#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x1n h GLU 2 N 0.00 0.41 -0.09 0.03 3.07 -2.07 -2.10 114.58 113.82 2x1n h GLU 2 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 2x1n h GLU 2 Cb 0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 27.82 2x1n h GLU 2 CO 0.00 0.27 0.00 0.09 -1.40 0.00 0.00 179.01 177.97 2x1n n ASN 3 N -4.48 1.50 -4.63 1.42 3.02 -1.26 -4.84 115.26 106.00 2x1n n ASN 3 Ca 0.05 -1.59 -0.34 0.00 -0.03 0.00 0.00 54.58 52.67 2x1n n ASN 3 Cb 0.19 -0.06 -0.10 0.00 -0.61 0.00 0.00 39.78 39.20 2x1n n ASN 3 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2x1n s PHE 4 N -1.89 3.05 -0.23 3.10 0.08 -0.79 -0.60 117.98 120.70 2x1n s PHE 4 Ca 0.35 0.09 -0.00 0.00 0.12 0.00 0.00 56.93 57.49 2x1n s PHE 4 Cb 0.19 -1.76 0.03 0.00 -0.57 0.00 0.00 43.02 40.91 2x1n s PHE 4 CO 0.29 0.38 -0.10 -1.14 -0.10 0.00 0.00 175.22 174.55 2x1n s GLN 5 N -0.79 2.79 0.12 0.44 2.00 0.18 -4.92 119.66 119.48 2x1n s GLN 5 Ca 0.12 -0.99 -0.31 0.00 -2.00 0.00 0.00 55.36 52.18 2x1n s GLN 5 Cb -0.11 -2.87 -0.09 0.00 0.80 0.00 0.00 33.01 30.74 2x1n s GLN 5 CO 0.02 -0.38 1.50 0.15 -0.50 0.00 0.00 175.29 176.08 2x1n s LYS 6 N 1.29 4.26 -0.21 1.67 1.02 -1.26 -0.87 119.74 125.63 2x1n s LYS 6 Ca -0.00 2.22 -0.15 0.00 0.02 0.00 0.00 55.97 58.05 2x1n s LYS 6 Cb -0.16 -3.29 -0.08 0.00 -0.52 0.00 0.00 37.83 33.77 2x1n s LYS 6 CO -0.07 -0.56 -0.33 0.28 -0.92 0.00 0.00 175.35 173.75 2x1n n VAL 7 N 4.14 1.46 -3.48 3.17 0.31 0.21 -4.94 118.33 119.19 2x1n n VAL 7 Ca 0.13 -0.07 -0.12 0.00 -0.01 0.00 0.00 64.34 64.27 2x1n n VAL 7 Cb 0.41 -2.11 -0.03 0.00 -0.91 0.00 0.00 33.84 31.20 2x1n n VAL 7 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2x1n s GLU 8 N -2.69 1.03 0.29 5.55 -1.05 -1.17 -5.00 118.70 115.66 2x1n s GLU 8 Ca -0.31 -0.19 -0.29 0.00 -0.15 0.00 0.00 54.97 54.02 2x1n s GLU 8 Cb 0.08 0.48 -0.10 0.00 -0.44 0.00 0.00 34.13 34.15 2x1n s GLU 8 CO 0.43 -0.41 1.13 0.21 0.95 0.00 0.00 175.26 177.57 2x1n s LYS 9 N -2.71 4.57 0.00 -4.83 2.20 -1.26 0.01 119.74 117.72 2x1n s LYS 9 Ca -0.01 1.86 0.00 0.00 -0.36 0.00 0.00 55.97 57.46 2x1n s LYS 9 Cb -0.01 -3.15 0.00 0.00 -1.51 0.00 0.00 37.83 33.17 2x1n s LYS 9 CO -0.05 0.13 0.00 0.44 -0.36 0.00 0.00 175.35 175.51 2x1n n ILE 10 N 1.08 0.00 0.00 5.43 -5.35 -0.34 -4.82 119.36 115.35 2x1n n ILE 10 Ca -0.01 -0.27 0.00 0.00 -0.27 0.00 0.00 62.75 62.20 2x1n n ILE 10 Cb 0.44 0.89 0.00 0.00 -1.74 0.00 0.00 39.64 39.23 2x1n n ILE 10 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2x1n n GLY 11 N 0.82 -0.27 2.97 3.28 0.00 -1.17 -5.00 105.19 105.83 2x1n n GLY 11 Ca 0.00 -1.04 -0.21 0.00 0.00 0.00 0.00 46.02 44.76 2x1n n GLY 11 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2x1n s GLU 12 N -2.00 1.15 0.00 1.61 0.41 -1.26 0.16 118.70 118.77 2x1n s GLU 12 Ca 0.00 -0.27 0.00 0.00 -0.41 0.00 0.00 54.97 54.29 2x1n s GLU 12 Cb 0.00 -1.03 0.00 0.00 -1.78 0.00 0.00 34.13 31.32 2x1n s GLU 12 CO 0.00 0.02 0.00 0.41 -0.49 0.00 0.00 175.26 175.20 2x1n n GLY 13 N 3.73 3.39 2.38 -1.39 0.00 -0.74 -4.97 105.19 107.59 2x1n n GLY 13 Ca -0.22 -1.80 -0.28 0.00 0.00 0.00 0.00 46.02 43.71 2x1n n GLY 13 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2x1n n THR 14 N 0.00 3.83 0.00 2.61 -2.24 -1.26 -4.39 114.28 112.83 2x1n n THR 14 Ca 0.00 -3.00 0.00 0.00 -2.27 0.00 0.00 64.05 58.78 2x1n n THR 14 Cb 0.00 -1.88 0.00 0.00 -2.10 0.00 0.00 70.33 66.35 2x1n n THR 14 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2x1n n TYR 15 N 1.63 0.00 -3.64 4.78 4.01 -1.26 -4.81 117.16 117.88 2x1n n TYR 15 Ca 0.54 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 58.12 2x1n n TYR 15 Cb 0.52 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.47 2x1n n TYR 15 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2x1n s GLY 16 N -2.00 -0.41 0.07 2.72 0.00 -1.26 -4.78 107.32 101.66 2x1n s GLY 16 Ca 0.00 1.12 -0.27 0.00 0.00 0.00 0.00 44.72 45.57 2x1n s GLY 16 CO 0.00 0.85 0.85 0.54 0.00 0.00 0.00 173.10 175.34 2x1n s VAL 17 N -0.79 4.63 -0.21 1.40 0.11 -1.21 -1.78 120.40 122.55 2x1n s VAL 17 Ca -0.08 1.82 -0.09 0.00 -2.93 0.00 0.00 61.98 60.70 2x1n s VAL 17 Cb -0.03 -4.21 -0.05 0.00 -1.53 0.00 0.00 36.38 30.57 2x1n s VAL 17 CO 0.06 0.34 0.12 -0.69 -3.33 0.00 0.00 175.10 171.60 2x1n s VAL 18 N -0.04 5.15 0.05 2.04 1.01 0.12 -2.55 120.40 126.19 2x1n s VAL 18 Ca 0.42 0.10 0.07 0.00 0.00 0.00 0.00 61.98 62.58 2x1n s VAL 18 Cb -0.22 -3.36 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 2x1n s VAL 18 CO 0.26 0.41 -0.18 -0.31 0.00 0.00 0.00 175.10 175.28 2x1n s TYR 19 N 0.65 2.54 -0.04 5.22 1.51 0.18 -1.20 117.35 126.21 2x1n s TYR 19 Ca 0.06 -0.26 -0.30 0.00 -1.01 0.00 0.00 57.07 55.56 2x1n s TYR 19 Cb -0.12 -1.45 -0.03 0.00 -0.11 0.00 0.00 41.96 40.25 2x1n s TYR 19 CO 0.01 0.26 1.04 0.21 -1.11 0.00 0.00 175.55 175.96 2x1n s LYS 20 N -1.50 4.48 0.17 -0.62 2.20 0.10 -0.11 119.74 124.46 2x1n s LYS 20 Ca 0.15 1.48 0.01 0.00 -0.36 0.00 0.00 55.97 57.24 2x1n s LYS 20 Cb -0.10 -3.49 -0.04 0.00 -1.51 0.00 0.00 37.83 32.68 2x1n s LYS 20 CO 0.06 -0.21 0.03 0.00 -0.36 0.00 0.00 175.35 174.86 2x1n s ALA 21 N 1.50 1.26 -0.09 3.13 0.00 0.25 -0.62 121.76 127.19 2x1n s ALA 21 Ca 0.52 -1.59 0.01 0.00 0.00 0.00 0.00 51.96 50.90 2x1n s ALA 21 Cb -0.21 0.69 0.02 0.00 0.00 0.00 0.00 23.12 23.61 2x1n s ALA 21 CO 0.24 -0.38 -0.12 0.50 0.00 0.00 0.00 175.76 176.00 2x1n s ARG 22 N -3.96 1.80 -0.42 0.00 3.52 -0.05 -0.28 118.95 119.55 2x1n s ARG 22 Ca 0.26 -0.41 -0.28 0.00 -0.13 0.00 0.00 55.73 55.16 2x1n s ARG 22 Cb 0.07 -1.60 0.00 0.00 -1.56 0.00 0.00 34.95 31.86 2x1n s ARG 22 CO 0.04 -0.09 1.55 1.21 -0.81 0.00 0.00 175.30 177.21 2x1n s ASN 23 N 1.06 6.11 0.51 -2.12 3.84 -0.42 -0.65 114.94 123.28 2x1n s ASN 23 Ca -0.06 0.87 0.18 0.00 0.21 0.00 0.00 52.86 54.05 2x1n s ASN 23 Cb -0.15 -2.54 1.29 0.00 -0.55 0.00 0.00 41.25 39.30 2x1n s ASN 23 CO -0.01 -1.61 2.12 0.11 -2.79 0.00 0.00 177.10 174.92 2x1n h LYS 24 N 11.65 0.00 0.15 0.43 1.57 -1.19 0.20 116.57 129.38 2x1n h LYS 24 Ca -0.29 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.15 2x1n h LYS 24 Cb 1.13 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.43 2x1n h LYS 24 CO 1.09 0.06 -1.77 -0.07 -0.57 0.00 0.00 179.45 178.19 2x1n h LEU 25 N 0.00 0.50 0.03 2.94 3.38 -1.90 -3.40 115.31 116.86 2x1n h LEU 25 Ca -0.00 -0.92 -0.36 0.00 0.09 0.00 0.00 57.88 56.68 2x1n h LEU 25 Cb 0.10 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 2x1n h LEU 25 CO 0.01 1.78 -2.22 0.35 0.09 0.00 0.00 178.44 178.45 2x1n n THR 26 N -3.64 1.55 0.00 0.22 -2.24 -1.21 -5.01 114.28 103.96 2x1n n THR 26 Ca -0.27 -0.70 0.00 0.00 -2.27 0.00 0.00 64.05 60.80 2x1n n THR 26 Cb 1.03 -1.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 2x1n n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x1n n GLY 27 N 1.95 0.33 3.73 3.38 0.00 0.69 -5.06 105.19 110.21 2x1n n GLY 27 Ca -0.35 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.26 2x1n n GLY 27 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2x1n s GLU 28 N -0.88 4.32 -0.15 1.61 2.12 -1.26 -4.71 118.70 119.74 2x1n s GLU 28 Ca 0.00 2.14 -0.21 0.00 0.36 0.00 0.00 54.97 57.26 2x1n s GLU 28 Cb 0.00 -3.20 -0.03 0.00 0.26 0.00 0.00 34.13 31.16 2x1n s GLU 28 CO 0.00 -0.40 0.64 0.08 -0.54 0.00 0.00 175.26 175.04 2x1n s VAL 29 N 0.63 5.04 0.43 3.70 1.01 -1.26 -1.29 120.40 128.66 2x1n s VAL 29 Ca 0.62 1.24 0.05 0.00 0.00 0.00 0.00 61.98 63.89 2x1n s VAL 29 Cb -0.38 -3.96 -0.06 0.00 0.00 0.00 0.00 36.38 31.97 2x1n s VAL 29 CO 0.35 0.17 0.01 0.68 0.00 0.00 0.00 175.10 176.31 2x1n s VAL 30 N 1.49 1.76 -0.28 2.92 -7.23 0.61 -3.78 120.40 115.89 2x1n s VAL 30 Ca 0.31 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.45 2x1n s VAL 30 Cb -0.16 -2.78 0.03 0.00 0.56 0.00 0.00 36.38 34.03 2x1n s VAL 30 CO 0.12 0.00 -0.00 0.00 -0.31 0.00 0.00 175.10 174.91 2x1n s ALA 31 N -2.77 2.83 -0.25 1.32 0.00 -0.85 -0.58 121.76 121.47 2x1n s ALA 31 Ca 0.27 -1.58 -0.16 0.00 0.00 0.00 0.00 51.96 50.49 2x1n s ALA 31 Cb 0.08 -1.91 -0.03 0.00 0.00 0.00 0.00 23.12 21.26 2x1n s ALA 31 CO 0.14 -1.03 0.42 -0.51 0.00 0.00 0.00 175.76 174.79 2x1n s LEU 32 N 1.34 4.07 -0.31 0.00 1.43 0.84 -1.61 118.68 124.44 2x1n s LEU 32 Ca -0.01 0.42 -0.09 0.00 -1.03 0.00 0.00 54.13 53.41 2x1n s LEU 32 Cb -0.18 -2.52 -0.01 0.00 0.03 0.00 0.00 46.19 43.51 2x1n s LEU 32 CO -0.01 -0.19 0.15 -0.75 0.23 0.00 0.00 176.35 175.78 2x1n s LYS 33 N 1.94 3.36 -0.12 1.70 2.20 0.04 -0.64 119.74 128.22 2x1n s LYS 33 Ca 0.18 -0.70 -0.06 0.00 -0.36 0.00 0.00 55.97 55.03 2x1n s LYS 33 Cb -0.15 -3.55 -0.04 0.00 -1.51 0.00 0.00 37.83 32.58 2x1n s LYS 33 CO 0.09 -0.40 0.11 -1.59 -0.36 0.00 0.00 175.35 173.21 2x1n s LYS 34 N 1.61 3.37 -0.04 4.03 -2.85 -1.06 0.10 119.74 124.91 2x1n s LYS 34 Ca 0.05 -0.18 0.06 0.00 -1.00 0.00 0.00 55.97 54.89 2x1n s LYS 34 Cb -0.17 -3.12 -0.08 0.00 -2.06 0.00 0.00 37.83 32.39 2x1n s LYS 34 CO 0.06 0.75 0.07 -0.89 0.10 0.00 0.00 175.35 175.44 2x1n n ILE 35 N 2.05 0.25 -1.66 3.79 2.08 -0.65 -3.30 119.36 121.91 2x1n n ILE 35 Ca -0.20 -0.21 0.00 0.00 0.56 0.00 0.00 62.75 62.90 2x1n n ILE 35 Cb 0.55 -0.37 0.00 0.00 -0.75 0.00 0.00 39.64 39.07 2x1n n ILE 35 CO 0.00 0.00 0.00 -2.11 0.56 0.00 0.00 176.55 175.00 2x1n n ARG 36 N -2.03 -0.63 -3.55 0.38 -4.01 -1.26 -4.86 116.66 100.70 2x1n n ARG 36 Ca -0.06 0.45 -0.28 0.00 -1.04 0.00 0.00 57.85 56.91 2x1n n ARG 36 Cb 0.49 -0.94 -0.15 0.00 -3.04 0.00 0.00 32.46 28.81 2x1n n ARG 36 CO 0.00 0.00 0.00 -0.51 -3.04 0.00 0.00 177.63 174.08 2x1n s LEU 37 N -0.06 0.51 0.33 2.89 1.02 0.15 -4.91 118.68 118.61 2x1n s LEU 37 Ca 0.00 -1.17 0.09 0.00 0.02 0.00 0.00 54.13 53.06 2x1n s LEU 37 Cb 0.00 -0.33 -0.04 0.00 0.02 0.00 0.00 46.19 45.83 2x1n s LEU 37 CO 0.00 -0.42 0.10 1.51 0.02 0.00 0.00 176.35 177.56 2x1n s ASP 38 N 2.10 4.58 0.53 2.29 -4.77 -1.26 -4.19 116.67 115.96 2x1n s ASP 38 Ca 0.08 -0.79 -0.12 0.00 -3.30 0.00 0.00 52.55 48.42 2x1n s ASP 38 Cb -0.16 -0.72 -0.06 0.00 -1.09 0.00 0.00 42.92 40.90 2x1n s ASP 38 CO -0.32 -0.24 0.94 0.42 0.70 0.00 0.00 175.17 176.66 2x1n s THR 39 N -2.42 4.69 0.00 2.11 -4.23 -1.26 -4.57 115.64 109.96 2x1n s THR 39 Ca 0.36 0.85 0.00 0.00 -1.18 0.00 0.00 61.69 61.72 2x1n