#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n60 h ALA 15 N 0.00 1.15 0.00 2.89 0.00 -2.02 -2.78 119.26 118.49 1n60 h ALA 15 Ca 0.00 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1n60 h ALA 15 Cb 0.00 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1n60 h ALA 15 CO 0.00 0.53 -0.35 0.93 0.00 0.00 0.00 179.25 180.35 1n60 h GLU 16 N 1.21 0.00 0.00 0.00 5.08 -2.07 -3.05 114.58 115.75 1n60 h GLU 16 Ca 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 1n60 h GLU 16 Cb -0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.13 1n60 h GLU 16 CO -0.08 0.35 -0.46 0.87 -1.00 0.00 0.00 179.01 178.69 1n60 h LYS 17 N 0.00 0.00 0.01 2.33 1.57 -2.00 -3.40 116.57 115.08 1n60 h LYS 17 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1n60 h LYS 17 Cb 0.87 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.18 1n60 h LYS 17 CO 0.05 0.00 -0.01 1.25 -0.57 0.00 0.00 179.45 180.17 1n60 h LEU 18 N 0.00 -0.01 -1.61 2.94 5.85 -1.38 -3.34 115.31 117.76 1n60 h LEU 18 Ca 0.00 -0.16 -0.44 0.00 0.84 0.00 0.00 57.88 58.11 1n60 h LEU 18 Cb 0.89 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.94 1n60 h LEU 18 CO 0.00 0.15 -0.82 0.00 -0.34 0.00 0.00 178.44 177.43 1n60 n GLN 19 N -5.02 -4.80 0.00 1.25 6.02 -1.26 -0.68 117.38 112.89 1n60 n GLN 19 Ca -0.08 0.58 0.00 0.00 -0.01 0.00 0.00 57.00 57.50 1n60 n GLN 19 Cb 0.11 -5.16 0.00 0.00 1.02 0.00 0.00 30.24 26.21 1n60 n GLN 19 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1n60 n GLY 20 N -1.65 0.96 3.66 1.08 0.00 -1.26 -4.54 105.19 103.43 1n60 n GLY 20 Ca -0.22 -1.77 -0.45 0.00 0.00 0.00 0.00 46.02 43.58 1n60 n GLY 20 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1n60 n MET 21 N 0.00 1.97 0.00 1.61 2.81 -1.14 -1.74 117.12 120.62 1n60 n MET 21 Ca 0.00 0.70 0.00 0.00 -1.81 0.00 0.00 57.70 56.59 1n60 n MET 21 Cb 0.00 -2.34 0.00 0.00 -0.71 0.00 0.00 33.22 30.17 1n60 n MET 21 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1n60 n GLY 22 N 2.05 2.56 3.79 3.03 0.00 0.16 -5.03 105.19 111.75 1n60 n GLY 22 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 1n60 n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n60 n LYS 24 N -0.28 3.78 -1.91 0.00 5.02 -1.26 -4.30 118.16 119.20 1n60 n LYS 24 Ca 0.06 -2.79 -0.42 0.00 -2.02 0.00 0.00 58.31 53.14 1n60 n LYS 24 Cb 0.51 -2.86 -0.03 0.00 -0.02 0.00 0.00 35.03 32.62 1n60 n LYS 24 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1n60 s ARG 25 N 1.24 4.20 0.53 1.97 3.52 -1.26 -4.94 118.95 124.20 1n60 s ARG 25 Ca 0.57 2.37 -0.20 0.00 -0.13 0.00 0.00 55.73 58.34 1n60 s ARG 25 Cb 0.16 -3.37 -0.06 0.00 -1.56 0.00 0.00 34.95 30.12 1n60 s ARG 25 CO -0.07 -0.68 1.15 0.15 -0.81 0.00 0.00 175.30 175.04 1n60 s LYS 26 N 1.90 3.41 0.06 5.12 -0.14 -1.26 -4.91 119.74 123.92 1n60 s LYS 26 Ca 0.73 1.69 -0.30 0.00 -1.36 0.00 0.00 55.97 56.72 1n60 s LYS 26 Cb -0.42 -2.10 -0.05 0.00 -1.68 0.00 0.00 37.83 33.58 1n60 s LYS 26 CO 0.32 -0.82 0.96 1.03 -0.76 0.00 0.00 175.35 176.08 1n60 s ARG 27 N -3.14 4.63 0.38 1.68 0.52 -1.26 -4.93 118.95 116.84 1n60 s ARG 27 Ca 0.71 1.42 0.15 0.00 -0.52 0.00 0.00 55.73 57.49 1n60 s ARG 27 Cb -0.26 -3.41 0.78 0.00 0.52 0.00 0.00 34.95 32.58 1n60 s ARG 27 CO 0.30 0.11 1.83 -0.39 0.02 0.00 0.00 175.30 177.17 1n60 h VAL 28 N 4.35 1.13 0.00 3.52 -1.51 -1.92 -2.92 116.25 118.90 1n60 h VAL 28 Ca -0.42 -1.27 -0.02 0.00 -1.23 0.00 0.00 66.70 63.75 1n60 h VAL 28 Cb 1.21 1.71 -0.00 0.00 -2.13 0.00 0.00 31.29 32.08 1n60 h VAL 28 CO 0.73 0.35 -0.10 -0.33 -1.23 0.00 0.00 177.57 176.99 1n60 h GLU 29 N 0.00 0.00 0.00 5.19 3.07 -1.92 -3.06 114.58 117.86 1n60 h GLU 29 Ca -0.00 0.00 -0.06 0.00 -0.50 0.00 0.00 59.36 58.80 1n60 h GLU 29 Cb 0.68 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.58 1n60 h GLU 29 CO 0.05 0.10 -0.27 -0.44 -1.40 0.00 0.00 179.01 177.05 1n60 h ASP 30 N 0.00 0.00 -0.08 1.42 5.19 -1.92 -2.34 116.42 118.69 1n60 h ASP 30 Ca -0.00 0.00 0.02 0.00 -0.62 0.00 0.00 57.03 56.43 1n60 h ASP 30 Cb 0.32 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.81 1n60 h ASP 30 CO 0.01 0.27 -0.03 0.40 -3.12 0.00 0.00 179.24 176.78 1n60 h ILE 31 N 0.00 0.90 -0.10 0.35 1.08 -1.72 -0.43 117.51 117.58 1n60 h ILE 31 Ca -0.00 0.00 -0.21 0.00 -0.39 0.00 0.00 64.86 64.25 1n60 h ILE 31 Cb 0.62 0.90 0.01 0.00 -3.07 0.00 0.00 36.82 35.28 1n60 h ILE 31 CO 0.04 0.00 -0.78 0.08 -0.69 0.00 0.00 178.15 176.80 1n60 h ARG 32 N -0.02 0.70 -0.28 2.37 0.11 -1.72 -3.27 114.38 112.27 1n60 h ARG 32 Ca 0.04 -0.62 -0.10 0.00 0.10 0.00 0.00 59.98 59.40 1n60 h ARG 32 Cb 0.08 0.14 -0.01 0.00 1.11 0.00 0.00 29.97 31.29 1n60 h ARG 32 CO -0.09 1.23 -0.23 0.74 0.10 0.00 0.00 179.97 181.71 1n60 h PHE 33 N 0.39 0.58 0.00 4.08 0.04 -1.22 0.66 116.94 121.48 1n60 h PHE 33 Ca -0.07 -0.12 0.00 0.00 2.80 0.00 0.00 57.97 60.58 1n60 h PHE 33 Cb 1.42 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 39.43 1n60 h PHE 33 CO 0.10 0.72 0.00 0.25 -0.60 0.00 0.00 178.31 178.78 1n60 n THR 34 N -4.13 0.86 -0.01 -1.55 -2.24 -0.19 -2.50 114.28 104.52 1n60 n THR 34 Ca -0.00 0.21 0.03 0.00 -2.27 0.00 0.00 64.05 62.02 1n60 n THR 34 Cb 0.40 -0.98 0.07 0.00 -2.10 0.00 0.00 70.33 67.73 1n60 n THR 34 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1n60 n GLN 35 N -1.68 2.17 -1.22 -0.78 6.02 -0.67 -4.98 117.38 116.24 1n60 n GLN 35 Ca 0.04 -1.59 -0.08 0.00 -0.01 0.00 0.00 57.00 55.36 1n60 n GLN 35 Cb 0.21 -1.15 -0.03 0.00 1.02 0.00 0.00 30.24 30.28 1n60 n GLN 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1n60 n GLY 36 N 0.17 0.97 0.98 1.08 0.00 -0.89 -4.91 105.19 102.59 1n60 n GLY 36 Ca 0.06 -0.70 0.08 0.00 0.00 0.00 0.00 46.02 45.46 1n60 n GLY 36 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n60 n LYS 37 N -2.77 3.15 -0.64 1.61 4.76 0.14 -4.93 118.16 119.47 1n60 n LYS 37 Ca -0.08 -2.63 -0.31 0.00 -2.87 0.00 0.00 58.31 52.43 1n60 n LYS 37 Cb 0.25 -1.70 0.18 0.00 -1.84 0.00 0.00 35.03 31.93 1n60 n LYS 37 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1n60 n GLY 38 N 0.12 -1.56 2.77 0.72 0.00 -1.21 -4.79 105.19 101.25 1n60 n GLY 38 Ca 0.19 -0.87 -0.30 0.00 0.00 0.00 0.00 46.02 45.05 1n60 n GLY 38 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1n60 s ASN 39 N -2.30 3.93 0.30 1.61 2.47 -1.26 -5.05 114.94 114.64 1n60 s ASN 39 Ca 0.63 -2.37 0.04 0.00 0.42 0.00 0.00 52.86 51.58 1n60 s ASN 39 Cb -0.21 -1.12 -0.02 0.00 -1.45 0.00 0.00 41.25 38.45 1n60 s ASN 39 CO 0.64 -0.31 0.45 -0.31 -3.72 0.00 0.00 177.10 173.84 1n60 s TYR 40 N 0.66 3.34 0.22 0.43 1.51 -1.26 -0.75 117.35 121.50 1n60 s TYR 40 Ca 0.15 0.00 -0.08 0.00 -1.01 0.00 0.00 57.07 56.13 1n60 s TYR 40 Cb -0.22 -1.81 0.34 0.00 -0.11 0.00 0.00 41.96 40.15 1n60 s TYR 40 CO -0.07 0.18 1.72 0.28 -1.11 0.00 0.00 175.55 176.56 1n60 h VAL 41 N 0.95 0.68 0.00 0.71 2.07 -1.94 0.15 116.25 118.87 1n60 h VAL 41 Ca -0.49 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1n60 h VAL 41 Cb 1.24 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1n60 h VAL 41 CO 0.58 0.06 0.00 -0.67 0.02 0.00 0.00 177.57 177.57 1n60 n ASP 42 N -5.05 0.00 0.07 0.57 2.03 -1.26 -1.25 116.55 111.66 1n60 n ASP 42 Ca 0.10 0.25 0.13 0.00 0.52 0.00 0.00 54.79 55.79 1n60 n ASP 42 Cb 0.34 -0.39 0.47 0.00 -0.72 0.00 0.00 41.12 40.82 1n60 n ASP 42 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1n60 n ASP 43 N -1.39 0.54 -4.73 1.67 8.00 0.51 -4.83 116.55 116.32 1n60 n ASP 43 Ca 0.07 0.56 -0.41 0.00 0.71 0.00 0.00 54.79 55.72 1n60 n ASP 43 Cb 0.18 -0.70 -0.04 0.00 -0.02 0.00 0.00 41.12 40.53 1n60 n ASP 43 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1n60 s VAL 44 N -3.09 4.34 -0.07 2.53 1.01 -0.38 -4.98 120.40 119.75 1n60 s VAL 44 Ca 0.11 1.93 -0.01 0.00 0.00 0.00 0.00 61.98 64.01 1n60 s VAL 44 Cb 0.14 -4.23 0.03 0.00 0.00 0.00 0.00 36.38 32.31 1n60 s VAL 44 CO 0.54 0.29 -0.01 -0.54 0.00 0.00 0.00 175.10 175.38 1n60 s LYS 45 N 0.00 0.70 0.17 2.72 1.02 -1.26 -5.08 119.74 118.00 1n60 s LYS 45 Ca 0.48 0.05 0.10 0.00 0.02 0.00 0.00 55.97 56.63 1n60 s LYS 45 Cb -0.25 -0.99 -0.04 0.00 -0.52 0.00 0.00 37.83 36.03 1n60 s LYS 45 CO 0.31 -0.27 -0.22 -0.51 -0.92 0.00 0.00 175.35 173.74 1n60 s LEU 46 N 1.80 2.41 0.23 3.17 1.43 -1.26 -5.08 118.68 121.38 1n60 s LEU 46 Ca 0.03 -0.83 -0.32 0.00 -1.03 0.00 0.00 54.13 51.98 1n60 s LEU 46 Cb -0.13 -1.01 -0.12 0.00 0.03 0.00 0.00 46.19 44.96 1n60 s LEU 46 CO -0.05 0.06 1.65 -2.65 0.23 0.00 0.00 176.35 175.59 1n60 n PRO 47 N 0.44 2.65 -0.94 1.29 -0.02 -1.26 -1.71 135.00 135.44 1n60 n PRO 47 Ca -0.14 0.95 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 1n60 n PRO 47 Cb 0.56 -2.76 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 1n60 n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n60 n GLY 48 N 3.23 0.64 3.72 -1.23 0.00 -1.26 -4.57 105.19 105.72 1n60 n GLY 48 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1n60 n GLY 48 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1n60 s MET 49 N -0.27 4.24 0.48 1.61 0.00 -0.69 -4.33 119.30 120.34 1n60 s MET 49 Ca 0.00 2.30 0.08 0.00 0.00 0.00 0.00 55.69 58.07 1n60 s MET 49 Cb 0.00 -3.17 0.03 0.00 0.00 0.00 0.00 34.83 31.69 1n60 s MET 49 CO 0.00 -0.55 0.59 -0.51 0.00 0.00 0.00 175.02 174.55 1n60 s LEU 50 N 0.94 3.36 -0.05 4.11 1.43 0.55 -4.91 118.68 124.12 1n60 s LEU 50 Ca 0.68 -0.68 0.03 0.00 -1.03 0.00 0.00 54.13 53.13 1n60 s LEU 50 Cb -0.42 -2.11 0.00 0.00 0.03 0.00 0.00 46.19 43.69 1n60 s LEU 50 CO 0.32 -0.95 -0.14 0.12 0.23 0.00 0.00 176.35 175.93 1n60 s PHE 51 N -2.51 1.54 0.06 0.29 2.19 -0.17 -0.56 117.98 118.83 1n60 s PHE 51 Ca 0.54 -0.49 0.08 0.00 0.33 0.00 0.00 56.93 57.39 1n60 s PHE 51 Cb -0.07 -1.07 -0.03 0.00 -1.31 0.00 0.00 43.02 40.54 1n60 s PHE 51 CO 0.33 -0.21 -0.23 0.20 1.83 0.00 0.00 175.22 177.14 1n60 s GLY 52 N 0.30 1.27 0.28 13.12 0.00 0.41 -0.29 107.32 122.41 1n60 s GLY 52 Ca -0.08 -1.19 -0.15 0.00 0.00 0.00 0.00 44.72 43.29 1n60 s GLY 52 CO 0.03 -1.12 0.59 -0.35 0.00 0.00 0.00 173.10 172.24 1n60 s ASP 53 N -1.38 -0.08 -0.02 1.64 2.15 -0.20 -4.37 116.67 114.41 1n60 s ASP 53 Ca 0.09 -0.87 -0.08 0.00 0.43 0.00 0.00 52.55 52.12 1n60 s ASP 53 Cb -0.09 0.66 -0.05 0.00 -0.30 0.00 0.00 42.92 43.14 1n60 s ASP 53 CO 0.03 -1.27 0.27 -0.36 -0.17 0.00 0.00 175.17 173.67 1n60 s PHE 54 N -3.78 3.61 -0.02 -5.34 0.08 -1.26 -0.63 117.98 110.64 1n60 s PHE 54 Ca 0.19 0.64 -0.30 0.00 0.12 0.00 0.00 56.93 57.58 1n60 s PHE 54 Cb -0.03 -2.03 -0.03 0.00 -0.57 0.00 0.00 43.02 40.36 1n60 s PHE 54 CO 0.09 0.65 0.99 0.08 -0.10 0.00 0.00 175.22 176.93 1n60 s VAL 55 N -1.20 4.83 0.19 -0.44 1.01 0.32 -4.96 120.40 120.16 1n60 s VAL 55 Ca 0.24 2.04 0.11 0.00 0.00 0.00 0.00 61.98 64.37 1n60 s VAL 55 Cb -0.14 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.89 1n60 s VAL 55 CO 0.13 0.13 -0.23 -0.13 0.00 0.00 0.00 175.10 174.99 1n60 s ARG 56 N 1.23 1.55 0.11 2.72 0.52 -1.26 -0.55 118.95 123.27 1n60 s ARG 56 Ca 0.51 -1.52 -0.31 0.00 -0.52 0.00 0.00 55.73 53.90 1n60 s ARG 56 Cb -0.21 -1.86 -0.08 0.00 0.52 0.00 0.00 34.95 33.33 1n60 s ARG 56 CO 0.26 0.40 1.36 0.45 0.02 0.00 0.00 175.30 177.79 1n60 s SER 57 N -2.70 6.86 0.00 0.23 0.15 0.65 -4.81 113.70 114.08 1n60 s SER 57 Ca 0.21 2.28 0.28 0.00 0.70 0.00 0.00 55.95 59.42 1n60 s SER 57 Cb -0.08 -2.59 0.97 0.00 -1.71 0.00 0.00 66.02 62.62 1n60 s SER 57 CO 0.10 -0.63 1.75 -1.54 1.20 0.00 0.00 173.24 174.12 1n60 n SER 58 N 3.93 0.19 -4.57 5.45 3.41 -1.26 -0.15 113.62 120.63 1n60 n SER 58 Ca 0.11 0.24 -0.32 0.00 -0.26 0.00 0.00 58.87 58.64 1n60 n SER 58 Cb 0.43 -0.24 -0.11 0.00 -0.26 0.00 0.00 64.21 64.03 1n60 n SER 58 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1n60 s HIS 59 N -3.00 2.82 0.18 7.33 3.76 -1.26 -4.88 115.29 120.24 1n60 s HIS 59 Ca 0.13 -0.09 0.05 0.00 -0.15 0.00 0.00 55.06 55.01 1n60 s HIS 59 Cb 0.18 -1.58 0.04 0.00 1.11 0.00 0.00 32.58 32.34 1n60 s HIS 59 CO 0.59 0.35 1.42 0.00 -0.85 0.00 0.00 174.74 176.24 1n60 h ALA 60 N 4.52 0.60 -1.52 -1.40 0.00 -1.81 -3.22 119.26 116.42 1n60 h ALA 60 Ca -0.48 -0.72 -0.02 0.00 0.00 0.00 0.00 54.91 53.68 1n60 h ALA 60 Cb 1.16 -0.10 -0.25 0.00 0.00 0.00 0.00 17.79 18.61 1n60 h ALA 60 CO 0.52 0.95 -0.35 -1.58 0.00 0.00 0.00 179.25 178.79 1n60 s HIS 61 N -3.20 -1.22 -0.05 0.00 2.46 -1.26 -2.11 115.29 109.91 1n60 s HIS 61 Ca -0.02 1.38 -0.29 0.00 0.47 0.00 0.00 55.06 56.60 1n60 s HIS 61 Cb 0.11 0.34 0.10 0.00 -0.13 0.00 0.00 32.58 33.00 1n60 s HIS 61 CO 0.81 -0.78 0.82 0.00 -2.47 0.00 0.00 174.74 173.12 1n60 s ALA 62 N 2.72 -1.81 0.38 1.58 0.00 -0.92 -0.80 121.76 122.90 1n60 s ALA 62 Ca 0.15 1.24 -0.23 0.00 0.00 0.00 0.00 51.96 53.12 1n60 s ALA 62 Cb -0.15 -0.04 -0.10 0.00 0.00 0.00 0.00 23.12 22.83 1n60 s ALA 62 CO -0.18 -0.46 0.95 1.03 0.00 0.00 0.00 175.76 177.09 1n60 s ARG 63 N -1.88 4.38 -0.39 0.00 0.52 0.94 -0.74 118.95 121.78 1n60 s ARG 63 Ca -0.03 1.21 -0.19 0.00 -0.52 0.00 0.00 55.73 56.20 1n60 s ARG 63 Cb -0.00 -2.45 0.01 0.00 0.52 0.00 0.00 34.95 33.02 1n60 s ARG 63 CO 0.00 0.10 0.56 0.42 0.02 0.00 0.00 175.30 176.41 1n60 s ILE 64 N -1.93 4.95 -0.07 1.52 1.01 0.81 -1.48 121.20 126.01 1n60 s ILE 64 Ca 0.57 0.20 -0.22 0.00 0.00 0.00 0.00 60.65 61.20 1n60 s ILE 64 Cb -0.13 -4.07 -0.30 0.00 0.01 0.00 0.00 42.46 37.97 1n60 s ILE 64 CO 0.18 -0.39 0.82 0.11 0.00 0.00 0.00 174.94 175.67 1n60 h LYS 65 N 8.64 0.25 -2.90 2.79 1.79 -0.97 -3.46 116.57 122.70 1n60 h LYS 65 Ca -0.27 -0.42 -0.08 0.00 -2.18 0.00 0.00 60.65 57.70 1n60 h LYS 65 Cb 1.11 0.16 -0.17 0.00 -1.58 0.00 0.00 32.23 31.75 1n60 h LYS 65 CO 0.82 1.20 -0.08 0.45 -1.08 0.00 0.00 179.45 180.77 1n60 s SER 66 N -6.88 -0.33 -0.18 0.86 0.15 -1.18 -4.99 113.70 101.15 1n60 s SER 66 Ca -0.15 0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.60 1n60 s SER 66 Cb 0.01 0.43 0.04 0.00 -1.71 0.00 0.00 66.02 64.79 1n60 s SER 66 CO 0.80 -0.64 -0.08 -0.63 1.20 0.00 0.00 173.24 173.88 1n60 s ILE 67 N -2.22 1.38 -0.44 6.45 1.01 -1.26 -1.38 121.20 124.74 1n60 s ILE 67 Ca -0.07 -0.79 -0.16 0.00 0.00 0.00 0.00 60.65 59.63 1n60 s ILE 67 Cb -0.01 -1.49 0.04 0.00 0.01 0.00 0.00 42.46 41.01 1n60 s ILE 67 CO -0.00 0.18 0.41 -0.62 0.00 0.00 0.00 174.94 174.90 1n60 s ASP 68 N 1.52 6.16 0.00 3.58 -1.08 0.36 -4.90 116.67 122.30 1n60 s ASP 68 Ca 0.00 -0.96 0.16 0.00 -0.52 0.00 0.00 52.55 51.24 1n60 s ASP 68 Cb -0.15 -2.20 0.45 0.00 -1.46 0.00 0.00 42.92 39.56 1n60 s ASP 68 CO -0.08 -0.60 1.37 0.35 0.52 0.00 0.00 175.17 176.73 1n60 n THR 69 N 5.31 0.94 -0.16 1.71 -2.24 -1.26 -2.14 114.28 116.43 1n60 n THR 69 Ca -0.10 -0.97 -0.10 0.00 -2.27 0.00 0.00 64.05 60.61 1n60 n THR 69 Cb 0.46 0.55 -0.00 0.00 -2.10 0.00 0.00 70.33 69.24 1n60 n THR 69 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1n60 h SER 70 N 3.12 0.82 -0.57 3.42 4.64 -1.90 -0.94 113.55 122.14 1n60 h SER 70 Ca 0.00 -0.31 -0.08 0.00 -0.47 0.00 0.00 61.79 60.92 1n60 h SER 70 Cb 0.85 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.69 1n60 h SER 70 CO 0.00 0.93 0.03 0.11 -0.87 0.00 0.00 176.83 177.03 1n60 h LYS 71 N 0.69 0.99 -0.49 4.77 1.57 -1.83 -1.49 116.57 120.77 1n60 h LYS 71 Ca 0.13 -0.30 -0.02 0.00 -1.87 0.00 0.00 60.65 58.59 1n60 h LYS 71 Cb 0.52 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 1n60 h LYS 71 CO 0.03 0.97 0.24 0.00 -0.57 0.00 0.00 179.45 180.12 1n60 h ALA 72 N 0.98 0.63 -0.21 3.86 0.00 -1.72 -2.31 119.26 120.49 1n60 h ALA 72 Ca 0.16 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1n60 h ALA 72 Cb 0.51 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1n60 h ALA 72 CO 0.02 0.19 -0.03 0.87 0.00 0.00 0.00 179.25 180.30 1n60 h LYS 73 N 0.65 0.31 0.00 0.00 1.57 -0.94 -1.96 116.57 116.20 1n60 h LYS 73 Ca 0.17 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1n60 h LYS 73 Cb 0.11 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1n60 h LYS 73 CO -0.02 0.36 0.00 0.00 -0.57 0.00 0.00 179.45 179.22 1n60 n ALA 74 N -2.49 2.06 -2.07 3.86 0.00 -0.58 -4.77 120.51 116.51 1n60 n ALA 74 Ca 0.00 -0.02 -0.41 0.00 0.00 0.00 0.00 53.44 53.01 1n60 n ALA 74 Cb 0.21 -1.42 -0.03 0.00 0.00 0.00 0.00 19.45 18.21 1n60 n ALA 74 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1n60 s LEU 75 N -3.99 4.44 0.33 0.00 2.96 -0.74 -4.94 118.68 116.75 1n60 s LEU 75 Ca 0.09 2.23 -0.29 0.00 -0.22 0.00 0.00 54.13 55.95 1n60 s LEU 75 Cb 0.13 -3.61 -0.12 0.00 0.50 0.00 0.00 46.19 43.10 1n60 s LEU 75 CO 0.49 -0.39 1.51 -2.65 -1.32 0.00 0.00 176.35 173.99 1n60 n PRO 76 N 2.60 2.59 -0.30 0.98 -0.02 -1.26 -2.20 135.00 137.38 1n60 n PRO 76 Ca 0.05 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 1n60 n PRO 76 Cb 0.45 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 1n60 n PRO 76 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n60 n GLY 77 N 1.29 0.80 3.72 -1.23 0.00 -1.26 -4.98 105.19 103.54 1n60 n GLY 77 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 1n60 n GLY 77 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n60 s VAL 78 N -2.70 5.32 -0.09 1.61 1.01 -0.94 -0.50 120.40 124.11 1n60 s VAL 78 Ca 0.00 0.49 0.13 0.00 0.00 0.00 0.00 61.98 62.60 1n60 s VAL 78 Cb 0.00 -3.61 -0.19 0.00 0.00 0.00 0.00 36.38 32.58 1n60 s VAL 78 CO 0.00 0.38 0.15 0.49 0.00 0.00 0.00 175.10 176.12 1n60 n PHE 79 N 3.68 0.00 -3.52 5.22 3.01 0.13 -4.92 117.46 121.05 1n60 n PHE 79 Ca -0.12 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.17 1n60 n PHE 79 Cb 0.52 -0.53 -0.06 0.00 -0.01 0.00 0.00 39.48 39.40 1n60 n PHE 79 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1n60 s ALA 80 N -2.58 -1.79 -0.26 4.37 0.00 -1.02 -4.99 121.76 115.49 1n60 s ALA 80 Ca -0.06 1.31 -0.02 0.00 0.00 0.00 0.00 51.96 53.19 1n60 s ALA 80 Cb 0.06 -0.05 0.08 0.00 0.00 0.00 0.00 23.12 23.21 1n60 s ALA 80 CO 0.57 -0.39 0.08 0.08 0.00 0.00 0.00 175.76 176.10 1n60 s VAL 81 N -1.35 0.57 0.18 0.00 1.01 -1.26 -0.67 120.40 118.87 1n60 s VAL 81 Ca -0.09 -0.94 -0.19 0.00 0.00 0.00 0.00 61.98 60.76 1n60 s VAL 81 Cb -0.00 -1.29 -0.08 0.00 0.00 0.00 0.00 36.38 35.01 1n60 s VAL 81 CO 0.07 -0.49 0.66 -0.76 0.00 0.00 0.00 175.10 174.58 1n60 s LEU 82 N 1.80 4.39 0.38 3.92 1.43 0.20 -4.89 118.68 125.91 1n60 s LEU 82 Ca 0.05 1.34 0.04 0.00 -1.03 0.00 0.00 54.13 54.52 1n60 s LEU 82 Cb -0.17 -3.38 -0.03 0.00 0.03 0.00 0.00 46.19 42.64 1n60 s LEU 82 CO -0.20 0.10 0.11 0.42 0.23 0.00 0.00 176.35 177.01 1n60 s THR 83 N -1.41 0.73 0.51 5.49 -4.23 -1.26 -0.63 115.64 114.84 1n60 s THR 83 Ca 0.39 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 59.11 1n60 s THR 83 Cb -0.17 -2.47 0.36 0.00 1.34 0.00 0.00 72.50 71.56 1n60 s THR 83 CO 0.21 0.00 2.02 0.00 -0.54 0.00 0.00 174.62 176.31 1n60 h ALA 84 N 1.90 2.31 -0.56 3.99 0.00 -1.77 -0.36 119.26 124.78 1n60 h ALA 84 Ca -0.37 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.58 1n60 h ALA 84 Cb 1.26 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.03 1n60 h ALA 84 CO 0.60 -0.43 0.37 0.00 0.00 0.00 0.00 179.25 179.79 1n60 h ALA 85 N 1.78 1.82 0.00 0.00 0.00 -1.94 -0.13 119.26 120.79 1n60 h ALA 85 Ca 0.21 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1n60 h ALA 85 Cb 0.73 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1n60 h ALA 85 CO -0.02 0.10 -0.42 -0.44 0.00 0.00 0.00 179.25 178.47 1n60 h ASP 86 N 0.55 0.00 0.40 0.00 3.32 -1.45 -3.34 116.42 115.90 1n60 h ASP 86 Ca 0.24 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 56.98 1n60 h ASP 86 Cb 0.24 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.74 1n60 h ASP 86 CO -0.07 0.42 -1.79 0.18 -1.72 0.00 0.00 179.24 176.26 1n60 n LEU 87 N -3.40 1.24 -0.17 1.55 4.77 -0.31 -4.42 117.00 116.26 1n60 n LEU 87 Ca 0.01 0.36 -0.01 0.00 -0.03 0.00 0.00 56.01 56.34 1n60 n LEU 87 Cb 0.59 -0.10 0.08 0.00 -2.33 0.00 0.00 43.42 41.65 1n60 n LEU 87 CO 0.38 0.49 0.86 0.11 -1.33 0.00 0.00 177.39 177.90 1n60 h LYS 88 N 0.02 0.14 -0.03 3.23 1.57 -1.21 -0.85 116.57 119.44 1n60 h LYS 88 Ca -0.32 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.46 1n60 h LYS 88 Cb 2.02 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 34.30 1n60 h LYS 88 CO 0.08 0.09 0.04 -1.35 -0.57 0.00 0.00 179.45 177.74 1n60 h PRO 89 N 0.15 0.00 -0.29 3.15 0.11 -1.77 -0.58 132.00 132.77 1n60 h PRO 89 Ca 0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.39 1n60 h PRO 89 Cb 0.42 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.53 1n60 h PRO 89 CO -0.43 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.64 1n60 n LEU 90 N -3.66 2.61 -3.52 2.35 4.77 -0.45 -4.93 117.00 114.17 1n60 n LEU 90 Ca -0.02 -1.11 -0.25 0.00 -0.03 0.00 0.00 56.01 54.59 1n60 n LEU 90 Cb 0.12 -0.18 0.06 0.00 -2.33 0.00 0.00 43.42 41.09 1n60 n LEU 90 CO 0.25 0.56 0.16 -3.20 -1.33 0.00 0.00 177.39 173.83 1n60 n ASN 91 N 0.94 -5.99 -0.08 -1.43 4.05 -0.23 -4.91 115.26 107.62 1n60 n ASN 91 Ca 0.18 -0.52 0.05 0.00 0.45 0.00 0.00 54.58 54.74 1n60 n ASN 91 Cb 0.47 -4.75 0.08 0.00 1.23 0.00 0.00 39.78 36.81 1n60 n ASN 91 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1n60 n LEU 92 N -4.71 2.25 0.18 1.20 4.77 -0.48 -4.64 117.00 115.57 1n60 n LEU 92 Ca -0.01 -2.57 0.13 0.00 -0.03 0.00 0.00 56.01 53.53 1n60 n LEU 92 Cb 0.57 -0.24 0.39 0.00 -2.33 0.00 0.00 43.42 41.81 1n60 n LEU 92 CO 0.63 0.62 0.88 1.12 -1.33 0.00 0.00 177.39 179.30 1n60 h HIS 93 N 0.10 0.00 -3.23 -1.77 2.07 -1.86 -3.43 115.15 107.03 1n60 h HIS 93 Ca 0.00 0.00 -0.51 0.00 -2.85 0.00 0.00 60.37 57.01 1n60 h HIS 93 Cb 0.78 0.00 -0.17 0.00 2.57 0.00 0.00 27.41 30.59 1n60 h HIS 93 CO 0.02 0.00 -0.77 0.71 -3.07 0.00 0.00 177.93 174.82 1n60 s TYR 94 N -3.28 1.79 0.07 6.12 2.02 -1.26 -0.57 117.35 122.24 1n60 s TYR 94 Ca 0.07 -0.49 0.07 0.00 -0.37 0.00 0.00 57.07 56.35 1n60 s TYR 94 Cb 0.09 -0.88 -0.03 0.00 -0.40 0.00 0.00 41.96 40.73 1n60 s TYR 94 CO 0.58 0.33 -0.18 0.00 -1.57 0.00 0.00 175.55 174.72 1n60 s MET 95 N -2.93 1.04 0.58 -0.62 0.23 -0.03 -4.84 119.30 112.72 1n60 s MET 95 Ca 0.17 -0.99 -0.18 0.00 -1.03 0.00 0.00 55.69 53.65 1n60 s MET 95 Cb -0.05 -1.16 -0.04 0.00 -1.53 0.00 0.00 34.83 32.06 1n60 s MET 95 CO 0.07 0.27 1.12 -1.25 -2.03 0.00 0.00 175.02 173.20 1n60 s PRO 96 N -1.61 3.17 0.37 3.16 0.04 -1.26 -0.77 135.00 138.11 1n60 s PRO 96 Ca 0.03 1.53 0.08 0.00 0.04 0.00 0.00 61.00 62.68 1n60 s PRO 96 Cb -0.09 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 1n60 s PRO 96 CO 0.03 -0.98 0.16 0.95 0.04 0.00 0.00 177.00 177.20 1n60 s THR 97 N -1.98 2.70 0.40 1.26 -4.23 -0.19 -4.79 115.64 108.82 1n60 s THR 97 Ca 0.71 -1.69 0.36 0.00 -1.18 0.00 0.00 61.69 59.89 1n60 s THR 97 Cb -0.23 -2.97 0.39 0.00 1.34 0.00 0.00 72.50 71.03 1n60 s THR 97 CO 0.32 -0.10 2.15 -0.07 -0.54 0.00 0.00 174.62 176.38 1n60 h LEU 98 N 1.48 0.00 -0.74 4.79 3.38 -1.84 -1.88 115.31 120.50 1n60 h LEU 98 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1n60 h LEU 98 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1n60 h LEU 98 CO 0.65 0.03 0.00 0.00 0.09 0.00 0.00 178.44 179.22 1n60 n ALA 99 N -2.14 2.59 -0.93 1.53 0.00 -1.24 -4.65 120.51 115.67 1n60 n ALA 99 Ca -0.01 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.03 1n60 n ALA 99 Cb 0.20 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.42 1n60 n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n60 n GLY 100 N 1.11 0.50 0.00 0.00 0.00 -0.71 -5.00 105.19 101.09 1n60 n GLY 100 Ca 0.19 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1n60 n GLY 100 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1n60 n ASP 101 N 0.56 0.11 -4.25 1.61 -0.08 -1.26 -4.90 116.55 108.33 1n60 n ASP 101 Ca 0.00 -0.34 -0.16 0.00 -1.51 0.00 0.00 54.79 52.78 1n60 n ASP 101 Cb 0.00 0.00 -0.10 0.00 2.34 0.00 0.00 41.12 43.36 1n60 n ASP 101 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 1n60 s VAL 102 N 1.59 1.28 -0.01 5.18 -7.23 -1.26 -1.02 120.40 118.93 1n60 s VAL 102 Ca 0.00 -1.93 0.03 0.00 -1.81 0.00 0.00 61.98 58.27 1n60 s VAL 102 Cb 0.00 -1.73 -0.01 0.00 0.56 0.00 0.00 36.38 35.20 1n60 s VAL 102 CO 0.00 -0.60 -0.11 -1.58 -0.31 0.00 0.00 175.10 172.50 1n60 s GLN 103 N -3.30 0.85 0.16 4.82 0.74 0.05 -4.59 119.66 118.40 1n60 s GLN 103 Ca 0.14 -0.40 -0.31 0.00 0.05 0.00 0.00 55.36 54.84 1n60 s GLN 103 Cb -0.01 -0.82 -0.09 0.00 1.10 0.00 0.00 33.01 33.19 1n60 s GLN 103 CO 0.02 0.22 1.47 0.00 -0.55 0.00 0.00 175.29 176.46 1n60 s ALA 104 N -0.28 3.68 -0.13 1.58 0.00 -1.26 -0.85 121.76 124.49 1n60 s ALA 104 Ca 0.04 1.25 -0.13 0.00 0.00 0.00 0.00 51.96 53.12 1n60 s ALA 104 Cb -0.04 -3.57 -0.11 0.00 0.00 0.00 0.00 23.12 19.40 1n60 s ALA 104 CO -0.00 -0.70 0.24 0.28 0.00 0.00 0.00 175.76 175.58 1n60 h VAL 105 N 4.05 0.67 -4.30 0.00 2.07 -1.10 -3.45 116.25 114.18 1n60 h VAL 105 Ca -0.43 -1.56 -0.57 0.00 0.82 0.00 0.00 66.70 64.96 1n60 h VAL 105 Cb 1.21 1.32 -0.30 0.00 -1.52 0.00 0.00 31.29 32.00 1n60 h VAL 105 CO 0.87 0.23 -0.84 -0.76 0.02 0.00 0.00 177.57 177.09 1n60 s LEU 106 N -8.32 2.02 0.25 2.57 1.43 -1.24 -4.69 118.68 110.70 1n60 s LEU 106 Ca -0.11 -0.35 -0.30 0.00 -1.03 0.00 0.00 54.13 52.34 1n60 s LEU 106 Cb -0.00 -0.99 -0.10 0.00 0.03 0.00 0.00 46.19 45.13 1n60 s LEU 106 CO 0.31 0.22 1.46 0.00 0.23 0.00 0.00 176.35 178.58 1n60 s ALA 107 N -0.38 3.65 0.00 4.21 0.00 -0.45 -4.54 121.76 124.25 1n60 s ALA 107 Ca 0.06 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.38 1n60 s ALA 107 Cb -0.08 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.47 1n60 s ALA 107 CO -0.00 -0.78 0.00 -3.47 0.00 0.00 0.00 175.76 171.51 1n60 n ASP 108 N 2.32 0.00 0.01 0.00 2.03 -1.26 -4.38 116.55 115.27 1n60 n ASP 108 Ca 0.07 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.27 1n60 n ASP 108 Cb 0.40 0.00 -0.14 0.00 -0.72 0.00 0.00 41.12 40.66 1n60 n ASP 108 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1n60 h GLU 109 N 0.00 0.07 -3.60 -0.67 5.08 -1.92 -3.44 114.58 110.10 1n60 h GLU 109 Ca 0.00 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.16 1n60 h GLU 109 Cb 0.00 0.05 -0.14 0.00 0.50 0.00 0.00 28.75 29.16 1n60 h GLU 109 CO 0.00 0.79 -0.26 -1.59 -1.00 0.00 0.00 179.01 176.95 1n60 s LYS 110 N -2.62 0.91 0.03 2.33 -2.85 -1.26 -0.13 119.74 116.14 1n60 s LYS 110 Ca -0.06 -0.81 0.00 0.00 -1.00 0.00 0.00 55.97 54.10 1n60 s LYS 110 Cb 0.08 0.38 -0.04 0.00 -2.06 0.00 0.00 37.83 36.19 1n60 s LYS 110 CO 0.82 -0.31 0.13 0.14 0.10 0.00 0.00 175.35 176.23 1n60 s VAL 111 N -3.64 4.95 0.00 1.79 -7.23 0.08 -4.77 120.40 111.58 1n60 s VAL 111 Ca 0.03 -0.44 0.00 0.00 -1.81 0.00 0.00 61.98 59.75 1n60 s VAL 111 Cb 0.03 -3.33 0.00 0.00 0.56 0.00 0.00 36.38 33.64 1n60 s VAL 111 CO -0.10 0.25 0.11 0.18 -0.31 0.00 0.00 175.10 175.23 1n60 n LEU 112 N 0.78 0.23 -3.66 1.32 4.77 -1.24 -2.16 117.00 117.03 1n60 n LEU 112 Ca -0.10 -0.46 -0.15 0.00 -0.03 0.00 0.00 56.01 55.27 1n60 n LEU 112 Cb 0.52 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.54 1n60 n LEU 112 CO 0.43 0.06 0.19 0.72 -1.33 0.00 0.00 177.39 177.47 1n60 s PHE 113 N -0.47 -0.38 0.21 -1.77 -0.71 -0.90 -3.57 117.98 110.39 1n60 s PHE 113 Ca 0.00 0.62 -0.31 0.00 -1.04 0.00 0.00 56.93 56.20 1n60 s PHE 113 Cb 0.00 0.23 -0.10 0.00 -1.21 0.00 0.00 43.02 41.94 1n60 s PHE 113 CO 0.00 -0.48 1.46 -1.14 -1.34 0.00 0.00 175.22 173.72 1n60 s GLN 114 N -1.28 4.27 0.00 1.99 0.74 -1.22 -1.66 119.66 122.50 1n60 s GLN 114 Ca -0.13 2.27 0.00 0.00 0.05 0.00 0.00 55.36 57.56 1n60 s GLN 114 Cb -0.03 -3.14 0.00 0.00 1.10 0.00 0.00 33.01 30.94 1n60 s GLN 114 CO 0.07 -0.46 