 175.72 1n1a s VAL 36 N -0.67 0.58 -0.29 4.02 1.01 -0.31 0.03 120.40 124.77 1n1a s VAL 36 Ca 0.10 -0.17 -0.29 0.00 0.00 0.00 0.00 61.98 61.62 1n1a s VAL 36 Cb -0.11 -0.80 -0.01 0.00 0.00 0.00 0.00 36.38 35.46 1n1a s VAL 36 CO 0.01 0.15 1.49 -0.63 0.00 0.00 0.00 175.10 176.13 1n1a s ILE 37 N 1.87 3.86 -0.07 2.22 1.01 -1.26 -0.27 121.20 128.56 1n1a s ILE 37 Ca 0.03 0.95 -0.18 0.00 0.00 0.00 0.00 60.65 61.45 1n1a s ILE 37 Cb -0.14 -3.94 -0.29 0.00 0.01 0.00 0.00 42.46 38.10 1n1a s ILE 37 CO -0.07 -0.44 0.71 0.50 0.00 0.00 0.00 174.94 175.64 1n1a h LYS 38 N 10.43 0.29 -3.62 2.79 3.64 -0.80 -3.45 116.57 125.85 1n1a h LYS 38 Ca -0.30 -0.50 -0.43 0.00 -1.27 0.00 0.00 60.65 58.15 1n1a h LYS 38 Cb 1.13 0.18 -0.38 0.00 -0.41 0.00 0.00 32.23 32.75 1n1a h LYS 38 CO 1.03 1.24 -0.76 0.50 -2.27 0.00 0.00 179.45 179.18 1n1a s ARG 39 N -2.47 0.49 0.38 1.90 3.52 0.24 -4.89 118.95 118.12 1n1a s ARG 39 Ca -0.17 0.13 -0.27 0.00 -0.13 0.00 0.00 55.73 55.30 1n1a s ARG 39 Cb 0.03 -0.95 -0.09 0.00 -1.56 0.00 0.00 34.95 32.38 1n1a s ARG 39 CO 0.80 -0.33 1.26 -1.21 -0.81 0.00 0.00 175.30 175.01 1n1a s GLU 40 N 2.00 4.14 0.45 5.12 0.41 -1.26 -0.50 118.70 129.06 1n1a s GLU 40 Ca 0.05 2.07 -0.22 0.00 -0.41 0.00 0.00 54.97 56.45 1n1a s GLU 40 Cb -0.12 -2.85 -0.08 0.00 -1.78 0.00 0.00 34.13 29.30 1n1a s GLU 40 CO -0.05 -0.32 1.06 0.20 -0.49 0.00 0.00 175.26 175.66 1n1a s GLY 41 N -0.78 2.63 0.00 -1.39 0.00 -1.26 -4.64 107.32 101.88 1n1a s GLY 41 Ca 0.54 0.69 0.26 0.00 0.00 0.00 0.00 44.72 46.21 1n1a s GLY 41 CO 0.47 1.07 1.46 -1.30 0.00 0.00 0.00 173.10 174.79 1n1a n THR 42 N -0.60 0.00 -2.69 0.90 -2.24 -1.26 -4.91 114.28 103.48 1n1a n THR 42 Ca 0.08 -0.19 -0.22 0.00 -2.27 0.00 0.00 64.05 61.44 1n1a n THR 42 Cb 0.51 0.67 0.11 0.00 -2.10 0.00 0.00 70.33 69.52 1n1a n THR 42 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n1a n GLY 43 N 1.34 0.90 0.02 3.38 0.00 -1.26 -5.07 105.19 104.50 1n1a n GLY 43 Ca 0.12 -2.07 -0.01 0.00 0.00 0.00 0.00 46.02 44.07 1n1a n GLY 43 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1n1a n THR 44 N -2.73 0.26 -2.01 2.61 5.66 -1.26 -4.79 114.28 112.02 1n1a n THR 44 Ca 0.16 -0.21 -0.38 0.00 -3.05 0.00 0.00 64.05 60.58 1n1a n THR 44 Cb 0.59 -0.46 0.02 0.00 -1.55 0.00 0.00 70.33 68.92 1n1a n THR 44 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1n1a s GLU 45 N -2.23 3.43 -0.02 1.09 0.41 -1.26 -4.90 118.70 115.22 1n1a s GLU 45 Ca -0.03 2.01 -0.06 0.00 -0.41 0.00 0.00 54.97 56.48 1n1a s GLU 45 Cb 0.02 -2.32 0.01 0.00 -1.78 0.00 0.00 34.13 30.06 1n1a s GLU 45 CO 0.24 -0.89 0.14 -1.64 -0.49 0.00 0.00 175.26 172.62 1n1a s MET 46 N -2.81 0.36 0.49 1.61 -1.94 -1.26 -2.23 119.30 113.51 1n1a s MET 46 Ca 0.68 -0.14 -0.24 0.00 -1.71 0.00 0.00 55.69 54.28 1n1a s MET 46 Cb -0.35 0.15 -0.07 0.00 2.01 0.00 0.00 34.83 36.58 1n1a s MET 46 CO 0.41 -0.07 1.40 -2.14 -0.01 0.00 0.00 175.02 174.61 1n1a s PRO 47 N -0.76 3.48 0.18 2.03 0.02 -1.26 -5.07 135.00 133.62 1n1a s PRO 47 Ca -0.08 2.36 0.10 0.00 0.02 0.00 0.00 61.00 63.39 1n1a s PRO 47 Cb -0.05 -2.50 -0.04 0.00 0.02 0.00 0.00 34.50 31.92 1n1a s PRO 47 CO 0.01 -0.96 -0.21 -1.64 -0.33 0.00 0.00 177.00 173.86 1n1a s MET 48 N -2.62 1.41 0.29 5.54 -1.94 -1.26 -4.86 119.30 115.85 1n1a s MET 48 Ca 0.65 -1.47 -0.29 0.00 -1.71 0.00 0.00 55.69 52.88 1n1a s MET 48 Cb -0.43 -1.62 -0.14 0.00 2.01 0.00 0.00 34.83 34.66 1n1a s MET 48 CO 0.53 0.34 1.09 -0.89 -0.01 0.00 0.00 175.02 176.08 1n1a n ILE 49 N 0.29 1.87 0.00 2.53 5.41 -1.26 -1.55 119.36 126.65 1n1a n ILE 49 Ca -0.13 -0.47 0.00 0.00 1.00 0.00 0.00 62.75 63.15 1n1a n ILE 49 Cb 0.56 -1.11 0.00 0.00 -0.71 0.00 0.00 39.64 38.38 1n1a n ILE 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1n1a n GLY 50 N 1.24 3.11 3.82 7.39 0.00 0.54 -4.93 105.19 116.36 1n1a n GLY 50 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 1n1a n GLY 50 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1n1a s ASP 51 N -1.15 6.57 -0.29 1.61 1.01 -0.59 -4.23 116.67 119.60 1n1a s ASP 51 Ca 0.00 1.75 -0.27 0.00 0.71 0.00 0.00 52.55 54.75 1n1a s ASP 51 Cb 0.00 -2.54 0.01 0.00 1.01 0.00 0.00 42.92 41.40 1n1a s ASP 51 CO 0.00 -0.62 0.94 -0.60 0.21 0.00 0.00 175.17 175.10 1n1a s ARG 52 N -3.47 4.08 0.10 8.23 6.06 -0.73 -1.18 118.95 132.04 1n1a s ARG 52 Ca 0.63 0.95 0.05 0.00 -2.50 0.00 0.00 55.73 54.86 1n1a s ARG 52 Cb -0.12 -3.70 -0.04 0.00 0.06 0.00 0.00 34.95 31.14 1n1a s ARG 52 CO 0.21 -0.73 0.02 0.14 -2.50 0.00 0.00 175.30 172.45 1n1a s VAL 53 N 3.24 4.12 -0.15 7.11 -7.23 0.80 -0.17 120.40 128.12 1n1a s VAL 53 Ca 0.40 -0.99 0.02 0.00 -1.81 0.00 0.00 61.98 59.59 1n1a s VAL 53 Cb -0.14 -2.99 0.01 0.00 0.56 0.00 0.00 36.38 33.83 1n1a s VAL 53 CO 0.12 0.09 -0.20 -0.36 -0.31 0.00 0.00 175.10 174.43 1n1a s PHE 54 N -1.39 2.72 0.18 2.82 0.40 0.14 -1.83 117.98 121.03 1n1a s PHE 54 Ca 0.27 -1.35 -0.03 0.00 -0.60 0.00 0.00 56.93 55.22 1n1a s PHE 54 Cb -0.11 -1.86 -0.03 0.00 0.51 0.00 0.00 43.02 41.52 1n1a s PHE 54 CO 0.19 -0.63 0.16 0.14 0.70 0.00 0.00 175.22 175.79 1n1a s VAL 55 N 0.94 0.04 -0.01 -0.44 -7.23 -0.35 -1.22 120.40 112.12 1n1a s VAL 55 Ca -0.04 -1.84 0.05 0.00 -1.81 0.00 0.00 61.98 58.34 1n1a s VAL 55 Cb -0.15 -2.27 -0.01 0.00 0.56 0.00 0.00 36.38 34.51 1n1a s VAL 55 CO -0.04 -0.16 -0.18 -1.00 -0.31 0.00 0.00 175.10 173.41 1n1a s HIS 56 N -4.09 1.58 0.23 2.82 3.76 -1.12 -0.25 115.29 118.22 1n1a s HIS 56 Ca 0.31 -0.30 -0.08 0.00 -0.15 0.00 0.00 55.06 54.83 1n1a s HIS 56 Cb 0.06 -1.02 -0.02 0.00 1.11 0.00 0.00 32.58 32.71 1n1a s HIS 56 CO 0.07 -0.03 0.35 1.52 -0.85 0.00 0.00 174.74 175.80 1n1a s TYR 57 N -0.41 0.68 -0.04 1.40 -0.85 -1.26 -1.37 117.35 115.51 1n1a s TYR 57 Ca 0.07 -0.99 -0.04 0.00 -0.52 0.00 0.00 57.07 55.59 1n1a s TYR 57 Cb -0.07 -0.10 0.01 0.00 0.38 0.00 0.00 41.96 42.18 1n1a s TYR 57 CO -0.01 -0.86 0.11 0.99 -1.52 0.00 0.00 175.55 174.26 1n1a s THR 58 N -4.05 -0.01 -0.08 -3.49 2.01 -0.86 -1.71 115.64 107.46 1n1a s THR 58 Ca 0.29 0.02 0.04 0.00 0.31 0.00 0.00 61.69 62.35 1n1a s THR 58 Cb 0.02 -0.16 -0.01 0.00 0.01 0.00 0.00 72.50 72.36 1n1a s THR 58 CO 0.10 0.01 -0.20 -0.83 -0.69 0.00 0.00 174.62 173.01 1n1a s GLY 59 N 0.17 1.41 0.08 4.40 0.00 -0.64 -2.29 107.32 110.46 1n1a s GLY 59 Ca -0.01 -0.99 0.09 0.00 0.00 0.00 0.00 44.72 43.81 1n1a s GLY 59 CO -0.00 -0.53 -0.24 -0.98 0.00 0.00 0.00 173.10 171.35 1n1a s TRP 60 N -0.10 2.06 0.37 1.90 0.51 0.13 -0.21 118.94 123.60 1n1a s TRP 60 Ca -0.04 -0.39 -0.09 0.00 -2.12 0.00 0.00 56.10 53.46 1n1a s TRP 60 Cb -0.14 -1.18 -0.06 0.00 -0.81 0.00 0.00 33.47 31.28 1n1a s TRP 60 CO 0.04 0.19 0.70 -0.51 -0.51 0.00 0.00 176.95 176.86 1n1a s LEU 61 N -1.58 3.89 0.52 2.99 1.43 