s THR 39 Cb -0.03 -3.80 0.00 0.00 1.34 0.00 0.00 72.50 70.02 2x1n s THR 39 CO 0.22 -0.85 0.00 -0.62 -0.54 0.00 0.00 174.62 172.83 2x1n n GLU 40 N -2.04 0.00 0.00 3.99 -0.58 -1.26 -5.05 120.64 115.70 2x1n n GLU 40 Ca 0.05 0.17 0.00 0.00 -0.42 0.00 0.00 57.16 56.96 2x1n n GLU 40 Cb 0.54 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.41 2x1n n GLU 40 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 2x1n n THR 41 N 1.14 0.00 -0.67 2.62 -1.04 -1.26 -4.68 114.28 110.38 2x1n n THR 41 Ca 0.00 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 62.03 2x1n n THR 41 Cb 0.00 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 68.54 2x1n n THR 41 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2x1n n GLU 42 N 0.00 1.59 0.00 -2.82 -0.58 -1.26 -5.12 120.64 112.45 2x1n n GLU 42 Ca 0.00 -1.40 0.00 0.00 -0.42 0.00 0.00 57.16 55.34 2x1n n GLU 42 Cb 0.00 -0.91 0.00 0.00 -0.57 0.00 0.00 31.44 29.96 2x1n n GLU 42 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2x1n n GLY 43 N -0.50 1.29 3.66 0.62 0.00 -1.26 -4.68 105.19 104.32 2x1n n GLY 43 Ca 0.03 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 44.93 2x1n n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x1n s VAL 44 N 0.00 3.35 0.73 1.61 1.01 -1.26 -4.95 120.40 120.89 2x1n s VAL 44 Ca 0.00 0.42 -0.14 0.00 0.00 0.00 0.00 61.98 62.27 2x1n s VAL 44 Cb 0.00 -3.27 0.04 0.00 0.00 0.00 0.00 36.38 33.15 2x1n s VAL 44 CO 0.00 -0.04 1.15 -2.16 0.00 0.00 0.00 175.10 174.05 2x1n s PRO 45 N 4.22 2.26 0.36 2.72 0.04 -1.26 -4.87 135.00 138.47 2x1n s PRO 45 Ca 0.80 1.51 0.09 0.00 0.04 0.00 0.00 61.00 63.44 2x1n s PRO 45 Cb -0.37 -1.87 0.68 0.00 0.04 0.00 0.00 34.50 32.97 2x1n s PRO 45 CO 0.34 -1.69 1.84 0.66 0.04 0.00 0.00 177.00 178.20 2x1n h SER 46 N -0.49 0.21 -0.90 6.66 4.64 -1.94 -2.47 113.55 119.25 2x1n h SER 46 Ca -0.46 -0.06 -0.00 0.00 -0.47 0.00 0.00 61.79 60.80 2x1n h SER 46 Cb 1.26 -0.06 -0.04 0.00 -0.31 0.00 0.00 62.40 63.25 2x1n h SER 46 CO 0.50 0.46 0.55 0.71 -0.87 0.00 0.00 176.83 178.18 2x1n h THR 47 N 0.20 1.25 -0.09 2.95 1.35 -1.89 -2.07 112.91 114.61 2x1n h THR 47 Ca 0.03 -0.54 -0.22 0.00 -0.55 0.00 0.00 66.41 65.13 2x1n h THR 47 Cb 0.53 -0.02 0.01 0.00 -1.73 0.00 0.00 68.15 66.94 2x1n h THR 47 CO 0.04 0.26 -0.83 0.00 -0.25 0.00 0.00 175.52 174.74 2x1n h ALA 48 N 1.30 0.36 -0.41 6.62 0.00 -1.76 -1.90 119.26 123.46 2x1n h ALA 48 Ca 0.32 -0.63 0.03 0.00 0.00 0.00 0.00 54.91 54.64 2x1n h ALA 48 Cb -0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2x1n h ALA 48 CO -0.06 0.72 0.21 0.82 0.00 0.00 0.00 179.25 180.94 2x1n h ILE 49 N 0.42 0.98 0.02 0.00 1.08 -1.15 -2.30 117.51 116.56 2x1n h ILE 49 Ca -0.06 -0.14 -0.00 0.00 -0.39 0.00 0.00 64.86 64.26 2x1n h ILE 49 Cb 1.45 0.52 0.00 0.00 -3.07 0.00 0.00 36.82 35.72 2x1n h ILE 49 CO 0.16 0.08 -0.01 0.03 -0.69 0.00 0.00 178.15 177.72 2x1n h ARG 50 N 0.42 -0.03 -1.00 2.37 3.08 -1.39 -2.46 114.38 115.38 2x1n h ARG 50 Ca 0.17 0.00 0.14 0.00 0.07 0.00 0.00 59.98 60.36 2x1n h ARG 50 Cb 0.08 0.01 -0.09 0.00 0.08 0.00 0.00 29.97 30.04 2x1n h ARG 50 CO -0.12 0.52 0.63 1.49 -1.07 0.00 0.00 179.97 181.42 2x1n h GLU 51 N -0.59 0.92 -0.09 0.04 4.81 -1.31 -0.73 114.58 117.62 2x1n h GLU 51 Ca -0.00 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.09 2x1n h GLU 51 Cb 0.56 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.74 2x1n h GLU 51 CO 0.00 0.61 -0.28 0.82 -0.73 0.00 0.00 179.01 179.43 2x1n h ILE 52 N 0.94 1.41 -0.26 2.32 2.04 -1.46 -1.82 117.51 120.68 2x1n h ILE 52 Ca 0.52 -1.64 -0.14 0.00 1.00 0.00 0.00 64.86 64.59 2x1n h ILE 52 Cb 0.58 2.24 -0.01 0.00 -0.74 0.00 0.00 36.82 38.89 2x1n h ILE 52 CO -0.29 0.47 -0.43 0.77 0.00 0.00 0.00 178.15 178.67 2x1n h SER 53 N -0.13 0.69 0.05 1.72 4.64 -1.20 -2.38 113.55 116.95 2x1n h SER 53 Ca -0.01 -0.32 -0.07 0.00 -0.47 0.00 0.00 61.79 60.92 2x1n h SER 53 Cb 0.91 -0.19 0.01 0.00 -0.31 0.00 0.00 62.40 62.81 2x1n h SER 53 CO 0.06 1.03 -0.31 -0.07 -0.87 0.00 0.00 176.83 176.66 2x1n h LEU 54 N 0.52 0.19 -1.87 5.97 3.38 -1.22 -3.33 115.31 118.97 2x1n h LEU 54 Ca 0.04 -0.95 -0.02 0.00 0.09 0.00 0.00 57.88 57.04 2x1n h LEU 54 Cb 0.96 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.64 2x1n h LEU 54 CO 0.09 1.13 -0.08 -0.07 0.09 0.00 0.00 178.44 179.60 2x1n h LEU 55 N -0.71 0.00 -1.96 1.67 4.07 -1.37 -0.78 115.31 116.23 2x1n h LEU 55 Ca -0.05 0.00 0.02 0.00 0.08 0.00 0.00 57.88 57.93 2x1n h LEU 55 Cb 1.22 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.95 2x1n h LEU 55 CO 0.06 0.08 0.08 0.11 -1.08 0.00 0.00 178.44 177.68 2x1n h LYS 56 N 0.00 0.06 0.04 1.13 1.79 -1.53 -3.00 116.57 115.07 2x1n h LYS 56 Ca -0.00 -0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 58.18 2x1n h LYS 56 Cb 0.14 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.74 2x1n h LYS 56 CO 0.01 0.04 -1.58 0.93 -1.08 0.00 0.00 179.45 177.76 2x1n h GLU 57 N 0.06 0.09 -5.91 3.15 5.08 -1.27 -3.45 114.58 112.34 2x1n h GLU 57 Ca 0.05 -0.15 -0.59 0.00 -1.00 0.00 0.00 59.36 57.66 2x1n h GLU 57 Cb 0.12 0.06 -0.11 0.00 0.50 0.00 0.00 28.75 29.31 2x1n h GLU 57 CO -0.00 0.81 0.76 -0.51 -1.00 0.00 0.00 179.01 179.06 2x1n s LEU 58 N -6.52 3.84 -0.30 1.33 1.43 -0.88 -4.98 118.68 112.61 2x1n s LEU 58 Ca -0.07 -0.63 -0.00 0.00 -1.03 0.00 0.00 54.13 52.40 2x1n s LEU 58 Cb 0.08 -2.58 0.06 0.00 0.03 0.00 0.00 46.19 43.78 2x1n s LEU 58 CO 0.82 -1.56 -0.02 0.21 0.23 0.00 0.00 176.35 176.04 2x1n s ASN 59 N 3.53 4.78 -0.27 2.29 3.84 -1.26 -4.90 114.94 122.95 2x1n s ASN 59 Ca 0.29 -1.40 -0.25 0.00 0.21 0.00 0.00 52.86 51.71 2x1n s ASN 59 Cb -0.12 -1.67 0.09 0.00 -0.55 0.00 0.00 41.25 38.99 2x1n s ASN 59 CO 0.14 -0.26 0.81 -2.28 -2.79 0.00 0.00 177.10 172.72 2x1n s HIS 60 N 1.18 -0.70 0.42 0.43 2.46 -1.26 -5.06 115.29 112.77 2x1n s HIS 60 Ca -0.05 1.70 0.23 0.00 0.47 0.00 0.00 55.06 57.41 2x1n s HIS 60 Cb -0.20 0.30 1.22 0.00 -0.13 0.00 0.00 32.58 33.77 2x1n s HIS 60 CO -0.03 -0.34 1.75 -1.35 -2.47 0.00 0.00 174.74 172.30 2x1n h PRO 61 N 4.75 0.28 -0.64 2.88 0.11 -1.99 -1.28 132.00 136.11 2x1n h PRO 61 Ca -0.29 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2x1n h PRO 61 Cb 1.16 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2x1n h PRO 61 CO 0.07 0.19 0.00 0.09 -0.21 0.00 0.00 178.00 178.13 2x1n n ASN 62 N -4.58 4.15 -4.06 -2.05 4.13 -1.26 -4.83 115.26 106.75 2x1n n ASN 62 Ca 0.27 -2.47 -0.27 0.00 1.68 0.00 0.00 54.58 53.79 2x1n n ASN 62 Cb 1.02 -0.56 -0.17 0.00 -1.54 0.00 0.00 39.78 38.54 2x1n n ASN 62 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2x1n s ILE 63 N -1.97 1.39 0.39 2.41 1.01 -0.48 -0.76 121.20 123.19 2x1n s ILE 63 Ca 0.41 -0.61 -0.26 0.00 0.00 0.00 0.00 60.65 60.20 2x1n s ILE 63 Cb 0.28 -1.26 -0.11 0.00 0.01 0.00 0.00 42.46 41.38 2x1n s ILE 63 CO 0.17 0.41 1.23 0.55 0.00 0.00 0.00 174.94 177.31 2x1n n VAL 64 N 3.95 2.36 -3.39 2.92 3.14 -0.77 -4.56 118.33 121.98 2x1n n VAL 64 Ca -0.21 -0.50 -0.40 0.00 -2.96 0.00 0.00 64.34 60.28 2x1n n VAL 64 Cb 0.52 -1.49 -0.09 0.00 -1.06 0.00 0.00 33.84 31.71 2x1n n VAL 64 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 2x1n s LYS 65 N -2.06 3.83 -0.38 1.45 2.20 -1.26 -4.97 119.74 118.55 2x1n s LYS 65 Ca 0.59 -0.15 -0.27 0.00 -0.36 0.00 0.00 55.97 55.79 2x1n s LYS 65 Cb -0.54 -3.72 0.02 0.00 -1.51 0.00 0.00 37.83 32.08 2x1n s LYS 65 CO 0.59 -0.38 0.97 -1.17 -0.36 0.00 0.00 175.35 175.00 2x1n s LEU 66 N 2.07 3.95 -0.13 5.43 2.96 -1.26 -1.61 118.68 130.08 2x1n s LEU 66 Ca 0.14 0.61 -0.15 0.00 -0.22 0.00 0.00 54.13 54.51 2x1n s LEU 66 Cb -0.16 -3.33 -0.25 0.00 0.50 0.00 0.00 46.19 42.95 2x1n s LEU 66 CO 0.11 -0.91 0.44 -0.07 -1.32 0.00 0.00 176.35 174.59 2x1n h LEU 67 N 10.23 0.30 -7.00 -0.68 3.38 0.13 -3.48 115.31 118.18 2x1n h LEU 67 Ca -0.23 -0.80 -0.05 0.00 0.09 0.00 0.00 57.88 56.89 2x1n h LEU 67 Cb 1.07 -0.10 -0.20 0.00 0.09 0.00 0.00 40.66 41.52 2x1n h LEU 67 CO 1.01 1.64 0.16 -0.62 0.09 0.00 0.00 178.44 180.72 2x1n s ASP 68 N -6.98 -0.71 -0.30 -0.43 2.15 -1.14 -5.01 116.67 104.25 2x1n s ASP 68 Ca -0.22 1.15 -0.02 0.00 0.43 0.00 0.00 52.55 53.89 2x1n s ASP 68 Cb 0.05 1.09 0.05 0.00 -0.30 0.00 0.00 42.92 43.81 2x1n s ASP 68 CO 0.73 -0.39 0.00 -0.69 -0.17 0.00 0.00 175.17 174.65 2x1n s VAL 69 N -0.24 2.99 -0.30 1.11 1.01 -1.26 -1.26 120.40 122.45 2x1n s VAL 69 Ca -0.04 -1.41 -0.14 0.00 0.00 0.00 0.00 61.98 60.39 2x1n s VAL 69 Cb -0.03 -2.73 -0.03 0.00 0.00 0.00 0.00 36.38 33.59 2x1n s VAL 69 CO 0.04 -0.12 0.31 -0.63 0.00 0.00 0.00 175.10 174.70 2x1n s ILE 70 N 1.25 5.22 -0.25 2.22 1.01 0.10 -4.97 121.20 125.77 2x1n s ILE 70 Ca -0.05 0.26 -0.02 0.00 0.00 0.00 0.00 60.65 60.84 2x1n s ILE 70 Cb -0.20 -3.69 0.02 0.00 0.01 0.00 0.00 42.46 38.61 2x1n s ILE 70 CO -0.01 0.10 -0.05 -2.28 0.00 0.00 0.00 174.94 172.70 2x1n s HIS 71 N 1.95 3.07 0.35 3.97 2.46 -1.26 -0.89 115.29 124.93 2x1n s HIS 71 Ca 0.11 -1.50 0.04 0.00 0.47 0.00 0.00 55.06 54.18 2x1n s HIS 71 Cb -0.16 -2.07 -0.03 0.00 -0.13 0.00 0.00 32.58 30.18 2x1n s HIS 71 CO 0.11 -0.71 0.15 0.95 -2.47 0.00 0.00 174.74 172.76 2x1n s THR 72 N 1.34 0.49 0.12 0.89 -4.23 -0.81 -5.06 115.64 108.39 2x1n s THR 72 Ca 0.00 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.21 2x1n s THR 72 Cb -0.17 -2.48 -0.09 0.00 1.34 0.00 0.00 72.50 71.11 2x1n s THR 72 CO -0.04 0.00 1.58 -0.08 -0.54 0.00 0.00 174.62 175.54 2x1n h GLU 73 N 2.04 -0.57 -0.07 3.99 4.81 -1.98 -3.29 114.58 119.51 2x1n h GLU 73 Ca -0.34 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 2x1n h GLU 73 Cb 1.26 0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.77 2x1n h GLU 73 CO 0.54 -0.38 0.00 0.27 -0.73 0.00 0.00 179.01 178.71 2x1n n ASN 74 N -5.45 1.86 -3.99 1.04 6.94 -1.26 -4.79 115.26 109.60 2x1n n ASN 74 Ca -0.06 -1.51 -0.10 0.00 -0.02 0.00 0.00 54.58 52.89 2x1n n ASN 74 Cb 0.37 -0.04 -0.11 0.00 -2.36 0.00 0.00 39.78 37.64 2x1n n ASN 74 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2x1n s LYS 75 N -0.68 0.34 -0.18 -3.83 3.01 -1.24 -0.68 119.74 116.49 2x1n s LYS 75 Ca 0.09 -0.63 0.01 0.00 -1.01 0.00 0.00 55.97 54.43 2x1n s LYS 75 Cb 0.06 0.04 0.03 0.00 -1.01 0.00 0.00 37.83 36.95 2x1n s LYS 75 CO 0.08 -0.03 -0.13 -1.17 0.51 0.00 0.00 175.35 174.61 2x1n s LEU 76 