0.00 0.09 -0.55 0.00 0.00 175.29 174.44 1n60 n ASN 115 N 2.96 -1.78 -4.74 6.67 5.03 0.79 -4.87 115.26 119.32 1n60 n ASN 115 Ca 0.09 0.00 -0.37 0.00 0.87 0.00 0.00 54.58 55.17 1n60 n ASN 115 Cb 0.40 -0.30 0.05 0.00 -1.02 0.00 0.00 39.78 38.91 1n60 n ASN 115 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 1n60 s GLN 116 N -0.17 2.93 0.09 3.52 0.74 -0.67 -4.28 119.66 121.83 1n60 s GLN 116 Ca 0.00 2.07 -0.31 0.00 0.05 0.00 0.00 55.36 57.17 1n60 s GLN 116 Cb 0.00 -2.06 -0.07 0.00 1.10 0.00 0.00 33.01 31.98 1n60 s GLN 116 CO 0.00 -1.30 1.37 -1.21 -0.55 0.00 0.00 175.29 173.60 1n60 s GLU 117 N -3.14 4.33 -0.04 1.67 8.01 -1.26 -0.25 118.70 128.01 1n60 s GLU 117 Ca 0.76 2.02 0.00 0.00 0.01 0.00 0.00 54.97 57.77 1n60 s GLU 117 Cb -0.37 -3.32 -0.03 0.00 -4.31 0.00 0.00 34.13 26.11 1n60 s GLU 117 CO 0.41 -0.44 -0.04 0.28 0.01 0.00 0.00 175.26 175.48 1n60 n VAL 118 N 4.07 0.25 -3.79 2.63 0.31 0.29 -1.35 118.33 120.74 1n60 n VAL 118 Ca 0.11 -0.10 -0.11 0.00 -0.01 0.00 0.00 64.34 64.24 1n60 n VAL 118 Cb 0.43 -0.67 -0.08 0.00 -0.91 0.00 0.00 33.84 32.61 1n60 n VAL 118 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1n60 s ALA 119 N -2.09 -0.56 -0.23 3.52 0.00 -1.07 -4.27 121.76 117.06 1n60 s ALA 119 Ca -0.06 -0.06 0.02 0.00 0.00 0.00 0.00 51.96 51.87 1n60 s ALA 119 Cb 0.02 0.26 0.05 0.00 0.00 0.00 0.00 23.12 23.44 1n60 s ALA 119 CO 0.10 -0.36 -0.14 0.12 0.00 0.00 0.00 175.76 175.48 1n60 s PHE 120 N -2.31 3.11 -0.13 0.00 5.36 0.20 -0.52 117.98 123.70 1n60 s PHE 120 Ca -0.07 -2.09 -0.13 0.00 -0.96 0.00 0.00 56.93 53.67 1n60 s PHE 120 Cb -0.02 -1.93 -0.05 0.00 -0.34 0.00 0.00 43.02 40.68 1n60 s PHE 120 CO -0.02 -0.85 0.30 0.08 -1.46 0.00 0.00 175.22 173.26 1n60 s VAL 121 N 1.17 5.28 -0.12 3.12 1.01 0.20 -0.63 120.40 130.43 1n60 s VAL 121 Ca -0.04 0.57 0.03 0.00 0.00 0.00 0.00 61.98 62.53 1n60 s VAL 121 Cb -0.18 -3.62 0.01 0.00 0.00 0.00 0.00 36.38 32.59 1n60 s VAL 121 CO -0.08 0.45 -0.21 -0.69 0.00 0.00 0.00 175.10 174.58 1n60 s VAL 122 N 0.00 1.91 0.26 2.92 1.01 0.15 -1.03 120.40 125.63 1n60 s VAL 122 Ca 0.18 -0.91 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 1n60 s VAL 122 Cb -0.14 -1.69 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 1n60 s VAL 122 CO 0.06 0.52 0.27 0.00 0.00 0.00 0.00 175.10 175.95 1n60 s ALA 123 N 0.69 1.04 0.34 5.51 0.00 0.60 0.17 121.76 130.10 1n60 s ALA 123 Ca -0.11 -1.62 0.06 0.00 0.00 0.00 0.00 51.96 50.29 1n60 s ALA 123 Cb -0.16 1.32 0.73 0.00 0.00 0.00 0.00 23.12 25.02 1n60 s ALA 123 CO 0.02 -0.68 1.88 -0.22 0.00 0.00 0.00 175.76 176.76 1n60 h LYS 124 N 2.38 0.76 -3.31 0.00 3.64 -1.06 -0.41 116.57 118.57 1n60 h LYS 124 Ca -0.31 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 58.98 1n60 h LYS 124 Cb 1.24 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 32.85 1n60 h LYS 124 CO 0.44 0.50 0.12 0.16 -2.27 0.00 0.00 179.45 178.41 1n60 s ASP 125 N -5.84 0.08 0.50 4.20 1.47 -1.26 -4.40 116.67 111.43 1n60 s ASP 125 Ca -0.10 -1.04 0.29 0.00 1.18 0.00 0.00 52.55 52.88 1n60 s ASP 125 Cb 0.21 0.75 1.26 0.00 -0.34 0.00 0.00 42.92 44.80 1n60 s ASP 125 CO 0.79 -1.45 1.96 0.08 0.68 0.00 0.00 175.17 177.23 1n60 h ARG 126 N 2.06 0.00 -0.04 2.11 0.11 -1.87 -1.04 114.38 115.71 1n60 h ARG 126 Ca -0.27 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.79 1n60 h ARG 126 Cb 1.25 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.33 1n60 h ARG 126 CO 0.35 0.12 -0.04 1.88 0.10 0.00 0.00 179.97 182.38 1n60 h TYR 127 N 0.00 0.12 -0.52 4.08 -1.99 -1.98 -1.75 116.97 114.92 1n60 h TYR 127 Ca -0.00 -0.04 -0.10 0.00 2.00 0.00 0.00 58.73 60.60 1n60 h TYR 127 Cb 0.54 -0.03 -0.02 0.00 2.00 0.00 0.00 36.73 39.23 1n60 h TYR 127 CO 0.00 0.56 -0.05 0.28 -0.00 0.00 0.00 178.16 178.95 1n60 h VAL 128 N -0.36 1.26 -0.61 -2.88 2.07 -1.93 -1.17 116.25 112.63 1n60 h VAL 128 Ca 0.01 -1.16 0.01 0.00 0.82 0.00 0.00 66.70 66.38 1n60 h VAL 128 Cb 0.54 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 1n60 h VAL 128 CO 0.01 0.41 0.40 0.00 0.02 0.00 0.00 177.57 178.41 1n60 h ALA 129 N 1.09 0.78 -0.65 1.67 0.00 -1.20 0.30 119.26 121.25 1n60 h ALA 129 Ca 0.15 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1n60 h ALA 129 Cb 0.57 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1n60 h ALA 129 CO 0.03 0.18 0.24 0.00 0.00 0.00 0.00 179.25 179.71 1n60 h ALA 130 N 1.24 1.20 -0.60 0.00 0.00 -0.73 -0.87 119.26 119.49 1n60 h ALA 130 Ca 0.23 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1n60 h ALA 130 Cb -0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 1n60 h ALA 130 CO -0.06 0.57 0.27 -0.44 0.00 0.00 0.00 179.25 179.59 1n60 h ASP 131 N 0.94 0.81 0.16 0.00 3.32 -0.55 -2.92 116.42 118.17 1n60 h ASP 131 Ca 0.22 -0.15 -0.11 0.00 0.02 0.00 0.00 57.03 57.01 1n60 h ASP 131 Cb 0.21 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1n60 h ASP 131 CO -0.02 0.73 -0.39 0.00 -1.72 0.00 0.00 179.24 177.85 1n60 h ALA 132 N 1.11 1.08 -0.94 3.45 0.00 -0.51 -2.48 119.26 120.96 1n60 h ALA 132 Ca 0.21 -0.40 0.02 0.00 0.00 0.00 0.00 54.91 54.74 1n60 h ALA 132 Cb 0.16 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1n60 h ALA 132 CO -0.02 0.59 0.62 0.82 0.00 0.00 0.00 179.25 181.25 1n60 h ILE 133 N 0.26 1.19 0.00 0.00 2.04 -1.00 -1.18 117.51 118.83 1n60 h ILE 133 Ca 0.03 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.47 1n60 h ILE 133 Cb 0.80 -0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.74 1n60 h ILE 133 CO 0.06 0.22 0.00 -0.33 0.00 0.00 0.00 178.15 178.11 1n60 h GLU 134 N 1.23 0.00 0.00 2.37 4.39 -1.27 -2.66 114.58 118.64 1n60 h GLU 134 Ca 0.36 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.06 1n60 h GLU 134 Cb -0.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.59 1n60 h GLU 134 CO -0.10 0.00 -0.63 1.28 -1.16 0.00 0.00 179.01 178.39 1n60 n LEU 135 N -2.59 0.59 -4.74 1.33 4.77 -0.45 -4.84 117.00 111.06 1n60 n LEU 135 Ca 0.00 0.08 -0.41 0.00 -0.03 0.00 0.00 56.01 55.65 1n60 n LEU 135 Cb 0.18 -0.20 -0.04 0.00 -2.33 0.00 0.00 43.42 41.03 1n60 n LEU 135 CO 0.19 0.05 0.79 -0.69 -1.33 0.00 0.00 177.39 176.40 1n60 s VAL 136 N -3.09 3.93 -0.17 4.08 1.01 -1.00 -4.40 120.40 120.75 1n60 s VAL 136 Ca 0.08 1.65 0.00 0.00 0.00 0.00 0.00 61.98 63.71 1n60 s VAL 136 Cb 0.15 -4.05 0.01 0.00 0.00 0.00 0.00 36.38 32.49 1n60 s VAL 136 CO 0.72 0.27 -0.16 -1.61 0.00 0.00 0.00 175.10 174.33 1n60 s GLU 137 N -0.28 3.14 -0.11 2.72 2.02 -0.91 -4.98 118.70 120.30 1n60 s GLU 137 Ca 0.49 -0.77 0.01 0.00 0.02 0.00 0.00 54.97 54.72 1n60 s GLU 137 Cb -0.29 -2.64 -0.02 0.00 0.10 0.00 0.00 34.13 31.29 1n60 s GLU 137 CO 0.34 -0.09 -0.14 0.08 0.02 0.00 0.00 175.26 175.47 1n60 s VAL 138 N 1.07 2.99 -0.15 2.63 1.01 -1.26 -0.49 120.40 126.20 1n60 s VAL 138 Ca -0.01 -0.70 -0.05 0.00 0.00 0.00 0.00 61.98 61.23 1n60 s VAL 138 Cb -0.14 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 33.97 1n60 s VAL 138 CO -0.05 0.54 0.01 -1.81 0.00 0.00 0.00 175.10 173.79 1n60 s ASP 139 N 0.07 5.18 0.15 3.32 1.11 -0.48 -4.99 116.67 121.04 1n60 s ASP 139 Ca -0.06 0.00 0.11 0.00 0.18 0.00 0.00 52.55 52.78 1n60 s ASP 139 Cb -0.15 -1.79 -0.04 0.00 1.07 0.00 0.00 42.92 42.01 1n60 s ASP 139 CO 0.05 0.21 -0.24 -0.31 1.18 0.00 0.00 175.17 176.06 1n60 s TYR 140 N 0.11 2.36 -0.25 4.23 1.51 -1.26 -0.32 117.35 123.73 1n60 s TYR 140 Ca 0.02 -0.35 0.02 0.00 -1.01 0.00 0.00 57.07 55.75 1n60 s TYR 140 Cb -0.13 -1.22 0.06 0.00 -0.11 0.00 0.00 41.96 40.56 1n60 s TYR 140 CO 0.02 0.42 -0.08 -1.21 -1.11 0.00 0.00 175.55 173.58 1n60 s GLU 141 N -2.34 1.97 0.46 -0.62 2.02 -0.55 -4.89 118.70 114.76 1n60 s GLU 141 Ca 0.18 -1.24 -0.24 0.00 0.02 0.00 0.00 54.97 53.68 1n60 s GLU 141 Cb -0.09 -2.79 -0.08 0.00 0.10 0.00 0.00 34.13 31.27 1n60 s GLU 141 CO 0.08 -0.60 1.33 -2.30 0.02 0.00 0.00 175.26 173.80 1n60 n PRO 142 N 4.51 1.96 -4.43 0.39 -0.02 -1.26 -0.04 135.00 136.10 1n60 n PRO 142 Ca -0.12 0.70 -0.23 0.00 -2.02 0.00 0.00 63.50 61.83 1n60 n PRO 142 Cb 0.43 -2.50 -0.10 0.00 -0.02 0.00 0.00 33.50 31.30 1n60 n PRO 142 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1n60 s LEU 143 N -2.39 2.56 0.21 2.45 1.43 0.02 -4.79 118.68 118.17 1n60 s LEU 143 Ca 0.64 -1.00 -0.31 0.00 -1.03 0.00 0.00 54.13 52.43 1n60 s LEU 143 Cb -0.47 -1.01 -0.11 0.00 0.03 0.00 0.00 46.19 44.64 1n60 s LEU 143 CO 0.56 0.01 1.57 -2.84 0.23 0.00 0.00 176.35 175.87 1n60 s PRO 144 N -3.40 4.20 -0.00 1.29 0.02 -1.26 -4.66 135.00 131.19 1n60 s PRO 144 Ca 0.27 2.42 -0.20 0.00 0.02 0.00 0.00 61.00 63.50 1n60 s PRO 144 Cb -0.05 -3.11 -0.05 0.00 0.02 0.00 0.00 34.50 31.31 1n60 s PRO 144 CO 0.12 -0.59 0.57 0.08 -0.33 0.00 0.00 177.00 176.85 1n60 s VAL 145 N 0.74 4.91 -0.25 3.83 1.01 -1.26 -4.82 120.40 124.55 1n60 s VAL 145 Ca 0.67 1.19 -0.02 0.00 0.00 0.00 0.00 61.98 63.83 1n60 s VAL 145 Cb -0.45 -3.90 0.03 0.00 0.00 0.00 0.00 36.38 32.05 1n60 s VAL 145 CO 0.36 0.44 -0.05 -0.22 0.00 0.00 0.00 175.10 175.64 1n60 s LEU 146 N -0.32 3.28 0.00 3.92 2.96 -1.26 -4.93 118.68 122.33 1n60 s LEU 146 Ca 0.30 -0.88 0.00 0.00 -0.22 0.00 0.00 54.13 53.33 1n60 s LEU 146 Cb -0.18 -1.69 0.00 0.00 0.50 0.00 0.00 46.19 44.82 1n60 s LEU 146 CO 0.17 -0.14 0.00 1.33 -1.32 0.00 0.00 176.35 176.39 1n60 n VAL 147 N 4.68 0.00 -2.98 1.68 0.24 -1.26 -0.56 118.33 120.14 1n60 n VAL 147 Ca -0.16 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.71 1n60 n VAL 147 Cb 0.47 0.01 -0.05 0.00 -1.47 0.00 0.00 33.84 32.80 1n60 n VAL 147 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1n60 s ASP 148 N -1.98 6.32 0.56 -1.34 -1.08 -1.26 -4.92 116.67 112.97 1n60 s ASP 148 Ca 0.00 -0.46 0.27 0.00 -0.52 0.00 0.00 52.55 51.84 1n60 s ASP 148 Cb 0.00 -2.37 1.63 0.00 -1.46 0.00 0.00 42.92 40.72 1n60 s ASP 148 CO 0.00 -1.03 2.19 1.55 0.52 0.00 0.00 175.17 178.40 1n60 h PRO 149 N 9.11 0.00 0.00 4.34 0.13 -1.94 0.37 132.00 144.02 1n60 h PRO 149 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1n60 h PRO 149 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1n60 h PRO 149 CO 1.01 0.04 0.00 0.74 -0.23 0.00 0.00 178.00 179.56 1n60 h PHE 150 N 0.00 0.00 -0.17 1.56 0.04 -1.99 -2.02 116.94 114.36 1n60 h PHE 150 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1n60 h PHE 150 Cb 0.10 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.25 1n60 h PHE 150 CO 0.00 0.00 0.00 1.63 -0.60 0.00 0.00 178.31 179.34 1n60 n LYS 151 N -2.74 1.62 0.26 1.51 5.02 0.11 -4.65 118.16 119.29 1n60 n LYS 151 Ca -0.01 -1.64 0.13 0.00 -2.02 0.00 0.00 58.31 54.77 1n60 n LYS 151 Cb 0.13 -1.29 0.68 0.00 -0.02 0.00 0.00 35.03 34.54 1n60 n LYS 151 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1n60 h ALA 152 N 2.65 1.17 -0.25 7.82 0.00 -1.22 -2.60 119.26 126.82 1n60 h ALA 152 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1n60 h ALA 152 Cb 0.65 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1n60 h ALA 152 CO 0.00 0.16 0.00 -1.33 0.00 0.00 0.00 179.25 178.08 1n60 n MET 153 N -3.49 2.82 -1.65 0.00 2.81 -1.26 -4.55 117.12 111.81 1n60 n MET 153 Ca -0.01 -2.71 -0.32 0.00 -1.81 0.00 0.00 57.70 52.85 1n60 n MET 153 Cb 0.28 -1.74 0.05 0.00 -0.71 0.00 0.00 33.22 31.10 1n60 n MET 153 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1n60 s GLU 154 N -2.57 2.83 0.53 0.03 2.02 -0.98 -4.78 118.70 115.77 1n60 s GLU 154 Ca 0.39 1.17 0.23 0.00 0.02 0.00 0.00 54.97 56.78 1n60 s GLU 154 Cb 0.31 -1.97 1.45 0.00 0.10 0.00 0.00 34.13 34.01 1n60 s GLU 154 CO 0.09 -1.20 2.13 -1.35 0.02 0.00 0.00 175.26 174.95 1n60 h PRO 155 N -0.36 0.00 -0.61 0.39 0.11 -1.90 -1.25 132.00 128.37 1n60 h PRO 155 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1n60 h PRO 155 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1n60 h PRO 155 CO 0.55 0.07 0.00 -0.40 -0.21 0.00 0.00 178.00 178.01 1n60 n ASP 156 N -4.03 4.40 -4.76 -2.05 5.75 -1.26 -4.76 116.55 109.84 1n60 n ASP 156 Ca -0.03 -2.37 -0.41 0.00 -0.01 0.00 0.00 54.79 51.98 1n60 n ASP 156 Cb 0.16 -0.53 -0.03 0.00 -1.03 0.00 0.00 41.12 39.69 1n60 n ASP 156 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1n60 s ALA 157 N -1.68 3.49 0.59 2.12 0.00 -0.47 -4.94 121.76 120.86 1n60 s ALA 157 Ca 0.48 1.18 -0.20 0.00 0.00 0.00 0.00 51.96 53.41 1n60 s ALA 157 Cb 0.30 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.93 1n60 s ALA 157 CO 0.24 -0.54 1.31 -0.35 0.00 0.00 0.00 175.76 176.42 1n60 n PRO 158 N 1.14 1.42 -2.64 0.00 -0.04 -1.26 -4.91 135.00 128.71 1n60 n PRO 158 Ca 0.01 0.53 -0.42 0.00 -0.04 0.00 0.00 63.50 63.58 1n60 n PRO 158 Cb 0.42 -2.54 -0.03 0.00 -0.04 0.00 0.00 33.50 31.32 1n60 n PRO 158 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1n60 s LEU 159 N -3.71 3.53 -0.10 1.53 2.96 -1.26 -4.84 118.68 116.79 1n60 s LEU 159 Ca 0.76 -0.32 -0.05 0.00 -0.22 0.00 0.00 54.13 54.30 1n60 s LEU 159 Cb -0.40 -2.77 -0.04 0.00 0.50 0.00 0.00 46.19 43.47 1n60 s LEU 159 CO 0.45 -1.59 0.16 -0.07 -1.32 0.00 0.00 176.35 173.99 1n60 h LEU 160 N 12.19 -0.04 -6.85 -0.68 4.07 -1.90 -3.40 115.31 118.69 1n60 h LEU 160 Ca -0.27 -0.13 -0.78 0.00 0.08 0.00 0.00 57.88 56.79 1n60 h LEU 160 Cb 1.06 0.01 -0.21 0.00 1.08 0.00 0.00 40.66 42.60 1n60 h LEU 160 CO 1.21 0.51 1.37 0.54 -1.08 0.00 0.00 178.44 180.99 1n60 n ARG 161 N -4.79 3.90 0.30 1.13 5.12 -1.26 -4.74 116.66 116.33 1n60 n ARG 161 Ca -0.02 -4.02 0.17 0.00 -1.93 0.00 0.00 57.85 52.05 1n60 n ARG 161 Cb 0.08 -2.75 0.99 0.00 -1.16 0.00 0.00 32.46 29.62 1n60 n ARG 161 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 1n60 h GLU 162 N 5.86 0.00 0.00 5.56 5.08 -1.80 0.11 114.58 129.39 1n60 h GLU 162 Ca 0.30 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 1n60 h GLU 162 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1n60 h GLU 162 CO 1.43 0.00 0.00 0.38 -1.00 0.00 0.00 179.01 179.82 1n60 h ASP 163 N 0.00 0.00 0.00 1.42 2.03 -1.99 -3.37 116.42 114.51 1n60 h ASP 163 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1n60 h ASP 163 Cb 0.03 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.53 1n60 h ASP 163 CO -0.00 0.00 -0.21 2.30 -1.03 0.00 0.00 179.24 180.30 1n60 n ILE 164 N -3.06 0.00 -4.69 4.15 -5.35 -0.86 -5.07 119.36 104.48 1n60 n ILE 164 Ca 0.02 -0.09 -0.26 0.00 -0.27 0.00 0.00 62.75 62.15 1n60 n ILE 164 Cb 0.39 0.56 -0.14 0.00 -1.74 0.00 0.00 39.64 38.70 1n60 n ILE 164 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1n60 s LYS 165 N -0.60 1.43 0.36 6.28 -0.14 -0.03 -5.14 119.74 121.90 1n60 s LYS 165 Ca 0.00 -0.92 0.04 0.00 -1.36 0.00 0.00 55.97 53.73 1n60 s LYS 165 Cb 0.00 -1.53 -0.01 0.00 -1.68 0.00 0.00 37.83 34.62 1n60 s LYS 165 CO 0.00 0.39 0.53 -0.51 -0.76 0.00 0.00 175.35 175.00 1n60 s ASP 166 N -1.10 5.97 0.18 2.83 -0.00 -1.26 -4.36 116.67 118.93 1n60 s ASP 166 Ca 0.08 0.01 -0.33 0.00 -0.00 0.00 0.00 52.55 52.31 1n60 s ASP 166 Cb -0.09 -1.41 -0.13 0.00 -0.00 0.00 0.00 42.92 41.29 1n60 s ASP 166 CO 0.01 -0.48 1.66 1.17 -0.00 0.00 0.00 175.17 177.53 1n60 n LYS 167 N -1.77 2.47 -3.32 8.23 4.81 -1.26 -4.49 118.16 122.84 1n60 n LYS 167 Ca -0.01 0.89 -0.08 0.00 -0.87 0.00 0.00 58.31 58.24 1n60 n LYS 167 Cb 0.58 -2.70 -0.07 0.00 0.02 0.00 0.00 35.03 32.86 1n60 n LYS 167 CO 0.00 0.00 0.00 1.41 1.17 0.00 0.00 177.40 179.98 1n60 s MET 168 N 1.10 0.39 0.00 1.64 1.75 -1.26 -4.93 119.30 117.98 1n60 s MET 168 Ca 0.77 0.39 0.24 0.00 -1.25 0.00 0.00 55.69 55.84 1n60 s MET 168 Cb -0.59 -0.34 0.29 0.00 2.84 0.00 0.00 34.83 37.03 1n60 s MET 168 CO 0.35 -0.81 1.27 0.25 -0.65 0.00 0.00 175.02 175.43 1n60 n THR 169 N 5.36 0.00 -3.33 10.11 -2.24 -1.26 -1.52 114.28 121.41 1n60 n THR 169 Ca -0.02 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1n60 n THR 169 Cb 0.50 0.76 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 1n60 n THR 169 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n60 n GLY 170 N 1.42 5.87 0.33 3.38 0.00 -1.26 -3.54 105.19 111.39 1n60 n GLY 170 Ca 0.09 -1.84 0.03 0.00 0.00 0.00 0.00 46.02 44.30 1n60 n GLY 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n60 n ALA 171 N -3.00 2.31 -0.57 4.61 0.00 -1.26 -2.99 120.51 119.60 1n60 n ALA 171 Ca 0.00 -0.81 0.06 0.00 0.00 0.00 0.00 53.44 52.69 1n60 n ALA 171 Cb 0.00 -0.25 0.15 0.00 0.00 0.00 0.00 19.45 19.35 1n60 n ALA 171 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1n60 n HIS 172 N 0.26 0.42 -2.08 0.00 8.25 -1.26 -4.90 115.22 115.91 1n60 n HIS 172 Ca 0.05 -0.72 -0.19 0.00 -0.26 0.00 0.00 57.72 56.61 1n60 n HIS 172 Cb 0.26 -0.14 0.12 0.00 1.12 0.00 0.00 29.99 31.34 1n60 n HIS 172 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1n60 n GLY 173 N -0.40 -0.38 0.03 -1.41 0.00 -1.26 -4.96 105.19 96.80 1n60 n GLY 173 Ca 0.13 -1.85 0.13 0.00 0.00 0.00 0.00 46.02 44.43 1n60 n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n60 n ALA 174 N -3.28 2.21 -2.40 4.61 0.00 -1.26 -4.64 120.51 115.76 1n60 n ALA 174 Ca -0.14 -0.07 -0.21 0.00 0.00 0.00 0.00 53.44 53.02 1n60 n ALA 174 Cb 0.42 -1.44 -0.10 0.00 0.00 0.00 0.00 19.45 18.33 1n60 n ALA 174 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1n60 s ARG 175 N -3.03 1.41 1.00 0.00 0.52 -1.26 -5.15 118.95 112.44 1n60 s ARG 175 Ca 0.12 -1.60 -0.12 0.00 -0.52 0.00 0.00 55.73 53.61 1n60 s ARG 175 Cb 0.16 -1.34 0.19 0.00 0.52 0.00 0.00 34.95 34.49 1n60 s ARG 175 CO 0.51 0.24 1.08 0.15 0.02 0.00 0.00 175.30 177.30 1n60 s LYS 176 N -3.43 0.37 0.34 3.54 1.02 -1.26 -4.81 119.74 115.51 1n60 s LYS 176 Ca 0.23 0.70 -0.25 0.00 0.02 0.00 0.00 55.97 56.66 1n60 s LYS 176 Cb -0.03 -1.72 -0.14 0.00 -0.52 0.00 0.00 37.83 35.43 1n60 s LYS 176 CO 0.09 -2.81 0.71 1.58 -0.92 0.00 0.00 175.35 173.99 1n60 n HIS 177 N -4.26 0.13 0.27 3.18 -0.00 -1.16 -4.77 115.22 108.62 1n60 n HIS 177 Ca 0.05 0.70 0.15 0.00 -0.00 0.00 0.00 57.72 58.63 1n60 n HIS 177 Cb 0.56 -2.08 0.87 0.00 -0.00 0.00 0.00 29.99 29.34 1n60 n HIS 177 CO 0.00 0.00 0.00 1.12 -0.00 0.00 0.00 176.34 177.46 1n60 h HIS 178 N 1.25 0.00 -0.19 1.57 2.07 -1.50 -0.04 115.15 118.32 1n60 h HIS 178 Ca -0.38 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.14 1n60 h HIS 178 Cb 1.39 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.37 1n60 h HIS 178 CO 0.41 0.00 0.00 0.09 -3.07 0.00 0.00 177.93 175.36 1n60 n ASN 179 N -3.92 2.29 -4.64 3.10 3.02 -1.26 -4.75 115.26 109.10 1n60 n ASN 179 Ca -0.02 -1.79 -0.40 0.00 -0.03 0.00 0.00 54.58 52.34 1n60 n ASN 179 Cb 0.13 -0.12 -0.07 0.00 -0.61 0.00 0.00 39.78 39.11 1n60 n ASN 179 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 1n60 s HIS 180 N -1.77 3.31 -0.14 3.10 2.46 -0.03 -0.90 115.29 121.33 1n60 s HIS 180 Ca 0.34 0.71 -0.15 0.00 0.47 0.00 0.00 55.06 56.44 1n60 s HIS 180 Cb 0.20 -2.72 -0.12 0.00 -0.13 0.00 0.00 32.58 29.81 1n60 s HIS 180 CO 0.29 -0.22 0.27 0.82 -2.47 0.00 0.00 174.74 173.43 1n60 h ILE 181 N 5.29 0.76 -2.83 0.89 2.04 -1.00 -3.44 117.51 119.22 1n60 h ILE 181 Ca -0.30 -1.65 -0.04 0.00 1.00 0.00 0.00 64.86 63.87 1n60 h ILE 181 Cb 1.14 1.52 -0.14 0.00 -0.74 0.00 0.00 36.82 38.60 1n60 h ILE 181 CO 0.73 0.26 0.14 0.72 0.00 0.00 0.00 178.15 180.00 1n60 s PHE 182 N -2.01 -0.49 -0.09 1.37 -0.12 -1.20 -4.97 117.98 110.45 1n60 s PHE 182 Ca -0.13 0.44 0.03 0.00 -0.05 0.00 0.00 56.93 57.22 1n60 s PHE 182 Cb 0.00 0.45 0.01 0.00 -0.63 0.00 0.00 43.02 42.85 1n60 s PHE 182 CO 0.36 -0.75 -0.19 0.50 -0.05 0.00 0.00 175.22 175.09 1n60 s ARG 183 N -3.05 2.54 -0.03 1.99 3.52 -1.26 -1.34 118.95 121.32 1n60 s ARG 183 Ca -0.02 -0.70 0.02 0.00 -0.13 0.00 0.00 55.73 54.90 1n60 s ARG 183 Cb -0.00 -1.99 0.01 0.00 -1.56 0.00 0.00 34.95 31.40 1n60 s ARG 183 CO -0.07 0.09 -0.07 -0.46 -0.81 0.00 0.00 175.30 173.98 1n60 s TRP 184 N 0.55 0.87 0.06 5.12 -0.00 -0.09 -4.98 118.94 120.46 1n60 s TRP 184 Ca -0.15 -0.23 0.01 0.00 -0.00 0.00 0.00 56.10 55.73 1n60 s TRP 184 Cb -0.17 -0.66 -0.03 0.00 -0.00 0.00 0.00 33.47 32.61 1n60 s TRP 184 CO 0.05 -0.13 -0.06 -1.21 -0.00 0.00 0.00 176.95 175.61 1n60 s GLU 185 N 0.41 0.59 -0.01 5.86 2.02 -1.26 -0.42 118.70 125.88 1n60 s GLU 185 Ca -0.06 -0.96 -0.26 0.00 0.02 0.00 0.00 54.97 53.70 1n60 s GLU 185 Cb -0.10 -0.13 0.06 0.00 0.10 0.00 0.00 34.13 34.06 1n60 s GLU 185 CO 0.01 -0.01 0.58 -1.50 0.02 0.00 0.00 175.26 174.36 1n60 s ILE 186 N -2.40 0.02 0.00 -1.63 2.07 -0.11 -5.00 121.20 114.15 1n60 s ILE 186 Ca -0.02 -0.13 0.00 0.00 -1.41 0.00 0.00 60.65 59.08 1n60 s ILE 186 Cb -0.03 -0.93 0.00 0.00 0.13 0.00 0.00 42.46 41.63 1n60 s ILE 186 CO -0.03 -0.07 0.00 0.61 -1.91 0.00 0.00 174.94 173.54 1n60 n GLY 187 N 0.79 -2.81 3.34 1.50 0.00 -1.26 -0.81 105.19 105.93 1n60 n GLY 187 Ca -0.19 -2.13 -0.46 0.00 0.00 0.00 0.00 46.02 43.24 1n60 n GLY 187 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n60 s ASP 188 N -1.51 6.35 0.09 1.61 -1.08 -0.45 -4.91 116.67 116.78 1n60 s ASP 188 Ca 0.00 -1.91 -0.19 0.00 -0.52 0.00 0.00 52.55 49.92 1n60 s ASP 188 Cb 0.00 -2.25 -0.08 0.00 -1.46 0.00 0.00 42.92 39.13 1n60 s ASP 188 CO 0.00 -0.88 1.59 0.50 0.52 0.00 0.00 175.17 176.90 1n60 h LYS 189 N 8.71 0.37 -0.45 4.34 3.64 -1.90 -0.87 116.57 130.41 1n60 h LYS 189 Ca -0.17 -0.09 -0.04 0.00 -1.27 0.00 0.00 60.65 59.09 1n60 h LYS 189 Cb 1.08 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.83 1n60 h LYS 189 CO 0.99 0.47 0.14 1.49 -2.27 0.00 0.00 179.45 180.27 1n60 h GLU 190 N 0.21 0.70 -0.43 1.90 4.81 -1.97 0.16 114.58 119.96 1n60 h GLU 190 Ca 0.08 -0.15 -0.09 0.00 -0.13 0.00 0.00 59.36 59.06 1n60 h GLU 190 Cb 0.26 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1n60 h GLU 190 CO -0.00 0.68 -0.07 0.78 -0.73 0.00 0.00 179.01 179.67 1n60 h GLY 191 N 0.59 0.88 0.89 1.92 0.00 -1.96 -0.59 103.07 104.80 1n60 h GLY 191 Ca 0.15 -0.70 -0.01 0.00 0.00 0.00 0.00 47.33 46.77 1n60 h GLY 191 CO -0.00 0.64 0.06 -0.84 0.00 0.00 0.00 176.54 176.39 1n60 h THR 192 N 0.64 1.14 -0.83 4.70 2.02 -0.88 -1.52 112.91 118.18 1n60 h THR 192 Ca 0.11 -0.40 -0.00 0.00 0.77 0.00 0.00 66.41 66.89 1n60 h THR 192 Cb 0.60 1.17 -0.04 0.00 -1.74 0.00 0.00 68.15 68.14 1n60 h THR 192 CO 0.04 0.12 0.50 0.44 0.37 0.00 0.00 175.52 176.99 1n60 h ASP 193 N 0.06 1.00 -0.87 4.18 3.32 -0.54 -1.13 116.42 122.45 1n60 h ASP 193 Ca 0.04 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 1n60 h ASP 193 Cb 0.15 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.40 1n60 h ASP 193 CO -0.00 0.77 0.51 0.00 -1.72 0.00 0.00 179.24 178.79 1n60 h ALA 194 N 1.27 1.11 -0.57 3.45 0.00 -0.88 -0.50 119.26 123.14 1n60 h ALA 194 Ca 0.30 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 1n60 h ALA 194 Cb -0.05 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.37 1n60 h ALA 194 CO -0.06 0.58 0.09 1.15 0.00 0.00 0.00 179.25 181.02 1n60 h THR 195 N 1.20 1.26 0.00 0.00 2.02 -0.68 -2.77 112.91 113.93 1n60 h THR 195 Ca 0.31 -0.97 -0.07 0.00 0.77 0.00 0.00 66.41 66.44 1n60 h THR 195 Cb -0.02 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 1n60 h THR 195 CO -0.06 0.36 -0.35 -0.26 0.37 0.00 0.00 175.52 175.58 1n60 h PHE 196 N 0.84 0.00 0.00 3.16 -1.00 -0.85 0.16 116.94 119.25 1n60 h PHE 196 Ca 0.17 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.93 1n60 h PHE 196 Cb 0.41 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.97 1n60 h PHE 196 CO 0.03 0.35 -0.12 0.00 -1.61 0.00 0.00 178.31 176.97 1n60 h ALA 197 N 1.65 1.09 0.00 2.45 0.00 -0.80 -3.29 119.26 120.35 1n60 h ALA 197 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1n60 h ALA 197 Cb 0.66 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1n60 h ALA 197 CO 0.05 0.14 0.00 1.63 0.00 0.00 0.00 179.25 181.07 1n60 n LYS 198 N -3.36 4.00 -1.93 0.00 5.02 -0.98 -5.06 118.16 115.86 1n60 n LYS 198 Ca -0.01 -0.17 -0.37 0.00 -2.02 0.00 0.00 58.31 55.74 1n60 n LYS 198 Cb 0.31 -0.66 0.03 0.00 -0.02 0.00 0.00 35.03 34.69 1n60 n LYS 198 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1n60 s ALA 199 N -0.62 2.70 0.29 7.82 0.00 0.01 -4.90 121.76 127.06 1n60 s ALA 199 Ca 0.00 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.12 1n60 s ALA 199 Cb 0.00 -3.50 0.43 0.00 0.00 0.00 0.00 23.12 20.05 1n60 s ALA 199 CO 0.00 -1.22 1.80 0.93 0.00 0.00 0.00 175.76 177.27 1n60 h GLU 200 N 1.27 0.68 -4.86 0.00 5.08 -1.89 -3.43 114.58 111.43 1n60 h GLU 200 Ca -0.51 -0.17 -0.48 0.00 -1.00 0.00 0.00 59.36 57.20 1n60 h GLU 200 Cb 1.30 -0.09 -0.31 0.00 0.50 0.00 0.00 28.75 30.15 1n60 h GLU 200 CO 0.57 0.71 -0.81 0.08 -1.00 0.00 0.00 179.01 178.56 1n60 s VAL 201 N -4.96 1.02 -0.11 3.13 1.01 -0.44 -4.93 120.40 115.13 1n60 s VAL 201 Ca -0.09 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 61.40 1n60 s VAL 201 Cb 0.15 -0.90 0.02 0.00 0.00 0.00 0.00 36.38 35.66 1n60 s VAL 201 CO 0.79 0.31 -0.10 -0.69 0.00 0.00 0.00 175.10 175.41 1n60 s VAL 202 N 0.14 1.15 -0.25 2.92 1.01 -1.26 -0.99 120.40 123.12 1n60 s VAL 202 Ca -0.03 -0.39 0.01 0.00 0.00 0.00 0.00 61.98 61.56 1n60 s VAL 202 Cb -0.10 -1.12 0.04 0.00 0.00 0.00 0.00 36.38 35.20 1n60 s VAL 202 CO 0.01 0.38 -0.10 -0.55 0.00 0.00 0.00 175.10 174.84 1n60 s SER 203 N 1.45 4.22 -0.04 3.32 0.15 0.13 -4.99 113.70 117.93 1n60 s SER 203 Ca 0.01 -1.11 0.04 0.00 0.70 0.00 0.00 55.95 55.59 1n60 s SER 203 Cb -0.13 -1.59 -0.00 0.00 -1.71 0.00 0.00 66.02 62.59 1n60 s SER 203 CO -0.06 -0.15 -0.17 -0.75 1.20 0.00 0.00 173.24 173.31 1n60 s LYS 204 N 1.21 1.76 0.10 5.44 2.20 -1.26 -1.03 119.74 128.16 1n60 s LYS 204 Ca -0.04 -0.60 -0.11 0.00 -0.36 0.00 0.00 55.97 54.87 1n60 s LYS 204 Cb -0.18 -1.53 0.01 0.00 -1.51 0.00 0.00 37.83 34.62 1n60 s LYS 204 CO -0.06 0.24 0.26 -0.51 -0.36 0.00 0.00 175.35 174.92 1n60 s ASP 205 N 0.05 0.00 -0.30 1.43 1.01 -0.60 -5.00 116.67 113.26 1n60 s ASP 205 Ca -0.04 -0.54 -0.04 0.00 0.71 0.00 0.00 52.55 52.64 1n60 s ASP 205 Cb -0.11 0.38 0.03 0.00 1.01 0.00 0.00 42.92 44.23 1n60 s ASP 205 CO 0.02 -0.77 0.03 -0.32 0.21 0.00 0.00 175.17 174.35 1n60 s MET 206 N -3.82 2.70 -0.26 8.23 1.75 -1.26 -0.61 119.30 126.03 1n60 s MET 206 Ca 0.04 -1.10 -0.10 0.00 -1.25 0.00 0.00 55.69 53.28 1n60 s MET 206 Cb 0.04 -3.25 -0.04 0.00 2.84 0.00 0.00 34.83 34.41 1n60 s MET 206 CO -0.11 -0.55 0.15 -0.06 -0.65 0.00 0.00 175.02 173.80 1n60 s PHE 207 N 1.36 3.19 -0.19 4.11 0.08 -0.01 -4.88 117.98 121.64 1n60 s PHE 207 Ca -0.02 -0.02 -0.14 0.00 0.12 0.00 0.00 56.93 56.88 1n60 s PHE 207 Cb -0.18 -2.32 -0.04 0.00 -0.57 0.00 0.00 43.02 39.90 1n60 s PHE 207 CO -0.00 -0.18 0.30 0.99 -0.10 0.00 0.00 175.22 176.23 1n60 s THR 208 N 1.60 5.29 -0.53 0.64 2.01 -1.26 -0.35 115.64 123.04 1n60 s THR 208 Ca 0.07 0.53 -0.16 0.00 0.31 0.00 0.00 61.69 62.43 1n60 s THR 208 Cb -0.15 -3.64 0.12 0.00 0.01 0.00 0.00 72.50 68.84 1n60 s THR 208 CO 0.08 0.34 0.50 -0.47 -0.69 0.00 0.00 174.62 174.38 1n60 s TYR 209 N 0.81 3.22 0.70 4.92 6.14 0.47 -4.46 117.35 129.15 1n60 s TYR 209 Ca 0.16 -1.19 -0.14 0.00 0.64 0.00 0.00 57.07 56.54 1n60 s TYR 209 Cb -0.13 -3.71 0.02 0.00 0.42 0.00 0.00 41.96 38.56 1n60 s TYR 209 CO 0.05 -1.01 1.12 -3.38 0.64 0.00 0.00 175.55 172.97 1n60 s HIS 210 N 1.72 2.50 0.14 4.97 -3.43 -1.26 -0.78 115.29 119.14 1n60 s HIS 210 Ca 0.04 1.57 -0.31 0.00 -0.80 0.00 0.00 55.06 55.56 1n60 s HIS 210 Cb -0.28 -3.19 -0.09 0.00 -1.43 0.00 0.00 32.58 27.58 1n60 s HIS 210 CO 0.04 -1.87 1.55 0.50 -2.00 0.00 0.00 174.74 172.97 1n60 s ARG 211 N -4.23 4.23 0.00 -0.38 3.52 -1.26 -3.83 118.95 117.01 1n60 s ARG 211 Ca 0.67 2.31 0.00 0.00 -0.13 0.00 0.00 55.73 58.58 1n60 s ARG 211 Cb -0.21 -3.25 0.00 0.00 -1.56 0.00 0.00 34.95 