0.25 -1.13 118.68 125.06 1n1a s LEU 61 Ca 0.10 1.00 0.28 0.00 -1.03 0.00 0.00 54.13 54.48 1n1a s LEU 61 Cb -0.10 -3.86 1.41 0.00 0.03 0.00 0.00 46.19 43.67 1n1a s LEU 61 CO 0.03 -0.34 1.93 -0.07 0.23 0.00 0.00 176.35 178.13 1n1a h LEU 62 N 1.35 0.04 -0.73 1.79 3.38 -1.90 -0.26 115.31 118.99 1n1a h LEU 62 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1n1a h LEU 62 Cb 1.19 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1n1a h LEU 62 CO 0.64 0.02 0.00 -0.90 0.09 0.00 0.00 178.44 178.29 1n1a n ASP 63 N -4.34 0.72 0.00 -0.43 5.68 -1.26 -4.84 116.55 112.09 1n1a n ASP 63 Ca 0.15 -1.98 0.00 0.00 -0.50 0.00 0.00 54.79 52.46 1n1a n ASP 63 Cb 0.78 -0.36 0.00 0.00 -1.14 0.00 0.00 41.12 40.40 1n1a n ASP 63 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1n1a n GLY 64 N 0.14 1.28 3.69 6.12 0.00 -0.11 -5.02 105.19 111.29 1n1a n GLY 64 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1n1a n GLY 64 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n1a s THR 65 N -3.24 3.67 -0.44 2.61 2.01 -1.24 -4.80 115.64 114.21 1n1a s THR 65 Ca 0.00 1.05 -0.24 0.00 0.31 0.00 0.00 61.69 62.82 1n1a s THR 65 Cb 0.00 -3.68 0.02 0.00 0.01 0.00 0.00 72.50 68.86 1n1a s THR 65 CO 0.00 -0.00 0.82 -0.75 -0.69 0.00 0.00 174.62 174.00 1n1a s LYS 66 N 2.45 3.51 0.02 4.92 2.20 -1.26 -0.58 119.74 130.99 1n1a s LYS 66 Ca 0.64 0.05 0.23 0.00 -0.36 0.00 0.00 55.97 56.53 1n1a s LYS 66 Cb -0.32 -3.91 0.14 0.00 -1.51 0.00 0.00 37.83 32.24 1n1a s LYS 66 CO 0.27 -1.10 1.13 1.97 -0.36 0.00 0.00 175.35 177.26 1n1a n PHE 67 N 6.79 0.13 -3.74 4.03 -1.74 0.71 -4.99 117.46 118.64 1n1a n PHE 67 Ca 0.03 0.04 -0.02 0.00 -0.56 0.00 0.00 57.45 56.95 1n1a n PHE 67 Cb 0.48 -0.29 -0.01 0.00 1.52 0.00 0.00 39.48 41.19 1n1a n PHE 67 CO 0.00 0.00 0.00 0.34 -0.56 0.00 0.00 176.76 176.54 1n1a s ASP 68 N -3.43 -0.11 -0.30 5.98 2.15 -1.22 -4.97 116.67 114.77 1n1a s ASP 68 Ca 0.07 -0.35 -0.19 0.00 0.43 0.00 0.00 52.55 52.51 1n1a s ASP 68 Cb 0.16 0.38 0.20 0.00 -0.30 0.00 0.00 42.92 43.36 1n1a s ASP 68 CO 0.78 -0.71 1.32 -0.55 -0.17 0.00 0.00 175.17 175.84 1n1a s SER 69 N -3.05 -0.01 0.56 -0.34 0.15 -1.26 -1.61 113.70 108.14 1n1a s SER 69 Ca 0.15 0.01 0.25 0.00 0.70 0.00 0.00 55.95 57.06 1n1a s SER 69 Cb 0.00 1.01 1.58 0.00 -1.71 0.00 0.00 66.02 66.90 1n1a s SER 69 CO 0.01 -0.00 2.15 0.77 1.20 0.00 0.00 173.24 177.37 1n1a h SER 70 N 6.59 0.00 -0.47 5.45 4.64 -1.72 -3.49 113.55 124.56 1n1a h SER 70 Ca -0.16 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 60.84 1n1a h SER 70 Cb 1.13 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.19 1n1a h SER 70 CO 0.10 0.00 1.02 -0.76 -0.87 0.00 0.00 176.83 176.32 1n1a s LEU 71 N -8.15 3.03 0.31 5.97 1.43 -1.25 -4.93 118.68 115.09 1n1a s LEU 71 Ca -0.05 -1.61 0.03 0.00 -1.03 0.00 0.00 54.13 51.48 1n1a s LEU 71 Cb 0.16 -2.59 -0.03 0.00 0.03 0.00 0.00 46.19 43.77 1n1a s LEU 71 CO 0.60 -3.13 0.47 -0.54 0.23 0.00 0.00 176.35 173.99 1n1a s LYS 76 N 6.56 3.37 -0.05 1.70 3.01 -1.26 -5.17 119.74 127.90 1n1a s LYS 76 Ca 0.69 -0.62 -0.16 0.00 -1.01 0.00 0.00 55.97 54.87 1n1a s LYS 76 Cb -0.01 -2.77 -0.05 0.00 -1.01 0.00 0.00 37.83 33.99 1n1a s LYS 76 CO 0.13 0.21 0.43 0.12 0.51 0.00 0.00 175.35 176.74 1n1a s PHE 77 N -2.19 3.64 0.10 3.18 2.19 0.66 -4.91 117.98 120.65 1n1a s PHE 77 Ca 0.39 0.94 0.04 0.00 0.33 