N -1.46 2.04 -0.21 3.17 0.20 -1.26 -1.92 118.68 119.24 2x1n s LEU 76 Ca -0.15 -0.71 -0.05 0.00 0.69 0.00 0.00 54.13 53.91 2x1n s LEU 76 Cb -0.10 -1.24 -0.02 0.00 -0.43 0.00 0.00 46.19 44.40 2x1n s LEU 76 CO -0.01 -0.10 0.01 -0.31 -0.29 0.00 0.00 176.35 175.66 2x1n s TYR 77 N 1.42 3.05 -0.28 5.38 1.51 -0.07 -1.64 117.35 126.73 2x1n s TYR 77 Ca 0.02 -0.46 -0.12 0.00 -1.01 0.00 0.00 57.07 55.50 2x1n s TYR 77 Cb -0.15 -2.11 -0.05 0.00 -0.11 0.00 0.00 41.96 39.54 2x1n s TYR 77 CO -0.10 -0.27 0.23 -0.51 -1.11 0.00 0.00 175.55 173.80 2x1n s LEU 78 N 1.12 4.02 -0.39 -1.29 1.43 0.12 -0.72 118.68 122.97 2x1n s LEU 78 Ca 0.03 0.06 -0.14 0.00 -1.03 0.00 0.00 54.13 53.05 2x1n s LEU 78 Cb -0.14 -2.19 0.01 0.00 0.03 0.00 0.00 46.19 43.90 2x1n s LEU 78 CO 0.02 -0.08 0.27 -0.69 0.23 0.00 0.00 176.35 176.10 2x1n s VAL 79 N 1.83 5.19 0.34 -1.59 1.01 -0.39 -0.78 120.40 126.01 2x1n s VAL 79 Ca 0.09 -0.57 0.08 0.00 0.00 0.00 0.00 61.98 61.58 2x1n s VAL 79 Cb -0.16 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.36 2x1n s VAL 79 CO 0.11 -0.22 0.28 -0.36 0.00 0.00 0.00 175.10 174.90 2x1n s PHE 80 N 1.68 2.86 0.48 5.22 0.40 -0.64 0.85 117.98 128.84 2x1n s PHE 80 Ca 0.05 -0.32 -0.23 0.00 -0.60 0.00 0.00 56.93 55.83 2x1n s PHE 80 Cb -0.19 -1.80 -0.07 0.00 0.51 0.00 0.00 43.02 41.48 2x1n s PHE 80 CO 0.10 0.19 1.22 -1.83 0.70 0.00 0.00 175.22 175.60 2x1n s GLU 81 N -3.98 3.59 -0.04 0.44 -1.05 -0.63 -2.00 118.70 115.02 2x1n s GLU 81 Ca 0.41 1.91 -0.24 0.00 -0.15 0.00 0.00 54.97 56.90 2x1n s GLU 81 Cb -0.05 -2.37 -0.04 0.00 -0.44 0.00 0.00 34.13 31.23 2x1n s GLU 81 CO 0.26 -0.73 0.71 0.12 0.95 0.00 0.00 175.26 176.57 2x1n s PHE 82 N -1.47 3.61 0.13 4.83 2.19 -1.25 -4.38 117.98 121.63 2x1n s PHE 82 Ca 0.66 1.29 0.10 0.00 0.33 0.00 0.00 56.93 59.31 2x1n s PHE 82 Cb -0.32 -2.80 -0.04 0.00 -1.31 0.00 0.00 43.02 38.55 2x1n s PHE 82 CO 0.39 0.13 -0.23 -0.51 1.83 0.00 0.00 175.22 176.82 2x1n s LEU 83 N 0.62 2.47 0.18 6.12 1.43 -1.26 -5.01 118.68 123.23 2x1n s LEU 83 Ca 0.38 -0.68 0.01 0.00 -1.03 0.00 0.00 54.13 52.80 2x1n s LEU 83 Cb -0.18 -1.35 0.05 0.00 0.03 0.00 0.00 46.19 44.75 2x1n s LEU 83 CO 0.19 0.18 1.42 0.45 0.23 0.00 0.00 176.35 178.82 2x1n h HIS 84 N 3.80 0.42 -2.21 0.29 3.86 -1.75 -3.48 115.15 116.09 2x1n h HIS 84 Ca -0.50 -0.20 0.20 0.00 -1.16 0.00 0.00 60.37 58.70 2x1n h HIS 84 Cb 1.17 -0.06 -0.04 0.00 1.06 0.00 0.00 27.41 29.55 2x1n h HIS 84 CO 0.60 0.97 0.60 0.00 0.86 0.00 0.00 177.93 180.96 2x1n n GLN 85 N -3.77 0.37 -2.84 2.45 10.64 -1.14 -5.03 117.38 118.06 2x1n n GLN 85 Ca -0.04 -0.97 -0.19 0.00 -1.83 0.00 0.00 57.00 53.97 2x1n n GLN 85 Cb 0.74 1.39 0.03 0.00 -0.86 0.00 0.00 30.24 31.54 2x1n n GLN 85 CO 0.00 0.00 0.00 0.16 -1.83 0.00 0.00 177.06 175.39 2x1n s ASP 86 N -3.15 5.40 0.18 2.61 1.47 -1.26 0.12 116.67 122.04 2x1n s ASP 86 Ca 0.21 -0.28 0.00 0.00 1.18 0.00 0.00 52.55 53.66 2x1n s ASP 86 Cb -0.02 -0.65 0.07 0.00 -0.34 0.00 0.00 42.92 41.99 2x1n s ASP 86 CO 0.02 -1.01 1.44 0.25 0.68 0.00 0.00 175.17 176.55 2x1n h LEU 87 N 0.32 0.41 0.01 2.11 5.85 -0.43 -2.96 115.31 120.61 2x1n h LEU 87 Ca -0.40 -0.27 0.03 0.00 0.84 0.00 0.00 57.88 58.08 2x1n h LEU 87 Cb 1.29 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 42.15 2x1n h LEU 87 CO 0.47 1.01 -0.26 0.50 -0.34 0.00 0.00 178.44 179.82 2x1n h LYS 88 N 0.22 -0.40 -0.92 1.25 1.63 -1.80 0.45 116.57 117.00 2x1n h LYS 88 Ca -0.03 0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 59.79 2x1n h LYS 88 Cb 1.32 0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 33.00 2x1n h LYS 88 CO 0.12 -0.26 0.57 0.87 -3.45 0.00 0.00 179.45 177.30 2x1n h LYS 89 N -0.41 1.24 -0.69 1.90 6.56 -1.90 -1.19 116.57 122.08 2x1n h LYS 89 Ca 0.06 -0.10 -0.02 0.00 -1.06 0.00 0.00 60.65 59.53 2x1n h LYS 89 Cb 0.49 -0.26 -0.03 0.00 -0.57 0.00 0.00 32.23 31.85 2x1n h LYS 89 CO -0.22 0.86 0.36 0.35 -2.06 0.00 0.00 179.45 178.74 2x1n h PHE 90 N 1.26 0.96 -0.45 -1.35 3.57 -1.28 -0.65 116.94 119.00 2x1n h PHE 90 Ca 0.33 -0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.70 2x1n h PHE 90 Cb -0.07 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 38.35 2x1n h PHE 90 CO 0.00 0.69 -0.14 0.52 -2.23 0.00 0.00 178.31 177.15 2x1n h MET 91 N 0.95 0.85 -0.48 1.11 2.86 -0.46 0.16 114.93 119.91 2x1n h MET 91 Ca 0.24 -0.31 -0.03 0.00 -2.06 0.00 0.00 59.70 57.54 2x1n h MET 91 Cb 0.06 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 2x1n h MET 91 CO -0.04 0.94 0.18 -0.44 1.06 0.00 0.00 176.91 178.62 2x1n h ASP 92 N 0.76 0.68 0.97 1.22 3.32 -0.94 -0.86 116.42 121.56 2x1n h ASP 92 Ca 0.12 -0.18 -0.17 0.00 0.02 0.00 0.00 57.03 56.82 2x1n h ASP 92 Cb 0.66 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.01 2x1n h ASP 92 CO 0.05 0.67 -0.80 0.00 -1.72 0.00 0.00 179.24 177.44 2x1n h ALA 93 N 1.03 0.59 -0.56 3.45 0.00 -0.87 -3.01 119.26 119.88 2x1n h ALA 93 Ca 0.16 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2x1n h ALA 93 Cb 0.21 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2x1n h ALA 93 CO -0.01 1.00 0.00 0.43 0.00 0.00 0.00 179.25 180.67 2x1n n SER 94 N -3.45 3.11 -4.57 0.00 7.64 0.53 -4.95 113.62 111.93 2x1n n SER 94 Ca -0.00 -2.03 -0.29 0.00 1.01 0.00 0.00 58.87 57.55 2x1n n SER 94 Cb 0.81 -0.39 0.22 0.00 -1.01 0.00 0.00 64.21 63.83 2x1n n SER 94 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2x1n s ALA 95 N -1.29 0.29 0.00 -0.43 0.00 -0.33 0.29 121.76 120.28 2x1n s ALA 95 Ca 0.38 0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.41 2x1n s ALA 95 Cb 0.20 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 20.03 2x1n s ALA 95 CO 0.25 -3.38 0.00 1.47 0.00 0.00 0.00 175.76 174.10 2x1n n LEU 96 N -4.61 0.00 -0.01 0.00 -0.00 -1.26 -3.99 117.00 107.13 2x1n n LEU 96 Ca 0.06 0.00 -0.17 0.00 -0.00 0.00 0.00 56.01 55.89 2x1n n LEU 96 Cb 0.54 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.87 2x1n n LEU 96 CO 0.55 0.00 0.27 0.71 -0.00 0.00 0.00 177.39 178.92 2x1n h THR 97 N 0.00 1.34 0.00 1.47 1.35 -1.93 -3.51 112.91 111.63 2x1n h THR 97 Ca 0.00 -1.99 0.00 0.00 -0.55 0.00 0.00 66.41 63.87 2x1n h THR 97 Cb 0.00 2.24 0.00 0.00 -1.73 0.00 0.00 68.15 68.66 2x1n h THR 97 CO 0.00 0.61 0.00 0.61 -0.25 0.00 0.00 175.52 176.49 2x1n n GLY 98 N 0.84 -0.08 3.70 5.82 0.00 0.14 -4.94 105.19 110.67 2x1n n GLY 98 Ca -0.09 -1.64 -0.41 0.00 0.00 0.00 0.00 46.02 43.89 2x1n n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x1n s ILE 99 N -2.98 4.93 0.27 -0.61 1.01 -1.26 -4.89 121.20 117.68 2x1n s ILE 99 Ca 0.00 1.74 -0.28 0.00 0.00 0.00 0.00 60.65 62.11 2x1n s ILE 99 Cb 0.00 -4.18 -0.14 0.00 0.01 0.00 0.00 42.46 38.15 2x1n s ILE 99 CO 0.00 0.15 1.00 -2.65 0.00 0.00 0.00 174.94 173.44 2x1n n PRO 100 N 4.27 1.26 -0.19 2.79 -0.02 -1.26 -4.78 135.00 137.08 2x1n n PRO 100 Ca 0.03 0.44 -0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2x1n n PRO 100 Cb 0.50 -1.81 0.08 0.00 -0.02 0.00 0.00 33.50 32.26 2x1n n PRO 100 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2x1n h LEU 101 N 2.09 -0.31 -1.59 2.45 -0.00 -1.98 -1.53 115.31 114.44 2x1n h LEU 101 Ca -0.39 0.15 0.06 0.00 -0.00 0.00 0.00 57.88 57.69 2x1n h LEU 101 Cb 1.35 0.27 -0.03 0.00 -0.00 0.00 0.00 40.66 42.25 2x1n h LEU 101 CO 0.61 -0.12 0.36 -0.65 -0.00 0.00 0.00 178.44 178.64 2x1n h PRO 102 N 0.09 0.49 -0.05 1.13 0.11 -1.99 0.11 132.00 131.89 2x1n h PRO 102 Ca 0.30 -0.03 -0.24 0.00 0.11 0.00 0.00 66.00 66.13 2x1n h PRO 102 Cb 0.47 -0.11 0.01 0.00 0.11 0.00 0.00 31.00 31.48 2x1n h PRO 102 CO -0.51 0.32 -0.93 1.25 -0.21 0.00 0.00 178.00 177.92 2x1n h LEU 103 N 0.50 0.83 -0.16 2.35 5.85 -1.67 -2.13 115.31 120.88 2x1n h LEU 103 Ca 0.23 -0.62 0.02 0.00 0.84 0.00 0.00 57.88 58.35 2x1n h LEU 103 Cb 0.28 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 2x1n h LEU 103 CO -0.06 1.42 0.05 0.40 -0.34 0.00 0.00 178.44 179.91 2x1n h ILE 104 N 0.41 0.95 -0.67 4.05 2.04 -0.44 -0.36 117.51 123.48 2x1n h ILE 104 Ca -0.09 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.73 2x1n h ILE 104 Cb 1.57 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 38.43 2x1n h ILE 104 CO 0.18 0.02 0.42 0.50 0.00 0.00 0.00 178.15 179.28 2x1n h LYS 105 N 0.13 0.90 -0.48 2.37 3.64 -0.83 -0.61 116.57 121.68 2x1n h LYS 105 Ca 0.07 -0.07 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 2x1n h LYS 105 Cb 0.05 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.66 2x1n h LYS 105 CO -0.08 0.62 -0.09 1.03 -2.27 0.00 0.00 179.45 178.67 2x1n h SER 106 N 0.91 0.91 -0.14 4.20 0.87 -1.16 -1.74 113.55 117.40 2x1n h SER 106 Ca 0.24 -0.35 -0.01 0.00 -1.23 0.00 0.00 61.79 60.45 2x1n h SER 106 Cb -0.06 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.65 2x1n h SER 106 CO -0.05 1.04 0.06 1.88 -0.53 0.00 0.00 176.83 179.24 2x1n h TYR 107 N 0.75 0.21 -0.85 2.24 0.05 -0.74 -0.95 116.97 117.69 2x1n h TYR 107 Ca 0.12 -0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.88 2x1n h TYR 107 Cb 0.63 -0.06 -0.04 0.00 1.01 0.00 0.00 36.73 38.27 2x1n h TYR 107 CO 0.05 0.26 0.47 1.25 -1.05 0.00 0.00 178.16 179.14 2x1n h LEU 108 N 0.09 1.06 -0.39 3.88 5.85 -1.08 0.08 115.31 124.79 2x1n h LEU 108 Ca 0.05 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 2x1n h LEU 108 Cb 0.14 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 2x1n h LEU 108 CO -0.01 0.84 0.15 0.15 -0.34 0.00 0.00 178.44 179.24 2x1n h PHE 109 N 1.19 0.60 -0.62 1.25 3.57 -1.12 -0.79 116.94 121.01 2x1n h PHE 109 Ca 0.30 -0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.66 2x1n h PHE 109 Cb 0.01 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.55 2x1n h PHE 109 CO 0.01 0.54 0.04 1.96 -2.23 0.00 0.00 178.31 178.62 2x1n h GLN 110 N 0.48 1.07 -0.56 1.11 4.20 -0.92 -2.61 115.11 117.88 2x1n h GLN 110 Ca 0.13 -0.32 -0.07 0.00 0.06 0.00 0.00 58.65 58.44 2x1n h GLN 110 Cb 0.20 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 2x1n h GLN 110 CO -0.01 1.02 0.06 -0.07 -0.67 0.00 0.00 178.83 179.16 2x1n h LEU 111 N 0.97 0.88 -1.09 1.46 3.38 -0.82 -2.46 115.31 117.64 2x1n h LEU 111 Ca 0.18 -0.21 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 2x1n h LEU 111 Cb 0.52 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2x1n h LEU 111 CO 0.02 0.91 -0.41 -0.07 0.09 0.00 0.00 178.44 178.98 2x1n h LEU 112 N 0.87 0.09 -0.46 1.67 3.38 -1.10 -0.33 115.31 119.43 2x1n h LEU 112 Ca 0.17 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 58.01 2x1n h LEU 112 Cb 0.43 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2x1n h LEU 112 CO 0.01 0.50 -0.09 1.56 0.09 0.00 0.00 178.44 180.51 2x1n h GLN 113 N 0.07 0.87 -0.41 1.13 4.20 -1.11 0.45 115.11 120.32 2x1n h GLN 113 Ca 0.00 -0.32 -0.10 0.00 0.06 0.00 0.00 58.65 58.29 2x1n h GLN 113 Cb 0.76 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.48 2x1n h GLN 113 CO 0.06 0.96 -0.13 0.78 -0.67 0.00 0.00 178.83 179.83 2x1n h GLY 114 N 0.71 0.88 1.40 3.46 0.00 -1.21 -2.50 103.07 105.82 2x1n h GLY 114 Ca 0.12 -0.75 -0.12 0.00 0.00 0.00 0.00 47.33 46.58 2x1n h GLY 114 CO 0.04 0.68 -0.30 -2.00 0.00 0.00 0.00 176.54 174.97 2x1n h LEU 115 N 0.63 0.70 -1.14 3.11 6.46 -0.97 -2.12 115.31 121.98 2x1n h LEU 115 Ca 0.10 -0.27 -0.06 0.00 -0.12 0.00 0.00 57.88 57.53 2x1n h LEU 115 Cb 0.67 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.39 2x1n h LEU 115 CO 0.05 0.95 -0.02 0.00 -0.62 0.00 0.00 178.44 178.80 2x1n h ALA 116 N 1.09 1.29 -0.27 1.25 0.00 -0.79 -2.09 119.26 119.75 2x1n h ALA 116 Ca 0.07 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.57 2x1n h ALA 116 Cb 0.80 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2x1n h ALA 116 CO 0.07 0.48 -0.55 0.35 0.00 0.00 0.00 179.25 179.60 2x1n h PHE 117 N 0.54 1.01 -0.20 0.00 3.57 -1.09 -1.96 116.94 118.82 2x1n h PHE 117 Ca 0.11 -0.36 -0.02 0.00 3.53 0.00 0.00 57.97 61.23 2x1n h PHE 117 Cb 0.38 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 2x1n h PHE 117 CO 0.01 1.17 0.06 0.00 -2.23 0.00 0.00 178.31 177.32 2x1n h HIS 119 N 0.15 0.35 0.00 0.00 3.86 -1.31 0.06 115.15 118.26 2x1n h HIS 119 Ca 0.07 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 59.13 2x1n h HIS 119 Cb 0.24 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.66 2x1n h HIS 119 CO 0.00 0.86 0.00 -1.13 0.86 0.00 0.00 177.93 178.52 2x1n n SER 120 N -3.82 0.01 -1.19 2.45 3.41 -0.74 -2.09 113.62 111.64 2x1n n SER 120 Ca -0.03 0.50 -0.05 0.00 -0.26 0.00 0.00 58.87 59.03 2x1n n SER 120 Cb 0.67 -0.50 0.19 0.00 -0.26 0.00 0.00 64.21 64.31 2x1n n SER 120 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2x1n n HIS 121 N -1.51 1.12 -4.27 7.33 8.25 -0.55 -4.98 115.22 120.61 2x1n n HIS 121 Ca 0.05 -1.67 -0.34 0.00 -0.26 0.00 0.00 57.72 55.51 2x1n n HIS 121 Cb 0.24 -0.49 -0.06 0.00 1.12 0.00 0.00 29.99 30.79 2x1n n HIS 121 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 2x1n n ARG 122 N -1.11 -1.89 -4.34 -0.41 -4.01 -0.89 -4.95 116.66 99.05 2x1n n ARG 122 Ca 0.33 0.23 -0.33 0.00 -1.04 0.00 0.00 57.85 57.05 2x1n n ARG 122 Cb 1.01 -4.38 -0.16 0.00 -3.04 0.00 0.00 32.46 25.89 2x1n n ARG 122 CO 0.00 0.00 0.00 0.08 -3.04 0.00 0.00 177.63 174.67 2x1n s VAL 123 N -3.79 2.24 -0.10 8.89 1.01 -0.10 -1.44 120.40 127.11 2x1n s VAL 123 Ca 0.35 -0.90 -0.11 0.00 0.00 0.00 0.00 61.98 61.33 2x1n s VAL 123 Cb -0.20 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.20 2x1n s VAL 123 CO 0.97 0.53 0.25 -0.76 0.00 0.00 0.00 175.10 176.09 2x1n s LEU 124 N 1.08 4.37 -0.15 3.92 1.43 0.60 -3.73 118.68 126.20 2x1n s LEU 124 Ca -0.00 0.60 -0.25 0.00 -1.03 0.00 0.00 54.13 53.46 2x1n s LEU 124 Cb -0.14 -2.29 -0.24 0.00 0.03 0.00 0.00 46.19 43.54 2x1n s LEU 124 CO -0.07 0.29 0.58 -0.74 0.23 0.00 0.00 176.35 176.65 2x1n h HIS 125 N 5.44 0.10 0.00 0.29 -0.00 -1.89 -0.44 115.15 118.66 2x1n h HIS 125 Ca -0.50 -0.07 0.00 0.00 -0.00 0.00 0.00 60.37 59.80 2x1n h HIS 125 Cb 1.20 -0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.61 2x1n h HIS 125 CO 0.69 1.24 0.00 0.54 -0.00 0.00 0.00 177.93 180.41 2x1n n ARG 126 N -4.43 0.00 -2.70 5.26 1.74 -1.26 -2.94 116.66 112.33 2x1n n ARG 126 Ca -0.19 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 56.82 2x1n n ARG 126 Cb 0.62 -1.65 0.03 0.00 -1.02 0.00 0.00 32.46 30.44 2x1n n ARG 126 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2x1n n ASP 127 N 0.00 1.49 -4.67 0.55 2.03 -1.26 -4.99 116.55 109.69 2x1n n ASP 127 Ca 0.00 -2.57 -0.43 0.00 0.52 0.00 0.00 54.79 52.32 2x1n n ASP 127 Cb 0.00 -0.52 -0.02 0.00 -0.72 0.00 0.00 41.12 39.86 2x1n n ASP 127 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2x1n s LEU 128 N -3.27 4.20 0.15 -2.67 1.43 -1.26 -4.88 118.68 112.38 2x1n s LEU 128 Ca 0.27 1.59 -0.20 0.00 -1.03 0.00 0.00 54.13 54.77 2x1n s LEU 128 Cb 0.43 -3.55 0.05 0.00 0.03 0.00 0.00 46.19 43.15 2x1n s LEU 128 CO 0.02 -0.61 0.52 -1.59 0.23 0.00 0.00 176.35 174.91 2x1n s LYS 129 N 2.73 1.21 0.29 1.70 -2.85 -1.26 -4.86 119.74 116.71 2x1n s LYS 129 Ca 0.50 -0.61 0.04 0.00 -1.00 0.00 0.00 55.97 54.91 2x1n s LYS 129 Cb -0.20 0.54 0.68 0.00 -2.06 0.00 0.00 37.83 36.79 2x1n s LYS 129 CO 0.15 -0.51 1.77 -1.35 0.10 0.00 0.00 175.35 175.51 2x1n h PRO 130 N 2.16 0.72 0.00 1.78 0.11 -1.94 0.11 132.00 134.94 2x1n h PRO 130 Ca -0.33 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2x1n h PRO 130 Cb 1.28 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2x1n h PRO 130 CO 0.41 0.47 0.00 0.00 -0.21 0.00 0.00 178.00 178.68 2x1n n GLN 131 N -4.79 0.29 0.00 1.05 0.00 -1.26 -2.07 117.38 110.60 2x1n n GLN 131 Ca 0.22 0.05 0.12 0.00 0.00 0.00 0.00 57.00 57.39 2x1n n GLN 131 Cb 0.53 -1.50 0.15 0.00 0.00 0.00 0.00 30.24 29.42 2x1n n GLN 131 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2x1n n ASN 132 N -1.33 2.39 -4.42 2.61 4.13 0.37 -4.87 115.26 114.15 2x1n n ASN 132 Ca 0.11 -1.72 -0.36 0.00 1.68 0.00 0.00 54.58 54.29 2x1n n ASN 132 Cb 0.22 0.14 -0.13 0.00 -1.54 0.00 0.00 39.78 38.48 2x1n n ASN 132 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2x1n s LEU 133 N -2.17 3.30 -0.08 3.41 1.43 -0.88 -1.57 118.68 122.13 2x1n s LEU 133 Ca 0.26 -0.24 -0.00 0.00 -1.03 0.00 0.00 54.13 53.12 2x1n s LEU 133 Cb 0.20 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.51 2x1n s LEU 133 CO 0.40 -0.02 -0.04 -0.76 0.23 0.00 0.00 176.35 176.15 2x1n s LEU 134 N 1.50 3.31 0.26 1.79 1.43 -0.67 -0.32 118.68 125.98 2x1n s LEU 134 Ca 0.06 0.03 0.11 0.00 -1.03 0.00 0.00 54.13 53.30 2x1n s LEU 134 Cb -0.15 -1.74 -0.05 0.00 0.03 0.00 0.00 46.19 44.29 2x1n s LEU 134 CO 0.02 0.36 -0.19 0.27 0.23 0.00 0.00 176.35 177.04 2x1n s ILE 135 N -0.80 2.29 0.37 -0.59 -4.36 0.12 -0.61 121.20 117.61 2x1n s ILE 135 Ca 0.12 -2.34 0.03 0.00 -0.26 0.00 0.00 60.65 58.20 2x1n s ILE 135 Cb -0.11 -2.23 -0.01 0.00 1.25 0.00 0.00 42.46 41.36 2x1n s ILE 135 CO 0.02 -0.44 0.12 -0.46 0.24 0.00 0.00 174.94 174.42 2x1n n ASN 136 N -0.52 1.38 0.23 4.36 0.23 -0.96 -1.86 115.26 118.12 2x1n n ASN 136 Ca -0.06 -2.93 0.12 0.00 -0.53 0.00 0.00 54.58 51.18 2x1n n ASN 136 Cb 0.60 0.86 0.35 0.00 -2.08 0.00 0.00 39.78 39.51 2x1n n ASN 136 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 2x1n h THR 137 N 1.57 0.20 -0.00 5.53 1.35 -1.94 -2.87 112.91 116.74 2x1n h THR 137 Ca -0.29 -1.02 0.00 0.00 -0.55 0.00 0.00 66.41 64.55 2x1n h THR 137 Cb 1.08 1.87 0.00 0.00 -1.73 0.00 0.00 68.15 69.37 2x1n h THR 137 CO 0.46 0.10 -0.09 -0.62 -0.25 0.00 0.00 175.52 175.12 2x1n n GLU 138 N -3.16 0.35 -0.06 4.72 4.71 -1.26 -4.50 120.64 121.43 2x1n n GLU 138 Ca 0.02 -0.07 0.00 0.00 -0.01 0.00 0.00 57.16 57.10 2x1n n GLU 138 Cb 0.47 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.40 2x1n n GLU 138 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2x1n n GLY 139 N 1.36 0.97 3.83 0.62 0.00 -1.08 -4.71 105.19 106.19 2x1n n GLY 139 Ca 0.11 -0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2x1n n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x1n s ALA 140 N -2.00 3.18 0.02 4.61 0.00 -1.26 -4.89 121.76 121.41 2x1n s ALA 140 Ca 0.00 0.22 0.04 0.00 0.00 0.00 0.00 51.96 52.23 2x1n s ALA 140 Cb 0.00 -2.96 -0.02 0.00 0.00 0.00 0.00 23.12 20.14 2x1n s ALA 140 CO 0.00 0.23 -0.13 -1.50 0.00 0.00 0.00 175.76 174.35 2x1n s ILE 141 N -2.09 1.06 0.02 0.00 2.07 -1.26 -2.25 121.20 118.75 2x1n s ILE 141 Ca 0.58 -0.80 0.02 0.00 -1.41 0.00 0.00 60.65 59.04 2x1n s ILE 141 Cb -0.10 -0.93 -0.01 0.00 0.13 0.00 0.00 42.46 41.55 2x1n s ILE 141 CO 0.15 0.13 -0.07 -0.54 -1.91 0.00 0.00 174.94 172.70 2x1n s LYS 142 N -0.77 0.51 0.05 3.50 1.02 0.22 -4.58 119.74 119.69 2x1n s LYS 142 Ca 0.03 -0.46 -0.31 0.00 0.02 0.00 0.00 55.97 55.25 2x1n s LYS 142 Cb -0.07 -0.41 -0.06 0.00 -0.52 0.00 0.00 37.83 36.78 2x1n s LYS 142 CO 0.00 0.10 1.28 -0.51 -0.92 0.00 0.00 175.35 175.30 2x1n s LEU 143 N -0.79 4.35 0.37 3.17 1.43 0.07 -1.67 118.68 125.60 2x1n s LEU 143 Ca -0.03 2.08 0.03 0.00 -1.03 0.00 0.00 54.13 55.18 2x1n s LEU 143 Cb -0.06 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.54 2x1n s LEU 143 CO 0.00 -0.57 0.09 0.00 0.23 0.00 0.00 176.35 176.10 2x1n s ALA 144 N 1.45 2.64 -0.41 4.21 0.00 -0.61 -1.85 121.76 127.19 2x1n s ALA 144 Ca 0.61 -1.63 -0.17 0.00 0.00 0.00 0.00 51.96 50.77 2x1n s ALA 144 Cb -0.31 0.69 0.02 0.00 0.00 0.00 0.00 23.12 23.53 2x1n s ALA 144 CO 0.28 -0.32 0.54 -3.47 0.00 0.00 0.00 175.76 172.79 2x1n n ASP 145 N -0.96 -7.67 -1.84 0.00 -0.08 -1.26 -4.81 116.55 99.93 2x1n n ASP 145 Ca -0.04 0.54 -0.05 0.00 -1.51 0.00 0.00 54.79 53.73 2x1n n ASP 145 Cb 0.66 -4.90 0.27 0.00 2.34 0.00 0.00 41.12 39.48 2x1n n ASP 145 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 2x1n n PHE 146 N -0.16 2.12 -0.15 -0.67 3.01 -1.26 -4.59 117.46 115.76 2x1n n PHE 146 Ca 0.08 -1.04 0.11 0.00 1.01 0.00 0.00 57.45 57.61 2x1n n PHE 146 Cb 0.44 -0.61 0.44 0.00 -0.01 0.00 0.00 39.48 39.74 2x1n n PHE 146 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2x1n h GLY 147 N 3.06 0.79 -2.09 1.37 0.00 -1.92 -1.75 103.07 102.53 2x1n h GLY 147 Ca 0.22 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2x1n h GLY 147 CO 0.64 0.13 0.00 1.04 0.00 0.00 0.00 176.54 178.34 2x1n n LEU 148 N -4.49 3.36 -4.77 3.11 4.77 -1.26 -4.32 117.00 113.41 2x1n n LEU 148 Ca 0.12 -1.69 -0.40 0.00 -0.03 0.00 0.00 56.01 54.00 2x1n n LEU 148 Cb 0.37 -0.29 -0.01 0.00 -2.33 0.00 0.00 43.42 41.16 2x1n n LEU 148 CO 0.33 0.78 0.98 0.00 -1.33 0.00 0.00 177.39 178.14 2x1n s ALA 149 N -1.20 3.34 0.07 -1.18 0.00 -0.66 -4.64 121.76 117.49 2x1n s ALA 149 Ca 0.36 1.26 