29.93 1n60 s ARG 211 CO 0.45 -0.60 0.00 1.33 -0.81 0.00 0.00 175.30 175.67 1n60 n VAL 212 N 4.11 0.00 -3.72 7.11 0.24 -0.41 -1.47 118.33 124.19 1n60 n VAL 212 Ca 0.14 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.30 1n60 n VAL 212 Cb 0.39 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.67 1n60 n VAL 212 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1n60 s HIS 213 N -1.63 -0.45 0.21 6.34 2.46 -1.26 -1.06 115.29 119.89 1n60 s HIS 213 Ca 0.00 1.05 0.28 0.00 0.47 0.00 0.00 55.06 56.86 1n60 s HIS 213 Cb 0.00 0.17 1.21 0.00 -0.13 0.00 0.00 32.58 33.83 1n60 s HIS 213 CO 0.00 -0.27 1.94 -1.00 -2.47 0.00 0.00 174.74 172.94 1n60 h PRO 214 N 5.14 0.00 -7.00 2.88 0.13 -1.86 -3.47 132.00 127.82 1n60 h PRO 214 Ca -0.27 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.32 1n60 h PRO 214 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1n60 h PRO 214 CO 0.26 0.13 -0.92 0.45 -0.23 0.00 0.00 178.00 177.70 1n60 n SER 215 N -3.35 -3.69 -4.74 1.44 2.88 -1.26 -4.89 113.62 100.01 1n60 n SER 215 Ca -0.00 -1.15 -0.37 0.00 -1.33 0.00 0.00 58.87 56.02 1n60 n SER 215 Cb 0.34 -1.41 0.05 0.00 -0.75 0.00 0.00 64.21 62.44 1n60 n SER 215 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1n60 s PRO 216 N -7.05 2.85 0.33 -1.46 0.04 -1.26 -4.89 135.00 123.56 1n60 s PRO 216 Ca 0.41 1.99 0.04 0.00 0.04 0.00 0.00 61.00 63.48 1n60 s PRO 216 Cb -0.23 -1.96 0.59 0.00 0.04 0.00 0.00 34.50 32.94 1n60 s PRO 216 CO 0.87 -1.35 1.89 1.25 0.04 0.00 0.00 177.00 179.70 1n60 h LEU 217 N 0.88 0.54 -9.30 -3.56 5.85 -1.86 -3.36 115.31 104.49 1n60 h LEU 217 Ca -0.51 -0.09 -0.57 0.00 0.84 0.00 0.00 57.88 57.55 1n60 h LEU 217 Cb 1.31 -0.14 -0.08 0.00 0.37 0.00 0.00 40.66 42.13 1n60 h LEU 217 CO 0.55 0.57 -0.06 -0.70 -0.34 0.00 0.00 178.44 178.46 1n60 s GLU 218 N -5.07 4.34 0.98 1.25 2.12 -0.97 -5.09 118.70 116.27 1n60 s GLU 218 Ca -0.08 0.56 -0.17 0.00 0.36 0.00 0.00 54.97 55.65 1n60 s GLU 218 Cb 0.16 -3.46 0.24 0.00 0.26 0.00 0.00 34.13 31.32 1n60 s GLU 218 CO 0.77 0.08 1.09 0.25 -0.54 0.00 0.00 175.26 176.91 1n60 n THR 219 N 3.84 0.00 -2.84 -1.70 -2.24 -1.26 -4.86 114.28 105.22 1n60 n THR 219 Ca -0.05 -0.66 -0.35 0.00 -2.27 0.00 0.00 64.05 60.71 1n60 n THR 219 Cb 0.51 -1.40 -0.07 0.00 -2.10 0.00 0.00 70.33 67.28 1n60 n THR 219 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1n60 s GLN 221 N -2.49 0.32 0.19 0.00 -2.07 -1.26 -2.46 119.66 111.90 1n60 s GLN 221 Ca 0.54 -0.11 -0.19 0.00 -1.82 0.00 0.00 55.36 53.78 1n60 s GLN 221 Cb -0.15 0.15 0.04 0.00 -1.09 0.00 0.00 33.01 31.96 1n60 s GLN 221 CO 0.19 -0.14 0.57 0.00 -1.32 0.00 0.00 175.29 174.59 1n60 s VAL 223 N -3.84 1.17 -0.11 0.00 1.01 0.37 -0.87 120.40 118.13 1n60 s VAL 223 Ca 0.07 -0.77 -0.11 0.00 0.00 0.00 0.00 61.98 61.17 1n60 s VAL 223 Cb -0.02 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.92 1n60 s VAL 223 CO -0.05 0.05 0.25 0.00 0.00 0.00 0.00 175.10 175.35 1n60 s ALA 224 N 1.59 3.73 -0.28 5.51 0.00 -0.12 -0.68 121.76 131.51 1n60 s ALA 224 Ca -0.01 -0.49 -0.03 0.00 0.00 0.00 0.00 51.96 51.43 1n60 s ALA 224 Cb -0.16 -2.21 0.10 0.00 0.00 0.00 0.00 23.12 20.84 1n60 s ALA 224 CO -0.07 0.38 0.11 0.45 0.00 0.00 0.00 175.76 176.63 1n60 s SER 225 N -0.45 3.59 -0.21 0.00 0.15 0.11 -0.40 113.70 116.49 1n60 s SER 225 Ca 0.17 -1.33 -0.22 0.00 0.70 0.00 0.00 55.95 55.26 1n60 s SER 225 Cb -0.13 -0.51 -0.02 0.00 -1.71 0.00 0.00 66.02 63.65 1n60 s SER 225 CO 0.05 -0.42 0.71 -0.32 1.20 0.00 0.00 173.24 174.46 1n60 s MET 226 N 1.95 4.20 -0.58 5.44 1.75 -1.26 -0.83 119.30 129.96 1n60 s MET 226 Ca 0.08 0.74 -0.20 0.00 -1.25 0.00 0.00 55.69 55.06 1n60 s MET 226 Cb -0.16 -3.61 0.08 0.00 2.84 0.00 0.00 34.83 33.97 1n60 s MET 226 CO -0.31 -0.35 0.77 0.34 -0.65 0.00 0.00 175.02 174.83 1n60 s ASP 227 N 1.28 6.21 0.42 1.11 -1.08 0.47 -4.42 116.67 120.66 1n60 s ASP 227 Ca 0.31 -1.05 0.22 0.00 -0.52 0.00 0.00 52.55 51.51 1n60 s ASP 227 Cb -0.16 -2.34 0.80 0.00 -1.46 0.00 0.00 42.92 39.76 1n60 s ASP 227 CO 0.10 -1.15 1.78 0.11 0.52 0.00 0.00 175.17 176.53 1n60 h LYS 228 N 9.24 0.00 -0.27 4.34 1.57 -1.84 0.21 116.57 129.82 1n60 h LYS 228 Ca -0.28 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.44 1n60 h LYS 228 Cb 1.08 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.38 1n60 h LYS 228 CO 1.08 0.27 -0.04 0.82 -0.57 0.00 0.00 179.45 181.01 1n60 h ILE 229 N 0.00 1.27 0.00 1.86 2.04 -1.96 -3.27 117.51 117.46 1n60 h ILE 229 Ca -0.00 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 64.84 1n60 h ILE 229 Cb 0.83 1.40 0.00 0.00 -0.74 0.00 0.00 36.82 38.30 1n60 h ILE 229 CO 0.03 0.32 -0.68 0.11 0.00 0.00 0.00 178.15 177.93 1n60 h LYS 230 N 0.26 0.00 -2.20 2.37 1.57 -1.93 -3.47 116.57 113.16 1n60 h LYS 230 Ca 0.07 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.65 1n60 h LYS 230 Cb 0.49 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.82 1n60 h LYS 230 CO 0.02 0.00 -0.29 0.41 -0.57 0.00 0.00 179.45 179.02 1n60 n GLY 231 N 1.26 0.06 3.14 3.86 0.00 0.71 -5.02 105.19 109.19 1n60 n GLY 231 Ca 0.02 -0.37 -0.26 0.00 0.00 0.00 0.00 46.02 45.41 1n60 n GLY 231 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1n60 s GLU 232 N -4.96 1.76 -0.21 1.61 2.02 -0.95 -4.91 118.70 113.05 1n60 s GLU 232 Ca 0.11 -0.61 -0.09 0.00 0.02 0.00 0.00 54.97 54.40 1n60 s GLU 232 Cb -0.05 -1.54 -0.04 0.00 0.10 0.00 0.00 34.13 32.60 1n60 s GLU 232 CO 0.14 0.26 0.10 -1.17 0.02 0.00 0.00 175.26 174.61 1n60 s LEU 233 N -0.01 3.91 -0.11 1.80 2.96 0.21 -0.39 118.68 127.04 1n60 s LEU 233 Ca -0.03 0.07 -0.02 0.00 -0.22 0.00 0.00 54.13 53.93 1n60 s LEU 233 Cb -0.11 -2.01 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 1n60 s LEU 233 CO 0.02 0.12 -0.02 -0.89 -1.32 0.00 0.00 176.35 174.26 1n60 s THR 234 N 0.71 4.07 -0.23 3.68 2.01 -0.01 -0.17 115.64 125.69 1n60 s THR 234 Ca 0.05 -0.32 -0.03 0.00 0.31 0.00 0.00 61.69 61.70 1n60 s THR 234 Cb -0.13 -2.73 0.08 0.00 0.01 0.00 0.00 72.50 69.73 1n60 s THR 234 CO 0.02 0.56 0.08 -0.22 -0.69 0.00 0.00 174.62 174.36 1n60 s LEU 235 N -0.36 0.98 0.11 4.42 2.96 -0.00 0.10 118.68 126.89 1n60 s LEU 235 Ca 0.06 -1.01 -0.24 0.00 -0.22 0.00 0.00 54.13 52.72 1n60 s LEU 235 Cb -0.12 -0.49 -0.07 0.00 0.50 0.00 0.00 46.19 46.01 1n60 s LEU 235 CO 0.02 -0.37 0.74 0.26 -1.32 0.00 0.00 176.35 175.69 1n60 s TRP 236 N 1.95 3.83 0.07 5.38 0.51 0.15 -0.65 118.94 130.18 1n60 s TRP 236 Ca 0.04 1.53 -0.27 0.00 -2.12 0.00 0.00 56.10 55.27 1n60 s TRP 236 Cb -0.17 -2.75 0.09 0.00 -0.81 0.00 0.00 33.47 29.83 1n60 s TRP 236 CO -0.18 0.44 1.04 0.20 -0.51 0.00 0.00 176.95 177.94 1n60 s GLY 237 N -0.74 -0.32 -1.23 0.98 0.00 -0.41 -0.48 107.32 105.12 1n60 s GLY 237 Ca 0.36 0.48 -0.19 0.00 0.00 0.00 0.00 44.72 45.37 1n60 s GLY 237 CO 0.24 0.11 1.65 -0.51 0.00 0.00 0.00 173.10 174.59 1n60 s THR 238 N -3.00 4.15 -0.20 0.90 -4.23 -0.76 -4.26 115.64 108.24 1n60 s THR 238 Ca 0.11 -1.73 0.01 0.00 -1.18 0.00 0.00 61.69 58.91 1n60 s THR 238 Cb 0.00 -5.14 0.03 0.00 1.34 0.00 0.00 72.50 68.73 1n60 s THR 238 CO -0.01 -1.97 -0.17 -0.36 -0.54 0.00 0.00 174.62 171.57 1n60 s PHE 239 N 4.17 2.91 0.11 3.99 0.08 -1.26 -4.73 117.98 123.24 1n60 s PHE 239 Ca 0.51 -1.77 0.25 0.00 0.12 0.00 0.00 56.93 56.04 1n60 s PHE 239 Cb 0.03 -1.94 0.93 0.00 -0.57 0.00 0.00 43.02 41.47 1n60 s PHE 239 CO 0.03 -0.81 1.83 1.96 -0.10 0.00 0.00 175.22 178.13 1n60 h GLN 240 N 7.91 0.00 -2.34 0.44 4.20 -1.28 -3.36 115.11 120.68 1n60 h GLN 240 Ca -0.39 0.00 -0.59 0.00 0.06 0.00 0.00 58.65 57.73 1n60 h GLN 240 Cb 1.12 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 28.50 1n60 h GLN 240 CO 0.60 0.20 -0.90 0.00 -0.67 0.00 0.00 178.83 178.06 1n60 n ALA 241 N -2.21 2.98 0.07 3.87 0.00 -1.26 -1.04 120.51 122.93 1n60 n ALA 241 Ca 0.00 -3.66 -0.01 0.00 0.00 0.00 0.00 53.44 49.77 1n60 n ALA 241 Cb 0.43 -0.84 0.27 0.00 0.00 0.00 0.00 19.45 19.31 1n60 n ALA 241 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1n60 h PRO 242 N 4.86 0.33 -0.25 0.00 0.13 -1.91 -1.52 132.00 133.65 1n60 h PRO 242 Ca 0.18 -0.12 -0.14 0.00 -0.87 0.00 0.00 66.00 65.05 1n60 h PRO 242 Cb 0.84 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.94 1n60 h PRO 242 CO 0.52 0.57 -0.43 0.45 -0.23 0.00 0.00 178.00 178.88 1n60 h HIS 243 N 0.30 0.74 -0.37 1.56 3.86 -1.91 -0.24 115.15 119.08 1n60 h HIS 243 Ca 0.05 -0.22 -0.02 0.00 -1.16 0.00 0.00 60.37 59.01 1n60 h HIS 243 Cb 0.62 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.92 1n60 h HIS 243 CO 0.01 0.94 0.15 0.28 0.86 0.00 0.00 177.93 180.17 1n60 h VAL 244 N 0.50 1.19 -0.71 2.45 2.07 -1.67 -1.39 116.25 118.68 1n60 h VAL 244 Ca 0.04 -0.60 0.00 0.00 0.82 0.00 0.00 66.70 66.96 1n60 h VAL 244 Cb 0.96 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 31.58 1n60 h VAL 244 CO 0.09 0.21 0.46 0.40 0.02 0.00 0.00 177.57 178.75 1n60 h ILE 245 N 0.46 1.19 -0.10 4.57 1.08 -0.89 -0.90 117.51 122.92 1n60 h ILE 245 Ca 0.12 -0.38 0.04 0.00 -0.39 0.00 0.00 64.86 64.26 1n60 h ILE 245 Cb 0.19 0.16 -0.04 0.00 -3.07 0.00 0.00 36.82 34.06 1n60 h ILE 245 CO -0.01 0.19 -0.15 -0.09 -0.69 0.00 0.00 178.15 177.40 1n60 h ARG 246 N 0.97 -0.18 -0.87 2.37 2.43 -0.48 0.63 114.38 119.25 1n60 h ARG 246 Ca 0.26 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.44 1n60 h ARG 246 Cb -0.08 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.47 1n60 h ARG 246 CO -0.05 -0.12 0.53 1.15 -1.51 0.00 0.00 179.97 179.96 1n60 h THR 247 N -0.19 1.24 -0.32 0.20 2.02 -0.80 0.12 112.91 115.18 1n60 h THR 247 Ca 0.08 -0.51 -0.07 0.00 0.77 0.00 0.00 66.41 66.68 1n60 h THR 247 Cb 0.31 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.72 1n60 h THR 247 CO -0.22 0.25 -0.09 0.58 0.37 0.00 0.00 175.52 176.41 1n60 h VAL 248 N 1.19 1.28 -0.81 3.16 2.07 -0.83 -0.74 116.25 121.57 1n60 h VAL 248 Ca 0.31 -1.15 0.01 0.00 0.82 0.00 0.00 66.70 66.69 1n60 h VAL 248 Cb -0.06 1.37 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 1n60 h VAL 248 CO -0.06 0.37 0.53 0.58 0.02 0.00 0.00 177.57 179.02 1n60 h VAL 249 N 0.40 1.19 -0.13 2.57 2.07 -0.61 -0.65 116.25 121.08 1n60 h VAL 249 Ca 0.08 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 1n60 h VAL 249 Cb 0.59 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1n60 h VAL 249 CO 0.03 0.20 0.04 -1.28 0.02 0.00 0.00 177.57 176.58 1n60 h SER 250 N 1.07 0.19 -0.13 0.57 0.87 -0.51 0.06 113.55 115.67 1n60 h SER 250 Ca 0.30 -0.19 -0.04 0.00 -1.23 0.00 0.00 61.79 60.63 1n60 h SER 250 Cb -0.08 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 61.81 1n60 h SER 250 CO -0.07 0.33 -0.03 -0.07 -0.53 0.00 0.00 176.83 176.46 1n60 h LEU 251 N 0.04 0.35 0.00 2.23 3.38 -0.35 -0.65 115.31 120.30 1n60 h LEU 251 Ca 0.04 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1n60 h LEU 251 Cb 0.20 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1n60 h LEU 251 CO -0.00 0.44 -1.72 2.30 0.09 0.00 0.00 178.44 179.55 1n60 n ILE 252 N -4.31 0.59 0.02 1.22 -5.35 -0.33 -4.18 119.36 107.02 1n60 n ILE 252 Ca 0.01 -0.60 0.09 0.00 -0.27 0.00 0.00 62.75 61.97 1n60 n ILE 252 Cb 0.23 -0.29 -0.11 0.00 -1.74 0.00 0.00 39.64 37.73 1n60 n ILE 252 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1n60 n SER 253 N -2.55 0.34 0.00 7.28 3.41 -0.00 -4.91 113.62 117.18 1n60 n SER 253 Ca -0.09 0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 1n60 n SER 253 Cb 0.71 1.31 0.00 0.00 -0.26 0.00 0.00 64.21 65.97 1n60 n SER 253 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n60 n GLY 254 N 1.27 1.52 3.76 5.00 0.00 -0.26 -5.03 105.19 111.45 1n60 n GLY 254 Ca -0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 1n60 n GLY 254 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n60 s LEU 255 N 0.00 4.54 0.49 0.99 1.43 -1.24 -5.02 118.68 119.87 1n60 s LEU 255 Ca 0.00 2.00 -0.20 0.00 -1.03 0.00 0.00 54.13 54.90 1n60 s LEU 255 Cb 0.00 -3.72 -0.08 0.00 0.03 0.00 0.00 46.19 42.42 1n60 s LEU 255 CO 0.00 0.02 1.06 -2.16 0.23 0.00 0.00 176.35 175.50 1n60 s PRO 256 N -1.47 3.72 0.40 1.29 0.04 -1.26 -4.34 135.00 133.38 1n60 s PRO 256 Ca 0.44 1.43 0.10 0.00 0.04 0.00 0.00 61.00 63.01 1n60 s PRO 256 Cb -0.26 -2.09 0.90 0.00 0.04 0.00 0.00 34.50 33.09 1n60 s PRO 256 CO 0.32 -0.51 1.96 0.93 0.04 0.00 0.00 177.00 179.74 1n60 h GLU 257 N 1.52 0.55 0.00 4.56 5.08 -1.91 -0.45 114.58 123.93 1n60 h GLU 257 Ca -0.50 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 1n60 h GLU 257 Cb 1.23 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.36 1n60 h GLU 257 CO 0.59 0.36 0.00 -2.39 -1.00 0.00 0.00 179.01 176.57 1n60 n HIS 258 N -4.48 0.00 -0.83 4.33 1.44 -1.26 -2.13 115.22 112.28 1n60 n HIS 258 Ca 0.11 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.90 1n60 n HIS 258 Cb 0.33 -0.50 0.24 0.00 0.12 0.00 0.00 29.99 30.18 1n60 n HIS 258 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1n60 n LYS 259 N -1.50 2.91 -3.99 -1.40 5.02 -0.19 -4.88 118.16 114.14 1n60 n LYS 259 Ca 0.04 -2.68 -0.30 0.00 -2.02 0.00 0.00 58.31 53.35 1n60 n LYS 259 Cb 0.18 -1.73 -0.16 0.00 -0.02 0.00 0.00 35.03 33.30 1n60 n LYS 259 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1n60 s ILE 260 N -2.46 1.56 -0.54 -0.18 1.01 -0.91 -0.62 121.20 119.06 1n60 s ILE 260 Ca 0.38 -0.88 -0.04 0.00 0.00 0.00 0.00 60.65 60.11 1n60 s ILE 260 Cb 0.30 -1.61 0.14 0.00 0.01 0.00 0.00 42.46 41.30 1n60 s ILE 260 CO 0.10 0.22 0.36 -1.00 0.00 0.00 0.00 174.94 174.63 1n60 s HIS 261 N 1.45 3.49 0.02 3.97 3.76 0.76 -4.84 115.29 123.89 1n60 s HIS 261 Ca 0.00 -2.47 -0.20 0.00 -0.15 0.00 0.00 55.06 52.25 1n60 s HIS 261 Cb -0.15 -3.28 -0.06 0.00 1.11 0.00 0.00 32.58 30.20 1n60 s HIS 261 CO -0.09 -0.92 0.58 0.08 -0.85 0.00 0.00 174.74 173.55 1n60 s VAL 262 N 0.56 4.86 -0.16 -0.90 1.01 -1.26 -0.82 120.40 123.68 1n60 s VAL 262 Ca 0.12 1.23 -0.02 0.00 0.00 0.00 0.00 61.98 63.32 1n60 s VAL 262 Cb -0.21 -3.92 0.05 0.00 0.00 0.00 0.00 36.38 32.29 1n60 s VAL 262 CO -0.04 0.46 -0.01 -0.63 0.00 0.00 0.00 175.10 174.89 1n60 s ILE 263 N -0.45 0.75 -0.45 2.22 1.01 0.18 -1.26 121.20 123.19 1n60 s ILE 263 Ca 0.30 -0.50 -0.16 0.00 0.00 0.00 0.00 60.65 60.29 1n60 s ILE 263 Cb -0.19 -1.07 0.04 0.00 0.01 0.00 0.00 42.46 41.26 1n60 s ILE 263 CO 0.18 -0.01 0.42 0.00 0.00 0.00 0.00 174.94 175.53 1n60 s ALA 264 N 1.78 3.48 0.47 9.38 0.00 0.17 -1.29 121.76 135.74 1n60 s ALA 264 Ca 0.00 -1.80 0.00 0.00 0.00 0.00 0.00 51.96 50.16 1n60 s ALA 264 Cb -0.16 -3.07 0.00 0.00 0.00 0.00 0.00 23.12 19.89 1n60 s ALA 264 CO -0.07 -1.68 0.00 -0.35 0.00 0.00 0.00 175.76 173.66 1n60 n PRO 265 N 5.47 3.43 -2.10 0.00 -0.04 -1.26 -4.51 135.00 135.99 1n60 n PRO 265 Ca -0.10 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.96 1n60 n PRO 265 Cb 0.46 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.90 1n60 n PRO 265 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1n60 s ASP 266 N -1.00 6.75 -0.12 3.54 1.01 0.07 -5.00 116.67 121.93 1n60 s ASP 266 Ca 0.00 2.70 0.03 0.00 0.71 0.00 0.00 52.55 55.99 1n60 s ASP 266 Cb 0.00 -2.65 0.01 0.00 1.01 0.00 0.00 42.92 41.29 1n60 s ASP 266 CO 0.00 -0.56 -0.21 -0.63 0.21 0.00 0.00 175.17 173.99 1n60 s ILE 267 N -1.07 1.89 -0.79 0.77 1.01 -1.26 -4.11 121.20 117.64 1n60 s ILE 267 Ca 0.50 -0.89 -0.08 0.00 0.00 0.00 0.00 60.65 60.17 1n60 s ILE 267 Cb -0.40 -1.67 -0.18 0.00 0.01 0.00 0.00 42.46 40.22 1n60 s ILE 267 CO 0.53 0.52 3.30 0.61 0.00 0.00 0.00 174.94 179.89 1n60 n GLY 268 N 3.91 3.60 0.00 6.18 0.00 -1.26 -4.40 105.19 113.22 1n60 n GLY 268 Ca -0.20 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.48 1n60 n GLY 268 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n60 n GLY 269 N 3.03 -1.75 1.37 -0.02 0.00 -1.17 -2.29 105.19 104.36 1n60 n GLY 269 Ca 0.60 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1n60 n GLY 269 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n60 n GLY 270 N -0.58 -0.12 2.53 -0.02 0.00 -1.26 -4.73 105.19 101.00 1n60 n GLY 270 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1n60 n GLY 270 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1n60 n PHE 271 N -3.41 -1.27 0.00 1.61 3.72 -1.26 -1.06 117.46 115.79 1n60 n PHE 271 Ca 0.00 0.08 0.00 0.00 -0.05 0.00 0.00 57.45 57.48 1n60 n PHE 271 Cb 0.05 -3.68 0.00 0.00 -0.94 0.00 0.00 39.48 34.90 1n60 n PHE 271 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1n60 n GLY 272 N -1.03 2.14 0.27 1.37 0.00 -1.26 0.08 105.19 106.76 1n60 n GLY 272 Ca -0.20 0.00 0.16 0.00 0.00 0.00 0.00 46.02 45.99 1n60 n GLY 272 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1n60 h ASN 273 N 0.00 0.00 -0.20 1.61 -1.24 -1.44 -3.26 115.58 111.05 1n60 h ASN 273 Ca 0.00 0.00 -0.06 0.00 0.71 0.00 0.00 56.30 56.95 1n60 h ASN 273 Cb 0.00 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.01 1n60 h ASN 273 CO 0.00 0.03 -0.09 0.29 -1.29 0.00 0.00 177.43 176.37 1n60 n LYS 274 N -3.15 2.01 -0.03 6.67 5.02 -1.26 -4.60 118.16 122.82 1n60 n LYS 274 Ca 0.00 -2.97 -0.10 0.00 -2.02 0.00 0.00 58.31 53.22 1n60 n LYS 274 Cb 0.31 -1.73 -0.09 0.00 -0.02 0.00 0.00 35.03 33.50 1n60 n LYS 274 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1n60 h VAL 275 N 1.02 1.17 -5.38 -0.18 2.07 -1.86 -0.12 116.25 112.98 1n60 h VAL 275 Ca 0.08 -1.69 -0.44 0.00 0.82 0.00 0.00 66.70 65.46 1n60 h VAL 275 Cb 1.37 2.14 0.08 0.00 -1.52 0.00 0.00 31.29 33.36 1n60 h VAL 275 CO 0.20 0.37 0.12 0.61 0.02 0.00 0.00 177.57 178.89 1n60 n GLY 276 N 1.30 0.57 3.88 2.17 0.00 -1.26 -4.55 105.19 107.30 1n60 n GLY 276 Ca -0.07 -2.02 -0.31 0.00 0.00 0.00 0.00 46.02 43.62 1n60 n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n60 s ALA 277 N -3.19 3.54 0.25 4.61 0.00 -1.26 -5.00 121.76 120.71 1n60 s ALA 277 Ca 0.64 -0.30 0.09 0.00 0.00 0.00 0.00 51.96 52.39 1n60 s ALA 277 Cb -0.04 -2.45 -0.05 0.00 0.00 0.00 0.00 23.12 20.58 1n60 s ALA 277 CO 0.42 0.42 -0.15 0.71 0.00 0.00 0.00 175.76 177.16 1n60 s TYR 278 N -1.91 2.00 0.36 0.00 2.02 -1.26 -5.03 117.35 113.53 1n60 s TYR 278 Ca 0.47 -0.49 0.09 0.00 -0.37 0.00 0.00 57.07 56.78 1n60 s TYR 278 Cb -0.11 -0.94 0.82 0.00 -0.40 0.00 0.00 41.96 41.33 1n60 s TYR 278 CO 0.23 0.51 1.86 1.03 -1.57 0.00 0.00 175.55 177.61 1n60 h SER 279 N 2.38 0.65 -0.86 2.29 0.87 -1.90 -1.15 113.55 115.83 1n60 h SER 279 Ca -0.39 0.04 0.05 0.00 -1.23 0.00 0.00 61.79 60.26 1n60 h SER 279 Cb 1.24 -0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 63.06 1n60 h SER 279 CO 0.62 0.32 0.56 1.23 -0.53 0.00 0.00 176.83 179.04 1n60 h GLY 280 N 0.69 1.22 0.76 5.77 0.00 -1.96 0.12 103.07 109.67 1n60 h GLY 280 Ca 0.45 -0.40 -0.02 0.00 0.00 0.00 0.00 47.33 47.37 1n60 h GLY 280 CO -0.21 0.32 -0.00 -0.97 0.00 0.00 0.00 176.54 175.67 1n60 h TYR 281 N 1.00 0.22 -0.51 5.60 0.05 -1.62 -0.72 116.97 120.99 1n60 h TYR 281 Ca 0.36 -0.04 -0.01 0.00 0.05 0.00 0.00 58.73 59.08 1n60 h TYR 281 Cb 0.13 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 37.79 1n60 h TYR 281 CO -0.00 0.45 0.26 0.28 -1.05 0.00 0.00 178.16 178.10 1n60 h VAL 282 N -0.07 1.19 -0.42 -2.88 2.07 -1.23 -1.95 116.25 112.95 1n60 h VAL 282 Ca 0.03 -0.50 -0.13 0.00 0.82 0.00 0.00 66.70 66.92 1n60 h VAL 282 Cb 0.36 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1n60 h VAL 282 CO 0.01 0.20 -0.27 0.00 0.02 0.00 0.00 177.57 177.53 1n60 h ALA 284 N 0.92 0.59 0.31 0.00 0.00 -1.01 0.90 119.26 120.96 1n60 h ALA 284 Ca 0.09 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1n60 h ALA 284 Cb 0.83 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1n60 h ALA 284 CO 0.07 0.06 -0.19 0.28 0.00 0.00 0.00 179.25 179.47 1n60 h VAL 285 N 0.62 0.61 -0.42 0.00 2.07 -1.06 -0.23 116.25 117.84 1n60 h VAL 285 Ca 0.17 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.73 1n60 h VAL 285 Cb -0.03 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.30 1n60 h VAL 285 CO -0.03 0.00 0.17 0.58 0.02 0.00 0.00 177.57 178.31 1n60 h VAL 286 N -0.47 0.91 -0.76 2.57 2.07 -0.80 -0.79 116.25 118.97 1n60 h VAL 286 Ca -0.03 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.39 1n60 h VAL 286 Cb 0.39 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 1n60 h VAL 286 CO 0.04 0.06 0.49 0.00 0.02 0.00 0.00 177.57 178.18 1n60 h ALA 287 N 1.25 0.99 -0.65 1.67 0.00 -0.68 -0.51 119.26 121.34 1n60 h ALA 287 Ca 0.19 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 1n60 h ALA 287 Cb 0.15 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1n60 h ALA 287 CO -0.17 0.31 0.14 1.03 0.00 0.00 0.00 179.25 180.56 1n60 h SER 288 N 0.97 0.98 -0.61 0.00 0.87 -0.54 0.56 113.55 115.77 1n60 h SER 288 Ca 0.30 -0.21 -0.04 0.00 -1.23 0.00 0.00 61.79 60.62 1n60 h SER 288 Cb -0.02 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 61.65 1n60 h SER 288 CO -0.10 0.95 0.24 0.40 -0.53 0.00 0.00 176.83 177.79 1n60 h ILE 289 N 0.98 1.23 -0.30 2.23 2.04 -0.66 0.61 117.51 123.64 1n60 h ILE 289 Ca 0.20 -0.72 -0.10 0.00 1.00 0.00 0.00 64.86 65.24 1n60 h ILE 289 Cb 0.37 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 1n60 h ILE 289 CO 0.00 0.28 -0.20 0.58 0.00 0.00 0.00 178.15 178.81 1n60 h VAL 290 N 0.85 1.30 0.00 1.67 2.07 -0.81 -3.29 116.25 118.03 1n60 h VAL 290 Ca 0.20 -1.33 -0.11 0.00 0.82 0.00 0.00 66.70 66.28 1n60 h VAL 290 Cb 0.21 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 1n60 h VAL 290 CO -0.02 0.43 -1.22 -0.07 0.02 0.00 0.00 177.57 176.71 1n60 h LEU 291 N 0.43 0.00 0.44 2.57 3.38 -0.79 -3.48 115.31 117.86 1n60 h LEU 291 Ca 0.06 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.84 1n60 h LEU 291 Cb 0.75 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.42 1n60 h LEU 291 CO 0.06 0.37 -0.17 0.61 0.09 0.00 0.00 178.44 179.39 1n60 n GLY 292 N 1.31 1.09 3.26 0.83 0.00 0.21 -5.02 105.19 106.88 1n60 n GLY 292 Ca -0.06 -0.50 -0.14 0.00 0.00 0.00 0.00 46.02 45.32 1n60 n GLY 292 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1n60 s VAL 293 N -2.30 0.71 0.50 1.61 -7.23 -1.24 -4.73 120.40 107.73 1n60 s VAL 293 Ca 0.00 -1.99 -0.21 0.00 -1.81 0.00 0.00 61.98 57.97 1n60 s VAL 293 Cb 0.00 -2.21 -0.07 0.00 0.56 0.00 0.00 36.38 34.65 1n60 s VAL 293 CO 0.00 -0.39 1.10 -2.84 -0.31 0.00 0.00 175.10 172.65 1n60 s PRO 294 N -3.92 3.62 -0.11 4.82 0.02 -1.26 -4.40 135.00 133.77 1n60 s PRO 294 Ca 0.26 1.55 -0.01 0.00 0.02 0.00 0.00 61.00 62.82 1n60 s PRO 294 Cb 0.06 -2.13 0.03 0.00 0.02 0.00 0.00 34.50 32.48 1n60 s PRO 294 CO 0.06 -0.62 -0.06 0.08 -0.33 0.00 0.00 177.00 176.13 1n60 s VAL 295 N -1.80 0.93 -0.01 3.83 1.01 0.46 -0.33 120.40 124.50 1n60 s VAL 295 Ca 0.69 -0.23 -0.11 0.00 0.00 0.00 0.00 61.98 62.33 1n60 s VAL 295 Cb -0.22 -0.97 -0.05 0.00 0.00 0.00 0.00 36.38 35.14 1n60 s VAL 295 CO 0.26 0.35 0.34 -0.75 0.00 0.00 0.00 175.10 175.29 1n60 s LYS 296 N 1.75 3.75 -0.07 2.72 2.20 0.28 -0.95 119.74 129.43 1n60 s LYS 296 Ca 0.05 0.20 0.00 0.00 -0.36 0.00 0.00 55.97 55.86 1n60 s LYS 296 Cb -0.13 -3.15 0.02 0.00 -1.51 0.00 0.00 37.83 33.07 1n60 s LYS 296 CO -0.08 0.68 -0.05 -0.46 -0.36 0.00 0.00 175.35 175.08 1n60 s TRP 297 N -1.16 0.99 -0.11 4.03 -0.00 -0.05 -0.44 118.94 122.19 1n60 s TRP 297 Ca 0.24 -0.35 -0.02 0.00 -0.00 0.00 0.00 56.10 55.97 1n60 s TRP 297 Cb -0.15 -0.87 0.04 0.00 -0.00 0.00 0.00 33.47 32.49 1n60 s TRP 297 CO 0.13 -0.30 0.00 0.08 -0.00 0.00 0.00 176.95 176.86 1n60 s VAL 298 N 1.26 0.50 0.39 5.86 1.01 -1.26 -0.80 120.40 127.36 1n60 s VAL 298 Ca -0.05 -0.13 -0.15 0.00 0.00 0.00 0.00 61.98 61.65 1n60 s VAL 298 Cb -0.14 -0.74 -0.08 0.00 0.00 0.00 0.00 36.38 35.42 1n60 s VAL 298 CO -0.02 0.13 0.82 -1.83 0.00 0.00 0.00 175.10 174.20 1n60 s GLU 299 N 1.91 3.96 0.58 2.72 -1.05 -1.03 -5.02 118.70 120.77 1n60 s GLU 299 Ca 0.03 0.72 -0.07 0.00 -0.15 0.00 0.00 54.97 55.50 1n60 s GLU 299 Cb -0.14 -2.34 -0.01 0.00 -0.44 0.00 0.00 34.13 31.21 1n60 s GLU 299 CO -0.06 0.00 0.91 -0.51 0.95 0.00 0.00 175.26 176.55 1n60 s ASP 300 N -2.65 5.78 0.21 0.83 1.01 -1.26 -4.74 116.67 115.86 1n60 s ASP 300 Ca 0.55 0.88 -0.09 0.00 0.71 0.00 0.00 52.55 54.60 1n60 s ASP 300 Cb -0.10 -1.92 0.29 0.00 1.01 0.00 0.00 42.92 42.20 1n60 s ASP 300 CO 0.23 -0.97 1.73 -0.09 0.21 0.00 0.00 175.17 176.28 1n60 h ARG 301 N -0.16 0.34 -0.75 8.23 9.65 -1.97 -0.01 114.38 129.71 1n60 h ARG 301 Ca -0.46 -0.02 0.01 0.00 -1.10 0.00 0.00 59.98 58.41 1n60 h ARG 301 Cb 1.24 -0.08 -0.04 0.00 -1.39 0.00 0.00 29.97 29.70 1n60 h ARG 301 CO 0.61 0.23 0.50 0.52 2.80 0.00 0.00 179.97 184.63 1n60 h MET 302 N 0.36 0.99 -0.05 0.20 2.86 -1.95 -0.00 114.93 117.33 1n60 h MET 302 Ca 0.32 -0.06 -0.21 0.00 -2.06 0.00 0.00 59.70 57.69 1n60 h MET 302 Cb 0.43 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 31.86 1n60 h MET 302 CO -0.34 0.66 -0.83 0.93 1.06 0.00 0.00 176.91 178.38 1n60 h GLU 303 N 1.02 0.46 -0.10 1.72 3.07 -1.68 -2.35 114.58 116.74 1n60 h GLU 303 Ca 0.28 -0.43 0.02 0.00 -0.50 0.00 0.00 59.36 58.73 1n60 h GLU 303 Cb -0.12 0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 27.87 1n60 h GLU 303 CO -0.06 1.07 -0.05 -0.97 -1.40 0.00 0.00 179.01 177.60 1n60 h ASN 304 N 0.29 -0.18 0.33 1.42 -0.73 -0.18 -0.25 115.58 116.29 1n60 h ASN 304 Ca -0.06 0.04 -0.09 0.00 1.87 0.00 0.00 56.30 58.07 1n60 h ASN 304 Cb 1.44 0.10 -0.01 0.00 0.27 0.00 0.00 38.32 40.12 1n60 h ASN 304 CO 0.15 -0.08 -0.39 -0.07 -0.37 0.00 0.00 177.43 176.67 1n60 h LEU 305 N -0.05 0.09 -0.72 0.34 3.38 -0.96 -2.86 115.31 114.52 1n60 h LEU 305 Ca 0.06 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1n60 h LEU 305 Cb 0.14 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1n60 h LEU 305 CO -0.13 0.48 -0.53 -1.54 0.09 0.00 0.00 178.44 176.81 1n60 n SER 306 N -4.06 1.63 0.00 -0.43 3.41 -0.89 -4.63 113.62 108.66 1n60 n SER 306 Ca -0.02 -1.32 0.00 0.00 -0.26 0.00 0.00 58.87 57.28 1n60 n SER 306 Cb 0.44 0.60 0.00 0.00 -0.26 0.00 0.00 64.21 64.99 1n60 n SER 306 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1n60 n THR 307 N -0.39 0.00 -4.09 6.66 -2.24 -0.13 -4.52 114.28 109.57 1n60 n THR 307 Ca 0.07 -0.12 -0.27 0.00 -2.27 0.00 0.00 64.05 61.46 1n60 n THR 307 Cb 0.39 1.49 -0.03 0.00 -2.10 0.00 0.00 70.33 70.08 1n60 n THR 307 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1n60 s THR 308 N -0.08 1.73 -0.34 4.28 -4.23 -1.08 -4.75 115.64 111.17 1n60 s THR 308 Ca 0.00 -1.62 -0.37 0.00 -1.18 0.00 0.00 61.69 58.52 1n60 s THR 308 Cb 0.00 -2.35 -0.13 0.00 1.34 0.00 0.00 72.50 71.36 1n60 s THR 308 CO 0.00 0.00 2.12 -1.54 -0.54 0.00 0.00 174.62 174.66 1n60 n SER 309 N -1.56 2.09 -4.65 3.99 3.41 -1.25 -4.79 113.62 110.87 1n60 n SER 309 Ca -0.05 0.54 -0.29 0.00 -0.26 0.00 0.00 58.87 58.81 1n60 n SER 309 Cb 0.65 -1.22 0.15 0.00 -0.26 0.00 0.00 64.21 63.53 1n60 n SER 309 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1n60 s PHE 310 N 6.60 2.25 0.09 7.33 -0.12 -1.04 -4.36 117.98 128.72 1n60 s PHE 310 Ca 1.08 0.79 0.06 0.00 -0.05 0.00 0.00 56.93 58.81 1n60 s PHE 310 Cb -0.94 -3.45 -0.03 0.00 -0.63 0.00 0.00 43.02 37.98 1n60 s PHE 310 CO 0.53 -2.55 -0.16 0.00 -0.05 0.00 0.00 175.22 172.99 1n60 s ALA 311 N -3.29 1.45 0.00 1.99 0.00 -0.23 -0.47 121.76 121.21 1n60 s ALA 311 Ca 0.65 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 51.47 1n60 s ALA 311 Cb -0.14 -0.14 0.00 0.00 0.00 0.00 0.00 23.12 22.84 1n60 s ALA 311 CO 0.54 0.21 0.00 0.54 0.00 0.00 0.00 175.76 177.05 1n60 n ARG 312 N 1.05 0.00 -2.89 0.00 5.12 -0.88 -1.28 116.66 117.78 1n60 n ARG 312 Ca -0.19 0.00 -0.11 0.00 -1.93 0.00 0.00 57.85 