0.00 0.00 56.93 58.63 1n1a s PHE 77 Cb -0.09 -2.38 -0.04 0.00 -1.31 0.00 0.00 43.02 39.20 1n1a s PHE 77 CO 0.33 0.46 -0.11 0.45 1.83 0.00 0.00 175.22 178.18 1n1a s SER 78 N -0.43 1.53 0.18 6.13 0.15 -1.26 -1.21 113.70 118.79 1n1a s SER 78 Ca 0.24 -0.80 -0.23 0.00 0.70 0.00 0.00 55.95 55.87 1n1a s SER 78 Cb -0.16 -0.01 0.07 0.00 -1.71 0.00 0.00 66.02 64.22 1n1a s SER 78 CO 0.12 -0.23 1.03 0.72 1.20 0.00 0.00 173.24 176.07 1n1a s PHE 79 N -2.31 0.04 -0.25 3.44 -0.12 -0.76 -4.97 117.98 113.05 1n1a s PHE 79 Ca 0.05 -0.42 -0.15 0.00 -0.05 0.00 0.00 56.93 56.36 1n1a s PHE 79 Cb -0.04 0.69 -0.04 0.00 -0.63 0.00 0.00 43.02 43.01 1n1a s PHE 79 CO 0.01 -0.91 0.39 -0.51 -0.05 0.00 0.00 175.22 174.15 1n1a s ASP 80 N -3.31 6.33 0.16 1.98 -0.00 -1.26 -0.14 116.67 120.43 1n1a s ASP 80 Ca 0.20 0.39 -0.30 0.00 -0.00 0.00 0.00 52.55 52.84 1n1a s ASP 80 Cb -0.02 -2.22 -0.07 0.00 -0.00 0.00 0.00 42.92 40.60 1n1a s ASP 80 CO 0.05 -0.15 1.16 -0.22 -0.00 0.00 0.00 175.17 176.00 1n1a s LEU 81 N 1.82 4.45 -1.00 1.23 2.96 -0.33 -3.87 118.68 123.94 1n1a s LEU 81 Ca 0.17 2.13 0.00 0.00 -0.22 0.00 0.00 54.13 56.21 1n1a s LEU 81 Cb -0.15 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.94 1n1a s LEU 81 CO 0.09 -0.33 0.00 0.61 -1.32 0.00 0.00 176.35 175.40 1n1a n GLY 82 N 2.33 -0.05 0.31 7.98 0.00 -1.26 -0.34 105.19 114.16 1n1a n GLY 82 Ca 0.05 -0.40 0.04 0.00 0.00 0.00 0.00 46.02 45.70 1n1a n GLY 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n1a n LYS 83 N -2.14 0.57 -1.02 1.61 4.76 -1.25 -4.73 118.16 115.96 1n1a n LYS 83 Ca -0.14 -1.11 -0.01 0.00 -2.87 0.00 0.00 58.31 54.18 1n1a n LYS 83 Cb 0.60 -1.15 -0.00 0.00 -1.84 0.00 0.00 35.03 32.64 1n1a n LYS 83 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1n1a n GLY 84 N 0.36 0.47 0.19 0.72 0.00 -1.26 -4.93 105.19 100.73 1n1a n GLY 84 Ca 0.05 -0.71 0.09 0.00 0.00 0.00 0.00 46.02 45.45 1n1a n GLY 84 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1n1a h GLU 85 N 0.30 0.00 -5.14 1.61 5.08 -1.93 -3.46 114.58 111.03 1n1a h GLU 85 Ca -0.02 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.71 1n1a h GLU 85 Cb 0.07 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.19 1n1a h GLU 85 CO 0.02 0.13 -0.52 0.14 -1.00 0.00 0.00 179.01 177.79 1n1a s VAL 86 N -3.15 0.95 0.54 3.13 -7.23 -1.26 -5.07 120.40 108.30 1n1a s VAL 86 Ca 0.05 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.02 1n1a s VAL 86 Cb 0.06 -2.24 -0.07 0.00 0.56 0.00 0.00 36.38 34.69 1n1a s VAL 86 CO 0.70 0.00 0.87 -0.38 -0.31 0.00 0.00 175.10 175.99 1n1a n ILE 87 N -1.13 2.99 -0.12 -0.62 5.41 -1.26 -4.69 119.36 119.94 1n1a n ILE 87 Ca -0.14 -0.50 -0.05 0.00 1.00 0.00 0.00 62.75 63.06 1n1a n ILE 87 Cb 0.66 -1.04 0.03 0.00 -0.71 0.00 0.00 39.64 38.58 1n1a n ILE 87 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 1n1a h LYS 88 N 0.74 0.22 -0.47 0.38 1.57 -1.81 0.99 116.57 118.19 1n1a h LYS 88 Ca -0.47 -0.01 0.14 0.00 -1.87 0.00 0.00 60.65 58.44 1n1a h LYS 88 Cb 1.36 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.61 1n1a h LYS 88 CO 0.52 0.14 0.42 0.00 -0.57 0.00 0.00 179.45 179.96 1n1a h ALA 89 N 1.29 2.28 0.03 3.86 0.00 -0.29 -1.45 119.26 124.98 1n1a h ALA 89 Ca 0.19 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 1n1a h ALA 89 Cb 0.22 0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.05 