0.07 0.00 0.00 0.00 0.00 51.96 53.65 2x1n s ALA 149 Cb 0.20 -3.49 -0.03 0.00 0.00 0.00 0.00 23.12 19.80 2x1n s ALA 149 CO 0.27 -0.79 -0.19 1.03 0.00 0.00 0.00 175.76 176.09 2x1n s ARG 150 N -2.12 1.11 -0.15 0.00 1.81 -0.17 -4.86 118.95 114.57 2x1n s ARG 150 Ca 0.55 -1.01 -0.23 0.00 -1.72 0.00 0.00 55.73 53.31 2x1n s ARG 150 Cb -0.39 -1.25 -0.02 0.00 -0.45 0.00 0.00 34.95 32.83 2x1n s ARG 150 CO 0.51 0.30 0.74 0.00 -0.68 0.00 0.00 175.30 176.16 2x1n s ALA 151 N -1.05 3.47 -0.63 2.13 0.00 -1.26 -0.29 121.76 124.14 2x1n s ALA 151 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 51.98 2x1n s ALA 151 Cb -0.09 -3.08 0.42 0.00 0.00 0.00 0.00 23.12 20.37 2x1n s ALA 151 CO 0.03 -0.46 1.78 1.97 0.00 0.00 0.00 175.76 179.08 2x1n n PHE 152 N 4.76 3.10 -0.36 0.00 -1.74 -0.52 -4.53 117.46 118.17 2x1n n PHE 152 Ca 0.01 -2.71 0.04 0.00 -0.56 0.00 0.00 57.45 54.23 2x1n n PHE 152 Cb 0.50 -1.03 0.19 0.00 1.52 0.00 0.00 39.48 40.66 2x1n n PHE 152 CO 0.00 0.00 0.00 0.78 -0.56 0.00 0.00 176.76 176.98 2x1n h GLY 153 N 2.37 1.53 -4.82 4.97 0.00 -1.94 -3.39 103.07 101.79 2x1n h GLY 153 Ca 0.52 -0.44 -0.68 0.00 0.00 0.00 0.00 47.33 46.73 2x1n h GLY 153 CO 1.32 0.26 -0.72 0.14 0.00 0.00 0.00 176.54 177.55 2x1n s VAL 154 N -6.02 3.52 0.26 4.60 1.01 -1.26 -5.10 120.40 117.40 2x1n s VAL 154 Ca -0.12 -0.75 -0.30 0.00 0.00 0.00 0.00 61.98 60.81 2x1n s VAL 154 Cb 0.21 -2.49 -0.14 0.00 0.00 0.00 0.00 36.38 33.95 2x1n s VAL 154 CO 0.81 0.45 1.11 -2.65 0.00 0.00 0.00 175.10 174.81 2x1n n PRO 155 N 1.76 1.42 -2.94 2.72 -0.02 -1.26 -4.89 135.00 131.78 2x1n n PRO 155 Ca -0.16 0.50 -0.42 0.00 -2.02 0.00 0.00 63.50 61.40 2x1n n PRO 155 Cb 0.53 -1.95 -0.05 0.00 -0.02 0.00 0.00 33.50 32.01 2x1n n PRO 155 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2x1n s VAL 156 N -0.72 4.78 0.33 -1.45 1.01 -1.26 -5.00 120.40 118.08 2x1n s VAL 156 Ca 0.63 1.12 -0.27 0.00 0.00 0.00 0.00 61.98 63.47 2x1n s VAL 156 Cb -0.73 -4.16 -0.09 0.00 0.00 0.00 0.00 36.38 31.40 2x1n s VAL 156 CO 0.57 -0.29 1.00 -0.13 0.00 0.00 0.00 175.10 176.25 2x1n s ARG 157 N 3.00 4.50 0.37 2.72 0.52 -1.26 -0.76 118.95 128.04 2x1n s ARG 157 Ca 0.32 1.49 -0.21 0.00 -0.52 0.00 0.00 55.73 56.81 2x1n s ARG 157 Cb -0.14 -2.85 -0.10 0.00 0.52 0.00 0.00 34.95 32.38 2x1n s ARG 157 CO 0.14 0.17 0.90 0.95 0.02 0.00 0.00 175.30 177.48 2x1n s THR 158 N -1.49 4.39 -0.06 0.02 -4.23 -0.23 -4.83 115.64 109.20 2x1n s THR 158 Ca 0.50 1.49 -0.28 0.00 -1.18 0.00 0.00 61.69 62.22 2x1n s THR 158 Cb -0.23 -3.73 -0.02 0.00 1.34 0.00 0.00 72.50 69.85 2x1n s THR 158 CO 0.29 -0.14 0.93 -0.31 -0.54 0.00 0.00 174.62 174.86 2x1n s TYR 159 N -1.95 3.57 0.16 3.99 1.51 -1.26 -4.96 117.35 118.41 2x1n s TYR 159 Ca 0.56 1.55 -0.11 0.00 -1.01 0.00 0.00 57.07 58.06 2x1n s TYR 159 Cb -0.12 -3.09 0.03 0.00 -0.11 0.00 0.00 41.96 38.67 2x1n s TYR 159 CO 0.17 -0.10 1.60 1.15 -1.11 0.00 0.00 175.55 177.26 2x1n h THR 160 N 4.94 1.27 -3.62 -0.71 2.02 -1.98 -3.33 112.91 111.50 2x1n h THR 160 Ca -0.36 -1.17 -0.74 0.00 0.77 0.00 0.00 66.41 64.91 2x1n h THR 160 Cb 1.18 0.96 -0.32 0.00 -1.74 0.00 0.00 68.15 68.24 2x1n h THR 160 CO 0.80 0.41 -0.12 -1.00 0.37 0.00 0.00 175.52 175.98 2x1n s HIS 161 N -4.93 3.64 0.28 3.16 3.76 -1.26 -5.07 115.29 114.87 2x1n s HIS 161 Ca -0.12 -2.52 -0.30 0.00 -0.15 0.00 0.00 55.06 51.97 2x1n s HIS 161 Cb 0.12 -3.45 -0.13 0.00 1.11 0.00 0.00 32.58 30.23 2x1n s HIS 161 CO 0.84 -0.88 1.33 -1.91 -0.85 0.00 0.00 174.74 173.27 2x1n n GLU 162 N 3.42 2.01 -0.70 1.40 4.07 -1.25 -4.89 120.64 124.70 2x1n n GLU 162 Ca 0.13 0.71 -0.01 0.00 -0.06 0.00 0.00 57.16 57.93 2x1n n GLU 162 Cb 0.41 -2.32 0.20 0.00 -0.06 0.00 0.00 31.44 29.68 2x1n n GLU 162 CO 0.00 0.00 0.00 1.55 -0.06 0.00 0.00 177.13 178.62 2x1n n VAL 163 N 1.21 2.45 -1.79 6.31 3.14 -1.26 -4.87 118.33 123.51 2x1n n VAL 163 Ca 0.09 -2.69 -0.15 0.00 -2.96 0.00 0.00 64.34 58.62 2x1n n VAL 163 Cb 0.33 -0.30 0.09 0.00 -1.06 0.00 0.00 33.84 32.91 2x1n n VAL 163 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 2x1n n VAL 164 N -1.07 2.55 -0.68 1.55 0.31 -1.26 -5.08 118.33 114.65 2x1n n VAL 164 Ca 0.29 -3.69 0.08 0.00 -0.01 0.00 0.00 64.34 61.00 2x1n n VAL 164 Cb 0.96 -0.82 -0.04 0.00 -0.91 0.00 0.00 33.84 33.03 2x1n n VAL 164 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 2x1n n THR 165 N -0.88 -0.52 -0.04 2.52 5.66 -1.26 -4.84 114.28 114.92 2x1n n THR 165 Ca 0.38 0.47 -0.10 0.00 -3.05 0.00 0.00 64.05 61.75 2x1n n THR 165 Cb 0.89 -0.71 -0.03 0.00 -1.55 0.00 0.00 70.33 68.93 2x1n n THR 165 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 2x1n n LEU 166 N -3.01 0.96 -0.24 1.09 7.94 -1.26 -4.67 117.00 117.81 2x1n n LEU 166 Ca -0.04 0.16 0.12 0.00 -1.11 0.00 0.00 56.01 55.13 2x1n n LEU 166 Cb 0.31 -0.37 0.40 0.00 0.53 0.00 0.00 43.42 44.29 2x1n n LEU 166 CO 0.02 0.03 1.22 -0.50 -1.11 0.00 0.00 177.39 177.04 2x1n h TRP 167 N -0.40 0.74 -0.45 1.96 4.06 -1.88 -2.32 115.95 117.67 2x1n h TRP 167 Ca -0.21 0.02 -0.04 0.00 2.06 0.00 0.00 58.89 60.73 2x1n h TRP 167 Cb 1.03 -0.23 -0.02 0.00 -1.00 0.00 0.00 29.16 28.93 2x1n h TRP 167 CO -0.07 0.29 0.03 0.66 -3.56 0.00 0.00 178.44 175.79 2x1n n TYR 168 N -4.53 1.58 -3.36 0.49 4.01 -1.26 -4.59 117.16 109.50 2x1n n TYR 168 Ca 0.16 -0.89 -0.38 0.00 -0.16 0.00 0.00 57.90 56.62 2x1n n TYR 168 Cb 0.45 -0.45 -0.06 0.00 -0.31 0.00 0.00 39.34 38.97 2x1n n TYR 168 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 2x1n s ARG 169 N -2.85 4.18 0.52 -0.72 3.52 -0.87 -4.03 118.95 118.70 2x1n s ARG 169 Ca 0.49 0.51 -0.20 0.00 -0.13 0.00 0.00 55.73 56.41 2x1n s ARG 169 Cb 0.39 -3.32 -0.07 0.00 -1.56 0.00 0.00 34.95 30.39 2x1n s ARG 169 CO 0.12 0.44 1.09 0.00 -0.81 0.00 0.00 175.30 176.14 2x1n s ALA 170 N -0.32 2.76 0.22 6.12 0.00 -1.26 -4.94 121.76 124.35 2x1n s ALA 170 Ca 0.26 0.72 0.23 0.00 0.00 0.00 0.00 51.96 53.17 2x1n s ALA 170 Cb -0.17 -3.31 0.98 0.00 0.00 0.00 0.00 23.12 20.62 2x1n s ALA 170 CO 0.13 -0.59 1.86 -1.00 0.00 0.00 0.00 175.76 176.16 2x1n h PRO 171 N 1.31 0.00 -0.32 0.00 0.13 -1.97 -2.57 132.00 128.58 2x1n h PRO 171 Ca -0.50 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.51 2x1n h PRO 171 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 2x1n h PRO 171 CO 0.58 0.24 -0.32 1.05 -0.23 0.00 0.00 178.00 179.32 2x1n h GLU 172 N 0.00 0.69 -0.48 0.86 9.09 -1.92 -1.17 114.58 121.65 2x1n h GLU 172 Ca -0.00 -0.32 -0.05 0.00 0.05 0.00 0.00 59.36 59.04 2x1n h GLU 172 Cb 0.68 -0.01 -0.02 0.00 -1.65 0.00 0.00 28.75 27.75 2x1n h GLU 172 CO 0.03 0.92 0.11 0.82 0.05 0.00 0.00 179.01 180.94 2x1n h ILE 173 N 0.58 1.24 -0.24 -1.06 2.04 -1.82 -1.72 117.51 116.54 2x1n h ILE 173 Ca 0.06 -0.85 -0.03 0.00 1.00 0.00 0.00 64.86 65.05 2x1n h ILE 173 Cb 0.83 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 2x1n h ILE 173 CO 0.07 0.30 0.04 -0.07 0.00 0.00 0.00 178.15 178.49 2x1n h LEU 174 N 0.65 0.31 -1.31 1.44 3.38 -1.28 -2.51 115.31 116.00 2x1n h LEU 174 Ca 0.15 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2x1n h LEU 174 Cb 0.34 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2x1n h LEU 174 CO 0.00 0.34 0.00 0.18 0.09 0.00 0.00 178.44 179.05 2x1n n LEU 175 N -4.38 1.92 -0.26 1.67 4.77 -0.46 -4.88 117.00 115.38 2x1n n LEU 175 Ca 0.00 -0.91 0.00 0.00 -0.03 0.00 0.00 56.01 55.08 2x1n n LEU 175 Cb 0.17 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2x1n n LEU 175 CO 0.37 0.45 0.00 0.61 -1.33 0.00 0.00 177.39 177.49 2x1n n GLY 176 N 1.12 0.98 3.76 -0.72 0.00 -0.94 -1.53 105.19 107.85 2x1n n GLY 176 Ca 0.14 -0.43 -0.39 0.00 0.00 0.00 0.00 46.02 45.34 2x1n n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x1n h LYS 178 N 2.12 0.00 -5.13 0.00 3.64 -1.96 -3.43 116.57 111.81 2x1n h LYS 178 Ca -0.50 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 58.52 2x1n h LYS 178 Cb 1.27 0.00 -0.19 0.00 -0.41 0.00 0.00 32.23 32.90 2x1n h LYS 178 CO 0.60 0.54 -0.75 0.71 -2.27 0.00 0.00 179.45 178.28 2x1n s TYR 179 N -2.98 1.16 0.80 1.91 2.02 -1.26 -1.07 117.35 117.92 2x1n s TYR 179 Ca 0.03 -0.58 -0.08 0.00 -0.37 0.00 0.00 57.07 56.08 2x1n s TYR 179 Cb 0.08 -0.63 0.13 0.00 -0.40 0.00 0.00 41.96 41.14 2x1n s TYR 179 CO 0.75 0.04 1.11 0.71 -1.57 0.00 0.00 175.55 176.59 2x1n s TYR 180 N -2.05 2.03 0.35 2.71 1.51 0.06 -4.83 117.35 117.13 2x1n s TYR 180 Ca 0.04 0.16 -0.12 0.00 -1.01 0.00 0.00 57.07 56.14 2x1n s TYR 180 Cb -0.05 -3.45 0.03 0.00 -0.11 0.00 0.00 41.96 38.38 2x1n s TYR 180 CO 0.01 -1.93 0.65 -1.54 -1.11 0.00 0.00 175.55 171.63 2x1n s SER 181 N -4.72 0.27 0.53 2.29 1.04 -1.26 -4.61 113.70 107.25 2x1n s SER 181 Ca 0.67 -1.18 0.36 0.00 0.48 0.00 0.00 55.95 56.27 2x1n s SER 181 Cb -0.07 0.75 1.82 0.00 0.10 0.00 0.00 66.02 68.63 2x1n s SER 181 CO 0.47 -1.47 2.08 0.71 0.98 0.00 0.00 173.24 176.02 2x1n h THR 182 N 2.06 0.00 0.00 2.02 1.35 -1.98 -2.79 112.91 113.58 2x1n h THR 182 Ca -0.29 -0.13 -0.09 0.00 -0.55 0.00 0.00 66.41 65.35 2x1n h THR 182 Cb 1.25 0.99 -0.01 0.00 -1.73 0.00 0.00 68.15 68.65 2x1n h THR 182 CO 0.38 0.00 -0.45 0.00 -0.25 0.00 0.00 175.52 175.20 2x1n h ALA 183 N 2.02 1.25 0.00 6.62 0.00 -1.95 -2.28 119.26 124.93 2x1n h ALA 183 Ca 0.00 -0.41 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 2x1n h ALA 183 Cb 0.14 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2x1n h ALA 183 CO 0.00 0.56 -0.25 -0.39 0.00 0.00 0.00 179.25 179.18 2x1n h VAL 184 N 0.00 0.86 0.01 0.00 -1.51 -1.91 -1.72 116.25 111.98 2x1n h VAL 184 Ca -0.00 -0.97 -0.23 0.00 -1.23 0.00 0.00 66.70 64.27 2x1n h VAL 184 Cb 0.80 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 31.54 2x1n h VAL 184 CO 0.06 0.24 -0.96 0.44 -1.23 0.00 0.00 177.57 176.12 2x1n h ASP 185 N 0.00 0.49 -0.61 4.19 3.32 -1.60 -2.39 116.42 119.83 2x1n h ASP 185 Ca -0.00 -0.41 -0.10 0.00 0.02 0.00 0.00 57.03 56.54 2x1n h ASP 185 Cb 0.56 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 2x1n h ASP 185 CO 0.03 1.22 0.00 0.40 -1.72 0.00 0.00 179.24 179.17 2x1n h ILE 186 N 0.20 1.27 -0.20 0.35 1.08 -1.35 -1.89 117.51 116.96 2x1n h ILE 186 Ca -0.08 -1.15 -0.01 0.00 -0.39 0.00 0.00 64.86 63.23 2x1n h ILE 186 Cb 1.61 0.80 -0.01 0.00 -3.07 0.00 0.00 36.82 36.15 2x1n h ILE 186 CO 0.16 0.42 0.10 -0.25 -0.69 