55.62 1n60 n ARG 312 Cb 0.55 0.00 0.06 0.00 -1.16 0.00 0.00 32.46 31.90 1n60 n ARG 312 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 1n60 n ASP 313 N 6.50 -2.24 -4.38 0.55 -0.08 0.04 -4.77 116.55 112.17 1n60 n ASP 313 Ca 0.00 -0.40 -0.33 0.00 -1.51 0.00 0.00 54.79 52.56 1n60 n ASP 313 Cb 0.00 -3.44 -0.14 0.00 2.34 0.00 0.00 41.12 39.88 1n60 n ASP 313 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 1n60 s TYR 314 N -3.23 2.72 -0.36 -0.67 1.51 -0.89 -1.83 117.35 114.61 1n60 s TYR 314 Ca 0.02 -0.53 -0.03 0.00 -1.01 0.00 0.00 57.07 55.52 1n60 s TYR 314 Cb -0.00 -1.74 0.07 0.00 -0.11 0.00 0.00 41.96 40.18 1n60 s TYR 314 CO 0.46 -0.10 0.11 -1.01 -1.11 0.00 0.00 175.55 173.90 1n60 s HIS 315 N -0.04 3.40 -0.33 2.71 3.76 0.09 -0.40 115.29 124.49 1n60 s HIS 315 Ca -0.04 -2.01 -0.02 0.00 -0.15 0.00 0.00 55.06 52.84 1n60 s HIS 315 Cb -0.14 -2.64 0.06 0.00 1.11 0.00 0.00 32.58 30.97 1n60 s HIS 315 CO 0.04 -0.86 0.06 -1.64 -0.85 0.00 0.00 174.74 171.48 1n60 s MET 316 N 1.24 2.34 -0.47 1.40 1.00 0.53 -1.18 119.30 124.16 1n60 s MET 316 Ca 0.01 -1.38 -0.26 0.00 0.00 0.00 0.00 55.69 54.06 1n60 s MET 316 Cb -0.21 -3.30 0.03 0.00 0.00 0.00 0.00 34.83 31.35 1n60 s MET 316 CO -0.02 -0.73 0.99 0.99 0.00 0.00 0.00 175.02 176.25 1n60 s THR 317 N 1.24 4.39 -0.08 2.05 2.01 0.78 -0.83 115.64 125.19 1n60 s THR 317 Ca -0.02 0.85 0.03 0.00 0.31 0.00 0.00 61.69 62.86 1n60 s THR 317 Cb -0.20 -4.49 0.01 0.00 0.01 0.00 0.00 72.50 67.83 1n60 s THR 317 CO -0.01 -0.90 -0.17 -0.89 -0.69 0.00 0.00 174.62 171.96 1n60 s THR 318 N 3.97 1.50 -0.00 -0.82 2.01 0.22 -0.73 115.64 121.78 1n60 s THR 318 Ca 0.40 -0.68 0.02 0.00 0.31 0.00 0.00 61.69 61.74 1n60 s THR 318 Cb -0.09 -1.33 -0.01 0.00 0.01 0.00 0.00 72.50 71.08 1n60 s THR 318 CO 0.28 0.44 -0.07 -1.61 -0.69 0.00 0.00 174.62 172.96 1n60 s GLU 319 N 0.60 0.57 -0.03 4.92 2.02 0.34 -1.55 118.70 125.56 1n60 s GLU 319 Ca -0.15 -0.26 0.08 0.00 0.02 0.00 0.00 54.97 54.66 1n60 s GLU 319 Cb -0.16 -0.55 -0.02 0.00 0.10 0.00 0.00 34.13 33.50 1n60 s GLU 319 CO 0.05 0.15 -0.25 -0.51 0.02 0.00 0.00 175.26 174.72 1n60 s LEU 320 N -0.18 2.05 -0.10 1.80 1.43 -0.20 -1.13 118.68 122.35 1n60 s LEU 320 Ca 0.03 -0.47 -0.03 0.00 -1.03 0.00 0.00 54.13 52.63 1n60 s LEU 320 Cb -0.03 -1.32 -0.03 0.00 0.03 0.00 0.00 46.19 44.84 1n60 s LEU 320 CO -0.00 0.30 0.01 0.00 0.23 0.00 0.00 176.35 176.89 1n60 s ALA 321 N -0.53 3.30 0.10 4.21 0.00 -0.34 -0.69 121.76 127.81 1n60 s ALA 321 Ca 0.08 -0.79 -0.12 0.00 0.00 0.00 0.00 51.96 51.13 1n60 s ALA 321 Cb -0.10 -1.56 0.01 0.00 0.00 0.00 0.00 23.12 21.47 1n60 s ALA 321 CO -0.00 0.51 0.28 0.00 0.00 0.00 0.00 175.76 176.55 1n60 s ALA 322 N -0.64 -0.54 0.66 0.00 0.00 -0.16 -0.21 121.76 120.87 1n60 s ALA 322 Ca 0.11 -0.34 -0.11 0.00 0.00 0.00 0.00 51.96 51.61 1n60 s ALA 322 Cb -0.12 0.56 -0.01 0.00 0.00 0.00 0.00 23.12 23.55 1n60 s ALA 322 CO 0.02 -0.56 1.05 0.95 0.00 0.00 0.00 175.76 177.23 1n60 s THR 323 N -3.74 4.25 0.47 0.00 -4.23 -0.33 -1.33 115.64 110.74 1n60 s THR 323 Ca 0.03 0.73 0.20 0.00 -1.18 0.00 0.00 61.69 61.48 1n60 s THR 323 Cb 0.03 -3.64 0.25 0.00 1.34 0.00 0.00 72.50 70.49 1n60 s THR 323 CO -0.11 -0.96 2.07 0.11 -0.54 0.00 0.00 174.62 175.20 1n60 h LYS 324 N -0.53 0.00 -0.00 3.99 1.57 -1.91 -0.36 116.57 119.33 1n60 h LYS 324 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1n60 h LYS 324 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1n60 h LYS 324 CO 0.61 0.12 0.00 -0.40 -0.57 0.00 0.00 179.45 179.20 1n60 n ASP 325 N -4.10 0.03 0.00 0.86 5.75 -1.26 -4.91 116.55 112.93 1n60 n ASP 325 Ca -0.02 -1.15 0.00 0.00 -0.01 0.00 0.00 54.79 53.61 1n60 n ASP 325 Cb 0.20 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 1n60 n ASP 325 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1n60 n GLY 326 N 0.94 0.90 3.68 6.12 0.00 -0.14 -5.07 105.19 111.62 1n60 n GLY 326 Ca 0.21 -0.12 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 1n60 n GLY 326 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1n60 s LYS 327 N -0.53 4.31 -0.14 1.61 2.47 -1.26 -4.82 119.74 121.38 1n60 s LYS 327 Ca 0.00 0.76 -0.28 0.00 -1.56 0.00 0.00 55.97 54.89 1n60 s LYS 327 Cb 0.00 -3.52 -0.01 0.00 -1.46 0.00 0.00 37.83 32.84 1n60 s LYS 327 CO 0.00 -0.13 0.93 0.42 0.16 0.00 0.00 175.35 176.74 1n60 s ILE 328 N 1.49 4.82 -0.12 5.43 1.01 -1.26 -1.18 121.20 131.39 1n60 s ILE 328 Ca 0.33 1.86 0.19 0.00 0.00 0.00 0.00 60.65 63.03 1n60 s ILE 328 Cb -0.16 -4.24 -0.27 0.00 0.01 0.00 0.00 42.46 37.80 1n60 s ILE 328 CO 0.13 -0.00 0.23 0.18 0.00 0.00 0.00 174.94 175.48 1n60 n LEU 329 N 5.22 0.00 -3.56 2.97 4.77 0.70 -4.57 117.00 122.54 1n60 n LEU 329 Ca 0.07 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.99 1n60 n LEU 329 Cb 0.48 0.27 -0.02 0.00 -2.33 0.00 0.00 43.42 41.82 1n60 n LEU 329 CO 0.50 0.27 0.85 0.00 -1.33 0.00 0.00 177.39 177.68 1n60 s ALA 330 N -2.88 -1.95 -0.02 -1.18 0.00 -1.17 -3.99 121.76 110.57 1n60 s ALA 330 Ca -0.09 1.26 0.04 0.00 0.00 0.00 0.00 51.96 53.18 1n60 s ALA 330 Cb 0.09 0.17 -0.01 0.00 0.00 0.00 0.00 23.12 23.37 1n60 s ALA 330 CO 0.81 -0.66 -0.13 1.41 0.00 0.00 0.00 175.76 177.19 1n60 s MET 331 N -2.77 1.13 -0.07 0.00 1.75 -1.15 -1.20 119.30 117.00 1n60 s MET 331 Ca 0.08 -0.46 -0.01 0.00 -1.25 0.00 0.00 55.69 54.05 1n60 s MET 331 Cb -0.01 -1.07 0.03 0.00 2.84 0.00 0.00 34.83 36.62 1n60 s MET 331 CO -0.06 0.25 -0.02 0.50 -0.65 0.00 0.00 175.02 175.04 1n60 s ARG 332 N -0.19 0.82 -0.03 4.11 3.52 -0.28 -1.21 118.95 125.68 1n60 s ARG 332 Ca 0.03 0.00 0.01 0.00 -0.13 0.00 0.00 55.73 55.64 1n60 s ARG 332 Cb -0.06 -1.06 0.02 0.00 -1.56 0.00 0.00 34.95 32.28 1n60 s ARG 332 CO -0.00 -0.26 -0.01 0.00 -0.81 0.00 0.00 175.30 174.22 1n60 s HIS 334 N 0.80 1.52 -0.06 0.00 -3.43 0.09 -1.31 115.29 112.91 1n60 s HIS 334 Ca -0.09 -0.40 0.06 0.00 -0.80 0.00 0.00 55.06 53.83 1n60 s HIS 334 Cb -0.12 -1.02 -0.01 0.00 -1.43 0.00 0.00 32.58 30.00 1n60 s HIS 334 CO -0.01 -0.13 -0.24 0.08 -2.00 0.00 0.00 174.74 172.44 1n60 s VAL 335 N -0.01 2.01 -0.27 -5.38 1.01 0.54 -0.16 120.40 118.13 1n60 s VAL 335 Ca -0.02 -1.04 -0.08 0.00 0.00 0.00 0.00 61.98 60.84 1n60 s VAL 335 Cb -0.10 -1.71 -0.02 0.00 0.00 0.00 0.00 36.38 34.55 1n60 s VAL 335 CO 0.01 0.56 0.10 -0.22 0.00 0.00 0.00 175.10 175.55 1n60 s LEU 336 N -0.10 3.71 -0.23 3.92 2.96 -0.32 -0.87 118.68 127.75 1n60 s LEU 336 Ca -0.05 -0.36 -0.07 0.00 -0.22 0.00 0.00 54.13 53.43 1n60 s LEU 336 Cb -0.14 -1.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.57 1n60 s LEU 336 CO 0.04 -0.10 0.05 0.00 -1.32 0.00 0.00 176.35 175.02 1n60 s ALA 337 N 1.60 3.12 -0.46 5.97 0.00 0.60 -0.73 121.76 131.88 1n60 s ALA 337 Ca 0.05 -1.09 -0.20 0.00 0.00 0.00 0.00 51.96 50.73 1n60 s ALA 337 Cb -0.16 -1.99 0.03 0.00 0.00 0.00 0.00 23.12 21.01 1n60 s ALA 337 CO 0.05 -0.39 0.64 0.34 0.00 0.00 0.00 175.76 176.39 1n60 s ASP 338 N 1.42 6.29 0.00 0.00 -1.08 -0.76 -1.05 116.67 121.50 1n60 s ASP 338 Ca 0.05 -0.50 0.23 0.00 -0.52 0.00 0.00 52.55 51.82 1n60 s ASP 338 Cb -0.15 -2.31 0.42 0.00 -1.46 0.00 0.00 42.92 39.43 1n60 s ASP 338 CO 0.03 -0.81 1.40 1.41 0.52 0.00 0.00 175.17 177.72 1n60 n HIS 339 N 6.24 0.44 -4.53 -5.34 8.25 -0.48 -4.84 115.22 114.95 1n60 n HIS 339 Ca -0.03 -0.22 0.00 0.00 -0.26 0.00 0.00 57.72 57.21 1n60 n HIS 339 Cb 0.47 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.58 1n60 n HIS 339 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1n60 n GLY 340 N 1.48 -0.22 0.15 -1.41 0.00 -1.26 -4.15 105.19 99.79 1n60 n GLY 340 Ca 0.19 -1.06 0.03 0.00 0.00 0.00 0.00 46.02 45.18 1n60 n GLY 340 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n60 h ALA 341 N -0.53 0.71 -3.81 4.61 0.00 0.59 -2.05 119.26 118.77 1n60 h ALA 341 Ca 0.00 -0.44 -0.36 0.00 0.00 0.00 0.00 54.91 54.11 1n60 h ALA 341 Cb 0.00 -0.08 -0.27 0.00 0.00 0.00 0.00 17.79 17.45 1n60 h ALA 341 CO 0.00 0.60 -0.77 -0.06 0.00 0.00 0.00 179.25 179.02 1n60 s PHE 342 N -3.04 0.76 -0.77 0.00 0.08 -1.26 -4.85 117.98 108.90 1n60 s PHE 342 Ca 0.04 -0.22 -0.23 0.00 0.12 0.00 0.00 56.93 56.63 1n60 s PHE 342 Cb 0.08 -0.47 0.06 0.00 -0.57 0.00 0.00 43.02 42.12 1n60 s PHE 342 CO 0.74 -0.02 1.15 0.34 -0.10 0.00 0.00 175.22 177.33 1n60 s ASP 343 N -0.56 6.28 -0.16 1.36 -1.08 -1.26 -4.53 116.67 116.71 1n60 s ASP 343 Ca 0.01 -1.04 0.16 0.00 -0.52 0.00 0.00 52.55 51.16 1n60 s ASP 343 Cb -0.05 -2.48 0.52 0.00 -1.46 0.00 0.00 42.92 39.46 1n60 s ASP 343 CO 0.00 -1.52 1.42 0.00 0.52 0.00 0.00 175.17 175.60 1n60 n ALA 344 N 8.21 2.95 -2.09 3.66 0.00 -1.26 -4.10 120.51 127.88 1n60 n ALA 344 Ca 0.07 -2.14 -0.43 0.00 0.00 0.00 0.00 53.44 50.95 1n60 n ALA 344 Cb 0.48 -0.71 -0.03 0.00 0.00 0.00 0.00 19.45 19.19 1n60 n ALA 344 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n60 s ALA 346 N 4.82 3.55 0.00 0.00 0.00 -1.26 -3.63 121.76 125.25 1n60 s ALA 346 Ca 0.72 1.45 0.00 0.00 0.00 0.00 0.00 51.96 54.13 1n60 s ALA 346 Cb -0.27 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.29 1n60 s ALA 346 CO 0.28 -0.89 0.00 -0.25 0.00 0.00 0.00 175.76 174.91 1n60 n ASP 347 N 0.71 0.00 -4.68 0.00 8.00 -1.26 -4.62 116.55 114.69 1n60 n ASP 347 Ca 0.01 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.12 1n60 n ASP 347 Cb 0.40 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.54 1n60 n ASP 347 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1n60 n PRO 348 N -0.03 1.49 0.25 -0.24 -0.02 -1.26 -4.80 135.00 130.39 1n60 n PRO 348 Ca 0.00 0.54 0.10 0.00 -2.02 0.00 0.00 63.50 62.12 1n60 n PRO 348 Cb 0.00 -2.35 0.66 0.00 -0.02 0.00 0.00 33.50 31.79 1n60 n PRO 348 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1n60 h SER 349 N 1.34 0.00 -0.07 2.55 4.64 -1.10 -1.63 113.55 119.28 1n60 h SER 349 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1n60 h SER 349 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1n60 h SER 349 CO 0.56 0.11 0.00 0.29 -0.87 0.00 0.00 176.83 176.92 1n60 n LYS 350 N -4.05 1.52 -3.70 4.77 5.02 -1.26 -4.64 118.16 115.81 1n60 n LYS 350 Ca -0.02 -0.77 -0.28 0.00 -2.02 0.00 0.00 58.31 55.23 1n60 n LYS 350 Cb 0.20 -1.42 -0.11 0.00 -0.02 0.00 0.00 35.03 33.68 1n60 n LYS 350 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1n60 n TRP 351 N -0.04 1.65 0.43 2.13 7.02 -0.61 -4.95 117.44 123.07 1n60 n TRP 351 Ca 0.18 -3.93 0.11 0.00 -1.02 0.00 0.00 57.50 52.84 1n60 n TRP 351 Cb 0.27 -0.29 0.46 0.00 -2.42 0.00 0.00 31.31 29.33 1n60 n TRP 351 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 1n60 n PRO 352 N 2.27 0.16 -0.65 -0.99 -0.04 -1.26 -1.08 135.00 133.41 1n60 n PRO 352 Ca 0.24 0.38 0.04 0.00 -0.04 0.00 0.00 63.50 64.12 1n60 n PRO 352 Cb 0.40 -1.80 0.21 0.00 -0.04 0.00 0.00 33.50 32.27 1n60 n PRO 352 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1n60 n ALA 353 N -1.72 3.76 -0.71 0.55 0.00 -1.26 -5.05 120.51 116.08 1n60 n ALA 353 Ca 0.03 -3.30 0.00 0.00 0.00 0.00 0.00 53.44 50.16 1n60 n ALA 353 Cb 0.23 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.29 1n60 n ALA 353 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n60 n GLY 354 N -1.11 1.93 2.30 0.00 0.00 -0.24 -1.99 105.19 106.08 1n60 n GLY 354 Ca 0.21 -0.44 -0.33 0.00 0.00 0.00 0.00 46.02 45.47 1n60 n GLY 354 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1n60 n PHE 355 N 8.76 3.19 0.24 1.61 3.72 0.87 -4.59 117.46 131.26 1n60 n PHE 355 Ca 0.00 -2.79 0.18 0.00 -0.05 0.00 0.00 57.45 54.79 1n60 n PHE 355 Cb 0.00 -1.34 0.88 0.00 -0.94 0.00 0.00 39.48 38.08 1n60 n PHE 355 CO 0.00 0.00 0.00 1.98 -0.05 0.00 0.00 176.76 178.69 1n60 h MET 356 N 1.81 0.00 -0.10 -1.08 1.85 -1.51 -0.39 114.93 115.51 1n60 h MET 356 Ca 0.61 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.70 1n60 h MET 356 Cb 1.22 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.25 1n60 h MET 356 CO 1.49 0.00 0.00 0.27 -0.40 0.00 0.00 176.91 178.27 1n60 n ASN 357 N -3.56 0.10 -0.83 1.39 6.94 -1.26 -1.61 115.26 116.42 1n60 n ASN 357 Ca 0.01 -1.06 0.06 0.00 -0.02 0.00 0.00 54.58 53.57 1n60 n ASN 357 Cb 0.32 -0.05 0.18 0.00 -2.36 0.00 0.00 39.78 37.87 1n60 n ASN 357 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1n60 n ILE 358 N -0.36 0.71 0.58 1.53 0.13 -0.16 -4.56 119.36 117.23 1n60 n ILE 358 Ca 0.00 -0.58 0.06 0.00 -1.10 0.00 0.00 62.75 61.13 1n60 n ILE 358 Cb 0.03 0.15 0.31 0.00 -0.84 0.00 0.00 39.64 39.28 1n60 n ILE 358 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1n60 n THR 360 N -1.29 0.36 -4.66 0.00 -2.24 -1.26 -4.36 114.28 100.83 1n60 n THR 360 Ca 0.06 0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 1n60 n THR 360 Cb 0.10 -0.68 0.00 0.00 -2.10 0.00 0.00 70.33 67.65 1n60 n THR 360 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n60 n GLY 361 N 0.96 1.71 0.83 3.38 0.00 -0.34 -3.19 105.19 108.54 1n60 n GLY 361 Ca 0.06 -0.61 0.05 0.00 0.00 0.00 0.00 46.02 45.52 1n60 n GLY 361 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1n60 n SER 362 N 1.13 2.37 -4.46 1.61 7.64 -1.26 -4.83 113.62 115.82 1n60 n SER 362 Ca 0.00 -2.14 -0.30 0.00 1.01 0.00 0.00 58.87 57.44 1n60 n SER 362 Cb 0.00 -0.35 -0.12 0.00 -1.01 0.00 0.00 64.21 62.73 1n60 n SER 362 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1n60 s TYR 363 N -1.62 2.55 -0.60 1.43 2.02 -1.19 -1.47 117.35 118.47 1n60 s TYR 363 Ca 0.25 -0.26 -0.22 0.00 -0.37 0.00 0.00 57.07 56.47 1n60 s TYR 363 Cb 0.15 -1.44 0.06 0.00 -0.40 0.00 0.00 41.96 40.33 1n60 s TYR 363 CO 0.14 0.27 0.89 0.34 -1.57 0.00 0.00 175.55 175.62 1n60 s ASP 364 N -1.56 6.23 -0.03 2.29 2.15 -0.07 -4.72 116.67 120.96 1n60 s ASP 364 Ca 0.15 -0.81 0.07 0.00 0.43 0.00 0.00 52.55 52.40 1n60 s ASP 364 Cb -0.10 -2.40 -0.02 0.00 -0.30 0.00 0.00 42.92 40.10 1n60 s ASP 364 CO 0.06 -1.27 -0.25 -0.04 -0.17 0.00 0.00 175.17 173.50 1n60 s MET 365 N 3.72 2.14 0.28 4.34 -1.94 -1.26 -4.86 119.30 121.72 1n60 s MET 365 Ca 0.23 -0.91 -0.01 0.00 -1.71 0.00 0.00 55.69 53.30 1n60 s MET 365 Cb -0.16 -2.02 0.40 0.00 2.01 0.00 0.00 34.83 35.06 1n60 s MET 365 CO 0.13 0.52 1.80 -1.35 -0.01 0.00 0.00 175.02 176.10 1n60 h PRO 366 N 5.61 0.76 -3.01 2.03 0.11 -1.81 -3.41 132.00 132.29 1n60 h PRO 366 Ca -0.41 -0.18 -0.08 0.00 0.11 0.00 0.00 66.00 65.44 1n60 h PRO 366 Cb 1.13 -0.10 -0.17 0.00 0.11 0.00 0.00 31.00 31.97 1n60 h PRO 366 CO 0.47 0.74 -0.12 0.54 -0.21 0.00 0.00 178.00 179.43 1n60 s VAL 367 N -5.06 0.06 0.20 3.15 0.11 -1.26 -4.87 120.40 112.73 1n60 s VAL 367 Ca -0.09 -0.45 -0.23 0.00 -2.93 0.00 0.00 61.98 58.28 1n60 s VAL 367 Cb 0.15 -0.92 0.05 0.00 -1.53 0.00 0.00 36.38 34.13 1n60 s VAL 367 CO 0.80 -0.25 0.73 0.00 -3.33 0.00 0.00 175.10 173.05 1n60 s ALA 368 N -2.32 -1.45 -0.14 1.54 0.00 -1.26 -2.91 121.76 115.22 1n60 s ALA 368 Ca -0.06 0.12 -0.11 0.00 0.00 0.00 0.00 51.96 51.90 1n60 s ALA 368 Cb -0.01 0.80 0.04 0.00 0.00 0.00 0.00 23.12 23.95 1n60 s ALA 368 CO -0.01 -0.92 0.35 -1.58 0.00 0.00 0.00 175.76 173.60 1n60 s HIS 369 N -3.71 -0.42 -0.02 0.00 2.46 -0.35 -1.35 115.29 111.90 1n60 s HIS 369 Ca 0.07 0.99 0.03 0.00 0.47 0.00 0.00 55.06 56.62 1n60 s HIS 369 Cb -0.03 0.15 0.00 0.00 -0.13 0.00 0.00 32.58 32.56 1n60 s HIS 369 CO -0.02 -0.21 -0.09 -1.17 -2.47 0.00 0.00 174.74 170.78 1n60 s LEU 370 N 0.45 1.83 -0.00 8.88 2.96 0.01 -1.35 118.68 131.45 1n60 s LEU 370 Ca -0.02 -0.18 0.03 0.00 -0.22 0.00 0.00 54.13 53.74 1n60 s LEU 370 Cb -0.04 -0.52 -0.01 0.00 0.50 0.00 0.00 46.19 46.12 1n60 s LEU 370 CO -0.02 0.07 -0.10 0.00 -1.32 0.00 0.00 176.35 174.99 1n60 s ALA 371 N 0.11 0.79 -0.05 5.97 0.00 -0.43 -0.93 121.76 127.22 1n60 s ALA 371 Ca -0.02 -0.44 0.01 0.00 0.00 0.00 0.00 51.96 51.51 1n60 s ALA 371 Cb -0.07 -0.19 0.02 0.00 0.00 0.00 0.00 23.12 22.88 1n60 s ALA 371 CO 0.00 0.18 -0.05 0.08 0.00 0.00 0.00 175.76 175.97 1n60 s VAL 372 N -0.30 0.62 -0.12 0.00 1.01 0.43 -0.34 120.40 121.70 1n60 s VAL 372 Ca 0.03 -0.17 0.01 0.00 0.00 0.00 0.00 61.98 61.85 1n60 s VAL 372 Cb -0.04 -0.63 -0.01 0.00 0.00 0.00 0.00 36.38 35.70 1n60 s VAL 372 CO -0.00 0.25 -0.16 -1.81 0.00 0.00 0.00 175.10 173.38 1n60 s ASP 373 N 0.92 3.79 -0.11 3.32 1.01 -0.05 -0.92 116.67 124.63 1n60 s ASP 373 Ca -0.11 -0.38 -0.05 0.00 0.71 0.00 0.00 52.55 52.72 1n60 s ASP 373 Cb -0.14 -1.55 -0.04 0.00 1.01 0.00 0.00 42.92 42.19 1n60 s ASP 373 CO 0.00 0.17 0.09 -0.83 0.21 0.00 0.00 175.17 174.81 1n60 s GLY 374 N 0.33 2.05 0.09 0.21 0.00 -0.45 -0.29 107.32 109.26 1n60 s GLY 374 Ca -0.13 -0.70 0.06 0.00 0.00 0.00 0.00 44.72 43.95 1n60 s GLY 374 CO 0.06 -0.43 -0.15 -1.34 0.00 0.00 0.00 173.10 171.25 1n60 s VAL 375 N -0.94 1.21 0.20 1.40 -7.23 -0.21 -0.38 120.40 114.44 1n60 s VAL 375 Ca 0.14 -1.44 -0.24 0.00 -1.81 0.00 0.00 61.98 58.63 1n60 s VAL 375 Cb -0.12 -1.24 -0.08 0.00 0.56 0.00 0.00 36.38 35.50 1n60 s VAL 375 CO 0.03 -0.27 0.78 -0.31 -0.31 0.00 0.00 175.10 175.02 1n60 s TYR 376 N -1.52 3.82 0.21 2.82 2.02 -0.08 -1.38 117.35 123.24 1n60 s TYR 376 Ca 0.02 1.58 -0.03 0.00 -0.37 0.00 0.00 57.07 58.27 1n60 s TYR 376 Cb -0.08 -2.74 -0.03 0.00 -0.40 0.00 0.00 41.96 38.70 1n60 s TYR 376 CO 0.03 0.44 0.18 0.95 -1.57 0.00 0.00 175.55 175.58 1n60 s THR 377 N -1.29 0.00 -1.37 -0.71 -4.23 -0.77 -4.90 115.64 102.36 1n60 s THR 377 Ca 0.39 -1.92 -0.12 0.00 -1.18 0.00 0.00 61.69 58.87 1n60 s THR 377 Cb -0.21 -2.46 0.10 0.00 1.34 0.00 0.00 72.50 71.27 1n60 s THR 377 CO 0.25 0.00 2.07 0.59 -0.54 0.00 0.00 174.62 176.98 1n60 n ASN 378 N -0.30 4.54 -4.00 3.99 5.03 0.28 -1.15 115.26 123.65 1n60 n ASN 378 Ca 0.02 -2.97 -0.10 0.00 0.87 0.00 0.00 54.58 52.40 1n60 n ASN 378 Cb 0.65 -1.57 -0.07 0.00 -1.02 0.00 0.00 39.78 37.77 1n60 n ASN 378 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1n60 s LYS 379 N 1.77 1.16 0.76 3.52 1.02 -1.23 -4.56 119.74 122.17 1n60 s LYS 379 Ca 0.44 -1.23 -0.15 0.00 0.02 0.00 0.00 55.97 55.05 1n60 s LYS 379 Cb 0.12 0.36 0.05 0.00 -0.52 0.00 0.00 37.83 37.85 1n60 s LYS 379 CO -0.04 -0.42 1.24 0.00 -0.92 0.00 0.00 175.35 175.21 1n60 s ALA 380 N -3.99 2.00 0.77 5.17 0.00 -1.26 -0.80 121.76 123.66 1n60 s ALA 380 Ca 0.19 0.97 -0.07 0.00 0.00 0.00 0.00 51.96 53.05 1n60 s ALA 380 Cb 0.04 -3.52 0.12 0.00 0.00 0.00 0.00 23.12 19.76 1n60 s ALA 380 CO 0.01 -2.09 1.08 -1.54 0.00 0.00 0.00 175.76 173.23 1n60 s SER 381 N -1.91 4.22 0.00 0.00 1.04 -1.26 -4.10 113.70 111.69 1n60 s SER 381 Ca 0.76 0.11 0.00 0.00 0.48 0.00 0.00 55.95 57.30 1n60 s SER 381 Cb -0.32 -0.51 0.00 0.00 0.10 0.00 0.00 66.02 65.29 1n60 s SER 381 CO 0.47 -1.97 0.00 0.61 0.98 0.00 0.00 173.24 173.33 1n60 n GLY 382 N -3.09 0.48 0.00 7.32 0.00 -1.26 -2.51 105.19 106.12 1n60 n GLY 382 Ca 0.12 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1n60 n GLY 382 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n60 n GLY 383 N 0.00 3.04 3.55 -0.02 0.00 0.38 -3.67 105.19 108.46 1n60 n GLY 383 Ca 0.00 -0.63 -0.41 0.00 0.00 0.00 0.00 46.02 44.97 1n60 n GLY 383 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n60 s VAL 384 N 0.00 5.03 0.00 1.61 1.01 -1.26 -2.07 120.40 124.72 1n60 s VAL 384 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.24 1n60 s VAL 384 Cb 0.00 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.42 1n60 s VAL 384 CO 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 175.10 174.88 1n60 n ALA 385 N 5.70 0.00 -2.98 5.51 0.00 -1.26 -4.48 120.51 123.01 1n60 n ALA 385 Ca -0.05 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.27 1n60 n ALA 385 Cb 0.49 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.00 1n60 n ALA 385 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1n60 n TYR 386 N -0.10 -1.50 -3.44 0.00 9.36 0.11 -3.32 117.16 118.27 1n60 n TYR 386 Ca 0.00 0.62 -0.20 0.00 3.32 0.00 0.00 57.90 61.64 1n60 n TYR 386 Cb 0.00 -3.98 0.07 0.00 -0.63 0.00 0.00 39.34 34.80 1n60 n TYR 386 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1n60 n ARG 387 N -3.11 -6.93 0.05 2.98 1.74 -1.26 -4.93 116.66 105.20 1n60 n ARG 387 Ca -0.16 0.75 0.11 0.00 -0.77 0.00 0.00 57.85 57.78 1n60 n ARG 387 Cb 0.60 -5.54 0.04 0.00 -1.02 0.00 0.00 32.46 26.54 1n60 n ARG 387 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1n60 n SER 389 N -2.14 -5.79 -2.10 0.00 7.64 -1.26 -0.04 113.62 109.93 1n60 n SER 389 Ca 0.01 0.07 -0.02 0.00 1.01 0.00 0.00 58.87 59.94 1n60 n SER 389 Cb 0.47 -4.86 0.01 0.00 -1.01 0.00 0.00 64.21 58.81 1n60 n SER 389 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1n60 n PHE 390 N -3.73 -1.02 -1.08 1.43 3.72 -1.26 -4.24 117.46 111.28 1n60 n PHE 390 Ca -0.24 0.37 -0.03 0.00 -0.05 0.00 0.00 57.45 57.51 1n60 n PHE 390 Cb 0.68 -2.73 -0.01 0.00 -0.94 0.00 0.00 39.48 36.48 1n60 n PHE 390 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1n60 n ARG 391 N -1.64 -0.94 0.08 -1.08 5.12 -1.04 -0.09 116.66 117.06 1n60 n ARG 391 Ca -0.01 0.42 -0.06 0.00 -1.93 0.00 0.00 57.85 56.27 1n60 n ARG 391 Cb 0.52 -4.24 0.09 0.00 -1.16 0.00 0.00 32.46 27.67 1n60 n ARG 391 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1n60 h VAL 392 N 0.00 1.41 -0.49 1.55 2.07 -0.63 -1.52 116.25 118.63 1n60 h VAL 392 Ca -0.06 -2.11 0.10 0.00 0.82 0.00 0.00 66.70 65.45 1n60 h VAL 392 Cb 0.56 2.10 -0.09 0.00 -1.52 0.00 0.00 31.29 32.34 1n60 h VAL 392 CO 0.09 0.62 -0.07 0.71 0.02 0.00 0.00 177.57 178.94 1n60 h THR 393 N 0.17 0.55 -0.34 2.57 1.35 -1.72 0.25 112.91 115.75 1n60 h THR 393 Ca -0.01 -0.02 -0.04 0.00 -0.55 0.00 0.00 66.41 65.79 1n60 h THR 393 Cb 1.19 0.50 -0.01 0.00 -1.73 0.00 0.00 68.15 68.10 1n60 h THR 393 CO 0.10 0.01 0.04 -0.33 -0.25 0.00 0.00 175.52 175.09 1n60 h GLU 394 N 0.05 0.57 -0.47 4.72 3.07 -1.80 -0.44 114.58 120.27 1n60 h GLU 394 Ca 0.24 -0.16 0.04 0.00 -0.50 0.00 0.00 59.36 58.98 1n60 h GLU 394 Cb 0.37 -0.06 -0.04 0.00 -0.84 0.00 0.00 28.75 28.18 1n60 h GLU 394 CO -0.47 0.66 0.25 0.00 -1.40 0.00 0.00 179.01 178.05 1n60 h ALA 395 N 0.88 0.60 -0.28 3.43 0.00 -0.80 -0.10 119.26 122.99 1n60 h ALA 395 Ca 0.10 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.84 1n60 h ALA 395 Cb 0.38 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1n60 h ALA 395 CO 0.01 -0.10 -0.56 0.28 0.00 0.00 0.00 179.25 178.89 1n60 h VAL 396 N 0.49 1.27 -0.53 0.00 2.07 -0.88 -1.75 116.25 116.92 1n60 h VAL 396 Ca 0.20 -1.74 -0.00 0.00 0.82 0.00 0.00 66.70 65.98 1n60 h VAL 396 Cb 0.10 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 1n60 h VAL 396 CO -0.14 0.57 0.33 0.22 0.02 0.00 0.00 177.57 178.57 1n60 h TYR 397 N 0.67 0.69 -0.04 1.57 3.20 -0.83 0.11 116.97 122.33 1n60 h TYR 397 Ca 0.01 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.90 1n60 h TYR 397 Cb 1.17 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 39.19 1n60 h TYR 397 CO 0.07 0.47 -0.07 0.00 -1.64 0.00 0.00 178.16 177.00 1n60 h ALA 398 N 1.16 -0.03 -0.17 1.82 0.00 -0.79 -0.54 119.26 120.72 1n60 h ALA 398 Ca 0.19 0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.96 1n60 h ALA 398 Cb -0.03 0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.90 1n60 h ALA 398 CO -0.04 -0.54 -0.54 0.97 0.00 0.00 0.00 179.25 179.10 1n60 h ILE 399 N -0.09 1.32 0.00 0.00 6.09 -1.14 -0.53 117.51 123.15 1n60 h ILE 399 Ca 0.04 -1.79 -0.11 0.00 -1.37 0.00 0.00 64.86 61.64 1n60 h ILE 399 Cb 0.15 1.98 -0.02 0.00 0.47 0.00 0.00 36.82 39.40 1n60 h ILE 399 CO -0.10 0.56 -0.52 -0.33 -3.07 0.00 0.00 178.15 174.68 1n60 h GLU 400 N 0.34 0.00 -0.18 2.19 4.39 -0.73 0.14 114.58 120.73 1n60 h GLU 400 Ca -0.02 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.46 1n60 h GLU 400 Cb 1.16 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.82 1n60 h GLU 400 CO 0.11 0.52 -0.73 0.00 -1.16 0.00 0.00 179.01 177.76 1n60 h ARG 401 N 0.00 0.82 -0.37 2.33 2.47 -1.11 -3.09 114.38 115.42 1n60 h ARG 401 Ca -0.01 -0.63 -0.08 0.00 -1.26 0.00 0.00 59.98 58.00 1n60 h ARG 401 Cb 1.01 0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 29.43 1n60 h ARG 401 CO 0.07 1.25 -0.11 0.00 0.56 0.00 0.00 179.97 181.74 1n60 h ALA 402 N 0.58 1.12 -0.74 0.04 0.00 -0.49 -0.24 119.26 119.53 1n60 h ALA 402 Ca -0.04 -0.29 0.05 0.00 0.00 0.00 0.00 54.91 54.63 1n60 h ALA 402 Cb 1.35 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 1n60 h ALA 402 CO 0.15 0.55 0.45 0.82 0.00 0.00 0.00 179.25 181.22 1n60 h ILE 403 N 0.59 1.04 -0.34 0.00 1.08 -0.78 0.39 117.51 119.50 1n60 h ILE 403 Ca 0.11 -0.29 -0.17 0.00 -0.39 0.00 0.00 64.86 64.11 1n60 h ILE 403 Cb 0.54 0.13 -0.00 0.00 -3.07 0.00 0.00 36.82 34.41 1n60 h ILE 403 CO 0.03 0.15 -0.47 -0.33 -0.69 0.00 0.00 178.15 176.84 1n60 h GLU 404 N 0.84 0.91 -0.02 2.37 4.39 -1.18 -0.17 114.58 121.71 1n60 h GLU 404 Ca 0.31 -0.53 -0.16 0.00 0.34 0.00 0.00 59.36 59.33 1n60 h GLU 404 Cb 0.11 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 1n60 h GLU 404 CO -0.15 1.18 -0.70 1.79 -1.16 0.00 0.00 179.01 179.97 1n60 h THR 405 N 0.72 1.46 -0.27 1.13 1.35 -0.86 -1.56 112.91 114.89 1n60 h THR 405 Ca 0.04 -2.29 -0.04 0.00 -0.55 0.00 0.00 66.41 63.56 1n60 h THR 405 Cb 1.08 2.23 -0.01 0.00 -1.73 0.00 0.00 68.15 69.71 1n60 h THR 405 CO 0.11 0.66 0.01 0.25 -0.25 0.00 0.00 175.52 176.30 1n60 h LEU 406 N 0.08 0.46 -0.84 3.87 5.85 -0.83 -2.01 115.31 121.90 1n60 h LEU 406 Ca -0.01 -0.30 0.03 0.00 0.84 0.00 0.00 57.88 58.43 1n60 h LEU 406 Cb 1.24 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 42.10 1n60 h LEU 406 CO 0.10 0.65 0.54 0.00 -0.34 0.00 0.00 178.44 179.39 1n60 h ALA 407 N 0.83 1.09 -0.37 1.25 0.00 -0.81 0.74 119.26 122.00 1n60 h ALA 407 Ca 0.08 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1n60 h ALA 407 Cb 0.40 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1n60 h ALA 407 CO 0.01 0.40 0.19 1.96 0.00 0.00 0.00 179.25 181.81 1n60 h GLN 408 N 1.07 0.38 -0.12 0.00 4.20 -1.18 -0.05 115.11 119.42 1n60 h GLN 408 Ca 0.33 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.96 1n60 h GLN 408 Cb -0.03 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 1n60 h GLN 408 CO -0.10 0.25 -0.17 0.00 -0.67 0.00 0.00 178.83 178.14 1n60 h ARG 409 N 0.40 0.19 -0.00 1.46 3.08 -0.48 -2.00 114.38 117.03 1n60 h ARG 409 Ca 0.15 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1n60 h ARG 409 Cb 0.04 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1n60 h ARG 409 CO -0.09 0.37 -0.18 1.28 -1.07 0.00 0.00 179.97 180.27 1n60 n LEU 410 N -4.25 0.30 -3.78 3.04 4.77 0.14 -4.94 117.00 112.28 1n60 n LEU 410 Ca -0.01 0.19 -0.24 0.00 -0.03 0.00 0.00 56.01 55.91 1n60 n LEU 410 Cb 0.29 -0.32 0.03 0.00 -2.33 0.00 0.00 43.42 41.09 1n60 n LEU 410 CO 0.38 0.07 -0.02 -0.62 -1.33 0.00 0.00 177.39 175.87 1n60 n GLU 411 N -1.31 -5.04 -4.59 3.23 1.02 -0.16 -4.99 120.64 108.79 1n60 n GLU 411 Ca 0.09 0.60 -0.28 0.00 -0.02 0.00 0.00 57.16 57.56 1n60 n GLU 411 Cb 0.32 -5.25 -0.14 0.00 -0.02 0.00 0.00 31.44 26.35 1n60 n GLU 411 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 1n60 s MET 412 N -6.22 1.47 0.19 3.49 1.75 -0.43 -5.04 119.30 114.52 1n60 s MET 412 Ca 0.22 -1.16 -0.31 0.00 -1.25 0.00 0.00 55.69 53.19 1n60 s MET 412 Cb -0.11 -1.75 -0.10 0.00 2.84 0.00 0.00 34.83 35.71 1n60 s MET 412 CO 0.82 0.43 1.52 0.34 -0.65 0.00 0.00 175.02 177.49 1n60 s ASP 413 N -1.59 6.61 0.50 1.11 -1.08 -1.26 -4.41 116.67 116.54 1n60 s ASP 413 Ca 0.11 2.63 0.29 0.00 -0.52 0.00 0.00 52.55 55.06 1n60 s ASP 413 Cb -0.10 -2.60 1.04 0.00 -1.46 0.00 0.00 42.92 39.80 1n60 s ASP 413 CO 0.04 -0.78 1.86 0.77 0.52 0.00 0.00 175.17 177.57 1n60 h SER 414 N 6.19 0.00 -0.19 -0.34 4.64 -1.92 -1.30 113.55 120.63 1n60 h SER 414 Ca -0.44 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.86 1n60 h SER 414 Cb 1.