1n1a h ALA 89 CO -0.24 -0.66 -0.24 -1.49 0.00 0.00 0.00 179.25 176.62 1n1a h TRP 90 N 0.00 0.19 -0.97 0.00 4.06 -1.09 -1.20 115.95 116.94 1n1a h TRP 90 Ca 0.22 -0.12 0.10 0.00 2.06 0.00 0.00 58.89 61.15 1n1a h TRP 90 Cb 1.06 -0.01 -0.08 0.00 -1.00 0.00 0.00 29.16 29.13 1n1a h TRP 90 CO 0.00 1.03 0.60 -0.44 -3.56 0.00 0.00 178.44 176.08 1n1a h ASP 91 N -0.71 0.91 -0.17 -3.49 3.32 -0.58 -2.01 116.42 113.68 1n1a h ASP 91 Ca -0.04 0.04 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 1n1a h ASP 91 Cb 1.12 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 40.53 1n1a h ASP 91 CO 0.05 0.51 -0.23 0.40 -1.72 0.00 0.00 179.24 178.25 1n1a h ILE 92 N 1.00 1.35 -0.21 0.35 2.04 -1.31 -3.30 117.51 117.42 1n1a h ILE 92 Ca 0.46 -1.44 -0.07 0.00 1.00 0.00 0.00 64.86 64.81 1n1a h ILE 92 Cb 0.39 1.89 -0.00 0.00 -0.74 0.00 0.00 36.82 38.35 1n1a h ILE 92 CO -0.24 0.43 -0.14 0.00 0.00 0.00 0.00 178.15 178.20 1n1a h ALA 93 N 0.60 0.31 0.00 1.87 0.00 -0.87 -3.26 119.26 117.90 1n1a h ALA 93 Ca 0.02 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 1n1a h ALA 93 Cb 0.80 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1n1a h ALA 93 CO 0.05 0.19 -0.28 0.82 0.00 0.00 0.00 179.25 180.03 1n1a h ILE 94 N 0.17 0.99 0.00 0.00 2.04 -1.54 -0.27 117.51 118.90 1n1a h ILE 94 Ca 0.04 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 64.85 1n1a h ILE 94 Cb 0.66 1.60 0.00 0.00 -0.74 0.00 0.00 36.82 38.34 1n1a h ILE 94 CO 0.04 0.28 0.00 0.00 0.00 0.00 0.00 178.15 178.47 1n1a n ALA 95 N -2.39 1.83 0.01 1.87 0.00 -1.23 -2.53 120.51 118.06 1n1a n ALA 95 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1n1a n ALA 95 Cb 0.36 -1.17 0.01 0.00 0.00 0.00 0.00 19.45 18.65 1n1a n ALA 95 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1n1a n THR 96 N -1.09 0.61 -3.83 0.00 -2.24 -0.12 -4.85 114.28 102.77 1n1a n THR 96 Ca 0.07 -0.81 -0.35 0.00 -2.27 0.00 0.00 64.05 60.70 1n1a n THR 96 Cb 0.05 0.70 -0.05 0.00 -2.10 0.00 0.00 70.33 68.93 1n1a n THR 96 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1n1a s MET 97 N -0.64 3.51 0.45 -0.78 1.00 -1.05 -5.10 119.30 116.69 1n1a s MET 97 Ca 0.02 -0.16 -0.11 0.00 0.00 0.00 0.00 55.69 55.44 1n1a s MET 97 Cb 0.01 -3.11 -0.06 0.00 0.00 0.00 0.00 34.83 31.67 1n1a s MET 97 CO 0.01 0.69 0.82 0.15 0.00 0.00 0.00 175.02 176.69 1n1a s LYS 98 N -1.65 3.75 0.22 2.03 3.01 -1.26 -4.38 119.74 121.46 1n1a s LYS 98 Ca 0.25 0.52 -0.30 0.00 -1.01 0.00 0.00 55.97 55.42 1n1a s LYS 98 Cb -0.13 -2.33 -0.10 0.00 -1.01 0.00 0.00 37.83 34.27 1n1a s LYS 98 CO 0.14 -0.14 1.44 0.08 0.51 0.00 0.00 175.35 177.39 1n1a s VAL 99 N -2.53 2.76 0.00 3.17 1.01 -0.95 -1.94 120.40 121.93 1n1a s VAL 99 Ca 0.52 0.61 0.00 0.00 0.00 0.00 0.00 61.98 63.11 1n1a s VAL 99 Cb -0.10 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.88 1n1a s VAL 99 CO 0.35 0.08 0.00 0.61 0.00 0.00 0.00 175.10 176.15 1n1a n GLY 100 N 2.59 0.66 3.76 4.51 0.00 0.20 -4.12 105.19 112.80 1n1a n GLY 100 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 1n1a n GLY 100 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1n1a s GLU 101 N -0.79 4.59 -0.11 1.61 2.12 -0.82 -4.37 118.70 120.94 1n1a s GLU 101 Ca 0.00 1.76 0.02 0.00 0.36 0.00 0.00 54.97 57.11 1n1a s GLU 101 Cb 0.00 -3.12 -0.01 0.00 0.26 0.00 0.00 34.13 31.26 1n1a s GLU 101 