0.00 0.00 178.15 177.90 2x1n h TRP 187 N 0.97 0.29 -0.96 1.37 2.91 -1.31 0.66 115.95 119.87 2x1n h TRP 187 Ca 0.17 -0.01 0.05 0.00 1.13 0.00 0.00 58.89 60.23 2x1n h TRP 187 Cb 0.56 -0.09 -0.06 0.00 -0.51 0.00 0.00 29.16 29.06 2x1n h TRP 187 CO 0.04 0.29 0.63 0.77 -1.03 0.00 0.00 178.44 179.13 2x1n h SER 188 N 0.21 1.01 0.43 2.65 0.02 -1.35 -1.34 113.55 115.18 2x1n h SER 188 Ca 0.07 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.85 2x1n h SER 188 Cb 0.10 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 2x1n h SER 188 CO -0.01 0.66 -0.72 0.25 -1.14 0.00 0.00 176.83 175.87 2x1n h LEU 189 N 1.15 0.29 -0.78 5.07 5.85 -1.01 -2.13 115.31 123.75 2x1n h LEU 189 Ca 0.40 -0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.95 2x1n h LEU 189 Cb 0.11 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 2x1n h LEU 189 CO -0.14 0.91 0.51 1.23 -0.34 0.00 0.00 178.44 180.60 2x1n h GLY 190 N 1.59 1.11 1.27 3.75 0.00 -0.50 -0.23 103.07 110.07 2x1n h GLY 190 Ca -0.02 -0.39 -0.06 0.00 0.00 0.00 0.00 47.33 46.85 2x1n h GLY 190 CO 0.11 0.36 0.09 0.00 0.00 0.00 0.00 176.54 177.10 2x1n h ILE 192 N 0.85 1.43 0.34 0.00 2.04 -1.04 -1.48 117.51 119.66 2x1n h ILE 192 Ca 0.18 -2.51 -0.01 0.00 1.00 0.00 0.00 64.86 63.51 2x1n h ILE 192 Cb 0.37 2.44 -0.00 0.00 -0.74 0.00 0.00 36.82 38.89 2x1n h ILE 192 CO 0.01 0.74 -0.19 0.15 0.00 0.00 0.00 178.15 178.86 2x1n h PHE 193 N 0.19 -0.50 -0.16 1.37 3.57 -0.89 -1.64 116.94 118.88 2x1n h PHE 193 Ca -0.07 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.41 2x1n h PHE 193 Cb 1.56 0.17 -0.01 0.00 2.79 0.00 0.00 35.95 40.47 2x1n h PHE 193 CO 0.05 -0.30 0.06 0.00 -2.23 0.00 0.00 178.31 175.89 2x1n h ALA 194 N 0.15 1.80 -0.27 2.41 0.00 -1.35 -2.64 119.26 119.36 2x1n h ALA 194 Ca -0.04 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 2x1n h ALA 194 Cb 0.40 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2x1n h ALA 194 CO 0.05 0.16 -0.36 1.49 0.00 0.00 0.00 179.25 180.59 2x1n h GLU 195 N 0.22 0.59 -0.03 0.00 4.81 -0.94 -1.23 114.58 118.01 2x1n h GLU 195 Ca 0.06 -0.28 -0.10 0.00 -0.13 0.00 0.00 59.36 58.90 2x1n h GLU 195 Cb 0.06 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 2x1n h GLU 195 CO -0.01 0.87 -0.45 0.52 -0.73 0.00 0.00 179.01 179.22 2x1n h MET 196 N 0.50 0.07 0.07 1.92 2.86 -0.96 -2.13 114.93 117.26 2x1n h MET 196 Ca 0.05 -0.03 -0.12 0.00 -2.06 0.00 0.00 59.70 57.54 2x1n h MET 196 Cb 0.85 -0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.52 2x1n h MET 196 CO 0.07 0.50 -0.56 0.28 1.06 0.00 0.00 176.91 178.27 2x1n h VAL 197 N 0.06 1.55 -0.01 -2.22 2.07 -1.24 -3.36 116.25 113.10 2x1n h VAL 197 Ca 0.00 -2.43 0.00 0.00 0.82 0.00 0.00 66.70 65.10 2x1n h VAL 197 Cb 0.81 3.18 0.00 0.00 -1.52 0.00 0.00 31.29 33.76 2x1n h VAL 197 CO 0.06 0.65 -0.07 0.35 0.02 0.00 0.00 177.57 178.58 2x1n n THR 198 N -4.33 0.00 -1.46 2.57 -2.24 -0.49 -4.91 114.28 103.43 2x1n n THR 198 Ca -0.14 -0.23 -0.16 0.00 -2.27 0.00 0.00 64.05 61.25 2x1n n THR 198 Cb 0.68 0.51 -0.07 0.00 -2.10 0.00 0.00 70.33 69.35 2x1n n THR 198 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2x1n n ARG 199 N -0.01 -1.35 -3.64 -0.78 1.74 -0.82 -4.97 116.66 106.85 2x1n n ARG 199 Ca 0.17 1.04 -0.12 0.00 -0.77 0.00 0.00 57.85 58.17 2x1n n ARG 199 Cb 0.36 -5.33 -0.06 0.00 -1.02 0.00 0.00 32.46 26.42 2x1n n ARG 199 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2x1n s ARG 200 N -3.29 0.98 0.41 5.56 1.70 -1.12 -5.00 118.95 118.19 2x1n s ARG 200 Ca 0.00 -0.42 -0.27 0.00 -0.47 0.00 0.00 55.73 54.57 2x1n s ARG 200 Cb 0.00 0.44 -0.10 0.00 -0.57 0.00 0.00 34.95 34.72 2x1n s ARG 200 CO 0.00 -0.35 1.41 0.00 -1.08 0.00 0.00 175.30 175.27 2x1n n ALA 201 N 0.30 1.95 -0.02 7.88 0.00 -1.26 -4.16 120.51 125.19 2x1n n ALA 201 Ca -0.18 0.29 -0.12 0.00 0.00 0.00 0.00 53.44 53.43 2x1n n ALA 201 Cb 0.61 -2.37 -0.10 0.00 0.00 0.00 0.00 19.45 17.59 2x1n n ALA 201 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2x1n h LEU 202 N 2.50 -0.04 -6.49 0.00 6.46 -1.91 -3.41 115.31 112.43 2x1n h LEU 202 Ca -0.50 -0.64 -0.60 0.00 -0.12 0.00 0.00 57.88 56.03 2x1n h LEU 202 Cb 1.27 0.01 -0.41 0.00 -0.73 0.00 0.00 40.66 40.80 2x1n h LEU 202 CO 0.62 0.67 -0.72 0.49 -0.62 0.00 0.00 178.44 178.87 2x1n n PHE 203 N -4.77 2.21 -2.54 1.25 3.72 -1.26 -5.02 117.46 111.06 2x1n n PHE 203 Ca -0.08 -3.99 -0.43 0.00 -0.05 0.00 0.00 57.45 52.89 2x1n n PHE 203 Cb 0.33 -0.43 0.00 0.00 -0.94 0.00 0.00 39.48 38.45 2x1n n PHE 203 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2x1n n PRO 204 N 1.60 3.20 -1.80 -1.08 -0.04 -1.26 -4.41 135.00 131.21 2x1n n PRO 204 Ca 0.25 -3.30 -0.30 0.00 -0.04 0.00 0.00 63.50 60.11 2x1n n PRO 204 Cb 0.42 -3.39 0.06 0.00 -0.04 0.00 0.00 33.50 30.55 2x1n n PRO 204 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2x1n s GLY 205 N 3.79 1.62 0.00 0.55 0.00 -1.26 -5.00 107.32 107.02 2x1n s GLY 205 Ca 0.51 -0.33 0.03 0.00 0.00 0.00 0.00 44.72 44.93 2x1n s GLY 205 CO 0.05 0.06 0.37 1.22 0.00 0.00 0.00 173.10 174.79 2x1n n ASP 206 N -3.14 0.71 -3.50 1.64 8.00 -1.26 -4.83 116.55 114.17 2x1n n ASP 206 Ca 0.07 -0.85 -0.07 0.00 0.71 0.00 0.00 54.79 54.64 2x1n n ASP 206 Cb 0.57 0.51 -0.00 0.00 -0.02 0.00 0.00 41.12 42.18 2x1n n ASP 206 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2x1n s SER 207 N -0.79 -0.15 0.15 -2.24 1.04 -1.26 -5.00 113.70 105.45 2x1n s SER 207 Ca 0.03 -0.78 -0.20 0.00 0.48 0.00 0.00 55.95 55.47 2x1n s SER 207 Cb 0.03 0.74 0.05 0.00 0.10 0.00 0.00 66.02 66.93 2x1n s SER 207 CO 0.08 -1.42 1.65 -0.33 0.98 0.00 0.00 173.24 174.21 2x1n h GLU 208 N 2.00 -0.14 -0.12 4.02 3.07 -1.99 -0.78 114.58 120.64 2x1n h GLU 208 Ca -0.24 0.01 -0.12 0.00 -0.50 0.00 0.00 59.36 58.50 2x1n h GLU 208 Cb 1.25 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 29.18 2x1n h GLU 208 CO 0.30 -0.09 -0.47 0.97 -1.40 0.00 0.00 179.01 178.32 2x1n h ILE 209 N -0.14 1.33 -0.48 3.13 6.09 -1.97 -2.49 117.51 122.98 2x1n h ILE 209 Ca 0.15 -1.66 -0.09 0.00 -1.37 0.00 0.00 64.86 61.88 2x1n h ILE 209 Cb 0.37 1.75 -0.02 0.00 0.47 0.00 0.00 36.82 39.39 2x1n h ILE 209 CO -0.37 0.50 -0.07 -0.78 -3.07 0.00 0.00 178.15 174.36 2x1n h ASP 210 N 0.24 0.84 -0.13 2.19 3.58 -1.84 -2.10 116.42 119.20 2x1n h ASP 210 Ca 0.01 -0.24 -0.00 0.00 0.42 0.00 0.00 57.03 57.22 2x1n h ASP 210 Cb 0.92 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.74 2x1n h ASP 210 CO 0.08 0.94 0.07 -0.61 -2.88 0.00 0.00 179.24 176.84 2x1n h GLN 211 N 0.78 0.18 -0.77 0.28 5.75 -0.92 -1.17 115.11 119.24 2x1n h GLN 211 Ca 0.13 -0.02 0.04 0.00 -0.15 0.00 0.00 58.65 58.65 2x1n h GLN 211 Cb 0.57 -0.04 -0.05 0.00 1.07 0.00 0.00 27.48 29.04 2x1n h GLN 211 CO 0.03 0.21 0.48 -0.07 -2.65 0.00 0.00 178.83 176.84 2x1n h LEU 212 N 0.11 0.79 -0.88 -2.39 3.38 -1.34 -1.92 115.31 113.05 2x1n h LEU 212 Ca 0.05 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 2x1n h LEU 212 Cb 0.08 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2x1n h LEU 212 CO -0.01 0.54 -0.46 -0.26 0.09 0.00 0.00 178.44 178.34 2x1n h PHE 213 N 0.93 0.00 -0.06 1.13 -1.00 -1.12 -0.74 116.94 116.08 2x1n h PHE 213 Ca 0.31 0.00 -0.16 0.00 2.81 0.00 0.00 57.97 60.94 2x1n h PHE 213 Cb 0.04 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.59 2x1n h PHE 213 CO -0.04 0.46 -0.66 0.00 -1.61 0.00 0.00 178.31 176.47 2x1n h ARG 214 N 0.00 0.23 -0.18 1.51 3.08 -0.90 -0.80 114.38 117.33 2x1n h ARG 214 Ca -0.00 -0.18 -0.05 0.00 0.07 0.00 0.00 59.98 59.82 2x1n h ARG 214 Cb 0.96 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 31.04 2x1n h ARG 214 CO 0.06 0.81 -0.10 0.82 -1.07 0.00 0.00 179.97 180.49 2x1n h ILE 215 N 0.17 1.31 -0.26 2.04 2.04 -0.93 -3.06 117.51 118.82 2x1n h ILE 215 Ca -0.01 -1.17 -0.09 0.00 1.00 0.00 0.00 64.86 64.59 2x1n h ILE 215 Cb 1.18 1.69 -0.01 0.00 -0.74 0.00 0.00 36.82 38.94 2x1n h ILE 215 CO 0.10 0.35 -0.21 -0.26 0.00 0.00 0.00 178.15 178.13 2x1n h PHE 216 N 0.07 0.53 0.00 1.37 0.04 -1.07 -0.81 116.94 117.07 2x1n h PHE 216 Ca 0.04 -0.10 -0.05 0.00 2.80 0.00 0.00 57.97 60.66 2x1n h PHE 216 Cb 0.59 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.60 2x1n h PHE 216 CO 0.07 0.66 -0.25 -0.09 -0.60 0.00 0.00 178.31 178.09 2x1n h ARG 217 N 0.43 0.00 0.02 1.51 2.43 -1.12 0.18 114.38 117.83 2x1n h ARG 217 Ca 0.07 0.00 -0.40 0.00 -0.81 0.00 0.00 59.98 58.84 2x1n h ARG 217 Cb 0.61 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.10 2x1n h ARG 217 CO 0.04 0.25 -2.33 2.41 -1.51 0.00 0.00 179.97 178.84 2x1n n THR 218 N -3.59 1.54 1.04 0.20 -1.04 -0.94 -4.56 114.28 106.93 2x1n n THR 218 Ca -0.01 -0.46 0.12 0.00 -2.04 0.00 0.00 64.05 61.66 2x1n n THR 218 Cb 0.39 -1.69 0.09 0.00 -1.82 0.00 0.00 70.33 67.29 2x1n n THR 218 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2x1n n LEU 219 N -3.77 2.39 0.00 -4.42 4.77 -0.35 -2.12 117.00 113.49 2x1n n LEU 219 Ca -0.46 -0.83 0.00 0.00 -0.03 0.00 0.00 56.01 54.69 2x1n n LEU 219 Cb 0.93 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 42.01 2x1n n LEU 219 CO 0.19 0.42 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 2x1n n GLY 220 N 1.37 -1.16 3.69 -0.72 0.00 0.64 -4.36 105.19 104.67 2x1n n GLY 220 Ca 0.12 -1.52 -0.42 0.00 0.00 0.00 0.00 46.02 44.20 2x1n n GLY 220 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2x1n s THR 221 N -3.18 3.74 0.47 2.61 2.01 -1.13 -4.56 115.64 115.61 2x1n s THR 221 Ca 0.00 1.15 -0.20 0.00 0.31 0.00 0.00 61.69 62.95 2x1n s THR 221 Cb 0.00 -3.74 -0.09 0.00 0.01 0.00 0.00 72.50 68.68 2x1n s THR 221 CO 0.00 0.02 1.02 -2.16 -0.69 0.00 0.00 174.62 172.81 2x1n s PRO 222 N 2.08 3.89 0.18 4.92 0.04 -1.26 -4.89 135.00 139.96 2x1n s PRO 222 Ca 0.63 1.32 0.02 0.00 0.04 0.00 0.00 61.00 63.01 2x1n s PRO 222 Cb -0.31 -2.12 -0.01 0.00 0.04 0.00 0.00 34.50 32.09 2x1n s PRO 222 CO 0.27 -0.35 0.09 -0.40 0.04 0.00 0.00 177.00 176.65 2x1n n ASP 223 N -0.88 0.65 0.22 6.66 5.68 -1.26 -4.99 116.55 122.63 2x1n n ASP 223 Ca 0.09 -2.03 0.15 0.00 -0.50 0.00 0.00 54.79 52.50 2x1n n ASP 223 Cb 0.53 0.58 0.65 0.00 -1.14 0.00 0.00 41.12 41.74 2x1n n ASP 223 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2x1n h GLU 224 N 0.00 0.00 0.30 0.11 4.39 -1.98 -1.40 114.58 116.00 2x1n h GLU 224 Ca -0.14 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.55 2x1n h GLU 224 Cb 0.57 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 2x1n h GLU 224 CO 0.22 0.00 -0.15 0.28 -1.16 0.00 0.00 179.01 178.20 2x1n h VAL 225 N 0.00 0.54 -0.09 3.13 2.07 -1.99 -3.16 116.25 116.75 2x1n h VAL 225 Ca 0.00 -0.78 -0.12 0.00 0.82 0.00 0.00 66.70 66.61 2x1n h VAL 225 Cb 0.38 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 2x1n h VAL 225 CO 0.00 0.12 -0.49 0.58 0.02 0.00 0.00 177.57 177.80 2x1n h VAL 226 N -0.92 1.34 -1.71 2.57 2.07 -1.94 -3.41 116.25 114.25 2x1n h VAL 226 Ca -0.04 -1.71 -0.33 0.00 0.82 0.00 0.00 66.70 65.44 2x1n h VAL 226 Cb 0.51 1.81 -0.28 0.00 -1.52 0.00 0.00 31.29 31.82 2x1n h VAL 226 CO 0.07 0.51 -0.68 0.86 0.02 0.00 0.00 177.57 178.35 2x1n s TRP 227 N -3.99 -0.47 0.16 1.57 -0.00 -0.54 -4.50 118.94 111.17 2x1n s TRP 227 Ca -0.04 -0.96 -0.31 0.00 -0.00 0.00 0.00 56.10 54.79 2x1n s TRP 227 Cb 0.13 -0.26 -0.10 0.00 -0.00 0.00 0.00 33.47 33.23 2x1n s TRP 227 CO 0.78 -1.03 1.62 -1.25 -0.00 0.00 0.00 176.95 177.06 2x1n s PRO 228 N 1.07 4.19 0.00 5.86 0.04 -1.19 -2.34 135.00 142.63 2x1n s PRO 228 Ca 0.23 2.41 0.00 0.00 0.04 0.00 0.00 61.00 63.68 2x1n s PRO 228 Cb -0.07 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.25 2x1n s PRO 228 CO -0.07 -0.66 0.00 0.41 0.04 0.00 0.00 177.00 176.72 2x1n n GLY 229 N 3.85 1.25 0.23 0.56 0.00 -1.26 -4.97 105.19 104.85 2x1n n GLY 229 Ca 0.15 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.18 2x1n n GLY 229 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2x1n h VAL 230 N 0.00 0.49 0.00 1.61 -1.51 -1.79 -1.28 116.25 113.77 2x1n h VAL 230 Ca 0.00 -0.04 0.00 0.00 -1.23 0.00 0.00 66.70 65.43 2x1n h VAL 230 Cb 0.00 0.37 0.00 0.00 -2.13 0.00 0.00 31.29 29.53 2x1n h VAL 230 CO 0.00 0.02 0.00 0.35 -1.23 0.00 0.00 177.57 176.71 2x1n n THR 231 N -5.28 0.00 -1.34 7.19 -2.24 -1.26 -1.94 114.28 109.41 2x1n n THR 231 Ca 0.09 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.95 2x1n n THR 231 Cb 0.35 -0.33 0.18 0.00 -2.10 0.00 0.00 70.33 68.43 2x1n n THR 231 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2x1n n SER 232 N -0.81 2.06 -4.88 3.42 3.41 -0.49 -5.00 113.62 111.34 2x1n n SER 232 Ca 0.14 -3.51 -0.34 0.00 -0.26 0.00 0.00 58.87 54.90 2x1n n SER 232 Cb 0.06 -0.48 -0.05 0.00 -0.26 0.00 0.00 64.21 63.48 2x1n n SER 232 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2x1n s MET 233 N -3.06 3.67 0.22 4.33 -1.94 -0.82 -5.01 119.30 116.69 2x1n s MET 233 Ca 0.35 0.04 -0.12 0.00 -1.71 0.00 0.00 55.69 54.25 2x1n s MET 233 Cb 0.33 -2.99 0.29 0.00 2.01 0.00 0.00 34.83 34.47 2x1n s MET 233 CO -0.02 0.57 1.63 -1.35 -0.01 0.00 0.00 175.02 175.84 2x1n h PRO 234 N 3.60 0.03 -0.25 2.03 0.11 -1.80 -1.65 132.00 134.07 2x1n h PRO 234 Ca -0.49 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2x1n h PRO 234 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2x1n h PRO 234 CO 0.68 0.02 0.00 -0.25 -0.21 0.00 0.00 178.00 178.23 2x1n n ASP 235 N -5.42 2.47 -4.74 -2.05 8.00 -0.58 -4.91 116.55 109.32 2x1n n ASP 235 Ca 0.09 -1.84 -0.41 0.00 0.71 0.00 0.00 54.79 53.34 2x1n n ASP 235 Cb 0.37 -0.16 -0.05 0.00 -0.02 0.00 0.00 41.12 41.26 2x1n n ASP 235 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2x1n s TYR 236 N -1.68 3.86 -0.07 1.24 6.14 -0.62 -4.96 117.35 121.26 2x1n s TYR 236 Ca 0.35 1.83 0.03 0.00 0.64 0.00 0.00 57.07 59.91 2x1n s TYR 236 Cb 0.20 -3.03 0.01 0.00 0.42 0.00 0.00 41.96 39.56 2x1n s TYR 236 CO 0.29 0.29 -0.14 0.15 0.64 0.00 0.00 175.55 176.77 2x1n s LYS 237 N -0.36 1.87 0.00 4.97 1.02 -1.26 -4.89 119.74 121.09 2x1n s LYS 237 Ca 0.45 -0.50 0.04 0.00 0.02 0.00 0.00 55.97 55.99 2x1n s LYS 237 Cb -0.24 -1.53 0.19 0.00 -0.52 0.00 0.00 37.83 35.73 2x1n s LYS 237 CO 0.30 0.07 1.13 -0.35 -0.92 0.00 0.00 175.35 175.59 2x1n n PRO 238 N 3.68 0.00 0.00 -1.68 -0.04 -1.26 -1.64 135.00 134.07 2x1n n PRO 238 Ca -0.22 0.41 0.14 0.00 -0.04 0.00 0.00 63.50 63.80 2x1n n PRO 238 Cb 0.52 -1.50 0.59 0.00 -0.04 0.00 0.00 33.50 33.07 2x1n n PRO 238 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2x1n n SER 239 N -1.49 0.38 -4.63 3.54 3.41 -1.26 -4.89 113.62 108.68 2x1n n SER 239 Ca 0.01 -0.39 -0.46 0.00 -0.26 0.00 0.00 58.87 57.78 2x1n n SER 239 Cb 0.05 -0.11 -0.03 0.00 -0.26 0.00 0.00 64.21 63.86 2x1n n SER 239 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2x1n n PHE 240 N -1.09 1.75 -1.84 7.33 3.72 -0.65 -4.91 117.46 121.76 2x1n n PHE 240 Ca 0.13 0.56 -0.38 0.00 -0.05 0.00 0.00 57.45 57.71 2x1n n PHE 240 Cb 0.29 -2.37 0.03 0.00 -0.94 0.00 0.00 39.48 36.49 2x1n n PHE 240 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 2x1n s PRO 241 N -0.64 3.27 -0.83 -1.08 0.02 -1.26 -4.96 135.00 129.51 2x1n s PRO 241 Ca 0.68 2.21 -0.15 0.00 0.02 0.00 0.00 61.00 63.76 2x1n s PRO 241 Cb -0.72 -2.32 0.20 0.00 0.02 0.00 0.00 34.50 31.68 2x1n s PRO 241 CO 0.53 -1.08 0.82 0.15 -0.33 0.00 0.00 177.00 177.08 2x1n s LYS 242 N -2.83 3.59 0.62 5.54 1.02 -1.26 -4.80 119.74 121.61 2x1n s LYS 242 Ca 0.70 -2.33 -0.03 0.00 0.02 0.00 0.00 55.97 54.32 2x1n s LYS 242 Cb -0.40 -4.50 0.04 0.00 -0.52 0.00 0.00 37.83 32.45 2x1n s LYS 242 CO 0.47 -1.37 0.89 -1.58 -0.92 0.00 0.00 175.35 172.85 2x1n s TRP 243 N 0.60 2.98 -0.02 3.18 0.51 -1.26 -4.95 118.94 119.98 2x1n s TRP 243 Ca 0.20 0.32 -0.00 0.00 -2.12 0.00 0.00 56.10 54.49 2x1n s TRP 243 Cb -0.10 -2.91 -0.04 0.00 -0.81 0.00 0.00 33.47 29.62 2x1n s TRP 243 CO -0.09 -1.05 0.06 0.00 -0.51 0.00 0.00 176.95 175.36 2x1n s ALA 244 N -2.99 3.49 -0.18 0.98 0.00 -1.26 -2.83 121.76 118.97 2x1n s ALA 244 Ca 0.57 -0.87 -0.29 0.00 0.00 0.00 0.00 51.96 51.37 2x1n s ALA 244 Cb -0.11 -1.53 -0.03 0.00 0.00 0.00 0.00 23.12 21.45 2x1n s ALA 244 CO 0.42 0.66 1.61 0.50 0.00 0.00 0.00 175.76 178.96 2x1n s ARG 245 N -1.56 3.90 0.62 0.00 3.52 -1.26 -3.94 118.95 120.23 2x1n s ARG 245 Ca 0.21 1.79 -0.15 0.00 -0.13 0.00 0.00 55.73 57.45 2x1n s ARG 245 Cb -0.12 -4.01 -0.03 0.00 -1.56 0.00 0.00 34.95 29.23 2x1n s ARG 245 CO 0.11 -1.17 1.06 -0.65 -0.81 0.00 0.00 175.30 173.84 2x1n s GLN 246 N 4.48 3.22 0.24 5.12 -0.21 -0.90 -4.91 119.66 126.70 2x1n s GLN 246 Ca 0.71 1.15 -0.30 0.00 0.02 0.00 0.00 55.36 56.95 2x1n s GLN 246 Cb -0.27 -2.02 -0.09 0.00 1.00 0.00 0.00 33.01 31.63 2x1n s GLN 246 CO 0.28 -0.89 1.27 0.34 -2.12 0.00 0.00 175.29 174.18 2x1n s ASP 247 N -3.00 6.93 0.53 5.90 -1.08 -1.26 -4.89 116.67 119.80 2x1n s ASP 247 Ca 0.62 2.45 0.35 0.00 -0.52 0.00 0.00 52.55 55.45 2x1n s ASP 247 Cb -0.16 -2.62 1.59 0.00 -1.46 0.00 0.00 42.92 40.27 2x1n s ASP 247 CO 0.41 -0.46 2.04 -0.26 0.52 0.00 0.00 175.17 177.41 2x1n h PHE 248 N 4.64 0.00 0.00 -5.34 -1.00 -1.95 -2.21 116.94 111.08 2x1n h PHE 248 Ca -0.46 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.28 2x1n h PHE 248 Cb 1.22 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.77 2x1n h PHE 248 CO 0.60 0.00 -0.18 0.66 -1.61 0.00 0.00 178.31 177.78 2x1n h SER 249 N 0.00 0.00 0.44 2.17 4.64 -1.91 -1.49 113.55 117.40 2x1n h SER 249 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2x1n h SER 249 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2x1n h SER 249 CO 0.00 0.18 -1.15 0.29 -0.87 0.00 0.00 176.83 175.28 2x1n n LYS 250 N -3.35 0.37 -0.03 4.77 5.02 -0.83 -3.12 118.16 120.98 2x1n n LYS 250 Ca 0.00 -0.01 -0.21 0.00 -2.02 0.00 0.00 58.31 56.07 2x1n n LYS 250 Cb 0.40 -1.61 -0.13 0.00 -0.02 0.00 0.00 35.03 33.66 2x1n n LYS 250 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2x1n h VAL 251 N 0.00 1.06 -2.28 -0.18 2.07 -1.50 -3.41 116.25 112.01 2x1n h VAL 251 Ca 0.00 -2.33 -0.59 0.00 0.82 0.00 0.00 66.70 64.60 2x1n h VAL 251 Cb 0.80 2.64 -0.41 0.00 -1.52 0.00 0.00 31.29 32.80 2x1n h VAL 251 CO 0.00 0.60 -0.73 1.33 0.02 0.00 0.00 177.57 178.79 2x1n n VAL 252 N -4.11 1.36 -0.12 2.57 0.24 -0.58 -4.96 118.33 112.74 2x1n n VAL 252 Ca -0.26 -4.80 -0.06 0.00 -2.04 0.00 0.00 64.34 57.19 2x1n n VAL 252 Cb 0.80 -2.05 0.01 0.00 -1.47 0.00 0.00 33.84 31.13 2x1n n VAL 252 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 2x1n h PRO 253 N 4.38 -0.14 0.00 7.34 0.11 -1.78 -2.71 132.00 139.20 2x1n h PRO 253 Ca 0.17 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.29 2x1n h PRO 253 Cb 0.74 0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.88 2x1n h PRO 253 CO 0.71 -0.10 0.00 -2.30 -0.21 0.00 0.00 178.00 176.10 2x1n n PRO 254 N -5.39 0.34 -3.43 1.05 -0.02 -1.26 -4.75 135.00 121.54 2x1n n PRO 254 Ca 0.02 0.08 -0.38 0.00 -2.02 0.00 0.00 63.50 61.20 2x1n n PRO 254 Cb 0.30 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.22 2x1n n PRO 254 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2x1n s LEU 255 N -2.31 4.47 0.00 2.45 2.96 -1.02 -5.09 118.68 120.14 2x1n s LEU 255 Ca 0.18 1.05 0.00 0.00 -0.22 0.00 0.00 54.13 55.14 2x1n s LEU 255 Cb 0.10 -2.76 0.00 0.00 0.50 0.00 0.00 46.19 44.03 2x1n s LEU 255 CO 0.20 0.28 0.00 -0.90 -1.32 0.00 0.00 176.35 174.61 2x1n n ASP 256 N 1.63 -0.63 0.01 3.68 5.68 -1.26 -4.78 116.55 120.88 2x1n n ASP 256 Ca -0.12 -0.68 -0.18 0.00 -0.50 0.00 0.00 54.79 53.30 2x1n n ASP 256 Cb 0.52 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 40.40 2x1n n ASP 256 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2x1n h GLU 257 N 0.00 0.65 -0.46 0.11 3.07 -1.99 -2.60 114.58 113.36 2x1n h GLU 257 Ca 0.00 -0.63 -0.05 0.00 -0.50 0.00 0.00 59.36 58.18 2x1n h GLU 257 Cb 0.00 0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 28.05 2x1n h GLU 257 CO 0.00 1.23 0.06 -0.44 -1.40 0.00 0.00 179.01 178.47 2x1n h ASP 258 N 0.30 0.67 -0.48 1.42 5.19 -1.96 -1.67 116.42 119.89 2x1n h ASP 258 Ca -0.09 -0.13 -0.08 0.00 -0.62 0.00 0.00 57.03 56.12 2x1n h ASP 258 Cb 1.48 -0.18 -0.02 0.00 0.18 0.00 0.00 39.33 40.80 2x1n h ASP 258 CO 0.16 0.70 -0.00 1.23 -3.12 0.00 0.00 179.24 178.21 2x1n h GLY 259 N 0.92 0.91 1.92 2.75 0.00 -1.90 -1.89 103.07 105.78 2x1n h GLY 259 Ca 0.15 -0.67 -0.10 0.00 0.00 0.00 0.00 47.33 46.71 2x1n h GLY 259 CO 0.01 0.62 -0.43 3.21 0.00 0.00 0.00 176.54 179.94 2x1n h ARG 260 N 0.70 0.09 -0.22 4.80 3.08 -1.23 -1.51 114.38 120.08 2x1n h ARG 260 Ca 0.13 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 60.05 2x1n h ARG 260 Cb 