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1n60 h SER 414 CO 0.87 0.06 0.02 0.00 -0.87 0.00 0.00 176.83 176.91 1n60 h ALA 415 N 1.94 0.25 -0.57 5.18 0.00 -1.98 -2.08 119.26 122.00 1n60 h ALA 415 Ca -0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1n60 h ALA 415 Cb 0.68 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1n60 h ALA 415 CO 0.01 -0.07 0.20 -0.44 0.00 0.00 0.00 179.25 178.95 1n60 h ASP 416 N 0.10 0.78 -0.65 0.00 3.32 -1.81 -0.74 116.42 117.41 1n60 h ASP 416 Ca 0.06 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 56.96 1n60 h ASP 416 Cb 0.32 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 1n60 h ASP 416 CO 0.00 0.72 0.28 0.25 -1.72 0.00 0.00 179.24 178.77 1n60 h LEU 417 N 0.83 0.88 -0.01 1.55 5.85 -1.13 -1.21 115.31 122.07 1n60 h LEU 417 Ca 0.19 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 1n60 h LEU 417 Cb 0.20 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.00 1n60 h LEU 417 CO -0.01 0.79 0.00 0.03 -0.34 0.00 0.00 178.44 178.92 1n60 h ARG 418 N 0.91 0.02 -0.99 1.25 3.08 -0.94 -2.88 114.38 114.83 1n60 h ARG 418 Ca 0.22 -0.00 0.12 0.00 0.07 0.00 0.00 59.98 60.39 1n60 h ARG 418 Cb 0.17 -0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.13 1n60 h ARG 418 CO -0.02 0.19 0.63 0.82 -1.07 0.00 0.00 179.97 180.51 1n60 h ILE 419 N -0.16 0.93 0.00 2.04 2.04 -0.86 -0.02 117.51 121.49 1n60 h ILE 419 Ca 0.00 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.52 1n60 h ILE 419 Cb 0.18 -0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.11 1n60 h ILE 419 CO -0.00 0.18 -0.05 0.50 0.00 0.00 0.00 178.15 178.78 1n60 h LYS 420 N 0.99 0.00 -0.00 2.37 3.64 -1.02 -3.26 116.57 119.29 1n60 h LYS 420 Ca 0.49 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.87 1n60 h LYS 420 Cb 0.48 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 1n60 h LYS 420 CO -0.25 0.05 -0.06 0.09 -2.27 0.00 0.00 179.45 177.01 1n60 n ASN 421 N -3.31 0.86 -4.75 4.20 3.02 -0.24 -4.98 115.26 110.05 1n60 n ASN 421 Ca -0.01 -0.93 -0.40 0.00 -0.03 0.00 0.00 54.58 53.21 1n60 n ASN 421 Cb 0.20 0.38 0.02 0.00 -0.61 0.00 0.00 39.78 39.78 1n60 n ASN 421 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1n60 n PHE 422 N -0.29 2.56 -1.76 3.10 3.72 -0.19 -0.89 117.46 123.71 1n60 n PHE 422 Ca 0.02 0.44 -0.42 0.00 -0.05 0.00 0.00 57.45 57.44 1n60 n PHE 422 Cb 0.07 -2.43 -0.03 0.00 -0.94 0.00 0.00 39.48 36.15 1n60 n PHE 422 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1n60 s ILE 423 N -1.21 2.11 0.34 4.37 1.01 -0.54 -4.52 121.20 122.76 1n60 s ILE 423 Ca 0.63 0.08 -0.08 0.00 0.00 0.00 0.00 60.65 61.29 1n60 s ILE 423 Cb -0.45 -3.05 -0.06 0.00 0.01 0.00 0.00 42.46 38.91 1n60 s ILE 423 CO 0.56 0.01 0.66 -1.10 0.00 0.00 0.00 174.94 175.07 1n60 s GLN 424 N 0.99 3.72 0.38 2.79 -1.52 -1.26 -4.55 119.66 120.20 1n60 s GLN 424 Ca 0.73 0.26 0.07 0.00 -1.95 0.00 0.00 55.36 54.47 1n60 s GLN 424 Cb -0.49 -2.52 0.80 0.00 -0.22 0.00 0.00 33.01 30.59 1n60 s GLN 424 CO 0.34 0.09 1.97 -1.35 -0.25 0.00 0.00 175.29 176.08 1n60 h PRO 425 N 1.51 0.66 0.00 2.91 0.11 -1.95 -0.18 132.00 135.06 1n60 h PRO 425 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1n60 h PRO 425 Cb 1.19 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1n60 h PRO 425 CO 0.65 0.44 0.00 -0.85 -0.21 0.00 0.00 178.00 178.03 1n60 n GLU 426 N -4.48 0.12 0.00 1.05 0.00 -1.26 -2.44 120.64 113.63 1n60 n GLU 426 Ca 0.10 0.35 0.14 0.00 0.00 0.00 0.00 57.16 57.75 1n60 n GLU 426 Cb 0.25 -1.73 0.63 0.00 0.00 0.00 0.00 31.44 30.59 1n60 n GLU 426 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1n60 n GLN 427 N -1.96 0.50 -3.17 3.44 6.02 -0.08 -4.86 117.38 117.27 1n60 n GLN 427 Ca 0.03 -0.13 -0.35 0.00 -0.01 0.00 0.00 57.00 56.54 1n60 n GLN 427 Cb 0.22 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.92 1n60 n GLN 427 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1n60 s PHE 428 N -2.59 3.56 0.17 1.08 0.40 -1.02 -3.02 117.98 116.56 1n60 s PHE 428 Ca 0.26 1.27 -0.31 0.00 -0.60 0.00 0.00 56.93 57.55 1n60 s PHE 428 Cb 0.20 -2.54 -0.09 0.00 0.51 0.00 0.00 43.02 41.10 1n60 s PHE 428 CO 0.49 0.29 1.35 -2.14 0.70 0.00 0.00 175.22 175.91 1n60 s PRO 429 N -2.26 4.35 -0.26 0.24 0.02 -1.26 -5.01 135.00 130.83 1n60 s PRO 429 Ca 0.45 2.08 -0.07 0.00 0.02 0.00 0.00 61.00 63.49 1n60 s PRO 429 Cb -0.15 -3.21 -0.02 0.00 0.02 0.00 0.00 34.50 31.15 1n60 s PRO 429 CO 0.20 -0.34 0.06 -0.47 -0.33 0.00 0.00 177.00 176.11 1n60 s TYR 430 N 0.50 3.08 -0.44 6.54 5.04 -0.56 -4.86 117.35 126.64 1n60 s TYR 430 Ca 0.60 -0.63 -0.27 0.00 -2.44 0.00 0.00 57.07 54.33 1n60 s TYR 430 Cb -0.37 -2.22 0.03 0.00 0.35 0.00 0.00 41.96 39.74 1n60 s TYR 430 CO 0.35 -0.44 1.01 1.41 -1.34 0.00 0.00 175.55 176.55 1n60 s MET 431 N 1.57 3.68 0.59 4.97 -2.45 -1.26 -0.25 119.30 126.15 1n60 s MET 431 Ca 0.05 0.43 -0.10 0.00 -1.25 0.00 0.00 55.69 54.82 1n60 s MET 431 Cb -0.15 -3.89 -0.04 0.00 1.25 0.00 0.00 34.83 31.99 1n60 s MET 431 CO 0.02 -1.22 0.99 0.00 1.05 0.00 0.00 175.02 175.86 1n60 s ALA 432 N 3.97 3.15 -1.44 4.11 0.00 0.01 -4.94 121.76 126.61 1n60 s ALA 432 Ca 0.42 -0.14 0.17 0.00 0.00 0.00 0.00 51.96 52.41 1n60 s ALA 432 Cb -0.09 -3.00 0.85 0.00 0.00 0.00 0.00 23.12 20.87 1n60 s ALA 432 CO 0.27 -0.60 1.49 -0.35 0.00 0.00 0.00 175.76 176.56 1n60 n PRO 433 N -2.58 0.24 -0.27 0.00 -0.04 -1.26 -1.46 135.00 129.63 1n60 n PRO 433 Ca 0.05 0.13 0.07 0.00 -0.04 0.00 0.00 63.50 63.70 1n60 n PRO 433 Cb 0.54 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.69 1n60 n PRO 433 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1n60 n LEU 434 N -1.28 3.21 0.00 1.53 4.77 -1.26 -4.44 117.00 119.53 1n60 n LEU 434 Ca 0.08 -2.52 0.00 0.00 -0.03 0.00 0.00 56.01 53.54 1n60 n LEU 434 Cb 0.13 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 1n60 n LEU 434 CO 0.13 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 1n60 n GLY 435 N -0.16 0.84 3.81 -0.72 0.00 -0.54 -4.82 105.19 103.61 1n60 n GLY 435 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 1n60 n GLY 435 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1n60 s TRP 436 N -2.03 3.76 -0.45 1.61 0.52 -1.26 -4.83 118.94 116.27 1n60 s TRP 436 Ca 0.00 1.27 -0.13 0.00 0.02 0.00 0.00 56.10 57.26 1n60 s TRP 436 Cb 0.00 -2.50 0.08 0.00 -1.15 0.00 0.00 33.47 29.90 1n60 s TRP 436 CO 0.00 0.53 0.34 -2.00 0.02 0.00 0.00 176.95 175.84 1n60 s GLU 437 N -1.34 2.80 0.29 4.98 2.12 -1.26 -0.81 118.70 125.47 1n60 s GLU 437 Ca 0.32 -1.42 -0.29 0.00 0.36 0.00 0.00 54.97 53.94 1n60 s GLU 437 Cb -0.19 -3.98 -0.10 0.00 0.26 0.00 0.00 34.13 30.13 1n60 s GLU 437 CO 0.20 -1.01 1.29 0.71 -0.54 0.00 0.00 175.26 175.91 1n60 s TYR 438 N 1.54 3.16 -0.06 5.30 1.51 0.65 -4.75 117.35 124.70 1n60 s TYR 438 Ca 0.04 1.37 -0.23 0.00 -1.01 0.00 0.00 57.07 57.23 1n60 s TYR 438 Cb -0.24 -3.62 -0.29 0.00 -0.11 0.00 0.00 41.96 37.70 1n60 s TYR 438 CO 0.04 -1.77 0.91 0.38 -1.11 0.00 0.00 175.55 174.00 1n60 h ASP 439 N 4.06 0.36 -4.55 2.29 2.03 -1.88 -1.49 116.42 117.23 1n60 h ASP 439 Ca -0.47 -0.92 0.07 0.00 -0.73 0.00 0.00 57.03 54.97 1n60 h ASP 439 Cb 1.22 -0.12 -0.18 0.00 -0.83 0.00 0.00 39.33 39.43 1n60 h ASP 439 CO 0.70 1.25 0.45 -0.94 -1.03 0.00 0.00 179.24 179.67 1n60 s SER 440 N -6.73 -0.42 -0.30 4.15 1.04 -1.26 -4.19 113.70 105.99 1n60 s SER 440 Ca -0.15 0.22 -0.26 0.00 0.48 0.00 0.00 55.95 56.25 1n60 s SER 440 Cb 0.00 0.40 0.19 0.00 0.10 0.00 0.00 66.02 66.71 1n60 s SER 440 CO 0.79 -0.56 1.44 -0.83 0.98 0.00 0.00 173.24 175.07 1n60 s GLY 441 N -1.90 0.33 -0.51 7.32 0.00 -1.26 -4.84 107.32 106.46 1n60 s GLY 441 Ca 0.00 3.45 0.04 0.00 0.00 0.00 0.00 44.72 48.21 1n60 s GLY 441 CO -0.03 1.81 0.35 0.21 0.00 0.00 0.00 173.10 175.44 1n60 s ASN 442 N -0.15 3.33 -0.05 1.64 3.04 -1.26 -4.10 114.94 117.38 1n60 s ASN 442 Ca 0.08 -3.15 -0.24 0.00 0.04 0.00 0.00 52.86 49.58 1n60 s ASN 442 Cb -0.04 -1.03 -0.23 0.00 -1.54 0.00 0.00 41.25 38.41 1n60 s ASN 442 CO -0.15 -0.18 1.06 1.88 -3.04 0.00 0.00 177.10 176.67 1n60 h TYR 443 N 5.97 0.23 -0.96 0.43 0.05 -1.95 -2.98 116.97 117.76 1n60 h TYR 443 Ca 0.13 -0.12 0.06 0.00 0.05 0.00 0.00 58.73 58.85 1n60 h TYR 443 Cb 0.87 -0.03 -0.06 0.00 1.01 0.00 0.00 36.73 38.51 1n60 h TYR 443 CO 0.48 0.89 0.62 -1.35 -1.05 0.00 0.00 178.16 177.75 1n60 h PRO 444 N -0.49 1.09 -0.41 4.88 0.11 -1.94 0.23 132.00 135.48 1n60 h PRO 444 Ca -0.02 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 65.97 1n60 h PRO 444 Cb 0.93 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 31.78 1n60 h PRO 444 CO 0.04 0.72 0.05 1.25 -0.21 0.00 0.00 178.00 179.85 1n60 h LEU 445 N 1.12 0.67 -0.43 2.35 7.12 -1.99 -1.04 115.31 123.10 1n60 h LEU 445 Ca 0.41 -0.27 -0.09 0.00 0.13 0.00 0.00 57.88 58.06 1n60 h LEU 445 Cb 0.16 -0.18 -0.01 0.00 -0.53 0.00 0.00 40.66 40.10 1n60 h LEU 445 CO -0.16 0.77 -0.07 0.00 -0.13 0.00 0.00 178.44 178.86 1n60 h ALA 446 N 0.92 0.59 -0.61 1.25 0.00 -1.28 -0.81 119.26 119.31 1n60 h ALA 446 Ca 0.12 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1n60 h ALA 446 Cb 0.40 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1n60 h ALA 446 CO 0.01 0.45 0.33 1.98 0.00 0.00 0.00 179.25 182.02 1n60 h MET 447 N 0.64 0.86 -0.45 0.00 1.85 -0.84 -0.13 114.93 116.87 1n60 h MET 447 Ca 0.11 -0.10 -0.02 0.00 -0.61 0.00 0.00 59.70 59.07 1n60 h MET 447 Cb 0.60 -0.17 -0.02 0.00 0.43 0.00 0.00 31.60 32.44 1n60 h MET 447 CO 0.04 0.66 0.18 -0.22 -0.40 0.00 0.00 176.91 177.17 1n60 h LYS 448 N 0.83 0.67 -0.69 0.39 3.64 -1.04 0.04 116.57 120.41 1n60 h LYS 448 Ca 0.22 -0.12 0.01 0.00 -1.27 0.00 0.00 60.65 59.48 1n60 h LYS 448 Cb 0.05 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 1n60 h LYS 448 CO -0.03 0.61 0.45 -0.22 -2.27 0.00 0.00 179.45 177.99 1n60 h LYS 449 N 0.58 0.91 -0.14 1.90 3.64 -0.78 -0.41 116.57 122.27 1n60 h LYS 449 Ca 0.15 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 1n60 h LYS 449 Cb 0.18 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 1n60 h LYS 449 CO -0.01 0.61 0.02 0.00 -2.27 0.00 0.00 179.45 177.79 1n60 h ALA 450 N 1.25 0.19 -0.74 5.00 0.00 -0.76 -0.86 119.26 123.34 1n60 h ALA 450 Ca 0.25 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1n60 h ALA 450 Cb -0.10 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 1n60 h ALA 450 CO -0.05 -0.14 0.44 0.52 0.00 0.00 0.00 179.25 180.02 1n60 h MET 451 N 0.01 1.00 -0.60 0.00 2.86 -0.76 -1.54 114.93 115.91 1n60 h MET 451 Ca 0.04 -0.09 -0.10 0.00 -2.06 0.00 0.00 59.70 57.49 1n60 h MET 451 Cb 0.31 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 1n60 h MET 451 CO 0.00 0.71 -0.00 -0.44 1.06 0.00 0.00 176.91 178.25 1n60 h ASP 452 N 1.01 1.02 -0.45 1.22 3.32 -0.99 -0.96 116.42 120.58 1n60 h ASP 452 Ca 0.26 -0.29 -0.07 0.00 0.02 0.00 0.00 57.03 56.95 1n60 h ASP 452 Cb -0.03 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.23 1n60 h ASP 452 CO -0.05 1.07 -0.01 0.74 -1.72 0.00 0.00 179.24 179.27 1n60 h THR 453 N 0.96 1.26 -0.00 0.35 2.02 -0.59 -2.97 112.91 113.93 1n60 h THR 453 Ca 0.17 -1.07 0.00 0.00 0.77 0.00 0.00 66.41 66.28 1n60 h THR 453 Cb 0.55 1.05 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 1n60 h THR 453 CO 0.03 0.37 -0.15 1.33 0.37 0.00 0.00 175.52 177.47 1n60 n VAL 454 N -4.37 0.00 -2.76 3.16 0.24 -0.63 -4.94 118.33 109.03 1n60 n VAL 454 Ca 0.00 -0.03 -0.10 0.00 -2.04 0.00 0.00 64.34 62.17 1n60 n VAL 454 Cb 0.31 -0.16 0.05 0.00 -1.47 0.00 0.00 33.84 32.57 1n60 n VAL 454 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1n60 n GLY 455 N 1.38 -0.18 0.15 7.63 0.00 -0.48 -4.78 105.19 108.92 1n60 n GLY 455 Ca 0.11 0.03 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 1n60 n GLY 455 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1n60 h TYR 456 N -0.97 -0.27 -0.25 1.61 3.20 -1.54 -0.31 116.97 118.43 1n60 h TYR 456 Ca -0.37 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.45 1n60 h TYR 456 Cb 1.20 0.11 -0.01 0.00 1.54 0.00 0.00 36.73 39.57 1n60 h TYR 456 CO 0.24 -0.16 -0.08 0.45 -1.64 0.00 0.00 178.16 176.96 1n60 h HIS 457 N -0.20 0.42 -0.54 -3.82 3.86 -1.92 -1.29 115.15 111.65 1n60 h HIS 457 Ca 0.02 -0.05 -0.09 0.00 -1.16 0.00 0.00 60.37 59.10 1n60 h HIS 457 Cb 0.23 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.56 1n60 h HIS 457 CO -0.15 0.48 -0.01 1.96 0.86 0.00 0.00 177.93 181.08 1n60 h GLN 458 N 0.38 0.94 -0.80 2.45 7.50 -1.78 -2.23 115.11 121.58 1n60 h GLN 458 Ca 0.08 -0.28 0.04 0.00 0.50 0.00 0.00 58.65 58.99 1n60 h GLN 458 Cb 0.39 -0.09 -0.05 0.00 0.05 0.00 0.00 27.48 27.77 1n60 h GLN 458 CO 0.02 0.93 0.50 -0.07 -1.50 0.00 0.00 178.83 178.71 1n60 h LEU 459 N 0.86 0.81 -1.10 1.46 3.38 -0.10 -0.79 115.31 119.83 1n60 h LEU 459 Ca 0.16 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 1n60 h LEU 459 Cb 0.52 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1n60 h LEU 459 CO 0.03 0.54 0.14 0.03 0.09 0.00 0.00 178.44 179.27 1n60 h ARG 460 N 0.95 0.78 -0.28 1.13 2.47 -0.87 0.48 114.38 119.04 1n60 h ARG 460 Ca 0.33 -0.15 -0.17 0.00 -1.26 0.00 0.00 59.98 58.74 1n60 h ARG 460 Cb 0.07 -0.12 -0.00 0.00 -1.65 0.00 0.00 29.97 28.27 1n60 h ARG 460 CO -0.14 0.69 -0.50 0.00 0.56 0.00 0.00 179.97 180.59 1n60 h ALA 461 N 1.40 0.59 -0.68 0.04 0.00 -0.92 -0.99 119.26 118.69 1n60 h ALA 461 Ca 0.17 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 1n60 h ALA 461 Cb 0.26 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1n60 h ALA 461 CO -0.00 0.68 0.42 1.49 0.00 0.00 0.00 179.25 181.83 1n60 h GLU 462 N 0.61 0.92 -0.21 0.00 4.81 -0.79 -1.80 114.58 118.12 1n60 h GLU 462 Ca 0.03 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1n60 h GLU 462 Cb 1.08 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.25 1n60 h GLU 462 CO 0.11 0.65 0.13 0.37 -0.73 0.00 0.00 179.01 179.54 1n60 h GLN 463 N 0.92 0.28 -0.53 1.92 4.15 -0.71 -0.67 115.11 120.47 1n60 h GLN 463 Ca 0.24 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.68 1n60 h GLN 463 Cb -0.04 -0.06 -0.04 0.00 0.21 0.00 0.00 27.48 27.55 1n60 h GLN 463 CO -0.05 0.22 0.29 -0.22 -1.93 0.00 0.00 178.83 177.14 1n60 h LYS 464 N 0.26 0.55 -0.43 1.69 3.64 -0.97 0.09 116.57 121.39 1n60 h LYS 464 Ca 0.08 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.37 1n60 h LYS 464 Cb 0.00 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.68 1n60 h LYS 464 CO -0.01 0.36 0.03 0.00 -2.27 0.00 0.00 179.45 177.56 1n60 h ALA 465 N 1.27 1.25 -0.33 5.00 0.00 -1.03 -1.57 119.26 123.84 1n60 h ALA 465 Ca 0.23 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1n60 h ALA 465 Cb 0.11 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1n60 h ALA 465 CO -0.14 0.51 -0.30 0.87 0.00 0.00 0.00 179.25 180.19 1n60 h LYS 466 N 0.65 0.70 -0.63 0.00 1.57 -0.40 -0.83 116.57 117.62 1n60 h LYS 466 Ca 0.14 -0.31 -0.03 0.00 -1.87 0.00 0.00 60.65 58.57 1n60 h LYS 466 Cb 0.36 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.62 1n60 h LYS 466 CO 0.01 0.91 0.26 1.96 -0.57 0.00 0.00 179.45 182.02 1n60 h GLN 467 N 0.59 0.94 -0.63 3.15 4.20 -0.56 0.08 115.11 122.89 1n60 h GLN 467 Ca 0.07 -0.16 -0.05 0.00 0.06 0.00 0.00 58.65 58.57 1n60 h GLN 467 Cb 0.80 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.40 1n60 h GLN 467 CO 0.07 0.78 0.19 0.93 -0.67 0.00 0.00 178.83 180.13 1n60 h GLU 468 N 0.88 0.98 -0.51 1.46 5.08 -0.98 -0.96 114.58 120.53 1n60 h GLU 468 Ca 0.21 -0.21 0.04 0.00 -1.00 0.00 0.00 59.36 58.39 1n60 h GLU 468 Cb 0.19 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.26 1n60 h GLU 468 CO -0.02 0.87 0.28 0.00 -1.00 0.00 0.00 179.01 179.14 1n60 h ALA 469 N 1.07 0.65 -0.21 3.43 0.00 -0.81 -1.83 119.26 121.56 1n60 h ALA 469 Ca 0.20 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.16 1n60 h ALA 469 Cb 0.30 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1n60 h ALA 469 CO -0.01 -0.05 -0.04 0.35 0.00 0.00 0.00 179.25 179.50 1n60 h PHE 470 N 0.55 -0.09 0.00 0.00 3.57 -0.36 -0.35 116.94 120.26 1n60 h PHE 470 Ca 0.22 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.73 1n60 h PHE 470 Cb 0.09 0.07 -0.00 0.00 2.79 0.00 0.00 35.95 38.90 1n60 h PHE 470 CO -0.09 -0.08 -0.03 0.87 -2.23 0.00 0.00 178.31 176.76 1n60 h LYS 471 N 0.01 0.00 -0.23 1.11 1.79 -0.77 -1.94 116.57 116.55 1n60 h LYS 471 Ca 0.10 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.57 1n60 h LYS 471 Cb 0.15 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.80 1n60 h LYS 471 CO -0.21 0.03 0.00 0.54 -1.08 0.00 0.00 179.45 178.73 1n60 n ARG 472 N -3.34 1.95 -1.55 3.15 1.74 -0.29 -4.91 116.66 113.41 1n60 n ARG 472 Ca -0.02 -1.43 -0.07 0.00 -0.77 0.00 0.00 57.85 55.55 1n60 n ARG 472 Cb 0.15 -1.42 -0.02 0.00 -1.02 0.00 0.00 32.46 30.15 1n60 n ARG 472 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1n60 n GLY 473 N 1.23 0.61 0.03 -0.13 0.00 -0.73 -4.95 105.19 101.25 1n60 n GLY 473 Ca 0.17 -0.68 0.12 0.00 0.00 0.00 0.00 46.02 45.62 1n60 n GLY 473 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1n60 n GLU 474 N -2.38 0.20 -3.69 1.61 1.02 -0.36 -4.93 120.64 112.12 1n60 n GLU 474 Ca -0.08 0.02 -0.15 0.00 -0.02 0.00 0.00 57.16 56.94 1n60 n GLU 474 Cb 0.36 -1.59 -0.08 0.00 -0.02 0.00 0.00 31.44 30.11 1n60 n GLU 474 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 1n60 s THR 475 N -3.13 0.03 -1.52 2.62 -1.32 -1.25 -4.96 115.64 106.10 1n60 s THR 475 Ca 0.06 -0.26 0.16 0.00 -1.21 0.00 0.00 61.69 60.44 1n60 s THR 475 Cb 0.15 -0.73 0.39 0.00 -1.51 0.00 0.00 72.50 70.80 1n60 s THR 475 CO 0.76 -0.14 1.31 0.54 -2.21 0.00 0.00 174.62 174.88 1n60 n ARG 476 N 1.44 2.51 -4.26 7.08 5.12 -1.26 -4.52 116.66 122.77 1n60 n ARG 476 Ca -0.19 -2.15 -0.34 0.00 -1.93 0.00 0.00 57.85 53.23 1n60 n ARG 476 Cb 0.56 -1.38 -0.09 0.00 -1.16 0.00 0.00 32.46 30.39 1n60 n ARG 476 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1n60 s GLU 477 N -1.08 3.01 0.12 5.56 2.02 -1.26 -1.67 118.70 125.41 1n60 s GLU 477 Ca 0.32 -0.43 0.10 0.00 0.02 0.00 0.00 54.97 54.98 1n60 s GLU 477 Cb 0.17 -2.83 -0.04 0.00 0.10 0.00 0.00 34.13 31.54 1n60 s GLU 477 CO 0.23 0.69 -0.25 0.96 0.02 0.00 0.00 175.26 176.91 1n60 s ILE 478 N -0.99 2.11 -0.11 -1.63 -4.36 -0.01 -4.88 121.20 111.32 1n60 s ILE 478 Ca 0.16 -1.68 0.00 0.00 -0.26 0.00 0.00 60.65 58.87 1n60 s ILE 478 Cb -0.12 -1.87 -0.02 0.00 1.25 0.00 0.00 42.46 41.70 1n60 s ILE 478 CO 0.06 0.07 -0.11 -0.32 0.24 0.00 0.00 174.94 174.87 1n60 s MET 479 N -1.97 3.19 0.06 0.37 -2.45 -1.26 -0.23 119.30 117.00 1n60 s MET 479 Ca 0.12 -0.65 0.09 0.00 -1.25 0.00 0.00 55.69 54.00 1n60 s MET 479 Cb -0.10 -2.62 -0.03 0.00 1.25 0.00 0.00 34.83 33.33 1n60 s MET 479 CO 0.05 0.35 -0.25 0.20 1.05 0.00 0.00 175.02 176.42 1n60 s GLY 480 N 0.01 1.36 -0.27 2.11 0.00 0.82 -4.27 107.32 107.08 1n60 s GLY 480 Ca -0.03 -1.25 0.00 0.00 0.00 0.00 0.00 44.72 43.44 1n60 s GLY 480 CO 0.04 -1.16 -0.05 -0.42 0.00 0.00 0.00 173.10 171.50 1n60 s ILE 481 N -0.85 2.65 -0.10 0.90 1.01 -1.26 -0.83 121.20 122.72 1n60 s ILE 481 Ca 0.11 -1.41 -0.14 0.00 0.00 0.00 0.00 60.65 59.20 1n60 s ILE 481 Cb -0.10 -2.50 -0.05 0.00 0.01 0.00 0.00 42.46 39.83 1n60 s ILE 481 CO 0.03 -0.02 0.35 -0.83 0.00 0.00 0.00 174.94 174.47 1n60 s GLY 482 N 1.21 2.33 -0.04 6.18 0.00 0.91 -4.43 107.32 113.48 1n60 s GLY 482 Ca -0.06 -0.34 0.05 0.00 0.00 0.00 0.00 44.72 44.37 1n60 s GLY 482 CO -0.03 0.36 -0.18 -0.42 0.00 0.00 0.00 173.10 172.83 1n60 s ILE 483 N -0.06 1.49 -0.16 0.90 1.01 -1.26 -0.64 121.20 122.48 1n60 s ILE 483 Ca 0.21 -0.77 -0.04 0.00 0.00 0.00 0.00 60.65 60.05 1n60 s ILE 483 Cb -0.14 -1.27 0.06 0.00 0.01 0.00 0.00 42.46 41.12 1n60 s ILE 483 CO 0.08 0.43 0.11 -0.55 0.00 0.00 0.00 174.94 175.01 1n60 s SER 484 N -0.10 1.96 -0.26 3.58 0.15 -0.24 -4.55 113.70 114.25 1n60 s SER 484 Ca -0.01 -0.42 -0.04 0.00 0.70 0.00 0.00 55.95 56.18 1n60 s SER 484 Cb -0.11 -0.09 0.01 0.00 -1.71 0.00 0.00 66.02 64.12 1n60 s SER 484 CO 0.02 -0.33 -0.01 0.12 1.20 0.00 0.00 173.24 174.24 1n60 s PHE 485 N 2.18 3.07 0.09 3.44 2.19 -1.26 -0.56 117.98 127.13 1n60 s PHE 485 Ca 0.03 -1.20 0.05 0.00 0.33 0.00 0.00 56.93 56.14 1n60 s PHE 485 Cb -0.15 -2.14 -0.03 0.00 -1.31 0.00 0.00 43.02 39.39 1n60 s PHE 485 CO -0.09 -0.63 -0.14 -0.59 1.83 0.00 0.00 175.22 175.61 1n60 s PHE 486 N 1.42 1.24 -0.22 10.12 -0.71 -0.53 -4.70 117.98 124.61 1n60 s PHE 486 Ca 0.02 -0.51 0.00 0.00 -1.04 0.00 0.00 56.93 55.40 1n60 s PHE 486 Cb -0.16 -0.68 0.03 0.00 -1.21 0.00 0.00 43.02 40.99 1n60 s PHE 486 CO -0.02 0.07 -0.12 0.99 -1.34 0.00 0.00 175.22 174.80 1n60 s THR 487 N -1.67 2.46 0.58 -4.49 2.01 -1.26 -1.54 115.64 111.73 1n60 s THR 487 Ca 0.02 -1.08 -0.06 0.00 0.31 0.00 0.00 61.69 60.88 1n60 s THR 487 Cb -0.08 -2.20 -0.00 0.00 0.01 0.00 0.00 72.50 70.24 1n60 s THR 487 CO 0.02 0.30 0.90 -1.61 -0.69 0.00 0.00 174.62 173.54 1n60 s GLU 488 N 1.28 3.04 -0.15 4.92 0.41 0.28 -4.92 118.70 123.56 1n60 s GLU 488 Ca 0.01 0.08 -0.04 0.00 -0.41 0.00 0.00 54.97 54.60 1n60 s GLU 488 Cb -0.16 -2.27 0.06 0.00 -1.78 0.00 0.00 34.13 29.98 1n60 s GLU 488 CO -0.08 -0.63 0.08 -1.50 -0.49 0.00 0.00 175.26 172.65 1n60 s ILE 489 N -2.98 -0.09 0.02 -1.63 2.07 -1.26 -3.94 121.20 113.40 1n60 s ILE 489 Ca 0.53 -0.07 -0.04 0.00 -1.41 0.00 0.00 60.65 59.66 1n60 s ILE 489 Cb -0.11 -0.50 -0.01 0.00 0.13 0.00 0.00 42.46 41.97 1n60 s ILE 489 CO 0.46 -0.20 0.07 0.68 -1.91 0.00 0.00 174.94 174.03 1n60 s VAL 490 N 2.14 0.11 0.00 4.00 -7.23 0.25 -4.94 120.40 114.73 1n60 s VAL 490 Ca 0.02 -0.90 0.00 0.00 -1.81 0.00 0.00 61.98 59.30 1n60 s VAL 490 Cb -0.15 -0.52 0.00 0.00 0.56 0.00 0.00 36.38 36.26 1n60 s VAL 490 CO -0.08 -0.49 0.00 0.61 -0.31 0.00 0.00 175.10 174.83 1n60 n GLY 491 N 1.29 1.22 3.69 2.32 0.00 -1.21 -0.73 105.19 111.78 1n60 n GLY 491 Ca -0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 1n60 n GLY 491 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n60 s ALA 492 N -2.00 3.71 0.00 4.61 0.00 -1.26 -4.66 121.76 122.16 1n60 s ALA 492 Ca 0.00 1.28 0.00 0.00 0.00 0.00 0.00 51.96 53.24 1n60 s ALA 492 Cb 0.00 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 19.41 1n60 s ALA 492 CO 0.00 -1.14 0.00 0.41 0.00 0.00 0.00 175.76 175.03 1n60 n GLY 493 N 4.06 -0.22 3.67 0.00 0.00 -0.30 -4.75 105.19 107.65 1n60 n GLY 493 Ca 0.16 -0.98 -0.44 0.00 0.00 0.00 0.00 46.02 44.77 1n60 n GLY 493 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1n60 n PRO 494 N -0.20 1.98 0.27 1.61 -0.02 -1.24 -4.06 135.00 133.35 1n60 n PRO 494 Ca 0.00 0.70 0.12 0.00 -2.02 0.00 0.00 63.50 62.29 1n60 n PRO 494 Cb 0.00 -2.27 0.76 0.00 -0.02 0.00 0.00 33.50 31.97 1n60 n PRO 494 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1n60 h SER 495 N 2.96 0.00 -0.57 2.55 4.64 -1.78 -0.17 113.55 121.18 1n60 h SER 495 Ca -0.45 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 60.92 1n60 h SER 495 Cb 1.29 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.35 1n60 h SER 495 CO 0.66 0.04 0.38 0.50 -0.87 0.00 0.00 176.83 177.54 1n60 h LYS 496 N 0.00 0.56 0.00 4.77 3.64 -1.94 -3.33 116.57 120.27 1n60 h LYS 496 Ca -0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1n60 h LYS 496 Cb 0.08 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 1n60 h LYS 496 CO 0.00 0.37 0.00 0.27 -2.27 0.00 0.00 179.45 177.83 1n60 n ASN 497 N -4.47 0.18 -4.08 4.20 0.23 -0.82 -5.02 115.26 105.47 1n60 n ASN 497 Ca 0.08 -0.64 -0.32 0.00 -0.53 0.00 0.00 54.58 53.17 1n60 n ASN 497 Cb 0.21 0.13 -0.16 0.00 -2.08 0.00 0.00 39.78 37.88 1n60 n ASN 497 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1n60 s ASP 499 N 1.28 -0.14 -0.34 0.00 -4.77 -1.26 -1.45 116.67 109.99 1n60 s ASP 499 Ca 0.01 -0.02 -0.07 0.00 -3.30 0.00 0.00 52.55 49.17 1n60 s ASP 499 Cb -0.15 0.30 0.04 0.00 -1.09 0.00 0.00 42.92 42.01 1n60 s ASP 499 CO -0.10 -0.46 0.12 -0.63 0.70 0.00 0.00 175.17 174.80 1n60 s ILE 500 N -1.53 3.92 -1.59 2.11 -1.09 0.22 -0.55 121.20 122.69 1n60 s ILE 500 Ca -0.12 -1.08 -0.07 0.00 -2.23 0.00 0.00 60.65 57.14 1n60 s ILE 500 Cb -0.05 -3.22 0.07 0.00 -1.58 0.00 0.00 42.46 37.68 1n60 s ILE 500 CO 0.03 -0.19 0.35 0.18 -1.23 0.00 0.00 174.94 174.08 1n60 n LEU 501 N 4.84 -1.42 0.00 2.97 4.77 -1.26 -0.86 117.00 126.04 1n60 n LEU 501 Ca -0.12 -1.15 0.00 0.00 -0.03 0.00 0.00 56.01 54.70 1n60 n LEU 501 Cb 0.45 -1.86 0.00 0.00 -2.33 0.00 0.00 43.42 39.68 1n60 n LEU 501 CO 0.32 0.37 0.00 0.61 -1.33 0.00 0.00 177.39 177.36 1n60 n GLY 502 N -1.97 1.48 3.58 -0.72 0.00 -1.26 -5.02 105.19 101.28 1n60 n GLY 502 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 1n60 n GLY 502 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n60 s VAL 503 N -2.58 5.01 0.47 1.61 1.01 -0.04 -5.02 120.40 120.88 1n60 s VAL 503 Ca 0.00 0.61 -0.23 0.00 0.00 0.00 0.00 61.98 62.36 1n60 s VAL 503 Cb 0.00 -3.93 -0.08 0.00 0.00 0.00 0.00 36.38 32.37 1n60 s VAL 503 CO 0.00 -0.11 1.20 -1.20 0.00 0.00 0.00 175.10 174.99 1n60 n SER 504 N 5.72 2.12 -3.56 3.32 7.64 -1.26 -0.61 113.62 126.98 1n60 n SER 504 Ca -0.04 1.03 -0.41 0.00 1.01 0.00 0.00 58.87 60.46 1n60 n SER 504 Cb 0.49 -1.48 -0.01 0.00 -1.01 0.00 0.00 64.21 62.21 1n60 n SER 504 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 1n60 n MET 505 N -0.30 4.01 -2.36 1.43 0.00 -0.53 -4.81 117.12 114.56 1n60 n MET 505 Ca 0.09 -3.13 -0.26 0.00 0.00 0.00 0.00 57.70 54.40 1n60 n MET 505 Cb 0.42 -2.80 0.13 0.00 0.00 0.00 0.00 33.22 30.97 1n60 n MET 505 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 175.97 175.38 1n60 s PHE 506 N 0.32 1.63 0.11 2.03 -0.12 -1.26 -1.15 117.98 119.54 1n60 s PHE 506 Ca 0.53 -0.06 0.01 0.00 -0.05 0.00 0.00 56.93 57.36 1n60 s PHE 506 Cb 0.16 -3.36 -0.00 0.00 -0.63 0.00 0.00 43.02 39.18 1n60 s PHE 506 CO -0.06 -2.00 0.12 -3.47 -0.05 0.00 0.00 175.22 169.75 1n60 n ASP 507 N -3.14 -0.31 -3.63 1.98 -0.08 -0.94 -3.82 116.55 106.62 1n60 n ASP 507 Ca 0.15 -1.64 -0.11 0.00 -1.51 0.00 0.00 54.79 51.68 1n60 n ASP 507 Cb 0.60 0.64 -0.05 0.00 2.34 0.00 0.00 41.12 44.65 1n60 n ASP 507 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 1n60 s SER 508 N -1.71 -0.25 -0.07 1.67 1.04 -1.26 -0.35 113.70 112.78 1n60 s SER 508 Ca 0.11 -0.27 -0.10 0.00 0.48 0.00 0.00 55.95 56.17 1n60 s SER 508 Cb 0.00 0.47 0.02 0.00 0.10 0.00 0.00 66.02 66.62 1n60 s SER 508 CO 0.08 -0.83 0.26 0.00 0.98 0.00 0.00 173.24 173.73 1n60 s ALA 509 N -3.63 -0.65 -0.05 5.32 0.00 -0.28 -1.91 121.76 120.55 1n60 s ALA 509 Ca 0.02 0.54 0.02 0.00 0.00 0.00 0.00 51.96 52.54 1n60 s ALA 509 Cb 0.01 -0.25 0.01 0.00 0.00 0.00 0.00 23.12 22.90 1n60 s ALA 509 CO -0.11 -0.17 -0.10 -2.00 0.00 0.00 0.00 175.76 173.38 1n60 s GLU 510 N -0.41 1.34 -0.07 0.00 2.12 0.01 -0.90 118.70 120.80 1n60 s GLU 510 Ca -0.05 -0.32 0.03 0.00 0.36 0.00 0.00 54.97 54.98 1n60 s GLU 510 Cb -0.03 -1.17 0.01 0.00 0.26 0.00 0.00 34.13 33.20 1n60 s GLU 510 CO 0.01 0.02 -0.14 0.42 -0.54 0.00 0.00 175.26 175.04 1n60 s ILE 511 N 0.62 1.25 -0.07 -3.70 1.01 0.62 -0.96 121.20 119.98 1n60 s ILE 511 Ca -0.11 -0.56 0.01 0.00 0.00 0.00 0.00 60.65 59.99 1n60 s ILE 511 Cb -0.14 -1.13 0.02 0.00 0.01 0.00 0.00 42.46 41.23 1n60 s ILE 511 CO 0.02 0.38 -0.06 -0.60 0.00 0.00 0.00 174.94 174.68 1n60 s ARG 512 N 0.55 1.17 -0.20 2.79 3.52 -0.08 -0.95 118.95 125.76 1n60 s ARG 512 Ca -0.14 -0.18 -0.11 0.00 -0.13 0.00 0.00 