CO 0.00 0.18 -0.18 0.08 -0.54 0.00 0.00 175.26 174.80 1n1a s VAL 102 N -1.22 2.61 0.20 3.70 1.01 0.35 -1.14 120.40 125.90 1n1a s VAL 102 Ca 0.46 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.62 1n1a s VAL 102 Cb -0.31 -2.05 -0.05 0.00 0.00 0.00 0.00 36.38 33.97 1n1a s VAL 102 CO 0.39 0.54 0.06 0.00 0.00 0.00 0.00 175.10 176.10 1n1a s HIS 104 N -3.85 2.59 -0.07 0.00 3.76 0.63 -1.57 115.29 116.77 1n1a s HIS 104 Ca 0.31 -1.39 0.05 0.00 -0.15 0.00 0.00 55.06 53.87 1n1a s HIS 104 Cb 0.07 -1.79 -0.01 0.00 1.11 0.00 0.00 32.58 31.96 1n1a s HIS 104 CO 0.08 -0.67 -0.22 0.96 -0.85 0.00 0.00 174.74 174.04 1n1a s ILE 105 N 1.06 2.33 -0.27 0.60 -4.36 -0.47 -1.16 121.20 118.93 1n1a s ILE 105 Ca -0.02 -0.96 -0.08 0.00 -0.26 0.00 0.00 60.65 59.33 1n1a s ILE 105 Cb -0.14 -1.88 -0.03 0.00 1.25 0.00 0.00 42.46 41.66 1n1a s ILE 105 CO -0.07 0.57 0.10 -0.89 0.24 0.00 0.00 174.94 174.89 1n1a s THR 106 N -0.14 4.51 -0.16 8.37 2.01 0.90 -1.38 115.64 129.75 1n1a s THR 106 Ca -0.03 -0.18 -0.02 0.00 0.31 0.00 0.00 61.69 61.77 1n1a s THR 106 Cb -0.14 -3.16 -0.02 0.00 0.01 0.00 0.00 72.50 69.20 1n1a s THR 106 CO 0.04 0.27 -0.09 0.00 -0.69 0.00 0.00 174.62 174.15 1n1a s LYS 108 N 0.62 3.30 0.20 0.00 -0.14 -0.59 -0.49 119.74 122.63 1n1a s LYS 108 Ca -0.05 0.71 -0.22 0.00 -1.36 0.00 0.00 55.97 55.05 1n1a s LYS 108 Cb -0.15 -2.05 0.13 0.00 -1.68 0.00 0.00 37.83 34.08 1n1a s LYS 108 CO 0.03 -0.77 1.56 -1.35 -0.76 0.00 0.00 175.35 174.06 1n1a h PRO 109 N -0.47 -0.10 0.00 -1.68 0.11 -1.86 -1.79 132.00 126.21 1n1a h PRO 109 Ca -0.44 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1n1a h PRO 109 Cb 1.21 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1n1a h PRO 109 CO 0.62 -0.07 0.00 -0.85 -0.21 0.00 0.00 178.00 177.49 1n1a n GLU 110 N -5.43 0.01 -0.11 1.05 0.00 -1.26 -0.64 120.64 114.27 1n1a n GLU 110 Ca 0.06 0.49 0.09 0.00 0.00 0.00 0.00 57.16 57.80 1n1a n GLU 110 Cb 0.36 -1.54 0.14 0.00 0.00 0.00 0.00 31.44 30.40 1n1a n GLU 110 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1n1a n TYR 111 N -1.57 0.28 0.00 -1.84 4.02 -0.68 -4.85 117.16 112.52 1n1a n TYR 111 Ca 0.00 -0.19 0.00 0.00 -0.01 0.00 0.00 57.90 57.70 1n1a n TYR 111 Cb 0.02 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.33 1n1a n TYR 111 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1n1a n ALA 112 N 1.06 0.00 1.44 -0.72 0.00 0.19 0.50 120.51 122.98 1n1a n ALA 112 Ca 0.14 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.72 1n1a n ALA 112 Cb 0.48 0.00 0.73 0.00 0.00 0.00 0.00 19.45 20.66 1n1a n ALA 112 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1n1a n TYR 113 N 0.00 0.00 -4.97 0.00 4.02 -1.10 -4.77 117.16 110.34 1n1a n TYR 113 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1n1a n TYR 113 Cb 0.00 -0.25 0.00 0.00 -0.02 0.00 0.00 39.34 39.07 1n1a n TYR 113 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1n1a n GLY 114 N 1.27 1.18 0.09 2.72 0.00 -0.10 -2.42 105.19 107.94 1n1a n GLY 114 Ca 0.15 -0.59 0.13 0.00 0.00 0.00 0.00 46.02 45.70 1n1a n GLY 114 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1n1a n SER 115 N -2.50 0.79 0.18 1.61 3.41 -1.26 0.29 113.62 116.13 1n1a n SER 115 Ca 0.00 0.45 0.10 0.00 -0.26 0.00 0.00 58.87 59.15 1n1a n SER 115 Cb 0.00 -0.53 0.10 0.00 -0.26 0.00 0.00 64.21 63.52 1n1a n SER 115 