0.51 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.56 2x1n h ARG 260 CO 0.03 0.51 -0.22 1.03 -1.07 0.00 0.00 179.97 180.24 2x1n h SER 261 N 0.08 0.58 -0.21 7.04 0.87 -1.00 -1.98 113.55 118.93 2x1n h SER 261 Ca 0.00 -0.48 -0.03 0.00 -1.23 0.00 0.00 61.79 60.05 2x1n h SER 261 Cb 0.80 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.59 2x1n h SER 261 CO 0.06 0.94 0.01 0.25 -0.53 0.00 0.00 176.83 177.56 2x1n h LEU 262 N 0.23 0.36 -1.30 2.23 5.85 -1.23 -2.20 115.31 119.24 2x1n h LEU 262 Ca 0.03 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.44 2x1n h LEU 262 Cb 0.78 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 2x1n h LEU 262 CO 0.06 0.57 0.24 0.25 -0.34 0.00 0.00 178.44 179.22 2x1n h LEU 263 N 0.14 0.65 -0.97 2.25 5.85 -1.31 -1.11 115.31 120.80 2x1n h LEU 263 Ca 0.06 -0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 2x1n h LEU 263 Cb 0.38 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 2x1n h LEU 263 CO 0.01 0.56 -0.06 -1.28 -0.34 0.00 0.00 178.44 177.33 2x1n h SER 264 N 0.72 0.66 1.70 1.25 0.87 -1.15 -2.02 113.55 115.57 2x1n h SER 264 Ca 0.18 -0.17 -0.02 0.00 -1.23 0.00 0.00 61.79 60.56 2x1n h SER 264 Cb 0.08 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 61.86 2x1n h SER 264 CO -0.02 0.77 -0.09 1.56 -0.53 0.00 0.00 176.83 178.52 2x1n h GLN 265 N 0.63 0.00 0.00 2.24 4.20 -0.64 -2.89 115.11 118.65 2x1n h GLN 265 Ca 0.12 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.70 2x1n h GLN 265 Cb 0.48 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.24 2x1n h GLN 265 CO 0.03 0.09 -0.76 0.52 -0.67 0.00 0.00 178.83 178.03 2x1n h MET 266 N 0.00 0.00 -0.41 1.46 2.86 -1.07 -1.17 114.93 116.59 2x1n h MET 266 Ca -0.00 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.58 2x1n h MET 266 Cb 0.96 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.58 2x1n h MET 266 CO 0.01 0.53 0.04 1.28 1.06 0.00 0.00 176.91 179.83 2x1n n LEU 267 N -3.18 4.65 -4.74 1.22 4.77 -0.77 -3.94 117.00 115.01 2x1n n LEU 267 Ca -0.01 -3.14 -0.41 0.00 -0.03 0.00 0.00 56.01 52.42 2x1n n LEU 267 Cb 0.79 -0.62 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 2x1n n LEU 267 CO 0.42 0.76 1.04 1.57 -1.33 0.00 0.00 177.39 179.85 2x1n n HIS 268 N -0.33 2.68 -0.03 -1.77 -0.00 -1.10 -4.93 115.22 109.74 2x1n n HIS 268 Ca 0.28 0.48 -0.12 0.00 0.46 0.00 0.00 57.72 58.82 2x1n n HIS 268 Cb 1.06 -2.48 -0.07 0.00 -0.12 0.00 0.00 29.99 28.38 2x1n n HIS 268 CO 0.00 0.00 0.00 1.88 0.46 0.00 0.00 176.34 178.68 2x1n h TYR 269 N 2.69 0.20 -2.91 1.57 0.05 -1.91 -3.42 116.97 113.23 2x1n h TYR 269 Ca -0.49 -0.04 -0.57 0.00 0.05 0.00 0.00 58.73 57.69 2x1n h TYR 269 Cb 1.26 -0.05 -0.04 0.00 1.01 0.00 0.00 36.73 38.91 2x1n h TYR 269 CO 0.51 0.44 0.92 0.34 -1.05 0.00 0.00 178.16 179.33 2x1n s ASP 270 N -5.70 6.90 0.56 3.88 -1.08 -1.26 -4.79 116.67 115.17 2x1n s ASP 270 Ca -0.14 1.68 0.24 0.00 -0.52 0.00 0.00 52.55 53.80 2x1n s ASP 270 Cb 0.05 -2.54 1.52 0.00 -1.46 0.00 0.00 42.92 40.49 2x1n s ASP 270 CO 0.70 -0.80 2.15 -0.65 0.52 0.00 0.00 175.17 177.09 2x1n h PRO 271 N 8.40 0.00 -0.07 4.34 0.11 -1.96 -1.62 132.00 141.20 2x1n h PRO 271 Ca -0.27 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.68 2x1n h PRO 271 Cb 1.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 2x1n h PRO 271 CO 0.98 0.00 -0.65 -0.91 -0.21 0.00 0.00 178.00 177.20 2x1n h ASN 272 N 0.00 0.33 0.99 -2.05 2.35 -1.96 -3.18 115.58 112.06 2x1n h ASN 272 Ca 0.05 -0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.60 2x1n h ASN 272 Cb 0.23 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.50 2x1n h ASN 272 CO -0.00 0.89 -0.69 0.11 -1.65 0.00 0.00 177.43 176.09 2x1n h LYS 273 N 0.20 0.00 -6.90 0.81 1.79 -1.72 -3.48 116.57 107.28 2x1n h LYS 273 Ca -0.01 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 57.93 2x1n h LYS 273 Cb 1.18 0.00 0.08 0.00 -1.58 0.00 0.00 32.23 31.91 2x1n h LYS 273 CO 0.10 0.00 0.67 0.50 -1.08 0.00 0.00 179.45 179.64 2x1n s ARG 274 N -3.23 4.28 0.27 3.15 3.52 -0.80 -4.92 118.95 121.22 2x1n s ARG 274 Ca 0.04 2.29 -0.30 0.00 -0.13 0.00 0.00 55.73 57.64 2x1n s ARG 274 Cb 0.12 -3.03 -0.10 0.00 -1.56 0.00 0.00 34.95 30.37 2x1n s ARG 274 CO 0.74 -0.28 1.44 -1.50 -0.81 0.00 0.00 175.30 174.89 2x1n s ILE 275 N -1.14 2.59 0.78 4.11 2.07 -0.44 -5.01 121.20 124.15 2x1n s ILE 275 Ca 0.50 0.51 -0.12 0.00 -1.41 0.00 0.00 60.65 60.13 2x1n s ILE 275 Cb -0.41 -3.32 0.06 0.00 0.13 0.00 0.00 42.46 38.91 2x1n s ILE 275 CO 0.55 0.09 1.13 -0.94 -1.91 0.00 0.00 174.94 173.85 2x1n s SER 276 N 0.24 4.76 0.15 4.50 1.04 -1.26 -4.87 113.70 118.26 2x1n s SER 276 Ca 0.58 1.05 -0.11 0.00 0.48 0.00 0.00 55.95 57.95 2x1n s SER 276 Cb -0.42 -1.72 0.00 0.00 0.10 0.00 0.00 66.02 63.98 2x1n s SER 276 CO 0.46 -1.77 1.55 0.00 0.98 0.00 0.00 173.24 174.46 2x1n h ALA 277 N -0.96 0.66 0.16 5.32 0.00 -1.94 -1.61 119.26 120.89 2x1n h ALA 277 Ca -0.46 -0.38 0.01 0.00 0.00 0.00 0.00 54.91 54.08 2x1n h ALA 277 Cb 1.29 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 2x1n h ALA 277 CO 0.63 0.63 -0.19 0.87 0.00 0.00 0.00 179.25 181.19 2x1n h LYS 278 N 0.81 -0.38 -0.95 0.00 1.57 -1.93 -2.65 116.57 113.04 2x1n h LYS 278 Ca 0.11 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2x1n h LYS 278 Cb 0.75 0.09 -0.05 0.00 0.08 0.00 0.00 32.23 33.10 2x1n h LYS 278 CO 0.06 -0.25 0.59 0.00 -0.57 0.00 0.00 179.45 179.28 2x1n h ALA 279 N 0.39 1.21 -0.33 3.86 0.00 -1.93 -2.38 119.26 120.08 2x1n h ALA 279 Ca 0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2x1n h ALA 279 Cb 0.39 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2x1n h ALA 279 CO -0.07 0.64 0.15 0.00 0.00 0.00 0.00 179.25 179.97 2x1n h ALA 280 N 1.33 1.65 0.00 0.00 0.00 -1.19 -1.87 119.26 119.18 2x1n h ALA 280 Ca 0.34 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 2x1n h ALA 280 Cb -0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2x1n h ALA 280 CO -0.07 0.28 -0.19 -0.07 0.00 0.00 0.00 179.25 179.21 2x1n h LEU 281 N 0.46 0.00 -0.15 0.00 3.38 -1.06 -1.87 115.31 116.08 2x1n h LEU 281 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2x1n h LEU 281 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2x1n h LEU 281 CO -0.02 0.19 -0.02 0.00 0.09 0.00 0.00 178.44 178.68 2x1n n ALA 282 N -2.28 2.65 -1.76 1.53 0.00 -0.71 -4.90 120.51 115.05 2x1n n ALA 282 Ca -0.01 -0.23 -0.40 0.00 0.00 0.00 0.00 53.44 52.80 2x1n n ALA 282 Cb 0.33 -1.44 -0.04 0.00 0.00 0.00 0.00 19.45 18.30 2x1n n ALA 282 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2x1n s HIS 283 N -2.21 3.57 0.56 0.00 5.04 -0.70 -4.89 115.29 116.66 2x1n s HIS 283 Ca 0.39 1.71 0.23 0.00 -1.54 0.00 0.00 55.06 55.85 2x1n s HIS 283 Cb 0.21 -3.25 1.23 0.00 0.04 0.00 0.00 32.58 30.81 2x1n s HIS 283 CO 0.41 -0.49 1.67 -1.35 -2.34 0.00 0.00 174.74 172.63 2x1n h PRO 284 N 3.71 0.00 0.00 2.88 0.11 -1.92 -0.88 132.00 135.90 2x1n h PRO 284 Ca -0.47 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.61 2x1n h PRO 284 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2x1n h PRO 284 CO 0.66 0.00 -0.17 0.35 -0.21 0.00 0.00 178.00 178.64 2x1n h PHE 285 N 0.00 0.00 -0.56 0.65 3.57 -1.90 -2.62 116.94 116.08 2x1n h PHE 285 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2x1n h PHE 285 Cb 0.86 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.60 2x1n h PHE 285 CO 0.00 0.17 0.00 1.19 -2.23 0.00 0.00 178.31 177.44 2x1n n PHE 286 N -4.23 1.41 -0.25 0.41 3.72 -0.33 -4.47 117.46 113.72 2x1n n PHE 286 Ca -0.02 -0.55 -0.04 0.00 -0.05 0.00 0.00 57.45 56.79 2x1n n PHE 286 Cb 0.24 -0.27 0.12 0.00 -0.94 0.00 0.00 39.48 38.63 2x1n n PHE 286 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 2x1n h GLN 287 N 3.59 1.10 -0.74 -1.08 4.15 -1.62 -2.94 115.11 117.57 2x1n h GLN 287 Ca 0.00 -0.18 -0.46 0.00 0.77 0.00 0.00 58.65 58.78 2x1n h GLN 287 Cb 1.40 -0.19 -0.27 0.00 0.21 0.00 0.00 27.48 28.64 2x1n h GLN 287 CO 0.25 0.87 0.17 -0.40 -1.93 0.00 0.00 178.83 177.79 2x1n n ASP 288 N -4.30 4.74 -4.74 -0.69 5.75 -1.26 -5.02 116.55 111.02 2x1n n ASP 288 Ca 0.07 -3.75 -0.41 0.00 -0.01 0.00 0.00 54.79 50.68 2x1n n ASP 288 Cb 0.16 -0.71 -0.03 0.00 -1.03 0.00 0.00 41.12 39.51 2x1n n ASP 288 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2x1n s VAL 289 N -4.01 3.27 0.10 2.12 0.11 -1.11 -5.03 120.40 115.84 2x1n s VAL 289 Ca 0.54 1.05 0.00 0.00 -2.93 0.00 0.00 61.98 60.64 2x1n s VAL 289 Cb 0.45 -3.67 -0.00 0.00 -1.53 0.00 0.00 36.38 31.63 2x1n s VAL 289 CO 0.02 0.16 0.01 0.35 -3.33 0.00 0.00 175.10 172.31 2x1n n THR 290 N 2.60 0.00 -3.28 5.04 -2.24 -1.26 -5.09 114.28 110.05 2x1n n THR 290 Ca 0.06 -0.50 -0.25 0.00 -2.27 0.00 0.00 64.05 61.09 2x1n n THR 290 Cb 0.43 0.13 -0.07 0.00 -2.10 0.00 0.00 70.33 68.72 2x1n n THR 290 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2x1n n LYS 291 N -0.23 1.70 -2.32 -0.78 4.81 -1.26 -4.53 118.16 115.54 2x1n n LYS 291 Ca -0.03 -3.98 -0.33 0.00 -0.87 0.00 0.00 58.31 53.10 2x1n n LYS 291 Cb 0.13 -1.77 -0.02 0.00 0.02 0.00 0.00 35.03 33.39 2x1n n LYS 291 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2x1n s PRO 292 N -1.97 3.66 -0.00 1.64 0.04 -1.26 -4.92 135.00 132.19 2x1n s PRO 292 Ca 0.38 1.19 -0.08 0.00 0.04 0.00 0.00 61.00 62.53 2x1n s PRO 292 Cb 0.18 -2.08 -0.05 0.00 0.04 0.00 0.00 34.50 32.58 2x1n s PRO 292 CO -0.06 -0.53 0.29 0.14 0.04 0.00 0.00 177.00 176.88 2x1n s VAL 293 N -2.34 5.26 0.51 -0.36 -7.23 -1.26 -4.56 120.40 110.41 2x1n s VAL 293 Ca 0.63 0.32 -0.18 0.00 -1.81 0.00 0.00 61.98 60.94 2x1n s VAL 293 Cb -0.14 -3.58 -0.08 0.00 0.56 0.00 0.00 36.38 33.14 2x1n s VAL 293 CO 0.29 0.43 1.01 -2.16 -0.31 0.00 0.00 175.10 174.35 2x1n s PRO 294 N -1.56 3.84 -0.82 4.82 0.04 -1.26 -4.96 135.00 135.08 2x1n s PRO 294 Ca 0.26 1.15 -0.26 0.00 0.04 0.00 0.00 61.00 62.19 2x1n s PRO 294 Cb -0.14 -2.11 0.03 0.00 0.04 0.00 0.00 34.50 32.32 2x1n s PRO 294 CO 0.14 -0.38 1.44 -1.58 0.04 0.00 0.00 177.00 176.66 2x1n s HIS 295 N -2.33 2.26 -2.20 0.56 2.46 -1.26 -5.00 115.29 109.79 2x1n s HIS 295 Ca 0.63 -0.16 0.18 0.00 0.47 0.00 0.00 55.06 56.17 2x1n s HIS 295 Cb -0.13 -4.55 0.14 0.00 -0.13 0.00 0.00 32.58 27.91 2x1n s HIS 295 CO 0.26 -2.04 1.06 1.28 -2.47 0.00 0.00 174.74 172.82