55.73 55.17 1n60 s ARG 512 Cb -0.15 -1.18 -0.05 0.00 -1.56 0.00 0.00 34.95 32.01 1n60 s ARG 512 CO 0.04 -0.14 0.20 0.42 -0.81 0.00 0.00 175.30 175.01 1n60 s ILE 513 N 1.22 5.36 0.70 4.11 1.01 -0.21 -1.27 121.20 132.12 1n60 s ILE 513 Ca -0.05 0.32 -0.11 0.00 0.00 0.00 0.00 60.65 60.80 1n60 s ILE 513 Cb -0.14 -3.54 0.01 0.00 0.01 0.00 0.00 42.46 38.81 1n60 s ILE 513 CO -0.02 0.40 1.09 -1.00 0.00 0.00 0.00 174.94 175.40 1n60 s HIS 514 N 0.58 3.33 0.40 3.97 3.76 0.46 -4.43 115.29 123.36 1n60 s HIS 514 Ca 0.11 1.10 0.09 0.00 -0.15 0.00 0.00 55.06 56.22 1n60 s HIS 514 Cb -0.12 -3.02 0.89 0.00 1.11 0.00 0.00 32.58 31.44 1n60 s HIS 514 CO 0.01 -1.15 1.99 -1.35 -0.85 0.00 0.00 174.74 173.39 1n60 h PRO 515 N -0.64 0.55 -0.25 8.40 0.11 -1.87 -0.80 132.00 137.50 1n60 h PRO 515 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1n60 h PRO 515 Cb 1.24 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1n60 h PRO 515 CO 0.63 0.37 0.00 0.25 -0.21 0.00 0.00 178.00 179.04 1n60 n THR 516 N -4.48 0.32 0.00 -1.15 -2.24 -1.26 -3.25 114.28 102.23 1n60 n THR 516 Ca 0.09 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1n60 n THR 516 Cb 0.25 0.49 0.00 0.00 -2.10 0.00 0.00 70.33 68.97 1n60 n THR 516 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n60 n GLY 517 N 1.22 0.42 3.93 3.38 0.00 -0.31 -5.02 105.19 108.81 1n60 n GLY 517 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 1n60 n GLY 517 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1n60 s SER 518 N -2.60 4.51 -0.01 1.61 1.04 -1.26 -4.78 113.70 112.20 1n60 s SER 518 Ca 0.00 0.37 -0.02 0.00 0.48 0.00 0.00 55.95 56.78 1n60 s SER 518 Cb 0.00 -0.90 0.00 0.00 0.10 0.00 0.00 66.02 65.22 1n60 s SER 518 CO 0.00 -1.80 0.05 -0.69 0.98 0.00 0.00 173.24 171.78 1n60 s VAL 519 N -3.35 0.02 -0.13 5.02 1.01 0.04 -0.40 120.40 122.61 1n60 s VAL 519 Ca 0.63 -0.18 0.01 0.00 0.00 0.00 0.00 61.98 62.44 1n60 s VAL 519 Cb -0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 36.38 36.14 1n60 s VAL 519 CO 0.46 -0.10 -0.15 -0.51 0.00 0.00 0.00 175.10 174.80 1n60 s ILE 520 N -0.28 2.81 -0.00 2.22 1.10 -0.40 -0.66 121.20 125.98 1n60 s ILE 520 Ca -0.03 -0.75 0.01 0.00 -0.51 0.00 0.00 60.65 59.37 1n60 s ILE 520 Cb -0.02 -2.16 -0.00 0.00 0.15 0.00 0.00 42.46 40.42 1n60 s ILE 520 CO 0.00 0.53 -0.05 0.00 -2.11 0.00 0.00 174.94 173.31 1n60 s ALA 521 N 0.41 0.40 0.09 1.50 0.00 0.07 -0.90 121.76 123.33 1n60 s ALA 521 Ca -0.12 -0.21 0.04 0.00 0.00 0.00 0.00 51.96 51.68 1n60 s ALA 521 Cb -0.16 -0.11 -0.03 0.00 0.00 0.00 0.00 23.12 22.82 1n60 s ALA 521 CO 0.06 0.10 -0.11 1.03 0.00 0.00 0.00 175.76 176.83 1n60 s ARG 522 N -0.10 0.84 0.09 0.00 0.52 -0.13 -1.13 118.95 119.05 1n60 s ARG 522 Ca 0.02 -1.09 0.02 0.00 -0.52 0.00 0.00 55.73 54.15 1n60 s ARG 522 Cb -0.02 -0.64 -0.04 0.00 0.52 0.00 0.00 34.95 34.77 1n60 s ARG 522 CO -0.00 0.12 -0.07 -1.64 0.02 0.00 0.00 175.30 173.72 1n60 s MET 523 N -2.44 0.81 0.00 3.54 -1.94 -1.03 -0.81 119.30 117.43 1n60 s MET 523 Ca 0.03 -1.26 0.16 0.00 -1.71 0.00 0.00 55.69 52.91 1n60 s MET 523 Cb -0.05 -0.27 0.70 0.00 2.01 0.00 0.00 34.83 37.22 1n60 s MET 523 CO 0.01 0.00 1.49 0.41 -0.01 0.00 0.00 175.02 176.93 1n60 n GLY 524 N 0.17 -0.15 2.86 -0.03 0.00 -0.80 -4.48 105.19 102.76 1n60 n GLY 524 Ca -0.14 -0.29 -0.18 0.00 0.00 0.00 0.00 46.02 45.42 1n60 n GLY 524 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1n60 n THR 525 N -0.04 0.00 -3.29 2.61 -2.24 -1.26 -2.40 114.28 107.66 1n60 n THR 525 Ca 0.13 -1.07 -0.06 0.00 -2.27 0.00 0.00 64.05 60.78 1n60 n THR 525 Cb 0.22 -1.14 -0.06 0.00 -2.10 0.00 0.00 70.33 67.25 1n60 n THR 525 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1n60 s LYS 526 N -4.54 0.42 0.53 -0.78 2.47 -1.26 -4.14 119.74 112.43 1n60 s LYS 526 Ca 0.50 0.55 -0.22 0.00 -1.56 0.00 0.00 55.97 55.24 1n60 s LYS 526 Cb -0.03 -0.20 -0.05 0.00 -1.46 0.00 0.00 37.83 36.09 1n60 s LYS 526 CO 0.34 -0.74 1.31 0.45 0.16 0.00 0.00 175.35 176.87 1n60 s SER 527 N 2.62 5.47 -0.21 1.43 0.15 -1.26 -4.34 113.70 117.57 1n60 s SER 527 Ca 0.14 2.66 0.15 0.00 0.70 0.00 0.00 55.95 59.59 1n60 s SER 527 Cb -0.14 -2.63 0.46 0.00 -1.71 0.00 0.00 66.02 61.99 1n60 s SER 527 CO -0.20 -1.42 1.17 0.00 1.20 0.00 0.00 173.24 173.99 1n60 n GLN 528 N -0.91 2.04 0.00 5.44 3.00 -1.26 -4.57 117.38 121.12 1n60 n GLN 528 Ca 0.10 -3.42 0.00 0.00 -0.01 0.00 0.00 57.00 53.66 1n60 n GLN 528 Cb 0.46 -1.56 0.00 0.00 0.00 0.00 0.00 30.24 29.14 1n60 n GLN 528 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1n60 n GLY 529 N -0.57 1.09 0.00 1.08 0.00 -1.26 -3.02 105.19 102.50 1n60 n GLY 529 Ca 0.22 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.40 1n60 n GLY 529 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1n60 n GLN 530 N -0.04 0.97 -0.65 1.61 3.00 -1.26 -4.88 117.38 116.13 1n60 n GLN 530 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1n60 n GLN 530 Cb 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 28.75 1n60 n GLN 530 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1n60 n GLY 531 N 0.94 0.60 0.37 1.08 0.00 -1.26 -4.95 105.19 101.96 1n60 n GLY 531 Ca 0.23 -0.67 0.08 0.00 0.00 0.00 0.00 46.02 45.66 1n60 n GLY 531 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1n60 h HIS 532 N 0.00 1.00 0.00 1.61 3.86 -1.98 0.58 115.15 120.23 1n60 h HIS 532 Ca 0.00 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1n60 h HIS 532 Cb 0.00 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.15 1n60 h HIS 532 CO 0.00 0.43 0.00 0.93 0.86 0.00 0.00 177.93 180.15 1n60 h GLU 533 N 0.90 0.00 0.00 2.45 5.08 -1.92 -0.96 114.58 120.13 1n60 h GLU 533 Ca 0.45 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.54 1n60 h GLU 533 Cb 0.48 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.69 1n60 h GLU 533 CO -0.21 0.00 -1.51 2.41 -1.00 0.00 0.00 179.01 178.70 1n60 n THR 534 N -2.94 1.52 0.11 1.13 -1.04 0.03 -4.55 114.28 108.54 1n60 n THR 534 Ca -0.01 -0.09 -0.17 0.00 -2.04 0.00 0.00 64.05 61.74 1n60 n THR 534 Cb 0.17 -2.04 -0.14 0.00 -1.82 0.00 0.00 70.33 66.51 1n60 n THR 534 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 1n60 h THR 535 N -1.00 1.48 -0.36 12.58 1.35 -0.84 -3.12 112.91 122.99 1n60 h THR 535 Ca -0.40 -3.02 -0.02 0.00 -0.55 0.00 0.00 66.41 62.43 1n60 h THR 535 Cb 1.31 2.94 -0.02 0.00 -1.73 0.00 0.00 68.15 70.66 1n60 h THR 535 CO -0.24 0.88 0.16 1.88 -0.25 0.00 0.00 175.52 177.95 1n60 h TYR 536 N 0.09 0.49 0.00 4.73 0.05 -1.43 -1.19 116.97 119.71 1n60 h TYR 536 Ca -0.14 -0.01 -0.08 0.00 0.05 0.00 0.00 58.73 58.55 1n60 h TYR 536 Cb 1.98 -0.16 -0.01 0.00 1.01 0.00 0.00 36.73 39.55 1n60 h TYR 536 CO 0.07 0.38 -0.37 0.00 -1.05 0.00 0.00 178.16 177.20 1n60 h ALA 537 N 1.67 1.23 -0.34 3.88 0.00 -1.75 -2.48 119.26 121.49 1n60 h ALA 537 Ca 0.13 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 1n60 h ALA 537 Cb 0.08 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1n60 h ALA 537 CO -0.02 0.46 -0.17 1.96 0.00 0.00 0.00 179.25 181.48 1n60 h GLN 538 N 0.00 0.62 -0.06 0.00 4.20 -1.17 0.22 115.11 118.92 1n60 h GLN 538 Ca -0.00 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.49 1n60 h GLN 538 Cb 0.72 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.45 1n60 h GLN 538 CO 0.05 0.76 0.02 0.82 -0.67 0.00 0.00 178.83 179.81 1n60 h ILE 539 N 0.56 1.16 -0.69 2.54 2.04 -1.17 -2.37 117.51 119.57 1n60 h ILE 539 Ca 0.09 -0.47 -0.02 0.00 1.00 0.00 0.00 64.86 65.46 1n60 h ILE 539 Cb 0.61 1.36 -0.03 0.00 -0.74 0.00 0.00 36.82 38.02 1n60 h ILE 539 CO 0.04 0.13 0.36 0.40 0.00 0.00 0.00 178.15 179.08 1n60 h ILE 540 N -0.08 1.22 -0.54 -0.67 2.04 -1.28 -2.24 117.51 115.97 1n60 h ILE 540 Ca 0.02 -0.58 0.06 0.00 1.00 0.00 0.00 64.86 65.36 1n60 h ILE 540 Cb 0.19 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 36.56 1n60 h ILE 540 CO -0.00 0.25 0.24 0.00 0.00 0.00 0.00 178.15 178.64 1n60 h ALA 541 N 1.18 0.68 -0.26 1.87 0.00 -0.81 -0.51 119.26 121.41 1n60 h ALA 541 Ca 0.24 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 1n60 h ALA 541 Cb 0.07 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1n60 h ALA 541 CO -0.04 -0.14 -0.08 1.15 0.00 0.00 0.00 179.25 180.15 1n60 h THR 542 N 0.45 1.29 -0.79 0.00 2.02 -1.27 0.15 112.91 114.77 1n60 h THR 542 Ca 0.25 -1.11 -0.00 0.00 0.77 0.00 0.00 66.41 66.32 1n60 h THR 542 Cb 0.22 1.48 -0.04 0.00 -1.74 0.00 0.00 68.15 68.07 1n60 h THR 542 CO -0.21 0.35 0.48 -0.33 0.37 0.00 0.00 175.52 176.17 1n60 h GLU 543 N 0.25 1.06 -0.00 6.66 4.39 -0.82 -3.30 114.58 122.82 1n60 h GLU 543 Ca 0.06 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1n60 h GLU 543 Cb 0.56 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.98 1n60 h GLU 543 CO 0.03 0.74 -0.30 1.28 -1.16 0.00 0.00 179.01 179.60 1n60 n LEU 544 N -4.38 0.64 -0.79 1.33 4.77 -0.25 -4.98 117.00 113.33 1n60 n LEU 544 Ca 0.08 -0.60 -0.09 0.00 -0.03 0.00 0.00 56.01 55.38 1n60 n LEU 544 Cb 0.06 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1n60 n LEU 544 CO 0.37 0.14 -0.09 0.61 -1.33 0.00 0.00 177.39 177.09 1n60 n GLY 545 N 1.05 0.75 3.60 -0.72 0.00 0.53 -4.73 105.19 105.67 1n60 n GLY 545 Ca 0.02 -0.59 -0.35 0.00 0.00 0.00 0.00 46.02 45.10 1n60 n GLY 545 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n60 s ILE 546 N -2.37 4.77 0.36 -0.61 1.01 -1.15 -4.78 121.20 118.42 1n60 s ILE 546 Ca 0.00 -0.04 -0.26 0.00 0.00 0.00 0.00 60.65 60.35 1n60 s ILE 546 Cb 0.00 -3.17 -0.12 0.00 0.01 0.00 0.00 42.46 39.18 1n60 s ILE 546 CO 0.00 0.42 1.09 -2.65 0.00 0.00 0.00 174.94 173.80 1n60 n PRO 547 N 3.89 1.57 -0.09 2.79 -0.02 -1.26 -4.12 135.00 137.76 1n60 n PRO 547 Ca -0.16 0.55 0.05 0.00 -2.02 0.00 0.00 63.50 61.92 1n60 n PRO 547 Cb 0.52 -2.07 0.38 0.00 -0.02 0.00 0.00 33.50 32.32 1n60 n PRO 547 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n60 h ALA 548 N 1.95 1.69 0.00 3.55 0.00 -1.02 0.37 119.26 125.79 1n60 h ALA 548 Ca -0.43 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1n60 h ALA 548 Cb 1.32 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1n60 h ALA 548 CO 0.59 0.26 0.00 -0.25 0.00 0.00 0.00 179.25 179.85 1n60 n ASP 549 N -4.46 0.55 -0.62 0.00 8.00 -1.26 -1.61 116.55 117.14 1n60 n ASP 549 Ca 0.06 0.66 0.06 0.00 0.71 0.00 0.00 54.79 56.28 1n60 n ASP 549 Cb 0.12 -0.77 0.15 0.00 -0.02 0.00 0.00 41.12 40.60 1n60 n ASP 549 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1n60 n ASP 550 N -2.14 1.80 -4.06 -2.24 8.00 0.12 -4.82 116.55 113.21 1n60 n ASP 550 Ca 0.01 -1.99 -0.26 0.00 0.71 0.00 0.00 54.79 53.26 1n60 n ASP 550 Cb 0.17 -0.22 -0.17 0.00 -0.02 0.00 0.00 41.12 40.88 1n60 n ASP 550 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1n60 s ILE 551 N -1.55 1.34 -0.20 0.53 1.01 -0.63 -0.78 121.20 120.92 1n60 s ILE 551 Ca 0.23 -0.59 -0.07 0.00 0.00 0.00 0.00 60.65 60.21 1n60 s ILE 551 Cb 0.12 -1.21 -0.04 0.00 0.01 0.00 0.00 42.46 41.34 1n60 s ILE 551 CO 0.16 0.40 0.07 -0.32 0.00 0.00 0.00 174.94 175.24 1n60 s MET 552 N 0.64 3.92 -0.14 2.79 -2.45 0.16 -4.97 119.30 119.25 1n60 s MET 552 Ca -0.15 -0.37 -0.04 0.00 -1.25 0.00 0.00 55.69 53.89 1n60 s MET 552 Cb -0.16 -3.24 -0.03 0.00 1.25 0.00 0.00 34.83 32.65 1n60 s MET 552 CO 0.04 0.18 -0.01 0.42 1.05 0.00 0.00 175.02 176.70 1n60 s ILE 553 N 0.62 4.15 0.04 10.11 -1.09 -1.26 -0.75 121.20 133.02 1n60 s ILE 553 Ca 0.03 -0.28 0.03 0.00 -2.23 0.00 0.00 60.65 58.21 1n60 s ILE 553 Cb -0.13 -2.80 -0.02 0.00 -1.58 0.00 0.00 42.46 37.93 1n60 s ILE 553 CO 0.01 0.52 -0.10 -1.61 -1.23 0.00 0.00 174.94 172.54 1n60 s GLU 554 N -0.02 0.67 0.04 2.79 2.02 -0.28 -4.86 118.70 119.05 1n60 s GLU 554 Ca 0.02 -0.69 -0.04 0.00 0.02 0.00 0.00 54.97 54.28 1n60 s GLU 554 Cb -0.13 -0.57 -0.02 0.00 0.10 0.00 0.00 34.13 33.51 1n60 s GLU 554 CO 0.02 0.13 0.06 -1.21 0.02 0.00 0.00 175.26 174.29 1n60 s GLU 555 N -1.24 0.55 0.00 1.61 2.02 -1.26 -2.48 118.70 117.91 1n60 s GLU 555 Ca -0.04 -0.80 0.00 0.00 0.02 0.00 0.00 54.97 54.16 1n60 s GLU 555 Cb -0.08 0.21 0.00 0.00 0.10 0.00 0.00 34.13 34.36 1n60 s GLU 555 CO 0.01 -0.13 0.00 0.41 0.02 0.00 0.00 175.26 175.57 1n60 n GLY 556 N 0.79 0.42 3.42 -1.39 0.00 -1.26 -4.89 105.19 102.29 1n60 n GLY 556 Ca -0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 1n60 n GLY 556 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1n60 s ASN 557 N -2.03 5.81 0.41 1.61 3.84 -1.26 -0.66 114.94 122.66 1n60 s ASN 557 Ca 0.00 -0.81 0.29 0.00 0.21 0.00 0.00 52.86 52.55 1n60 s ASN 557 Cb 0.00 -2.06 1.12 0.00 -0.55 0.00 0.00 41.25 39.76 1n60 s ASN 557 CO 0.00 -0.34 1.84 0.71 -2.79 0.00 0.00 177.10 176.52 1n60 h THR 558 N 5.73 0.00 0.00 -5.21 1.35 -1.50 -0.25 112.91 113.04 1n60 h THR 558 Ca -0.28 -0.44 -0.09 0.00 -0.55 0.00 0.00 66.41 65.05 1n60 h THR 558 Cb 1.12 1.34 -0.01 0.00 -1.73 0.00 0.00 68.15 68.87 1n60 h THR 558 CO 0.67 0.00 -0.44 0.44 -0.25 0.00 0.00 175.52 175.93 1n60 h ASP 559 N 0.00 0.00 0.00 5.36 3.32 -1.89 -3.39 116.42 119.82 1n60 h ASP 559 Ca 0.00 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.88 1n60 h ASP 559 Cb 0.51 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.03 1n60 h ASP 559 CO 0.00 0.44 -1.63 0.35 -1.72 0.00 0.00 179.24 176.69 1n60 n THR 560 N -3.84 0.63 -2.54 0.35 -2.24 -0.43 -5.00 114.28 101.21 1n60 n THR 560 Ca -0.01 -0.22 -0.38 0.00 -2.27 0.00 0.00 64.05 61.16 1n60 n THR 560 Cb 0.49 -1.06 -0.04 0.00 -2.10 0.00 0.00 70.33 67.62 1n60 n THR 560 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1n60 s ALA 561 N -2.22 3.23 0.75 6.98 0.00 -0.24 -5.00 121.76 125.27 1n60 s ALA 561 Ca -0.15 0.77 -0.15 0.00 0.00 0.00 0.00 51.96 52.43 1n60 s ALA 561 Cb 0.04 -3.29 0.05 0.00 0.00 0.00 0.00 23.12 19.93 1n60 s ALA 561 CO 0.24 -0.16 1.22 -1.25 0.00 0.00 0.00 175.76 175.81 1n60 s PRO 562 N -1.99 2.00 0.29 0.00 0.04 -1.26 -4.81 135.00 129.26 1n60 s PRO 562 Ca 0.51 1.79 -0.30 0.00 0.04 0.00 0.00 61.00 63.04 1n60 s PRO 562 Cb -0.26 -1.81 -0.11 0.00 0.04 0.00 0.00 34.50 32.35 1n60 s PRO 562 CO 0.33 -1.95 1.57 -0.47 0.04 0.00 0.00 177.00 176.52 1n60 s TYR 563 N -1.98 2.79 0.32 0.56 6.14 -1.26 -3.85 117.35 120.06 1n60 s TYR 563 Ca 0.75 0.83 -0.03 0.00 0.64 0.00 0.00 57.07 59.25 1n60 s TYR 563 Cb -0.30 -4.03 -0.00 0.00 0.42 0.00 0.00 41.96 38.05 1n60 s TYR 563 CO 0.47 -3.44 0.44 0.20 0.64 0.00 0.00 175.55 173.86 1n60 s GLY 564 N 0.45 1.39 0.00 8.97 0.00 -1.25 -4.38 107.32 112.51 1n60 s GLY 564 Ca 0.62 -1.47 0.24 0.00 0.00 0.00 0.00 44.72 44.12 1n60 s GLY 564 CO 0.48 -1.00 1.26 1.04 0.00 0.00 0.00 173.10 174.88 1n60 n LEU 565 N -0.52 2.95 0.00 0.66 7.99 -1.21 -4.37 117.00 122.50 1n60 n LEU 565 Ca 0.01 -0.99 0.00 0.00 -0.01 0.00 0.00 56.01 55.02 1n60 n LEU 565 Cb 0.62 -0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.93 1n60 n LEU 565 CO 0.29 0.49 0.00 0.61 -1.51 0.00 0.00 177.39 177.27 1n60 n GLY 566 N 1.35 -3.44 3.29 -0.72 0.00 -1.01 -4.72 105.19 99.95 1n60 n GLY 566 Ca 0.14 -1.99 -0.36 0.00 0.00 0.00 0.00 46.02 43.81 1n60 n GLY 566 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n60 s THR 567 N -0.75 3.52 0.00 2.61 2.01 -0.20 -4.60 115.64 118.23 1n60 s THR 567 Ca 0.00 -0.78 -0.30 0.00 0.31 0.00 0.00 61.69 60.93 1n60 s THR 567 Cb 0.00 -2.78 0.11 0.00 0.01 0.00 0.00 72.50 69.84 1n60 s THR 567 CO 0.00 0.16 1.19 -0.72 -0.69 0.00 0.00 174.62 174.57 1n60 s TYR 568 N 1.44 -0.08 -1.94 4.92 -0.85 -1.26 -4.80 117.35 114.78 1n60 s TYR 568 Ca 0.02 -0.06 0.00 0.00 -0.52 0.00 0.00 57.07 56.51 1n60 s TYR 568 Cb -0.17 0.56 0.00 0.00 0.38 0.00 0.00 41.96 42.74 1n60 s TYR 568 CO -0.01 -0.40 0.00 0.41 -1.52 0.00 0.00 175.55 174.03 1n60 n GLY 569 N -0.44 0.42 3.27 5.49 0.00 -1.26 -1.60 105.19 111.08 1n60 n GLY 569 Ca -0.07 -0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 1n60 n GLY 569 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1n60 n SER 570 N -1.75 -4.03 -0.07 1.61 7.64 -1.26 -3.31 113.62 112.45 1n60 n SER 570 Ca -0.23 -0.34 0.12 0.00 1.01 0.00 0.00 58.87 59.42 1n60 n SER 570 Cb 0.69 -3.32 0.19 0.00 -1.01 0.00 0.00 64.21 60.76 1n60 n SER 570 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1n60 n ARG 571 N -3.72 0.22 -0.02 1.43 1.85 -0.63 -4.24 116.66 111.56 1n60 n ARG 571 Ca -0.03 -0.15 -0.12 0.00 -1.00 0.00 0.00 57.85 56.55 1n60 n ARG 571 Cb 0.55 -1.50 -0.07 0.00 -1.05 0.00 0.00 32.46 30.40 1n60 n ARG 571 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 1n60 h SER 572 N 0.35 0.15 -0.24 2.89 0.02 -1.86 -0.50 113.55 114.37 1n60 h SER 572 Ca 0.00 -0.24 -0.06 0.00 -0.84 0.00 0.00 61.79 60.65 1n60 h SER 572 Cb 0.51 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 1n60 h SER 572 CO 0.00 0.35 -0.07 0.74 -1.14 0.00 0.00 176.83 176.71 1n60 h THR 573 N -0.06 1.29 -0.81 -2.27 2.02 -1.92 0.72 112.91 111.88 1n60 h THR 573 Ca 0.03 -1.09 0.08 0.00 0.77 0.00 0.00 66.41 66.21 1n60 h THR 573 Cb 0.26 1.51 -0.05 0.00 -1.74 0.00 0.00 68.15 68.13 1n60 h THR 573 CO 0.00 0.34 0.53 -0.65 0.37 0.00 0.00 175.52 176.11 1n60 h PRO 574 N 0.20 0.78 0.00 6.66 0.11 -1.74 -2.76 132.00 135.24 1n60 h PRO 574 Ca 0.06 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.12 1n60 h PRO 574 Cb 0.54 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.47 1n60 h PRO 574 CO 0.03 0.52 0.00 0.25 -0.21 0.00 0.00 178.00 178.58 1n60 n THR 575 N -4.50 0.00 0.23 -1.15 -2.24 -0.21 -4.07 114.28 102.34 1n60 n THR 575 Ca 0.13 0.25 0.08 0.00 -2.27 0.00 0.00 64.05 62.24 1n60 n THR 575 Cb 0.28 -1.21 0.54 0.00 -2.10 0.00 0.00 70.33 67.84 1n60 n THR 575 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1n60 h ALA 576 N -1.52 1.32 -0.50 6.98 0.00 -1.47 -0.05 119.26 124.02 1n60 h ALA 576 Ca 0.00 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 1n60 h ALA 576 Cb 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1n60 h ALA 576 CO 0.00 0.29 0.04 0.78 0.00 0.00 0.00 179.25 180.36 1n60 h GLY 577 N 1.09 0.91 0.92 0.00 0.00 -0.67 0.10 103.07 105.43 1n60 h GLY 577 Ca -0.00 -0.64 -0.00 0.00 0.00 0.00 0.00 47.33 46.69 1n60 h GLY 577 CO 0.03 0.59 -0.01 0.00 0.00 0.00 0.00 176.54 177.16 1n60 h ALA 578 N 0.95 -0.02 -0.88 3.60 0.00 -1.17 -2.45 119.26 119.30 1n60 h ALA 578 Ca 0.15 -0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.11 1n60 h ALA 578 Cb 0.46 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 1n60 h ALA 578 CO 0.02 -0.47 0.57 0.00 0.00 0.00 0.00 179.25 179.37 1n60 h ALA 579 N 0.89 1.64 -0.13 0.00 0.00 -0.65 -0.45 119.26 120.57 1n60 h ALA 579 Ca -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1n60 h ALA 579 Cb 0.09 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1n60 h ALA 579 CO 0.00 0.18 0.08 1.15 0.00 0.00 0.00 179.25 180.66 1n60 h THR 580 N 0.88 1.07 -0.58 0.00 2.02 -0.64 0.17 112.91 115.82 1n60 h THR 580 Ca 0.40 -0.16 -0.04 0.00 0.77 0.00 0.00 66.41 67.37 1n60 h THR 580 Cb 0.39 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 1n60 h THR 580 CO -0.17 0.06 0.19 0.00 0.37 0.00 0.00 175.52 175.97 1n60 h ALA 581 N 1.00 0.75 -0.30 6.16 0.00 -0.91 -0.69 119.26 125.27 1n60 h ALA 581 Ca 0.05 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 1n60 h ALA 581 Cb 0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1n60 h ALA 581 CO -0.01 0.41 -0.11 0.28 0.00 0.00 0.00 179.25 179.82 1n60 h VAL 582 N 0.81 1.29 -0.66 0.00 2.07 -0.85 0.05 116.25 118.95 1n60 h VAL 582 Ca 0.19 -1.18 0.02 0.00 0.82 0.00 0.00 66.70 66.55 1n60 h VAL 582 Cb 0.27 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.43 1n60 h VAL 582 CO -0.01 0.38 0.42 0.00 0.02 0.00 0.00 177.57 178.38 1n60 h ALA 583 N 0.77 0.86 -0.77 1.67 0.00 -0.60 -0.69 119.26 120.49 1n60 h ALA 583 Ca 0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1n60 h ALA 583 Cb 0.61 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 1n60 h ALA 583 CO 0.04 0.19 0.42 0.00 0.00 0.00 0.00 179.25 179.90 1n60 h ALA 584 N 1.28 1.28 -0.06 0.00 0.00 -0.83 -1.94 119.26 118.98 1n60 h ALA 584 Ca 0.26 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 1n60 h ALA 584 Cb -0.01 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1n60 h ALA 584 CO -0.09 0.58 -0.43 0.00 0.00 0.00 0.00 179.25 179.31 1n60 h ARG 585 N 1.08 0.14 -0.58 0.00 3.08 -0.46 0.20 114.38 117.84 1n60 h ARG 585 Ca 0.27 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.25 1n60 h ARG 585 Cb 0.04 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 1n60 h ARG 585 CO -0.04 0.54 0.32 0.87 -1.07 0.00 0.00 179.97 180.59 1n60 h LYS 586 N 0.11 0.81 -0.79 0.04 1.57 -0.45 -0.78 116.57 117.08 1n60 h LYS 586 Ca 0.01 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1n60 h LYS 586 Cb 0.81 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.92 1n60 h LYS 586 CO 0.06 0.62 0.48 0.82 -0.57 0.00 0.00 179.45 180.86 1n60 h ILE 587 N 0.79 1.22 -0.69 1.86 2.04 -0.81 -1.81 117.51 120.11 1n60 h ILE 587 Ca 0.20 -0.49 -0.06 0.00 1.00 0.00 0.00 64.86 65.52 1n60 h ILE 587 Cb 0.04 0.11 -0.03 0.00 -0.74 0.00 0.00 36.82 36.20 1n60 h ILE 587 CO -0.03 0.23 0.21 0.50 0.00 0.00 0.00 178.15 179.06 1n60 h LYS 588 N 1.09 1.07 -0.61 2.37 3.64 -0.60 0.84 116.57 124.38 1n60 h LYS 588 Ca 0.29 -0.22 -0.10 0.00 -1.27 0.00 0.00 60.65 59.34 1n60 h LYS 588 Cb -0.04 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.60 1n60 h LYS 588 CO -0.05 0.92 0.00 0.00 -2.27 0.00 0.00 179.45 178.05 1n60 h ALA 589 N 1.19 0.85 -0.43 5.00 0.00 -0.83 0.34 119.26 125.39 1n60 h ALA 589 Ca 0.22 -0.31 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1n60 h ALA 589 Cb 0.30 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1n60 h ALA 589 CO -0.01 0.67 -0.15 -0.22 0.00 0.00 0.00 179.25 179.54 1n60 h LYS 590 N 0.97 0.86 -0.69 0.00 3.64 -0.62 -2.41 116.57 118.32 1n60 h LYS 590 Ca 0.17 -0.35 0.03 0.00 -1.27 0.00 0.00 60.65 59.23 1n60 h LYS 590 Cb 0.56 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.30 1n60 h LYS 590 CO 0.03 0.99 0.46 0.00 -2.27 0.00 0.00 179.45 178.66 1n60 h ALA 591 N 0.85 1.58 -0.70 5.00 0.00 -0.49 -0.27 119.26 125.23 1n60 h ALA 591 Ca 0.10 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1n60 h ALA 591 Cb 0.70 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1n60 h ALA 591 CO 0.05 0.36 0.20 0.37 0.00 0.00 0.00 179.25 180.23 1n60 h GLN 592 N 0.86 1.10 -0.59 0.00 4.15 -0.58 0.69 115.11 120.74 1n60 h GLN 592 Ca 0.27 -0.25 -0.09 0.00 0.77 0.00 0.00 58.65 59.35 1n60 h GLN 592 Cb 0.02 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.53 1n60 h GLN 592 CO -0.07 0.96 -0.00 0.52 -1.93 0.00 0.00 178.83 178.30 1n60 h MET 593 N 1.04 1.04 -0.51 1.69 2.86 -0.77 0.07 114.93 120.33 1n60 h MET 593 Ca 0.22 -0.32 -0.04 0.00 -2.06 0.00 0.00 59.70 57.50 1n60 h MET 593 Cb 0.33 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 1n60 h MET 593 CO -0.00 1.01 0.18 0.82 1.06 0.00 0.00 176.91 179.98 1n60 h ILE 594 N 0.95 1.23 -0.84 -1.22 2.04 -0.64 -1.66 117.51 117.35 1n60 h ILE 594 Ca 0.17 -0.74 -0.00 0.00 1.00 0.00 0.00 64.86 65.29 1n60 h ILE 594 Cb 0.55 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.33 1n60 h ILE 594 CO 0.03 0.27 0.51 0.00 0.00 0.00 0.00 178.15 178.96 1n60 h ALA 595 N 1.03 1.08 -0.70 1.87 0.00 -0.59 -0.72 119.26 121.23 1n60 h ALA 595 Ca 0.17 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1n60 h ALA 595 Cb 0.25 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1n60 h ALA 595 CO -0.01 0.54 0.37 0.00 0.00 0.00 0.00 179.25 180.15 1n60 h ALA 596 N 1.27 0.91 -0.44 0.00 0.00 -0.71 0.98 119.26 121.26 1n60 h ALA 596 Ca 0.30 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1n60 h ALA 596 Cb -0.04 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 1n60 h ALA 596 CO -0.06 0.44 0.11 1.25 0.00 0.00 0.00 179.25 181.00 1n60 h HIS 597 N 0.98 0.74 -0.46 0.00 6.17 -0.70 -0.19 115.15 121.68 1n60 h HIS 597 Ca 0.25 -0.09 -0.12 0.00 0.71 0.00 0.00 60.37 61.12 1n60 h HIS 597 Cb 0.07 -0.21 -0.01 0.00 2.52 0.00 0.00 27.41 29.78 1n60 h HIS 597 CO 0.00 0.68 -0.20 0.52 0.71 0.00 0.00 177.93 179.65 1n60 h MET 598 N 0.59 0.92 -0.01 5.26 2.86 -0.70 -3.05 114.93 120.79 1n60 h MET 598 Ca 0.14 -0.38 0.00 0.00 -2.06 0.00 0.00 59.70 57.40 1n60 h MET 598 Cb 0.31 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.93 1n60 h MET 598 CO 0.00 1.03 -0.19 1.28 1.06 0.00 0.00 176.91 180.10 1n60 n LEU 599 N -4.12 1.68 -3.59 1.22 4.77 0.30 -4.96 117.00 112.29 1n60 n LEU 599 Ca 0.00 -0.55 -0.20 0.00 -0.03 0.00 0.00 56.01 55.24 1n60 n LEU 599 Cb 0.44 -0.04 0.06 0.00 -2.33 0.00 0.00 43.42 41.54 1n60 n LEU 599 CO 0.46 0.29 0.00 -0.62 -1.33 0.00 0.00 177.39 176.19 1n60 n GLU 600 N 0.03 -5.56 -4.39 3.23 1.02 -0.16 -5.00 120.64 109.81 1n60 n GLU 600 Ca 0.14 0.71 -0.20 0.00 -0.02 0.00 0.00 57.16 57.78 1n60 n GLU 600 Cb 0.41 -5.45 -0.09 0.00 -0.02 0.00 0.00 31.44 26.29 1n60 n GLU 600 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1n60 s VAL 601 N -3.55 0.58 0.40 2.62 -7.23 -0.74 -5.06 120.40 107.42 1n60 s VAL 601 Ca 0.00 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 57.96 1n60 s VAL 601 Cb -0.00 -2.55 -0.11 0.00 0.56 0.00 0.00 36.38 34.29 1n60 s VAL 601 CO 0.78 0.00 0.92 -1.00 -0.31 0.00 0.00 175.10 175.49 1n60 s HIS 602 N -3.48 3.38 0.38 2.82 3.76 -1.26 -4.52 115.29 116.36 1n60 s HIS 602 Ca 0.33 1.58 0.07 0.00 -0.15 0.00 0.00 55.06 56.90 1n60 s HIS 602 Cb 0.06 -2.81 0.80 0.00 1.11 0.00 0.00 32.58 31.73 1n60 s HIS 602 CO 0.16 -0.03 1.97 0.93 -0.85 0.00 0.00 174.74 176.91 1n60 h GLU 603 N 2.15 0.66 0.00 1.40 5.08 -1.91 0.16 114.58 122.12 1n60 h GLU 603 Ca -0.49 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 1n60 h GLU 603 Cb 1.18 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.28 1n60 h GLU 603 CO 0.62 0.44 0.00 0.78 -1.00 0.00 0.00 179.01 179.85 1n60 h GLY 604 N 0.68 0.00 0.12 -3.84 0.00 -1.97 -1.71 103.07 96.35 1n60 h GLY 604 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.63 1n60 h GLY 604 CO -0.10 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.66 1n60 n ASP 605 N -2.64 0.82 -4.74 0.19 8.00 0.55 -4.88 116.55 113.86 1n60 n ASP 605 Ca -0.00 -1.35 -0.30 0.00 0.71 0.00 0.00 54.79 53.84 1n60 n ASP 605 Cb 0.15 -0.02 -0.07 0.00 -0.02 0.00 0.00 41.12 41.17 1n60 n ASP 605 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1n60 s LEU 606 N -1.88 3.66 0.03 0.64 1.43 -0.65 -0.24 118.68 121.68 1n60 s LEU 606 Ca 0.39 -0.07 0.03 0.00 -1.03 0.00 0.00 54.13 53.45 1n60 s LEU 606 Cb 0.20 -2.34 -0.02 0.00 0.03 0.00 0.00 46.19 44.05 1n60 s LEU 606 CO 0.32 0.18 -0.10 -1.83 0.23 0.00 0.00 176.35 175.15 1n60 s GLU 607 N -2.31 0.69 0.11 1.70 -1.05 0.08 -4.85 118.70 113.07 1n60 s GLU 607 Ca 0.27 -0.64 -0.27 0.00 -0.15 0.00 0.00 54.97 54.18 1n60 s GLU 607 Cb -0.12 -0.62 -0.07 0.00 -0.44 0.00 0.00 34.13 32.89 1n60 s GLU 607 CO 0.20 0.15 0.85 -0.46 0.95 0.00 0.00 175.26 176.94 1n60 s TRP 608 N -0.88 3.83 -0.42 4.83 -0.11 -1.26 -0.79 118.94 124.14 1n60 s TRP 608 Ca -0.02 1.66 0.04 0.00 1.22 0.00 0.00 56.10 59.00 1n60 s TRP 608 Cb -0.07 -2.90 0.17 0.00 -1.50 0.00 0.00 33.47 29.17 1n60 s TRP 608 CO 0.01 0.33 0.38 0.34 -4.62 0.00 0.00 176.95 173.39 1n60 s ASP 609 N -0.42 1.13 0.00 5.86 2.15 0.30 -4.95 116.67 120.74 1n60 s ASP 609 Ca 0.41 -2.81 0.00 0.00 0.43 0.00 0.00 52.55 50.58 1n60 s ASP 609 Cb -0.23 -0.11 0.00 0.00 -0.30 0.00 0.00 42.92 42.28 1n60 s ASP 609 CO 0.27 -0.17 0.00 0.52 -0.17 0.00 0.00 175.17 175.62 1n60 n VAL 610 N 2.97 0.00 -1.66 1.11 0.31 -1.26 -3.07 118.33 116.73 1n60 n VAL 610 Ca 0.27 