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n1a h ALA 116 N 2.52 0.84 -1.03 7.33 0.00 -1.91 -3.41 119.26 123.60 1n1a h ALA 116 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1n1a h ALA 116 Cb 0.74 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1n1a h ALA 116 CO 0.00 0.15 0.00 0.41 0.00 0.00 0.00 179.25 179.81 1n1a n GLY 117 N 1.15 0.73 2.56 0.00 0.00 -1.02 -4.56 105.19 104.05 1n1a n GLY 117 Ca 0.02 -0.84 -0.26 0.00 0.00 0.00 0.00 46.02 44.94 1n1a n GLY 117 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1n1a s SER 118 N -4.00 2.59 0.41 1.61 0.01 0.26 -4.92 113.70 109.65 1n1a s SER 118 Ca 0.00 -1.82 -0.27 0.00 1.31 0.00 0.00 55.95 55.17 1n1a s SER 118 Cb 0.00 -0.13 -0.10 0.00 0.21 0.00 0.00 66.02 66.01 1n1a s SER 118 CO 0.00 -0.32 1.46 -2.16 0.41 0.00 0.00 173.24 172.63 1n1a s PRO 119 N 1.39 3.93 0.00 12.44 0.04 -1.25 0.15 135.00 151.71 1n1a s PRO 119 Ca 0.16 2.50 0.15 0.00 0.04 0.00 0.00 61.00 63.85 1n1a s PRO 119 Cb -0.20 -2.84 0.11 0.00 0.04 0.00 0.00 34.50 31.62 1n1a s PRO 119 CO -0.08 -0.65 0.96 -0.35 0.04 0.00 0.00 177.00 176.92 1n1a n PRO 120 N 0.19 1.04 0.14 0.56 -0.04 -1.26 -4.81 135.00 130.82 1n1a n PRO 120 Ca 0.03 -1.35 -0.01 0.00 -0.04 0.00 0.00 63.50 62.13 1n1a n PRO 120 Cb 0.40 -1.28 0.19 0.00 -0.04 0.00 0.00 33.50 32.78 1n1a n PRO 120 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1n1a h LYS 121 N 2.82 0.00 -4.06 0.54 1.57 -1.74 -3.43 116.57 112.27 1n1a h LYS 121 Ca 0.00 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.29 1n1a h LYS 121 Cb 0.60 0.00 -0.37 0.00 0.08 0.00 0.00 32.23 32.54 1n1a h LYS 121 CO 0.00 0.59 -0.79 0.42 -0.57 0.00 0.00 179.45 179.10 1n1a s ILE 122 N -3.64 0.78 1.09 1.86 1.01 0.12 -4.95 121.20 117.48 1n1a s ILE 122 Ca -0.01 -0.15 -0.16 0.00 0.00 0.00 0.00 60.65 60.32 1n1a s ILE 122 Cb 0.13 -0.84 0.23 0.00 0.01 0.00 0.00 42.46 41.99 1n1a s ILE 122 CO 0.76 0.32 1.12 -2.84 0.00 0.00 0.00 174.94 174.29 1n1a s PRO 123 N 1.65 -0.34 0.34 2.79 0.02 -1.26 0.91 135.00 139.12 1n1a s PRO 123 Ca 0.02 0.16 -0.25 0.00 0.02 0.00 0.00 61.00 60.95 1n1a s PRO 123 Cb -0.13 -1.68 -0.10 0.00 0.02 0.00 0.00 34.50 32.62 1n1a s PRO 123 CO -0.06 -3.17 0.97 -2.14 -0.33 0.00 0.00 177.00 172.28 1n1a s PRO 124 N -5.25 4.48 -1.09 5.54 0.02 -1.26 -3.99 135.00 133.45 1n1a s PRO 124 Ca 0.68 1.37 -0.01 0.00 0.02 0.00 0.00 61.00 63.07 1n1a s PRO 124 Cb -0.13 -2.72 0.00 0.00 0.02 0.00 0.00 34.50 31.67 1n1a s PRO 124 CO 0.56 0.17 0.91 0.09 -0.33 0.00 0.00 177.00 178.40 1n1a n ASN 125 N 0.38 -2.57 -4.64 2.53 3.02 0.14 -4.92 115.26 109.20 1n1a n ASN 125 Ca 0.03 -0.54 -0.38 0.00 -0.03 0.00 0.00 54.58 53.66 1n1a n ASN 125 Cb 0.50 -4.61 -0.09 0.00 -0.61 0.00 0.00 39.78 34.97 1n1a n ASN 125 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n1a s ALA 126 N -3.32 3.58 -0.06 5.41 0.00 -1.26 -4.77 121.76 121.34 1n1a s ALA 126 Ca 0.07 -0.86 -0.27 0.00 0.00 0.00 0.00 51.96 50.90 1n1a s ALA 126 Cb -0.03 -2.48 -0.03 0.00 0.00 0.00 0.00 23.12 20.59 1n1a s ALA 126 CO 0.65 -0.37 0.88 0.99 0.00 0.00 0.00 175.76 177.91 1n1a s THR 127 N 1.42 4.91 0.28 0.00 2.01 -1.26 -3.55 115.64 119.45 1n1a s THR 127 Ca 0.11 1.82 0.10 0.00 0.31 0.00 0.00 61.69 64.02 1n1a s THR 127 Cb -0.15 -4.21 -0.05 0.00 0.01 0.00 0.00 72.50 68.10 1n1a s THR 127 CO 0.07 0.14 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.23 1n1a s LEU 128 N 1.30 2.60 -0.07 4.42 1.43 0.35 -3.69 118.68 125.02 1n1a s LEU 128 Ca 0.45 -1.08 0.02 0.00 -1.03 0.00 0.00 54.13 52.49 1n1a s LEU 128 Cb -0.19 -0.95 0.01 0.00 0.03 0.00 0.00 46.19 45.10 1n1a s LEU 128 CO 0.21 -0.10 -0.14 -0.69 0.23 0.00 0.00 176.35 175.87 1n1a s VAL 129 N -2.67 1.26 -0.04 -1.59 1.01 -0.28 -0.35 120.40 117.73 1n1a s VAL 129 Ca 0.29 -0.55 0.06 0.00 0.00 0.00 0.00 61.98 61.78 1n1a s VAL 129 Cb -0.02 -1.14 -0.01 0.00 0.00 0.00 0.00 36.38 35.21 1n1a s VAL 129 CO 0.13 0.38 -0.21 -0.36 0.00 0.00 0.00 175.10 175.05 1n1a s PHE 130 N 0.66 1.97 -0.25 5.22 0.40 -0.48 -0.69 117.98 124.81 1n1a s PHE 130 Ca -0.14 -0.49 -0.06 0.00 -0.60 0.00 0.00 56.93 55.63 1n1a s PHE 130 Cb -0.16 -1.29 -0.01 0.00 0.51 0.00 0.00 43.02 42.06 1n1a s PHE 130 CO 0.04 -0.12 0.04 -2.00 0.70 0.00 0.00 175.22 173.87 1n1a s GLU 131 N -0.23 3.43 -0.04 0.44 2.12 -0.97 -1.37 118.70 122.08 1n1a s GLU 131 Ca 0.01 -0.62 0.06 0.00 0.36 0.00 0.00 54.97 54.79 1n1a s GLU 131 Cb -0.11 -3.24 -0.01 0.00 0.26 0.00 0.00 34.13 31.03 1n1a s GLU 131 CO 0.01 -0.26 -0.22 0.08 -0.54 0.00 0.00 175.26 174.33 1n1a s VAL 132 N 1.55 1.80 -0.09 3.70 1.01 -0.61 -2.02 120.40 125.73 1n1a s VAL 132 Ca 0.05 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.13 1n1a s VAL 132 Cb -0.15 -1.51 -0.00 0.00 0.00 0.00 0.00 36.38 34.71 1n1a s VAL 132 CO 0.01 0.51 -0.23 -0.70 0.00 0.00 0.00 175.10 174.69 1n1a s GLU 133 N -0.30 2.91 -0.27 2.72 2.12 -0.47 -1.02 118.70 124.39 1n1a s GLU 133 Ca 0.02 -0.87 -0.17 0.00 0.36 0.00 0.00 54.97 54.31 1n1a s GLU 133 Cb -0.11 -2.28 -0.03 0.00 0.26 0.00 0.00 34.13 31.97 1n1a s GLU 133 CO 0.01 0.25 0.47 -1.17 -0.54 0.00 0.00 175.26 174.29 1n1a s LEU 134 N 0.16 4.08 -0.24 2.70 2.96 -0.29 -2.81 118.68 125.25 1n1a s LEU 134 Ca -0.13 0.39 -0.07 0.00 -0.22 0.00 0.00 54.13 54.10 1n1a s LEU 134 Cb -0.16 -2.58 -0.17 0.00 0.50 0.00 0.00 46.19 43.77 1n1a s LEU 134 CO 0.07 -0.28 -0.12 0.49 -1.32 0.00 0.00 176.35 175.19 1n1a n PHE 135 N 5.50 0.32 -3.80 5.38 3.01 -0.36 0.61 117.46 128.13 1n1a n PHE 135 Ca -0.05 0.09 -0.01 0.00 1.01 0.00 0.00 57.45 58.49 1n1a n PHE 135 Cb 0.50 -1.04 0.00 0.00 -0.01 0.00 0.00 39.48 38.93 1n1a n PHE 135 CO 0.00 0.00 0.00 -1.83 1.01 0.00 0.00 176.76 175.94 1n1a s GLU 136 N -2.51 0.93 0.01 -1.08 -1.05 -1.09 -4.59 118.70 109.32 1n1a s GLU 136 Ca -0.33 -0.56 -0.25 0.00 -0.15 0.00 0.00 54.97 53.68 1n1a s GLU 136 Cb 0.10 0.28 0.06 0.00 -0.44 0.00 0.00 34.13 34.13 1n1a s GLU 136 CO 0.59 -0.43 0.55 -0.59 0.95 0.00 0.00 175.26 176.33 1n1a s PHE 137 N -2.50 -0.48 -0.05 4.83 -0.12 -1.26 0.27 117.98 118.67 1n1a s PHE 137 Ca 0.19 0.68 0.02 0.00 -0.05 0.00 0.00 56.93 57.77 1n1a s PHE 137 Cb -0.00 0.34 0.01 0.00 -0.63 0.00 0.00 43.02 42.74 1n1a s PHE 137 CO 0.01 -0.60 -0.10 0.21 -0.05 0.00 0.00 175.22 174.70 1n1a s LYS 138 N -1.86 1.34 0.27 1.99 2.47 0.76 -4.93 119.74 119.78 1n1a s LYS 138 Ca -0.08 -0.32 -0.26 0.00 -1.56 0.00 0.00 55.97 53.75 1n1a s LYS 138 Cb -0.01 -1.17 -0.16 0.00 -1.46 0.00 0.00 37.83 35.03 1n1a s LYS 138 CO 0.03 0.02 0.48 0.41 0.16 0.00 0.00 175.35 176.46 1n1a n GLY 139 N 3.75 -1.78 0.00 5.54 0.00 -1.26 -1.77 105.19 109.66 1n1a n GLY 139 Ca -0.23 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1n1a n GLY 139 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50