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.60 1n60 n VAL 610 Cb 0.48 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.41 1n60 n VAL 610 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1n60 n ASP 611 N 2.01 0.00 -3.48 4.52 5.75 -1.26 -3.40 116.55 120.69 1n60 n ASP 611 Ca 0.00 -1.35 -0.13 0.00 -0.01 0.00 0.00 54.79 53.30 1n60 n ASP 611 Cb 0.00 -0.07 -0.03 0.00 -1.03 0.00 0.00 41.12 39.99 1n60 n ASP 611 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1n60 s ARG 612 N 0.00 1.20 -0.18 0.11 1.70 -1.17 -0.87 118.95 119.73 1n60 s ARG 612 Ca 0.00 -0.38 -0.09 0.00 -0.47 0.00 0.00 55.73 54.80 1n60 s ARG 612 Cb 0.00 0.55 -0.05 0.00 -0.57 0.00 0.00 34.95 34.88 1n60 s ARG 612 CO 0.00 -0.49 0.10 -0.06 -1.08 0.00 0.00 175.30 173.77 1n60 s PHE 613 N -3.28 3.37 0.12 5.89 0.08 -0.09 -0.54 117.98 123.54 1n60 s PHE 613 Ca -0.01 0.27 0.08 0.00 0.12 0.00 0.00 56.93 57.39 1n60 s PHE 613 Cb -0.00 -2.10 -0.04 0.00 -0.57 0.00 0.00 43.02 40.31 1n60 s PHE 613 CO -0.09 0.31 -0.14 1.03 -0.10 0.00 0.00 175.22 176.23 1n60 s ARG 614 N 0.16 1.94 -0.19 0.44 0.52 0.03 -0.67 118.95 121.18 1n60 s ARG 614 Ca 0.07 -1.14 -0.29 0.00 -0.52 0.00 0.00 55.73 53.85 1n60 s ARG 614 Cb -0.12 -2.19 -0.00 0.00 0.52 0.00 0.00 34.95 33.17 1n60 s ARG 614 CO -0.00 0.48 1.10 0.08 0.02 0.00 0.00 175.30 176.98 1n60 s VAL 615 N -1.25 4.57 -0.10 3.52 1.01 -0.40 -0.75 120.40 127.00 1n60 s VAL 615 Ca 0.20 1.88 -0.39 0.00 0.00 0.00 0.00 61.98 63.68 1n60 s VAL 615 Cb -0.10 -4.21 -0.16 0.00 0.00 0.00 0.00 36.38 31.90 1n60 s VAL 615 CO 0.12 -0.13 1.53 0.29 0.00 0.00 0.00 175.10 176.90 1n60 n LYS 616 N 6.14 1.10 -0.90 2.72 5.02 0.67 -0.82 118.16 132.09 1n60 n LYS 616 Ca 0.12 0.40 0.00 0.00 -2.02 0.00 0.00 58.31 56.81 1n60 n LYS 616 Cb 0.46 -2.05 0.00 0.00 -0.02 0.00 0.00 35.03 33.42 1n60 n LYS 616 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n60 n GLY 617 N 3.30 1.00 2.19 0.72 0.00 -1.26 -4.82 105.19 106.32 1n60 n GLY 617 Ca 0.22 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.05 1n60 n GLY 617 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1n60 n LEU 618 N 0.00 0.61 0.26 0.99 4.77 0.00 -4.98 117.00 118.65 1n60 n LEU 618 Ca 0.00 -4.90 0.17 0.00 -0.03 0.00 0.00 56.01 51.25 1n60 n LEU 618 Cb 0.00 0.69 0.92 0.00 -2.33 0.00 0.00 43.42 42.71 1n60 n LEU 618 CO 0.00 2.22 1.02 1.55 -1.33 0.00 0.00 177.39 180.85 1n60 h PRO 619 N 3.33 0.00 0.00 3.23 0.13 -1.86 0.82 132.00 137.64 1n60 h PRO 619 Ca 0.09 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.20 1n60 h PRO 619 Cb 0.94 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.07 1n60 h PRO 619 CO 0.49 0.00 -0.08 1.05 -0.23 0.00 0.00 178.00 179.23 1n60 h GLU 620 N 0.00 0.00 -5.03 0.86 4.11 -1.94 -3.41 114.58 109.18 1n60 h GLU 620 Ca 0.00 0.00 -0.66 0.00 0.07 0.00 0.00 59.36 58.77 1n60 h GLU 620 Cb 0.02 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.11 1n60 h GLU 620 CO 0.00 0.08 -0.23 0.15 0.07 0.00 0.00 179.01 179.08 1n60 s LYS 621 N -3.71 3.62 0.19 1.06 1.02 0.28 -5.03 119.74 117.18 1n60 s LYS 621 Ca 0.01 -0.32 -0.18 0.00 0.02 0.00 0.00 55.97 55.50 1n60 s LYS 621 Cb 0.10 -3.79 0.03 0.00 -0.52 0.00 0.00 37.83 33.65 1n60 s LYS 621 CO 0.57 -0.52 0.53 -0.59 -0.92 0.00 0.00 175.35 174.42 1n60 s PHE 622 N 2.10 -0.14 -0.04 3.18 -0.71 -1.26 -1.28 117.98 119.83 1n60 s PHE 622 Ca 0.13 -0.19 0.01 0.00 -1.04 0.00 0.00 56.93 55.84 1n60 s PHE 622 Cb -0.16 0.40 0.02 0.00 -1.21 0.00 0.00 43.02 42.08 1n60 s PHE 622 CO 0.12 -0.92 -0.02 0.15 -1.34 0.00 0.00 175.22 173.21 1n60 s LYS 623 N -3.87 0.57 0.63 1.99 -0.14 0.16 -4.98 119.74 114.10 1n60 s LYS 623 Ca 0.09 -0.02 -0.11 0.00 -1.36 0.00 0.00 55.97 54.57 1n60 s LYS 623 Cb -0.01 -0.65 -0.03 0.00 -1.68 0.00 0.00 37.83 35.46 1n60 s LYS 623 CO -0.03 -0.10 1.04 0.95 -0.76 0.00 0.00 175.35 176.44 1n60 s THR 624 N 0.93 4.56 0.27 2.17 -4.23 -1.26 -0.92 115.64 117.16 1n60 s THR 624 Ca -0.11 0.83 -0.04 0.00 -1.18 0.00 0.00 61.69 61.19 1n60 s THR 624 Cb -0.14 -3.81 0.26 0.00 1.34 0.00 0.00 72.50 70.15 1n60 s THR 624 CO -0.01 -1.08 1.93 -0.03 -0.54 0.00 0.00 174.62 174.89 1n60 h MET 625 N -0.37 1.23 -0.21 3.99 4.05 -1.31 0.99 114.93 123.30 1n60 h MET 625 Ca -0.44 -0.07 -0.01 0.00 -0.28 0.00 0.00 59.70 58.89 1n60 h MET 625 Cb 1.20 -0.28 -0.01 0.00 -0.80 0.00 0.00 31.60 31.71 1n60 h MET 625 CO 0.62 0.81 0.08 -0.22 0.23 0.00 0.00 176.91 178.43 1n60 h LYS 626 N 1.26 0.32 -0.98 0.39 3.64 -1.92 0.11 116.57 119.39 1n60 h LYS 626 Ca 0.37 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.71 1n60 h LYS 626 Cb -0.08 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.64 1n60 h LYS 626 CO -0.10 0.39 0.65 0.93 -2.27 0.00 0.00 179.45 179.06 1n60 h GLU 627 N 0.18 1.25 -0.57 1.90 5.08 -1.71 -2.36 114.58 118.36 1n60 h GLU 627 Ca 0.07 -0.08 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 1n60 h GLU 627 Cb 0.20 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 1n60 h GLU 627 CO -0.00 0.83 -0.02 -0.07 -1.00 0.00 0.00 179.01 178.74 1n60 h LEU 628 N 1.29 1.00 -0.30 1.33 3.38 -0.31 0.01 115.31 121.71 1n60 h LEU 628 Ca 0.38 -0.32 0.04 0.00 0.09 0.00 0.00 57.88 58.07 1n60 h LEU 628 Cb -0.07 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.37 1n60 h LEU 628 CO -0.10 1.08 0.07 0.00 0.09 0.00 0.00 178.44 179.57 1n60 h ALA 629 N 0.96 0.32 -0.39 1.53 0.00 -0.59 -0.36 119.26 120.72 1n60 h ALA 629 Ca 0.16 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1n60 h ALA 629 Cb 0.57 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1n60 h ALA 629 CO 0.03 -0.34 0.15 2.35 0.00 0.00 0.00 179.25 181.44 1n60 h TRP 630 N 0.18 0.61 -0.44 0.00 2.91 -1.23 -2.58 115.95 115.40 1n60 h TRP 630 Ca 0.14 -0.05 0.08 0.00 1.13 0.00 0.00 58.89 60.19 1n60 h TRP 630 Cb 0.14 -0.18 -0.02 0.00 -0.51 0.00 0.00 29.16 28.59 1n60 h TRP 630 CO -0.16 0.54 0.30 0.00 -1.03 0.00 0.00 178.44 178.09 1n60 h ALA 631 N 1.00 2.06 0.00 2.65 0.00 -0.62 0.17 119.26 124.52 1n60 h ALA 631 Ca 0.13 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1n60 h ALA 631 Cb 0.20 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1n60 h ALA 631 CO -0.01 -0.16 -0.11 0.66 0.00 0.00 0.00 179.25 179.64 1n60 h SER 632 N 0.27 0.00 0.06 0.00 4.64 -0.64 0.12 113.55 117.99 1n60 h SER 632 Ca 0.20 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 61.14 1n60 h SER 632 Cb 0.44 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.47 1n60 h SER 632 CO -0.04 0.11 -2.33 -1.22 -0.87 0.00 0.00 176.83 172.48 1n60 n TYR 633 N -3.54 0.27 -0.00 4.77 4.02 -0.49 -0.86 117.16 121.33 1n60 n TYR 633 Ca -0.02 0.07 -0.19 0.00 -0.01 0.00 0.00 57.90 57.75 1n60 n TYR 633 Cb 0.25 -1.04 -0.14 0.00 -0.02 0.00 0.00 39.34 38.39 1n60 n TYR 633 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1n60 n ASN 634 N -3.16 1.90 -3.17 7.72 2.85 0.47 -4.60 115.26 117.27 1n60 n ASN 634 Ca -0.39 0.24 -0.18 0.00 -0.11 0.00 0.00 54.58 54.14 1n60 n ASN 634 Cb 1.04 -0.72 -0.03 0.00 1.24 0.00 0.00 39.78 41.32 1n60 n ASN 634 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 1n60 n SER 635 N -3.40 0.64 -4.73 1.20 7.64 0.39 -5.02 113.62 110.33 1n60 n SER 635 Ca -0.29 -3.00 -0.42 0.00 1.01 0.00 0.00 58.87 56.17 1n60 n SER 635 Cb 1.05 -0.53 -0.02 0.00 -1.01 0.00 0.00 64.21 63.69 1n60 n SER 635 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1n60 s PRO 636 N -2.18 4.19 0.42 1.43 0.04 -0.99 -4.69 135.00 133.22 1n60 s PRO 636 Ca 0.39 2.43 -0.26 0.00 0.04 0.00 0.00 61.00 63.60 1n60 s PRO 636 Cb 0.33 -3.10 -0.09 0.00 0.04 0.00 0.00 34.50 31.68 1n60 s PRO 636 CO -0.08 -0.58 1.44 -2.14 0.04 0.00 0.00 177.00 175.68 1n60 s PRO 637 N 0.28 3.86 0.43 0.56 0.02 -1.26 -4.86 135.00 134.03 1n60 s PRO 637 Ca 0.66 2.46 0.11 0.00 0.02 0.00 0.00 61.00 64.25 1n60 s PRO 637 Cb -0.45 -2.78 0.98 0.00 0.02 0.00 0.00 34.50 32.27 1n60 s PRO 637 CO 0.39 -0.69 2.04 -1.35 -0.33 0.00 0.00 177.00 177.06 1n60 h PRO 638 N 2.60 0.41 0.00 5.54 0.11 -2.00 -0.58 132.00 138.08 1n60 h PRO 638 Ca -0.51 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1n60 h PRO 638 Cb 1.25 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1n60 h PRO 638 CO 0.62 0.27 0.00 0.27 -0.21 0.00 0.00 178.00 178.96 1n60 n ASN 639 N -4.48 0.00 -4.29 -2.05 6.94 -1.26 -4.86 115.26 105.26 1n60 n ASN 639 Ca 0.05 -0.02 -0.19 0.00 -0.02 0.00 0.00 54.58 54.40 1n60 n ASN 639 Cb 0.20 -0.26 -0.11 0.00 -2.36 0.00 0.00 39.78 37.25 1n60 n ASN 639 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1n60 s LEU 640 N -2.52 2.46 0.47 -4.53 1.43 -0.23 -5.12 118.68 110.65 1n60 s LEU 640 Ca 0.18 -0.89 -0.22 0.00 -1.03 0.00 0.00 54.13 52.17 1n60 s LEU 640 Cb 0.12 -0.62 -0.08 0.00 0.03 0.00 0.00 46.19 45.64 1n60 s LEU 640 CO 0.27 -0.14 1.09 -1.61 0.23 0.00 0.00 176.35 176.18 1n60 s GLU 641 N -3.05 3.77 1.11 1.70 2.02 -1.26 -4.66 118.70 118.33 1n60 s GLU 641 Ca 0.15 1.55 -0.12 0.00 0.02 0.00 0.00 54.97 56.57 1n60 s GLU 641 Cb -0.03 -2.25 0.26 0.00 0.10 0.00 0.00 34.13 32.20 1n60 s GLU 641 CO 0.04 -0.49 1.05 -2.14 0.02 0.00 0.00 175.26 173.75 1n60 s PRO 642 N -2.95 -0.53 0.00 0.39 0.02 -1.26 -4.90 135.00 125.77 1n60 s PRO 642 Ca 0.66 1.04 0.00 0.00 0.02 0.00 0.00 61.00 62.71 1n60 s PRO 642 Cb -0.22 -1.58 0.00 0.00 0.02 0.00 0.00 34.50 32.71 1n60 s PRO 642 CO 0.27 -3.52 0.00 0.41 -0.33 0.00 0.00 177.00 173.83 1n60 n GLY 643 N 0.74 -1.17 2.94 0.52 0.00 -0.04 -4.96 105.19 103.23 1n60 n GLY 643 Ca 0.05 -1.61 -0.08 0.00 0.00 0.00 0.00 46.02 44.38 1n60 n GLY 643 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1n60 s LEU 644 N -2.71 -0.83 0.19 0.99 2.96 -1.26 -4.83 118.68 113.18 1n60 s LEU 644 Ca 0.00 -0.56 -0.21 0.00 -0.22 0.00 0.00 54.13 53.14 1n60 s LEU 644 Cb 0.00 1.20 0.05 0.00 0.50 0.00 0.00 46.19 47.94 1n60 s LEU 644 CO 0.00 -0.32 0.60 -1.83 -1.32 0.00 0.00 176.35 173.49 1n60 s GLU 645 N 2.33 1.40 0.07 1.98 -1.05 -1.26 -1.04 118.70 121.11 1n60 s GLU 645 Ca 0.11 -0.67 -0.26 0.00 -0.15 0.00 0.00 54.97 54.01 1n60 s GLU 645 Cb -0.12 0.58 0.09 0.00 -0.44 0.00 0.00 34.13 34.23 1n60 s GLU 645 CO -0.23 -0.61 0.74 0.00 0.95 0.00 0.00 175.26 176.11 1n60 s ALA 646 N -3.81 -1.72 0.07 -0.84 0.00 -0.12 -4.76 121.76 110.58 1n60 s ALA 646 Ca 0.05 0.80 0.07 0.00 0.00 0.00 0.00 51.96 52.88 1n60 s ALA 646 Cb -0.02 0.58 -0.03 0.00 0.00 0.00 0.00 23.12 23.65 1n60 s ALA 646 CO -0.07 -0.70 -0.19 0.08 0.00 0.00 0.00 175.76 174.88 1n60 s VAL 647 N -3.24 1.58 -0.02 0.00 1.01 -1.26 -0.27 120.40 118.19 1n60 s VAL 647 Ca 0.02 -1.34 0.00 0.00 0.00 0.00 0.00 61.98 60.66 1n60 s VAL 647 Cb -0.01 -1.42 0.02 0.00 0.00 0.00 0.00 36.38 34.98 1n60 s VAL 647 CO -0.10 0.03 0.02 0.21 0.00 0.00 0.00 175.10 175.26 1n60 s ASN 648 N -1.54 0.09 -0.28 3.32 3.84 -0.08 -4.78 114.94 115.51 1n60 s ASN 648 Ca 0.06 0.02 -0.07 0.00 0.21 0.00 0.00 52.86 53.08 1n60 s ASN 648 Cb -0.09 -0.07 0.00 0.00 -0.55 0.00 0.00 41.25 40.54 1n60 s ASN 648 CO 0.03 -0.10 0.06 -0.31 -2.79 0.00 0.00 177.10 173.99 1n60 s TYR 649 N 0.84 3.12 -0.34 0.43 1.51 -1.26 -1.13 117.35 120.51 1n60 s TYR 649 Ca -0.07 -0.88 -0.10 0.00 -1.01 0.00 0.00 57.07 55.01 1n60 s TYR 649 Cb -0.10 -2.23 0.01 0.00 -0.11 0.00 0.00 41.96 39.52 1n60 s TYR 649 CO -0.02 -0.53 0.18 -0.47 -1.11 0.00 0.00 175.55 173.59 1n60 s TYR 650 N 1.52 3.21 -0.46 2.71 5.04 0.53 -4.94 117.35 124.95 1n60 s TYR 650 Ca 0.04 -0.76 -0.17 0.00 -2.44 0.00 0.00 57.07 53.73 1n60 s TYR 650 Cb -0.16 -2.40 0.05 0.00 0.35 0.00 0.00 41.96 39.80 1n60 s TYR 650 CO 0.02 -0.55 0.48 0.34 -1.34 0.00 0.00 175.55 174.50 1n60 s ASP 651 N 1.58 6.19 0.41 4.32 2.15 -1.26 -2.21 116.67 127.85 1n60 s ASP 651 Ca 0.03 -0.97 -0.25 0.00 0.43 0.00 0.00 52.55 51.79 1n60 s ASP 651 Cb -0.18 -2.23 -0.08 0.00 -0.30 0.00 0.00 42.92 40.13 1n60 s ASP 651 CO 0.06 -0.70 1.23 -2.16 -0.17 0.00 0.00 175.17 173.44 1n60 s PRO 652 N 2.12 3.95 0.45 4.34 0.04 -1.26 -4.90 135.00 139.74 1n60 s PRO 652 Ca 0.10 1.98 0.26 0.00 0.04 0.00 0.00 61.00 63.37 1n60 s PRO 652 Cb -0.20 -2.67 0.79 0.00 0.04 0.00 0.00 34.50 32.46 1n60 s PRO 652 CO 0.11 -0.45 1.77 -1.00 0.04 0.00 0.00 177.00 177.47 1n60 h PRO 653 N 2.55 0.00 -2.79 0.56 0.13 -1.94 -3.28 132.00 127.23 1n60 h PRO 653 Ca -0.49 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 64.73 1n60 h PRO 653 Cb 1.24 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.30 1n60 h PRO 653 CO 0.62 0.13 0.31 1.21 -0.23 0.00 0.00 178.00 180.04 1n60 s ASN 654 N -6.08 -0.27 0.98 1.44 2.47 -1.26 -4.86 114.94 107.36 1n60 s ASN 654 Ca 0.03 -0.47 -0.13 0.00 0.42 0.00 0.00 52.86 52.71 1n60 s ASN 654 Cb 0.08 0.64 0.18 0.00 -1.45 0.00 0.00 41.25 40.70 1n60 s ASN 654 CO 0.63 -1.16 1.11 -0.04 -3.72 0.00 0.00 177.10 173.92 1n60 s MET 655 N -3.70 0.56 0.08 0.43 -1.94 -1.26 -4.77 119.30 108.71 1n60 s MET 655 Ca 0.10 0.38 0.03 0.00 -1.71 0.00 0.00 55.69 54.49 1n60 s MET 655 Cb -0.04 -1.76 -0.04 0.00 2.01 0.00 0.00 34.83 35.00 1n60 s MET 655 CO 0.03 -2.61 0.09 0.95 -0.01 0.00 0.00 175.02 173.47 1n60 s THR 656 N -3.09 4.57 -0.57 2.05 -4.23 0.10 -4.74 115.64 109.73 1n60 s THR 656 Ca 0.65 -0.77 0.05 0.00 -1.18 0.00 0.00 61.69 60.45 1n60 s THR 656 Cb -0.17 -3.21 0.20 0.00 1.34 0.00 0.00 72.50 70.65 1n60 s THR 656 CO 0.56 0.11 0.51 -1.22 -0.54 0.00 0.00 174.62 174.04 1n60 n TYR 657 N 0.39 1.70 -1.24 3.99 4.02 -1.26 -0.58 117.16 124.18 1n60 n TYR 657 Ca -0.08 -3.90 -0.30 0.00 -0.01 0.00 0.00 57.90 53.60 1n60 n TYR 657 Cb 0.52 -0.33 0.12 0.00 -0.02 0.00 0.00 39.34 39.63 1n60 n TYR 657 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 1n60 s PRO 658 N -1.21 1.67 0.27 -0.72 0.04 -1.25 -4.72 135.00 129.07 1n60 s PRO 658 Ca 0.31 0.95 -0.03 0.00 0.04 0.00 0.00 61.00 62.27 1n60 s PRO 658 Cb 0.05 -1.85 -0.02 0.00 0.04 0.00 0.00 34.50 32.72 1n60 s PRO 658 CO -0.14 -1.99 0.33 -0.59 0.04 0.00 0.00 177.00 174.65 1n60 s PHE 659 N -2.93 1.02 0.13 0.56 -0.71 -0.76 -0.56 117.98 114.73 1n60 s PHE 659 Ca 0.62 -1.24 -0.25 0.00 -1.04 0.00 0.00 56.93 55.03 1n60 s PHE 659 Cb -0.18 -0.27 0.07 0.00 -1.21 0.00 0.00 43.02 41.44 1n60 s PHE 659 CO 0.56 -0.89 0.74 0.20 -1.34 0.00 0.00 175.22 174.49 1n60 s GLY 660 N -3.18 -0.47 -0.21 1.99 0.00 -0.59 -0.79 107.32 104.08 1n60 s GLY 660 Ca 0.33 0.51 -0.01 0.00 0.00 0.00 0.00 44.72 45.55 1n60 s GLY 660 CO 0.16 0.17 -0.01 0.00 0.00 0.00 0.00 173.10 173.42 1n60 s ALA 661 N -3.54 1.45 -0.07 3.20 0.00 -0.18 -1.46 121.76 121.17 1n60 s ALA 661 Ca 0.05 -1.00 0.04 0.00 0.00 0.00 0.00 51.96 51.04 1n60 s ALA 661 Cb -0.02 -1.29 -0.02 0.00 0.00 0.00 0.00 23.12 21.79 1n60 s ALA 661 CO -0.08 -1.18 -0.19 0.71 0.00 0.00 0.00 175.76 175.03 1n60 s TYR 662 N 1.64 2.61 -0.05 0.00 1.51 0.28 -1.52 117.35 121.81 1n60 s TYR 662 Ca -0.03 -0.49 0.02 0.00 -1.01 0.00 0.00 57.07 55.56 1n60 s TYR 662 Cb -0.18 -1.66 0.01 0.00 -0.11 0.00 0.00 41.96 40.03 1n60 s TYR 662 CO -0.07 -0.06 -0.10 -0.06 -1.11 0.00 0.00 175.55 174.14 1n60 s PHE 663 N -0.27 1.25 -0.08 2.71 0.40 -0.12 -1.07 117.98 120.80 1n60 s PHE 663 Ca 0.01 -0.42 0.03 0.00 -0.60 0.00 0.00 56.93 55.95 1n60 s PHE 663 Cb -0.13 -0.93 0.01 0.00 0.51 0.00 0.00 43.02 42.47 1n60 s PHE 663 CO 0.03 -0.23 -0.18 0.00 0.70 0.00 0.00 175.22 175.54 1n60 s ILE 665 N 0.45 4.02 -0.05 0.00 1.01 0.06 -0.06 121.20 126.63 1n60 s ILE 665 Ca -0.15 -0.30 0.03 0.00 0.00 0.00 0.00 60.65 60.22 1n60 s ILE 665 Cb -0.16 -2.79 0.01 0.00 0.01 0.00 0.00 42.46 39.53 1n60 s ILE 665 CO 0.06 0.47 -0.13 -0.32 0.00 0.00 0.00 174.94 175.01 1n60 s MET 666 N 0.57 1.65 -0.10 2.79 1.75 -0.01 0.15 119.30 126.09 1n60 s MET 666 Ca -0.01 -0.46 -0.02 0.00 -1.25 0.00 0.00 55.69 53.94 1n60 s MET 666 Cb -0.14 -1.40 -0.03 0.00 2.84 0.00 0.00 34.83 36.10 1n60 s MET 666 CO 0.02 0.10 -0.01 -0.51 -0.65 0.00 0.00 175.02 173.98 1n60 s ASP 667 N 0.41 5.14 -0.05 1.11 1.01 -0.56 -0.13 116.67 123.61 1n60 s ASP 667 Ca -0.10 0.08 0.02 0.00 0.71 0.00 0.00 52.55 53.26 1n60 s ASP 667 Cb -0.14 -1.54 0.02 0.00 1.01 0.00 0.00 42.92 42.27 1n60 s ASP 667 CO 0.03 0.32 -0.09 -0.63 0.21 0.00 0.00 175.17 175.02 1n60 s ILE 668 N -0.56 0.86 -0.47 0.77 1.01 0.68 -0.02 121.20 123.46 1n60 s ILE 668 Ca 0.09 -0.33 -0.26 0.00 0.00 0.00 0.00 60.65 60.15 1n60 s ILE 668 Cb -0.12 -0.81 0.03 0.00 0.01 0.00 0.00 42.46 41.57 1n60 s ILE 668 CO 0.02 0.29 0.98 -0.62 0.00 0.00 0.00 174.94 175.61 1n60 s ASP 669 N 0.69 6.51 0.29 3.58 -1.08 -0.13 -0.83 116.67 125.71 1n60 s ASP 669 Ca -0.12 0.16 0.25 0.00 -0.52 0.00 0.00 52.55 52.32 1n60 s ASP 669 Cb -0.15 -2.47 0.97 0.00 -1.46 0.00 0.00 42.92 39.82 1n60 s ASP 669 CO 0.02 -1.12 1.76 -0.37 0.52 0.00 0.00 175.17 175.98 1n60 h VAL 670 N 6.11 0.00 0.00 1.11 -1.51 -1.64 0.14 116.25 120.46 1n60 h VAL 670 Ca -0.24 -0.34 -0.17 0.00 -1.23 0.00 0.00 66.70 64.73 1n60 h VAL 670 Cb 1.07 1.17 -0.03 0.00 -2.13 0.00 0.00 31.29 31.37 1n60 h VAL 670 CO 1.06 0.00 -0.94 0.44 -1.23 0.00 0.00 177.57 176.89 1n60 h ASP 671 N 0.00 0.00 0.00 4.19 3.32 -1.91 -3.34 116.42 118.67 1n60 h ASP 671 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1n60 h ASP 671 Cb 0.48 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1n60 h ASP 671 CO 0.00 0.71 -1.18 0.35 -1.72 0.00 0.00 179.24 177.40 1n60 n THR 672 N -3.18 0.00 -0.88 0.35 -2.24 -1.16 -4.99 114.28 102.18 1n60 n THR 672 Ca -0.03 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1n60 n THR 672 Cb 0.85 0.47 0.00 0.00 -2.10 0.00 0.00 70.33 69.54 1n60 n THR 672 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n60 n GLY 673 N 1.76 0.82 3.68 3.38 0.00 0.47 -4.48 105.19 110.82 1n60 n GLY 673 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1n60 n GLY 673 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n60 s VAL 674 N -3.19 4.77 -0.09 1.61 1.01 -1.20 -4.10 120.40 119.21 1n60 s VAL 674 Ca 0.00 2.04 -0.03 0.00 0.00 0.00 0.00 61.98 63.99 1n60 s VAL 674 Cb 0.00 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 1n60 s VAL 674 CO 0.00 -0.02 0.06 0.00 0.00 0.00 0.00 175.10 175.13 1n60 s ALA 675 N 2.19 3.51 -0.07 5.51 0.00 -1.26 -0.95 121.76 130.68 1n60 s ALA 675 Ca 0.48 -0.76 -0.00 0.00 0.00 0.00 0.00 51.96 51.67 1n60 s ALA 675 Cb -0.18 -1.65 0.02 0.00 0.00 0.00 0.00 23.12 21.32 1n60 s ALA 675 CO 0.16 0.61 -0.04 0.21 0.00 0.00 0.00 175.76 176.70 1n60 s LYS 676 N -1.04 1.01 0.02 0.00 2.47 0.96 -5.00 119.74 118.16 1n60 s LYS 676 Ca 0.15 -0.10 -0.30 0.00 -1.56 0.00 0.00 55.97 54.16 1n60 s LYS 676 Cb -0.12 -1.13 -0.07 0.00 -1.46 0.00 0.00 37.83 35.05 1n60 s LYS 676 CO 0.04 -0.20 1.61 0.99 0.16 0.00 0.00 175.35 177.95 1n60 s THR 677 N 1.47 3.35 -0.10 3.43 2.01 -1.26 -1.49 115.64 123.04 1n60 s THR 677 Ca -0.02 0.67 -0.18 0.00 0.31 0.00 0.00 61.69 62.48 1n60 s THR 677 Cb -0.13 -3.43 -0.28 0.00 0.01 0.00 0.00 72.50 68.67 1n60 s THR 677 CO -0.04 -0.02 0.63 -0.09 -0.69 0.00 0.00 174.62 174.41 1n60 h ARG 678 N 8.63 0.23 -2.27 4.92 2.43 -0.65 -3.47 114.38 124.21 1n60 h ARG 678 Ca -0.41 -0.40 -0.07 0.00 -0.81 0.00 0.00 59.98 58.30 1n60 h ARG 678 Cb 1.19 0.15 -0.22 0.00 -0.42 0.00 0.00 29.97 30.67 1n60 h ARG 678 CO 0.93 1.19 0.01 0.50 -1.51 0.00 0.00 179.97 181.09 1n60 s ARG 679 N -2.45 0.75 -0.10 0.20 3.52 -1.09 -4.98 118.95 114.80 1n60 s ARG 679 Ca -0.19 0.74 -0.02 0.00 -0.13 0.00 0.00 55.73 56.14 1n60 s ARG 679 Cb 0.03 0.36 0.04 0.00 -1.56 0.00 0.00 34.95 33.82 1n60 s ARG 679 CO 0.77 -0.12 0.02 0.12 -0.81 0.00 0.00 175.30 175.28 1n60 s PHE 680 N 0.09 0.67 -0.17 5.12 2.19 -1.26 -0.76 117.98 123.86 1n60 s PHE 680 Ca -0.02 -0.27 -0.02 0.00 0.33 0.00 0.00 56.93 56.96 1n60 s PHE 680 Cb -0.04 -0.82 -0.01 0.00 -1.31 0.00 0.00 43.02 40.85 1n60 s PHE 680 CO 0.02 -0.38 -0.10 -0.47 1.83 0.00 0.00 175.22 176.12 1n60 s TYR 681 N 1.97 2.88 -0.23 10.12 5.04 0.23 -1.52 117.35 135.84 1n60 s TYR 681 Ca 0.04 -0.82 0.00 0.00 -2.44 0.00 0.00 57.07 53.85 1n60 s TYR 681 Cb -0.13 -1.95 0.06 0.00 0.35 0.00 0.00 41.96 40.29 1n60 s TYR 681 CO -0.06 -0.38 -0.03 0.00 -1.34 0.00 0.00 175.55 173.74 1n60 s ALA 682 N 0.85 1.84 -0.25 3.97 0.00 0.28 -0.95 121.76 127.49 1n60 s ALA 682 Ca -0.03 -1.31 -0.12 0.00 0.00 0.00 0.00 51.96 50.50 1n60 s ALA 682 Cb -0.15 -1.42 -0.05 0.00 0.00 0.00 0.00 23.12 21.50 1n60 s ALA 682 CO 0.01 -1.22 0.23 -1.17 0.00 0.00 0.00 175.76 173.60 1n60 s LEU 683 N 1.45 4.09 -0.02 0.00 0.20 -0.57 -0.77 118.68 123.05 1n60 s LEU 683 Ca -0.04 0.15 0.07 0.00 0.69 0.00 0.00 54.13 55.00 1n60 s LEU 683 Cb -0.19 -2.20 -0.02 0.00 -0.43 0.00 0.00 46.19 43.35 1n60 s LEU 683 CO -0.07 -0.02 -0.24 -1.81 -0.29 0.00 0.00 176.35 173.93 1n60 s ASP 684 N 1.32 2.80 -0.27 3.68 1.01 -0.69 -1.01 116.67 123.51 1n60 s ASP 684 Ca 0.10 -0.44 0.01 0.00 0.71 0.00 0.00 52.55 52.93 1n60 s ASP 684 Cb -0.15 -0.38 0.08 0.00 1.01 0.00 0.00 42.92 43.48 1n60 s ASP 684 CO 0.07 0.28 -0.01 -0.62 0.21 0.00 0.00 175.17 175.11 1n60 s ASP 685 N -0.49 4.13 -0.26 0.27 -1.08 0.03 -3.39 116.67 115.87 1n60 s ASP 685 Ca 0.07 -1.48 0.09 0.00 -0.52 0.00 0.00 52.55 50.71 1n60 s ASP 685 Cb -0.10 -1.26 0.47 0.00 -1.46 0.00 0.00 42.92 40.57 1n60 s ASP 685 CO -0.00 -0.29 1.35 0.00 0.52 0.00 0.00 175.17 176.75 1n60 n GLY 687 N -1.10 0.88 3.71 0.00 0.00 -1.23 -0.75 105.19 106.70 1n60 n GLY 687 Ca 0.28 -0.74 -0.43 0.00 0.00 0.00 0.00 46.02 45.14 1n60 n GLY 687 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1n60 n THR 688 N 0.00 0.94 -3.73 2.61 -1.04 -0.81 -4.59 114.28 107.66 1n60 n THR 688 Ca 0.00 -0.24 -0.38 0.00 -2.04 0.00 0.00 64.05 61.40 1n60 n THR 688 Cb 0.00 -1.73 -0.12 0.00 -1.82 0.00 0.00 70.33 66.66 1n60 n THR 688 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1n60 s ARG 689 N -0.39 3.09 -0.03 -2.82 0.52 -1.26 -4.37 118.95 113.69 1n60 s ARG 689 Ca 0.67 -0.87 -0.24 0.00 -0.52 0.00 0.00 55.73 54.77 1n60 s ARG 689 Cb -0.57 -3.43 -0.21 0.00 0.52 0.00 0.00 34.95 31.26 1n60 s ARG 689 CO 0.48 -0.47 1.14 0.82 0.02 0.00 0.00 175.30 177.30 1n60 h ILE 690 N 5.85 1.48 -2.54 1.52 2.04 -1.94 -3.26 117.51 120.66 1n60 h ILE 690 Ca -0.31 -1.62 -0.45 0.00 1.00 0.00 0.00 64.86 63.48 1n60 h ILE 690 Cb 1.13 2.46 -0.37 0.00 -0.74 0.00 0.00 36.82 39.30 1n60 h ILE 690 CO 0.61 0.44 -0.72 0.21 0.00 0.00 0.00 178.15 178.69 1n60 s ASN 691 N -6.09 2.78 0.47 1.72 3.84 -1.26 0.38 114.94 116.77 1n60 s ASN 691 Ca -0.16 -1.07 0.15 0.00 0.21 0.00 0.00 52.86 52.00 1n60 s ASN 691 Cb 0.02 -0.01 1.13 0.00 -0.55 0.00 0.00 41.25 41.84 1n60 s ASN 691 CO 0.72 -0.42 2.05 -0.65 -2.79 0.00 0.00 177.10 176.01 1n60 h PRO 692 N 8.35 0.24 -0.20 0.43 0.11 -1.79 -0.93 132.00 138.21 1n60 h PRO 692 Ca -0.17 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.89 1n60 h PRO 692 Cb 1.04 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 1n60 h PRO 692 CO 0.40 0.16 0.02 1.98 -0.21 0.00 0.00 178.00 180.34 1n60 h MET 693 N 0.25 0.35 -0.61 1.05 4.05 -1.92 -1.17 114.93 116.92 1n60 h MET 693 Ca 0.16 -0.10 -0.05 0.00 -0.28 0.00 0.00 59.70 59.43 1n60 h MET 693 Cb 0.32 -0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 31.06 1n60 h MET 693 CO -0.03 0.52 0.18 0.82 0.23 0.00 0.00 176.91 178.63 1n60 h ILE 694 N 0.12 1.25 -0.46 1.77 2.04 -1.74 -1.90 117.51 118.59 1n60 h ILE 694 Ca 0.06 -0.85 -0.00 0.00 1.00 0.00 0.00 64.86 65.06 1n60 h ILE 694 Cb 0.35 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 1n60 h ILE 694 CO 0.01 0.32 0.28 0.40 0.00 0.00 0.00 178.15 179.16 1n60 h ILE 695 N 0.87 1.14 -0.75 -0.67 2.04 -1.10 -0.86 117.51 118.19 1n60 h ILE 695 Ca 0.19 -0.32 0.06 0.00 1.00 0.00 0.00 64.86 65.79 1n60 h ILE 695 Cb 0.31 0.53 -0.06 0.00 -0.74 0.00 0.00 36.82 36.86 1n60 h ILE 695 CO -0.00 0.15 0.44 -0.08 0.00 0.00 0.00 178.15 178.65 1n60 h GLU 696 N 0.61 0.78 -0.61 2.37 4.81 -0.98 -0.20 114.58 121.36 1n60 h GLU 696 Ca 0.16 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.29 1n60 h GLU 696 Cb -0.01 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.17 1n60 h GLU 696 CO -0.03 0.52 0.16 0.78 -0.73 0.00 0.00 179.01 179.70 1n60 h GLY 697 N 0.80 1.02 1.01 1.92 0.00 -0.77 0.02 103.07 107.07 1n60 h GLY 697 Ca 0.33 -0.60 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 1n60 h GLY 697 CO -0.18 0.56 0.53 1.46 0.00 0.00 0.00 176.54 178.91 1n60 h GLN 698 N 0.91 1.17 -0.17 4.80 1.08 -0.24 -1.18 115.11 121.47 1n60 h GLN 698 Ca 0.20 -0.10 -0.04 0.00 -1.45 0.00 0.00 58.65 57.26 1n60 h GLN 698 Cb 0.31 -0.25 -0.01 0.00 -0.05 0.00 0.00 27.48 27.49 1n60 h GLN 698 CO -0.00 0.81 -0.04 0.28 -0.95 0.00 0.00 178.83 178.93 1n60 h VAL 699 N 1.19 1.28 -0.52 -0.54 2.07 -0.57 -0.77 116.25 118.39 1n60 h VAL 699 Ca 0.31 -0.99 0.06 0.00 0.82 0.00 0.00 66.70 66.91 1n60 h VAL 699 Cb -0.07 1.58 -0.05 0.00 -1.52 0.00 0.00 31.29 31.23 1n60 h VAL 699 CO -0.06 0.30 0.22 0.45 0.02 0.00 0.00 177.57 178.50 1n60 h HIS 700 N 0.04 0.40 -0.44 1.57 3.86 -0.78 0.84 115.15 120.64 1n60 h HIS 700 Ca 0.04 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.24 1n60 h HIS 700 Cb 0.47 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 28.82 1n60 h HIS 700 CO 0.05 0.16 0.11 0.78 0.86 0.00 0.00 177.93 179.89 1n60 h GLY 701 N 0.43 0.77 1.60 2.45 0.00 -1.08 -2.09 103.07 105.15 1n60 h GLY 701 Ca 0.25 -0.48 -0.12 0.00 0.00 0.00 0.00 47.33 46.98 1n60 h GLY 701 CO -0.22 0.45 -0.38 -1.33 0.00 0.00 0.00 176.54 175.06 1n60 h GLY 702 N 0.59 0.49 1.70 4.60 0.00 -0.70 -2.00 103.07 107.74 1n60 h GLY 702 Ca 0.14 -0.46 -0.11 0.00 0.00 0.00 0.00 47.33 46.90 1n60 h GLY 702 CO 0.00 0.42 -0.36 1.41 0.00 0.00 0.00 176.54 178.01 1n60 h LEU 703 N 0.37 0.35 -0.51 3.11 3.38 -0.78 -0.28 115.31 120.96 1n60 h LEU 703 Ca 0.04 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.76 1n60 h LEU 703 Cb 0.84 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 1n60 h LEU 703 CO 0.07 0.70 -0.08 0.74 0.09 0.00 0.00 178.44 179.95 1n60 h THR 704 N 0.29 1.27 -0.59 0.22 2.02 -1.09 0.35 112.91 115.38 1n60 h THR 704 Ca 0.03 -1.22 -0.00 0.00 0.77 0.00 0.00 66.41 65.99 1n60 h THR 704 Cb 0.78 1.01 -0.03 0.00 -1.74 0.00 0.00 68.15 68.17 1n60 h THR 704 CO 0.06 0.43 0.36 -0.33 0.37 0.00 0.00 175.52 176.41 1n60 h GLU 705 N 0.82 0.79 -0.55 6.66 5.08 -1.08 -0.84 114.58 125.46 1n60 h GLU 705 Ca 0.13 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1n60 h GLU 705 Cb 0.64 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.69 1n60 h GLU 705 CO 0.04 0.56 0.35 0.00 -1.00 0.00 0.00 179.01 178.97 1n60 h ALA 706 N 1.18 0.70 -0.30 3.43 0.00 -0.62 0.14 119.26 123.80 1n60 h ALA 706 Ca 0.21 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.12 1n60 h ALA 706 Cb -0.03 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1n60 h ALA 706 CO -0.04 0.11 0.10 0.35 0.00 0.00 0.00 179.25 179.77 1n60 h PHE 707 N 0.72 0.18 -0.42 0.00 3.57 -0.72 -0.32 116.94 119.95 1n60 h PHE 707 Ca 0.21 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.72 1n60 h PHE 707 Cb -0.05 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.63 1n60 h PHE 707 CO -0.04 0.08 0.23 0.00 -2.23 0.00 0.00 178.31 176.35 1n60 h ALA 708 N 1.19 0.54 -0.09 2.41 0.00 -0.29 -0.14 119.26 122.87 1n60 h ALA 708 Ca 0.13 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1n60 h ALA 708 Cb 0.10 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1n60 h ALA 708 CO -0.14 0.07 0.02 0.28 0.00 0.00 0.00 179.25 179.48 1n60 h VAL 709 N 0.55 1.20 -0.28 0.00 2.07 -0.54 0.23 116.25 119.48 1n60 h VAL 709 Ca 0.15 -0.61 -0.14 0.00 0.82 0.00 0.00 66.70 66.92 1n60 h VAL 709 Cb 0.05 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1n60 h VAL 709 CO -0.02 0.17 -0.39 0.00 0.02 0.00 0.00 177.57 177.35 1n60 h ALA 710 N 0.81 0.80 0.00 1.67 0.00 -0.99 -3.34 119.26 118.21 1n60 h ALA 710 Ca 0.03 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1n60 h ALA 710 Cb 0.25 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1n60 h ALA 710 CO 0.00 0.65 -1.13 -1.33 0.00 0.00 0.00 179.25 177.44 1n60 n MET 711 N -4.04 0.13 0.00 0.00 2.00 -0.07 -0.00 117.12 115.13 1n60 n MET 711 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 57.70 57.66 1n60 n MET 711 Cb 0.52 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 32.24 1n60 n MET 711 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1n60 n GLY 712 N 1.47 0.00 3.77 3.03 0.00 -0.19 -2.35 105.19 110.92 1n60 n GLY 712 Ca 0.03 -0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 1n60 n GLY 712 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n60 s GLN 713 N -0.80 4.13 -0.12 1.61 -0.21 0.65 -4.52 119.66 120.40 1n60 s GLN 713 Ca 0.00 1.73 -0.30 0.00 0.02 0.00 0.00 55.36 56.81 1n60 s GLN 713 Cb 0.00 -2.67 0.12 0.00 1.00 0.00 0.00 33.01 31.46 1n60 s GLN 713 CO 0.00 -0.23 0.94 -1.83 -2.12 0.00 0.00 175.29 172.05 1n60 s GLU 714 N -2.30 0.69 -0.12 2.91 -1.05 -1.26 -4.74 118.70 112.84 1n60 s GLU 714 Ca 0.56 0.08 0.03 0.00 -0.15 0.00 0.00 54.97 55.49 1n60 s GLU 714 Cb -0.28 0.33 0.00 0.00 -0.44 0.00 0.00 34.13 33.74 1n60 s GLU 714 CO 0.35 -0.24 -0.22 0.42 0.95 0.00 0.00 175.26 176.52 1n60 s ILE 715 N -1.50 2.13 0.31 1.83 -1.09 -0.54 -4.79 121.20 117.54 1n60 s ILE 715 Ca -0.02 -0.98 0.06 0.00 -2.23 0.00 0.00 60.65 57.49 1n60 s ILE 715 Cb -0.00 -1.83 -0.06 0.00 -1.58 0.00 0.00 42.46 38.98 1n60 s ILE 715 CO 0.01 0.55 -0.02 -0.13 -1.23 0.00 0.00 174.94 174.12 1n60 s ARG 716 N 0.55 1.65 -0.02 2.79 0.52 -0.84 -4.57 118.95 119.03 1n60 s ARG 716 Ca -0.13 -1.87 0.03 0.00 -0.52 0.00 0.00 55.73 53.24 1n60 s ARG 716 Cb -0.17 -1.18 -0.01 0.00 0.52 0.00 0.00 34.95 34.12 1n60 s ARG 716 CO 0.04 -0.02 -0.11 0.71 0.02 0.00 0.00 175.30 175.94 1n60 s TYR 717 N -3.02 1.03 0.73 -0.53 1.51 -1.26 0.33 117.35 116.14 1n60 s TYR 717 Ca 0.32 -0.22 -0.05 0.00 -1.01 0.00 0.00 57.07 56.11 1n60 s TYR 717 Cb 0.06 -0.68 0.15 0.00 -0.11 0.00 0.00 41.96 41.38 1n60 s TYR 717 CO 0.14 -0.05 1.00 -0.40 -1.11 0.00 0.00 175.55 175.13 1n60 n ASP 718 N 2.95 0.80 0.28 2.29 5.68 -0.64 -4.91 116.55 123.01 1n60 n ASP 718 Ca -0.15 -1.80 0.16 0.00 -0.50 0.00 0.00 54.79 52.50 1n60 n ASP 718 Cb 0.55 -0.69 0.81 0.00 -1.14 0.00 0.00 41.12 40.65 1n60 n ASP 718 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1n60 h GLU 719 N 0.00 0.00 -0.01 0.11 5.08 -1.99 0.11 114.58 117.88 1n60 h GLU 719 Ca -0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 1n60 h GLU 719 Cb 1.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1n60 h GLU 719 CO 0.30 0.06 -0.16 1.04 -1.00 0.00 0.00 179.01 179.25 1n60 n GLN 720 N -3.30 0.73 -0.85 2.33 3.00 -1.26 -4.81 117.38 113.23 1n60 n GLN 720 Ca -0.01 -0.32 0.00 0.00 -0.01 0.00 0.00 57.00 56.66 1n60 n GLN 720 Cb 0.24 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 28.99 1n60 n GLN 720 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1n60 n GLY 721 N 1.30 0.58 3.73 1.08 0.00 0.03 -4.50 105.19 107.41 1n60 n GLY 721 Ca 0.13 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1n60 n GLY 721 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1n60 s ASN 722 N -2.01 6.76 0.02 1.61 0.01 -1.26 -4.48 114.94 115.58 1n60 s ASN 722 Ca 0.00 2.49 -0.30 0.00 -0.71 0.00 0.00 52.86 54.33 1n60 s ASN 722 Cb 0.00 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 39.02 1n60 s ASN 722 CO 0.00 -0.66 1.01 0.54 -1.51 0.00 0.00 177.10 176.47 1n60 s VAL 723 N 0.57 4.73 -0.07 1.60 0.11 -1.26 -1.62 120.40 124.46 1n60 s VAL 723 Ca 0.62 1.98 0.03 0.00 -2.93 0.00 0.00 61.98 61.69 1n60 s VAL 723 Cb -0.39 -4.27 -0.02 0.00 -1.53 0.00 0.00 36.38 30.17 1n60 s VAL 723 CO 0.36 0.16 -0.17 -0.76 -3.33 0.00 0.00 175.10 171.36 1n60 s LEU 724 N 0.94 2.54 -0.01 2.54 1.43 0.15 -4.67 118.68 121.62 1n60 s LEU 724 Ca 0.53 -0.32 0.00 0.00 -1.03 0.00 0.00 54.13 53.31 1n60 s LEU 724 Cb -0.22 -1.52 0.00 0.00 0.03 0.00 0.00 46.19 44.48 1n60 s LEU 724 CO 0.28 0.27 0.00 0.61 0.23 0.00 0.00 176.35 177.75 1n60 n GLY 725 N 2.78 0.45 2.54 -3.19 0.00 -1.26 -1.98 105.19 104.53 1n60 n GLY 725 Ca -0.17 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.07 1n60 n GLY 725 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n60 n ALA 726 N 1.00 6.53 -3.47 4.61 0.00 -1.26 -3.21 120.51 124.72 1n60 n ALA 726 Ca -0.00 -3.49 -0.09 0.00 0.00 0.00 0.00 53.44 49.86 1n60 n ALA 726 Cb 0.01 -2.29 -0.03 0.00 0.00 0.00 0.00 19.45 17.13 1n60 n ALA 726 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1n60 s SER 727 N 0.13 -0.24 0.00 0.00 1.04 -1.26 -4.44 113.70 108.93 1n60 s SER 727 Ca 0.56 -0.60 0.22 0.00 0.48 0.00 0.00 55.95 56.61 1n60 s SER 727 Cb 0.33 0.63 1.28 0.00 0.10 0.00 0.00 66.02 68.36 1n60 s SER 727 CO -0.21 -1.17 1.70 0.49 0.98 0.00 0.00 173.24 175.03 1n60 n PHE 728 N -0.39 0.00 0.16 5.02 3.72 -1.26 -0.57 117.46 124.13 1n60 n PHE 728 Ca -0.06 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.38 1n60 n PHE 728 Cb 0.61 -0.05 0.48 0.00 -0.94 0.00 0.00 39.48 39.58 1n60 n PHE 728 CO 0.00 0.00 0.00 0.52 -0.05 0.00 0.00 176.76 177.23 1n60 h MET 729 N 0.00 0.17 0.00 -1.08 2.86 -1.95 -3.38 114.93 111.55 1n60 h MET 729 Ca 0.00 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1n60 h MET 729 Cb 0.04 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.67 1n60 h MET 729 CO 0.00 0.24 -0.55 -0.25 1.06 0.00 0.00 176.91 177.41 1n60 n ASP 730 N -4.37 2.64 -4.63 1.22 8.00 -0.74 -5.02 116.55 113.64 1n60 n ASP 730 Ca -0.01 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.06 1n60 n ASP 730 Cb 0.19 0.22 -0.03 0.00 -0.02 0.00 0.00 41.12 41.49 1n60 n ASP 730 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1n60 s PHE 731 N -1.55 2.12 -0.60 1.24 5.36 0.26 -4.89 117.98 119.91 1n60 s PHE 731 Ca 0.00 0.54 -0.27 0.00 -0.96 0.00 0.00 56.93 56.23 1n60 s PHE 731 Cb 0.00 -3.97 0.01 0.00 -0.34 0.00 0.00 43.02 38.72 1n60 s PHE 731 CO 0.00 -2.95 1.53 0.12 -1.46 0.00 0.00 175.22 172.45 1n60 s PHE 732 N 5.09 2.09 -0.25 10.12 5.36 -1.26 -4.71 117.98 134.42 1n60 s PHE 732 Ca 0.71 0.45 -0.03 0.00 -0.96 0.00 0.00 56.93 57.10 1n60 s PHE 732 Cb -0.25 -4.35 0.01 0.00 -0.34 0.00 0.00 43.02 38.09 1n60 s PHE 732 CO 0.29 -2.14 -0.03 -0.51 -1.46 0.00 0.00 175.22 171.37 1n60 s LEU 733 N 6.87 3.18 0.48 6.12 1.43 -1.26 -4.51 118.68 130.99 1n60 s LEU 733 Ca 0.54 -0.67 -0.22 0.00 -1.03 0.00 0.00 54.13 52.75 1n60 s LEU 733 Cb -0.11 -1.73 -0.07 0.00 0.03 0.00 0.00 46.19 44.31 1n60 s LEU 733 CO 0.22 -0.10 1.15 -2.16 0.23 0.00 0.00 176.35 175.69 1n60 s PRO 734 N 1.41 3.66 0.78 1.29 0.04 -1.26 -5.03 135.00 135.89 1n60 s PRO 734 Ca 0.03 1.73 -0.03 0.00 0.04 0.00 0.00 61.00 62.76 1n60 s PRO 734 Cb -0.16 -2.30 0.16 0.00 0.04 0.00 0.00 34.50 32.24 1n60 s PRO 734 CO -0.03 -0.63 1.07 0.95 0.04 0.00 0.00 177.00 178.41 1n60 s THR 735 N -1.61 2.02 0.59 1.26 -4.23 -1.26 -4.90 115.64 107.52 1n60 s THR 735 Ca 0.66 -0.52 0.33 0.00 -1.18 0.00 0.00 61.69 60.98 1n60 s THR 735 Cb -0.27 -2.50 0.37 0.00 1.34 0.00 0.00 72.50 71.44 1n60 s THR 735 CO 0.32 0.00 2.27 0.00 -0.54 0.00 0.00 174.62 176.67 1n60 h ALA 736 N -0.78 1.38 -0.11 3.99 0.00 -1.96 -1.93 119.26 119.87 1n60 h ALA 736 Ca -0.36 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.38 1n60 h ALA 736 Cb 1.25 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.05 1n60 h ALA 736 CO 0.37 0.01 -0.56 0.28 0.00 0.00 0.00 179.25 179.34 1n60 h VAL 737 N 0.00 1.35 0.00 0.00 2.07 -2.02 -3.30 116.25 114.35 1n60 h VAL 737 Ca -0.00 -1.87 -0.11 0.00 0.82 0.00 0.00 66.70 65.55 1n60 h VAL 737 Cb 0.03 2.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.95 1n60 h VAL 737 CO 0.00 0.57 -0.64 -0.33 0.02 0.00 0.00 177.57 177.19 1n60 h GLU 738 N 0.19 0.00 -6.30 1.57 3.07 -1.82 -3.45 114.58 107.84 1n60 h GLU 738 Ca -0.04 0.00 -0.55 0.00 -0.50 0.00 0.00 59.36 58.27 1n60 h GLU 738 Cb 1.21 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.10 1n60 h GLU 738 CO 0.12 0.42 0.74 0.99 -1.40 0.00 0.00 179.01 179.87 1n60 s THR 739 N -2.98 4.22 0.84 1.13 2.01 -0.77 -4.97 115.64 115.12 1n60 s THR 739 Ca 0.03 1.54 -0.11 0.00 0.31 0.00 0.00 61.69 63.45 1n60 s THR 739 Cb 0.08 -3.99 0.10 0.00 0.01 0.00 0.00 72.50 68.70 1n60 s THR 739 CO 0.75 -0.02 1.15 -2.84 -0.69 0.00 0.00 174.62 172.98 1n60 s PRO 740 N 2.40 1.50 0.29 4.92 0.02 -1.26 -4.96 135.00 137.92 1n60 s PRO 740 Ca 0.56 1.54 -0.29 0.00 0.02 0.00 0.00 61.00 62.84 1n60 s PRO 740 Cb -0.25 -1.78 -0.10 0.00 0.02 0.00 0.00 34.50 32.39 1n60 s PRO 740 CO 0.21 -2.27 1.17 0.15 -0.33 0.00 0.00 177.00 175.93 1n60 s LYS 741 N -4.50 4.54 -0.11 5.54 1.02 -1.26 -5.04 119.74 119.93 1n60 s LYS 741 Ca 0.68 1.94 -0.01 0.00 0.02 0.00 0.00 55.97 58.60 1n60 s LYS 741 Cb -0.23 -3.15 -0.03 0.00 -0.52 0.00 0.00 37.83 33.90 1n60 s LYS 741 CO 0.54 0.08 -0.06 -1.58 -0.92 0.00 0.00 175.35 173.41 1n60 s TRP 742 N -1.13 2.96 -0.20 3.18 0.52 -1.26 -4.40 118.94 118.60 1n60 s TRP 742 Ca 0.46 -0.20 -0.05 0.00 0.02 0.00 0.00 56.10 56.33 1n60 s TRP 742 Cb -0.35 -1.84 -0.02 0.00 -1.15 0.00 0.00 33.47 30.12 1n60 s TRP 742 CO 0.45 0.10 -0.02 -2.00 0.02 0.00 0.00 176.95 175.51 1n60 s GLU 743 N -0.15 3.56 0.17 4.98 2.12 -0.58 -5.05 118.70 123.75 1n60 s GLU 743 Ca 0.02 -0.55 0.11 0.00 0.36 0.00 0.00 54.97 54.91 1n60 s GLU 743 Cb -0.13 -3.04 -0.04 0.00 0.26 0.00 0.00 34.13 31.18 1n60 s GLU 743 CO 0.03 -0.02 -0.24 0.95 -0.54 0.00 0.00 175.26 175.44 1n60 s THR 744 N 1.05 2.37 0.32 -1.70 -4.23 -1.26 -0.56 115.64 111.63 1n60 s THR 744 Ca 0.02 -1.93 -0.10 0.00 -1.18 0.00 0.00 61.69 58.49 1n60 s THR 744 Cb -0.14 -2.11 0.02 0.00 1.34 0.00 0.00 72.50 71.60 1n60 s THR 744 CO 0.01 -0.05 0.58 -0.62 -0.54 0.00 0.00 174.62 174.00 1n60 s ASP 745 N -2.49 0.31 0.18 3.99 -1.08 0.05 -4.91 116.67 112.72 1n60 s ASP 745 Ca 0.19 -1.18 -0.18 0.00 -0.52 0.00 0.00 52.55 50.86 1n60 s ASP 745 Cb -0.09 0.70 0.04 0.00 -1.46 0.00 0.00 42.92 42.11 1n60 s ASP 745 CO 0.09 -1.36 0.52 -0.72 0.52 0.00 0.00 175.17 174.21 1n60 s TYR 746 N -3.19 -0.21 0.33 -5.34 1.13 -1.26 -1.70 117.35 107.11 1n60 s TYR 746 Ca 0.23 -0.11 0.03 0.00 -1.41 0.00 0.00 57.07 55.82 1n60 s TYR 746 Cb -0.02 0.40 -0.05 0.00 -1.10 0.00 0.00 41.96 41.19 1n60 s TYR 746 CO 0.14 -0.87 0.08 0.95 -2.51 0.00 0.00 175.55 173.34 1n60 s THR 747 N -3.84 0.97 -0.20 -3.49 -4.23 -1.22 -4.93 115.64 98.71 1n60 s THR 747 Ca 0.06 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.57 1n60 s THR 747 Cb -0.01 -2.69 0.05 0.00 1.34 0.00 0.00 72.50 71.19 1n60 s THR 747 CO -0.06 0.00 -0.04 -0.69 -0.54 0.00 0.00 174.62 173.29 1n60 s VAL 748 N -3.37 1.24 -0.43 2.29 1.01 -1.26 -4.24 120.40 115.64 1n60 s VAL 748 Ca 0.35 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 61.43 1n60 s VAL 748 Cb 0.08 -1.51 0.13 0.00 0.00 0.00 0.00 36.38 35.08 1n60 s VAL 748 CO 0.15 -0.03 0.22 -0.89 0.00 0.00 0.00 175.10 174.55 1n60 s THR 749 N 1.54 1.40 0.73 3.92 2.01 -1.26 -4.94 115.64 119.04 1n60 s THR 749 Ca -0.03 -2.46 -0.16 0.00 0.31 0.00 0.00 61.69 59.35 1n60 s THR 749 Cb -0.17 -1.99 0.03 0.00 0.01 0.00 0.00 72.50 70.38 1n60 s THR 749 CO -0.07 -0.87 1.14 -2.65 -0.69 0.00 0.00 174.62 171.48 1n60 n PRO 750 N 3.66 0.56 -2.48 4.92 -0.02 -1.26 -3.52 135.00 136.87 1n60 n PRO 750 Ca 0.07 0.25 -0.43 0.00 -2.02 0.00 0.00 63.50 61.38 1n60 n PRO 750 Cb 0.35 -2.38 -0.02 0.00 -0.02 0.00 0.00 33.50 31.43 1n60 n PRO 750 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1n60 s SER 751 N -1.73 6.98 0.39 2.55 0.15 -0.27 -4.75 113.70 117.01 1n60 s SER 751 Ca 0.76 1.62 0.11 0.00 0.70 0.00 0.00 55.95 59.14 1n60 s SER 751 Cb -0.34 -2.54 0.78 0.00 -1.71 0.00 0.00 66.02 62.22 1n60 s SER 751 CO 0.48 -0.74 1.89 -0.65 1.20 0.00 0.00 173.24 175.42 1n60 h PRO 752 N 8.03 0.14 0.00 5.44 0.11 -1.89 -3.03 132.00 140.80 1n60 h PRO 752 Ca -0.25 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1n60 h PRO 752 Cb 1.09 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1n60 h PRO 752 CO 0.97 0.36 -0.66 -2.39 -0.21 0.00 0.00 178.00 176.08 1n60 n HIS 753 N -4.23 0.30 -2.87 0.65 1.44 -1.26 -4.89 115.22 104.36 1n60 n HIS 753 Ca -0.01 0.09 -0.40 0.00 -2.01 0.00 0.00 57.72 55.39 1n60 n HIS 753 Cb 0.31 -0.47 -0.06 0.00 0.12 0.00 0.00 29.99 29.89 1n60 n HIS 753 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 1n60 s HIS 754 N -3.11 3.94 0.54 -1.40 5.04 -1.15 -4.95 115.29 114.20 1n60 s HIS 754 Ca 0.07 1.76 0.26 0.00 -1.54 0.00 0.00 55.06 55.62 1n60 s HIS 754 Cb 0.15 -2.88 1.43 0.00 0.04 0.00 0.00 32.58 31.32 1n60 s HIS 754 CO 0.73 0.47 1.99 -1.35 -2.34 0.00 0.00 174.74 174.24 1n60 h PRO 755 N 4.34 0.00 0.00 2.88 0.11 -1.89 -1.44 132.00 136.01 1n60 h PRO 755 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1n60 h PRO 755 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1n60 h PRO 755 CO 0.67 0.00 -0.02 0.44 -0.21 0.00 0.00 178.00 178.89 1n60 n ILE 756 N -4.27 1.22 -1.12 4.15 -5.35 -1.26 -4.99 119.36 107.74 1n60 n ILE 756 Ca 0.09 -1.36 -0.04 0.00 -0.27 0.00 0.00 62.75 61.17 1n60 n ILE 756 Cb 0.60 0.27 -0.02 0.00 -1.74 0.00 0.00 39.64 38.75 1n60 n ILE 756 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1n60 n GLY 757 N -0.79 0.58 3.71 3.28 0.00 -0.54 -4.61 105.19 106.82 1n60 n GLY 757 Ca 0.06 -0.16 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 1n60 n GLY 757 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n60 s ALA 758 N -1.78 3.47 0.26 4.61 0.00 -1.26 -1.12 121.76 125.94 1n60 s ALA 758 Ca 0.00 -0.18 0.05 0.00 0.00 0.00 0.00 51.96 51.84 1n60 s ALA 758 Cb 0.00 -2.74 -0.03 0.00 0.00 0.00 0.00 23.12 20.35 1n60 s ALA 758 CO 0.00 -0.12 0.38 0.15 0.00 0.00 0.00 175.76 176.18 1n60 s LYS 759 N 0.88 3.38 0.85 0.00 1.02 0.07 -4.49 119.74 121.45 1n60 s LYS 759 Ca 0.28 -0.80 -0.11 0.00 0.02 0.00 0.00 55.97 55.36 1n60 s LYS 759 Cb -0.16 -2.88 0.10 0.00 -0.52 0.00 0.00 37.83 34.38 1n60 s LYS 759 CO 0.11 0.36 1.10 0.20 -0.92 0.00 0.00 175.35 176.20 1n60 s GLY 760 N -4.02 1.65 0.00 -3.33 0.00 -1.26 -4.80 107.32 95.57 1n60 s GLY 760 Ca 0.36 0.20 0.00 0.00 0.00 0.00 0.00 44.72 45.28 1n60 s GLY 760 CO 0.29 0.61 0.00 1.55 0.00 0.00 0.00 173.10 175.56 1n60 n VAL 761 N -3.79 0.00 0.12 1.40 3.14 -1.26 -4.64 118.33 113.31 1n60 n VAL 761 Ca 0.09 0.00 0.05 0.00 -2.96 0.00 0.00 64.34 61.52 1n60 n VAL 761 Cb 0.54 0.25 0.51 0.00 -1.06 0.00 0.00 33.84 34.07 1n60 n VAL 761 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1n60 h GLY 762 N 0.00 0.29 1.18 7.55 0.00 -1.93 -1.77 103.07 108.39 1n60 h GLY 762 Ca 0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 47.33 47.19 1n60 h GLY 762 CO 0.00 0.12 -0.89 0.83 0.00 0.00 0.00 176.54 176.60 1n60 h GLU 763 N 0.28 0.00 -0.74 4.80 5.08 -1.93 -3.40 114.58 118.67 1n60 h GLU 763 Ca 0.07 0.00 0.17 0.00 -1.00 0.00 0.00 59.36 58.60 1n60 h GLU 763 Cb 0.02 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.14 1n60 h GLU 763 CO -0.01 0.06 0.00 0.77 -1.00 0.00 0.00 179.01 178.83 1n60 h SER 764 N 0.00 -0.34 -0.84 1.42 0.02 -1.65 -0.55 113.55 111.60 1n60 h SER 764 Ca -0.02 0.19 0.07 0.00 -0.84 0.00 0.00 61.79 61.19 1n60 h SER 764 Cb 1.09 0.34 -0.06 0.00 0.14 0.00 0.00 62.40 63.91 1n60 h SER 764 CO 0.01 -0.17 0.55 1.55 -1.14 0.00 0.00 176.83 177.63 1n60 h PRO 765 N 0.10 0.88 -0.03 3.45 0.13 -1.77 0.37 132.00 135.14 1n60 h PRO 765 Ca 0.40 -0.05 -0.10 0.00 -0.87 0.00 0.00 66.00 65.38 1n60 h PRO 765 Cb 0.70 -0.20 0.01 0.00 0.13 0.00 0.00 31.00 31.64 1n60 h PRO 765 CO -0.65 0.59 -0.37 1.25 -0.23 0.00 0.00 178.00 178.58 1n60 h HIS 766 N 0.91 0.42 -0.26 1.56 2.76 -1.22 0.67 115.15 119.99 1n60 h HIS 766 Ca 0.37 -0.21 0.06 0.00 -2.20 0.00 0.00 60.37 58.39 1n60 h HIS 766 Cb 0.26 -0.06 -0.06 0.00 1.55 0.00 0.00 27.41 29.11 1n60 h HIS 766 CO -0.00 0.99 -0.12 0.28 -1.30 0.00 0.00 177.93 177.78 1n60 h VAL 767 N -0.26 0.62 0.01 5.26 2.07 -0.99 -2.35 116.25 120.61 1n60 h VAL 767 Ca -0.04 0.00 -0.21 0.00 0.82 0.00 0.00 66.70 67.27 1n60 h VAL 767 Cb 1.07 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 1n60 h VAL 767 CO 0.07 0.00 -0.98 1.23 0.02 0.00 0.00 177.57 177.91 1n60 h GLY 768 N -0.08 0.03 1.08 2.17 0.00 -1.02 -3.37 103.07 101.86 1n60 h GLY 768 Ca 0.14 -0.06 -0.13 0.00 0.00 0.00 0.00 47.33 47.27 1n60 h GLY 768 CO -0.31 0.06 -0.24 -1.33 0.00 0.00 0.00 176.54 174.71 1n60 h GLY 769 N 2.78 1.00 0.85 4.60 0.00 -0.44 -2.80 103.07 109.05 1n60 h GLY 769 Ca -0.02 -0.92 -0.01 0.00 0.00 0.00 0.00 47.33 46.38 1n60 h GLY 769 CO 0.13 0.84 0.03 -2.08 0.00 0.00 0.00 176.54 175.46 1n60 h VAL 770 N 0.74 1.16 0.00 4.60 2.07 -1.60 -0.86 116.25 122.37 1n60 h VAL 770 Ca 0.09 -0.48 -0.03 0.00 0.82 0.00 0.00 66.70 67.10 1n60 h VAL 770 Cb 0.82 1.31 -0.00 0.00 -1.52 0.00 0.00 31.29 31.90 1n60 h VAL 770 CO 0.07 0.14 -0.14 -0.65 0.02 0.00 0.00 177.57 177.01 1n60 h PRO 771 N -0.02 0.00 0.10 1.57 0.11 -1.75 -0.19 132.00 131.81 1n60 h PRO 771 Ca 0.03 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.14 1n60 h PRO 771 Cb 0.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.30 1n60 h PRO 771 CO -0.00 0.14 -0.05 0.00 -0.21 0.00 0.00 178.00 177.89 1n60 h PHE 773 N -0.32 0.17 -0.49 0.00 0.04 -0.92 -0.58 116.94 114.84 1n60 h PHE 773 Ca -0.01 -0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.67 1n60 h PHE 773 Cb 0.27 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.34 1n60 h PHE 773 CO -0.01 0.18 -0.01 1.03 -0.60 0.00 0.00 178.31 178.90 1n60 h SER 774 N 0.11 0.80 -0.48 2.17 0.87 -0.97 -1.42 113.55 114.64 1n60 h SER 774 Ca 0.04 -0.20 -0.06 0.00 -1.23 0.00 0.00 61.79 60.35 1n60 h SER 774 Cb 0.07 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 61.79 1n60 h SER 774 CO -0.01 0.87 0.11 0.78 -0.53 0.00 0.00 176.83 178.05 1n60 h ASN 775 N 0.77 0.78 -0.51 6.23 2.35 -0.32 -0.19 115.58 124.69 1n60 h ASN 775 Ca 0.15 -0.15 -0.04 0.00 -0.55 0.00 0.00 56.30 55.70 1n60 h ASN 775 Cb 0.48 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.62 1n60 h ASN 775 CO 0.02 0.78 0.15 0.00 -1.65 0.00 0.00 177.43 176.73 1n60 h ALA 776 N 1.32 0.67 -0.05 -0.83 0.00 -0.34 0.23 119.26 120.26 1n60 h ALA 776 Ca 0.17 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1n60 h ALA 776 Cb 0.33 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1n60 h ALA 776 CO 0.00 0.35 0.01 0.28 0.00 0.00 0.00 179.25 179.89 1n60 h VAL 777 N 0.70 1.18 -1.00 0.00 2.07 -1.06 -1.03 116.25 117.11 1n60 h VAL 777 Ca 0.16 -0.53 0.01 0.00 0.82 0.00 0.00 66.70 67.17 1n60 h VAL 777 Cb 0.30 1.45 -0.05 0.00 -1.52 0.00 0.00 31.29 31.47 1n60 h VAL 777 CO -0.00 0.15 0.66 0.78 0.02 0.00 0.00 177.57 179.17 1n60 h ASN 778 N -0.13 1.13 -0.42 0.57 2.35 -0.95 -2.34 115.58 115.78 1n60 h ASN 778 Ca 0.01 -0.03 -0.08 0.00 -0.55 0.00 0.00 56.30 55.65 1n60 h ASN 778 Cb 0.22 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 1n60 h ASN 778 CO -0.00 0.81 -0.04 -0.78 -1.65 0.00 0.00 177.43 175.78 1n60 h ASP 779 N 1.34 0.82 -0.85 5.81 3.58 -0.35 -2.12 116.42 124.65 1n60 h ASP 779 Ca 0.37 -0.22 0.08 0.00 0.42 0.00 0.00 57.03 57.67 1n60 h ASP 779 Cb -0.13 -0.22 -0.07 0.00 1.72 0.00 0.00 39.33 40.63 1n60 h ASP 779 CO -0.09 0.91 0.51 0.00 -2.88 0.00 0.00 179.24 177.69 1n60 h ALA 780 N 1.18 1.18 -0.05 -0.78 0.00 -0.63 -2.34 119.26 117.82 1n60 h ALA 780 Ca 0.14 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1n60 h ALA 780 Cb 0.52 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1n60 h ALA 780 CO 0.03 0.21 0.00 0.66 0.00 0.00 0.00 179.25 180.14 1n60 n TYR 781 N -4.67 0.04 -0.28 0.00 4.01 -1.09 -4.39 117.16 110.77 1n60 n TYR 781 Ca 0.13 -0.02 -0.04 0.00 -0.16 0.00 0.00 57.90 57.81 1n60 n TYR 781 Cb 0.22 0.00 0.10 0.00 -0.31 0.00 0.00 39.34 39.35 1n60 n TYR 781 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1n60 h ALA 782 N 4.44 1.13 0.00 -0.72 0.00 -0.81 -0.51 119.26 122.79 1n60 h ALA 782 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1n60 h ALA 782 Cb 0.66 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1n60 h ALA 782 CO 0.00 0.64 0.00 0.27 0.00 0.00 0.00 179.25 180.16 1n60 h PHE 783 N 1.15 0.00 -0.13 0.00 -0.00 -1.77 -0.24 116.94 115.95 1n60 h PHE 783 Ca 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.24 1n60 h PHE 783 Cb 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.09 1n60 h PHE 783 CO 0.02 0.00 0.00 1.28 -0.00 0.00 0.00 178.31 179.61 1n60 n LEU 784 N -2.32 3.03 -2.90 2.10 4.77 -0.22 -4.98 117.00 116.48 1n60 n LEU 784 Ca -0.00 -1.16 -0.17 0.00 -0.03 0.00 0.00 56.01 54.65 1n60 n LEU 784 Cb 0.11 -0.07 0.06 0.00 -2.33 0.00 0.00 43.42 41.19 1n60 n LEU 784 CO 0.14 0.56 0.17 0.59 -1.33 0.00 0.00 177.39 177.52 1n60 n ASN 785 N 1.31 -4.70 0.24 -1.43 3.02 -0.10 -4.90 115.26 108.69 1n60 n ASN 785 Ca 0.15 -0.43 0.16 0.00 -0.03 0.00 0.00 54.58 54.43 1n60 n ASN 785 Cb 0.57 -4.04 0.65 0.00 -0.61 0.00 0.00 39.78 36.35 1n60 n ASN 785 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n60 h ALA 786 N 0.77 1.00 -0.43 5.41 0.00 -1.76 -3.49 119.26 120.76 1n60 h ALA 786 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1n60 h ALA 786 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1n60 h ALA 786 CO 0.42 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.08 1n60 n GLY 787 N -0.02 -0.80 3.67 0.00 0.00 -1.26 -4.70 105.19 102.09 1n60 n GLY 787 Ca 0.01 -1.16 -0.43 0.00 0.00 0.00 0.00 46.02 44.44 1n60 n GLY 787 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1n60 s HIS 788 N 0.00 3.09 -0.29 1.61 2.46 -1.26 -4.95 115.29 115.95 1n60 s HIS 788 Ca 0.00 1.19 -0.13 0.00 0.47 0.00 0.00 55.06 56.59 1n60 s HIS 788 Cb 0.00 -3.42 -0.04 0.00 -0.13 0.00 0.00 32.58 29.00 1n60 s HIS 788 CO 0.00 -1.27 0.30 0.42 -2.47 0.00 0.00 174.74 171.72 1n60 s ILE 789 N 2.90 5.23 0.24 0.89 1.01 -1.26 -5.06 121.20 125.15 1n60 s ILE 789 Ca 0.53 0.30 -0.30 0.00 0.00 0.00 0.00 60.65 61.19 1n60 s ILE 789 Cb -0.21 -3.66 -0.09 0.00 0.01 0.00 0.00 42.46 38.51 1n60 s ILE 789 CO 0.16 0.14 1.14 -1.10 0.00 0.00 0.00 174.94 175.28 1n60 s GLN 790 N 1.93 4.58 0.83 2.79 -1.52 -1.26 -4.94 119.66 122.07 1n60 s GLN 790 Ca 0.11 1.83 -0.11 0.00 -1.95 0.00 0.00 55.36 55.25 1n60 s GLN 790 Cb -0.16 -3.21 0.09 0.00 -0.22 0.00 0.00 33.01 29.51 1n60 s GLN 790 CO 0.11 0.09 1.10 -1.64 -0.25 0.00 0.00 175.29 174.70 1n60 s MET 791 N -0.99 1.79 0.48 2.91 -1.94 -1.26 -4.58 119.30 115.71 1n60 s MET 791 Ca 0.48 1.21 -0.12 0.00 -1.71 0.00 0.00 55.69 55.55 1n60 s MET 791 Cb -0.32 -1.84 -0.06 0.00 2.01 0.00 0.00 34.83 34.62 1n60 s MET 791 CO 0.40 -1.98 0.88 -1.25 -0.01 0.00 0.00 175.02 173.05 1n60 s PRO 792 N -4.84 3.79 -0.92 2.03 0.04 -1.26 -4.75 135.00 129.08 1n60 s PRO 792 Ca 0.63 0.65 -0.03 0.00 0.04 0.00 0.00 61.00 62.29 1n60 s PRO 792 Cb -0.19 -2.26 0.23 0.00 0.04 0.00 0.00 34.50 32.32 1n60 s PRO 792 CO 0.57 -0.21 2.21 0.72 0.04 0.00 0.00 177.00 180.33 1n60 n HIS 793 N -1.71 2.53 -2.11 0.56 8.25 0.99 -4.82 115.22 118.92 1n60 n HIS 793 Ca 0.04 -2.42 -0.28 0.00 -0.26 0.00 0.00 57.72 54.81 1n60 n HIS 793 Cb 0.54 -1.38 0.13 0.00 1.12 0.00 0.00 29.99 30.40 1n60 n HIS 793 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 1n60 s ASP 794 N -0.52 3.97 0.19 0.41 -4.77 -0.99 -4.75 116.67 110.21 1n60 s ASP 794 Ca 0.50 0.28 -0.09 0.00 -3.30 0.00 0.00 52.55 49.95 1n60 s ASP 794 Cb 0.30 -0.61 0.09 0.00 -1.09 0.00 0.00 42.92 41.61 1n60 s ASP 794 CO -0.22 -2.17 1.68 0.00 0.70 0.00 0.00 175.17 175.16 1n60 h ALA 795 N -1.09 0.88 -0.33 2.11 0.00 -1.85 -1.07 119.26 117.91 1n60 h ALA 795 Ca -0.43 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.07 1n60 h ALA 795 Cb 1.28 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1n60 h ALA 795 CO 0.48 0.66 -0.33 0.11 0.00 0.00 0.00 179.25 180.17 1n60 h TRP 796 N 1.02 0.86 -0.18 0.00 5.08 -1.87 0.18 115.95 121.05 1n60 h TRP 796 Ca 0.20 -0.23 -0.15 0.00 1.08 0.00 0.00 58.89 59.79 1n60 h TRP 796 Cb 0.45 -0.19 -0.01 0.00 -3.00 0.00 0.00 29.16 26.41 1n60 h TRP 796 CO 0.03 0.97 -0.50 0.00 -1.28 0.00 0.00 178.44 177.66 1n60 h ARG 797 N 0.62 0.48 0.00 0.12 3.08 -1.80 -0.62 114.38 116.26 1n60 h ARG 797 Ca 0.07 -0.28 -0.16 0.00 0.07 0.00 0.00 59.98 59.67 1n60 h ARG 797 Cb 0.86 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.91 1n60 h ARG 797 CO 0.07 0.87 -0.76 -0.07 -1.07 0.00 0.00 179.97 179.02 1n60 h LEU 798 N 0.38 0.00 -0.43 3.04 3.38 -0.90 -1.94 115.31 118.84 1n60 h LEU 798 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1n60 h LEU 798 Cb 1.02 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 1n60 h LEU 798 CO 0.09 0.76 0.28 -0.25 0.09 0.00 0.00 178.44 179.41 1n60 h TRP 799 N 0.00 0.54 -0.82 1.13 7.01 -0.42 -2.02 115.95 121.38 1n60 h TRP 799 Ca -0.01 0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.02 1n60 h TRP 799 Cb 1.39 -0.18 -0.04 0.00 -2.10 0.00 0.00 29.16 28.22 1n60 h TRP 799 CO 0.00 0.35 0.54 0.87 -2.79 0.00 0.00 178.44 177.42 1n60 h LYS 800 N 0.58 1.04 0.10 2.65 1.79 -0.75 0.17 116.57 122.15 1n60 h LYS 800 Ca 0.16 -0.06 0.01 0.00 -2.18 0.00 0.00 60.65 58.57 1n60 h LYS 800 Cb -0.05 -0.23 -0.02 0.00 -1.58 0.00 0.00 32.23 30.35 1n60 h LYS 800 CO -0.03 0.69 -0.14 0.28 -1.08 0.00 0.00 179.45 179.17 1n60 h VAL 801 N 1.07 0.68 -0.25 0.50 2.07 -0.91 -0.69 116.25 118.73 1n60 h VAL 801 Ca 0.31 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.73 1n60 h VAL 801 Cb -0.06 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1n60 h VAL 801 CO -0.08 0.00 -0.26 1.23 0.02 0.00 0.00 177.57 178.48 1n60 h GLY 802 N -0.29 0.52 0.99 2.17 0.00 -0.76 -2.08 103.07 103.62 1n60 h GLY 802 Ca 0.01 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 46.92 1n60 h GLY 802 CO -0.06 0.39 0.22 -2.09 0.00 0.00 0.00 176.54 175.00 1n60 h GLU 803 N 0.42 0.46 0.00 4.80 4.57 -0.35 -0.83 114.58 123.65 1n60 h GLU 803 Ca 0.06 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 1n60 h GLU 803 Cb 0.68 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 29.17 1n60 h GLU 803 CO 0.05 0.33 -0.04 1.96 -1.18 0.00 0.00 179.01 180.12 1n60 h GLN 804 N 0.45 0.00 -0.03 1.92 4.20 -0.89 -1.67 115.11 119.10 1n60 h GLN 804 Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1n60 h GLN 804 Cb -0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.76 1n60 h GLN 804 CO -0.03 0.04 0.00 1.28 -0.67 0.00 0.00 178.83 179.46 1n60 n LEU 805 N -3.17 1.77 0.00 1.46 4.77 -0.74 -4.93 117.00 116.16 1n60 n LEU 805 Ca 0.00 -0.60 0.00 0.00 -0.03 0.00 0.00 56.01 55.38 1n60 n LEU 805 Cb 0.30 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1n60 n LEU 805 CO 0.28 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 1n60 n GLY 806 N 1.20 0.45 0.07 -0.72 0.00 -0.63 -4.93 105.19 100.63 1n60 n GLY 806 Ca 0.18 -0.89 0.13 0.00 0.00 0.00 0.00 46.02 45.44 1n60 n GLY 806 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1n60 n LEU 807 N 0.00 0.49 -1.02 0.99 4.77 -0.39 -3.65 117.00 118.19 1n60 n LEU 807 Ca 0.00 0.56 0.12 0.00 -0.03 0.00 0.00 56.01 56.66 1n60 n LEU 807 Cb 0.00 -0.42 0.14 0.00 -2.33 0.00 0.00 43.42 40.81 1n60 n LEU 807 CO 0.00 -0.18 0.65 1.41 -1.33 0.00 0.00 177.39 177.94 1n60 n HIS 808 N -1.97 0.15 -0.47 -1.77 8.25 -1.26 -5.01 115.22 113.14 1n60 n HIS 808 Ca 0.05 -0.08 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1n60 n HIS 808 Cb 0.36 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.47 1n60 n HIS 808 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31